NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
644696 | 6izp | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H5' G 1 H5' G 1 20.342 -6.388 -17.959 2 H5'' G 1 H5'' G 1 18.944 -6.663 -16.903 3 H4' G 1 H4' G 1 19.072 -5.481 -19.518 4 H3' G 1 H3' G 1 17.001 -5.635 -17.349 5 H2' G 1 H2' G 1 15.307 -5.034 -18.961 6 HO2' G 1 HO2' G 1 17.351 -3.849 -20.146 7 H1' G 1 H1' G 1 16.172 -6.792 -20.924 8 H8 G 1 H8 G 1 16.653 -8.139 -17.395 9 H1 G 1 H1 G 1 10.980 -9.425 -20.081 10 H21 G 1 H21 G 1 12.037 -7.249 -22.547 11 H22 G 1 H22 G 1 10.763 -8.303 -21.946 12 HO5' G 1 H5T G 1 18.727 -8.399 -18.842 13 H5' U 2 H5' U 2 16.315 -2.667 -19.359 14 H5'' U 2 H5'' U 2 16.137 -1.017 -18.733 15 H4' U 2 H4' U 2 14.207 -1.300 -19.942 16 H3' U 2 H3' U 2 13.658 -1.869 -17.055 17 H2' U 2 H2' U 2 11.412 -2.498 -17.573 18 HO2' U 2 HO2' U 2 10.437 -1.436 -19.117 19 H1' U 2 H1' U 2 11.999 -3.871 -19.957 20 H3 U 2 H3 U 2 10.631 -7.147 -17.195 21 H5 U 2 H5 U 2 14.449 -6.146 -15.791 22 H6 U 2 H6 U 2 14.520 -4.401 -17.434 23 H5' A 3 H5' A 3 10.831 0.276 -18.378 24 H5'' A 3 H5'' A 3 10.157 1.635 -17.457 25 H4' A 3 H4' A 3 8.363 0.188 -17.804 26 H3' A 3 H3' A 3 9.434 -0.171 -15.010 27 H2' A 3 H2' A 3 7.722 -1.798 -14.642 28 HO2' A 3 HO2' A 3 5.869 -1.089 -15.446 29 H1' A 3 H1' A 3 7.805 -2.859 -17.288 30 H8 A 3 H8 A 3 11.305 -2.822 -15.943 31 H61 A 3 H61 A 3 11.181 -7.073 -13.547 32 H62 A 3 H62 A 3 9.879 -8.180 -13.161 33 H2 A 3 H2 A 3 6.117 -6.439 -14.827 34 H5' C 4 H5' C 4 5.173 1.025 -14.622 35 H5'' C 4 H5'' C 4 4.896 1.596 -12.965 36 H4' C 4 H4' C 4 3.609 -0.451 -13.696 37 H3' C 4 H3' C 4 5.270 -0.455 -11.190 38 H2' C 4 H2' C 4 4.594 -2.691 -10.764 39 HO2' C 4 HO2' C 4 2.498 -2.098 -12.573 40 H1' C 4 H1' C 4 4.632 -3.476 -13.495 41 H41 C 4 H41 C 4 10.731 -4.656 -11.352 42 H42 C 4 H42 C 4 9.718 -5.851 -10.543 43 H5 C 4 H5 C 4 9.729 -2.855 -12.680 44 H6 C 4 H6 C 4 7.628 -1.921 -13.495 45 H5' U 5 H5' U 5 0.540 -2.525 -12.447 46 H5'' U 5 H5'' U 5 -0.798 -1.493 -11.904 47 H4' U 5 H4' U 5 -1.307 -3.503 -10.930 48 H3' U 5 H3' U 5 0.090 -1.775 -8.933 49 H2' U 5 H2' U 5 0.181 -3.561 -7.348 50 HO2' U 5 HO2' U 5 -2.087 -4.206 -8.454 51 H1' U 5 H1' U 5 0.768 -5.628 -9.149 52 H3 U 5 H3 U 5 4.666 -5.392 -6.990 53 H5 U 5 H5 U 5 4.441 -1.682 -8.932 54 H6 U 5 H6 U 5 2.301 -2.355 -9.802 55 H5' G 6 H5' G 6 -4.670 1.076 -9.573 56 H5'' G 6 H5'' G 6 -3.328 1.749 -8.629 57 H4' G 6 H4' G 6 -5.762 2.037 -7.809 58 H3' G 6 H3' G 6 -3.421 1.373 -6.050 59 H2' G 6 H2' G 6 -4.886 1.173 -4.185 60 HO2' G 6 HO2' G 6 -5.965 3.244 -5.108 61 H1' G 6 H1' G 6 -7.167 0.260 -5.697 62 H8 G 6 H8 G 6 -7.219 -2.426 -5.946 63 H1 G 6 H1 G 6 -2.549 -2.597 -1.576 64 H21 G 6 H21 G 6 -2.103 0.721 -2.435 65 H22 G 6 H22 G 6 -1.590 -0.658 -1.458 66 H5' G 7 H5' G 7 -1.514 6.280 -5.965 67 H5'' G 7 H5'' G 7 -1.177 5.748 -4.307 68 H4' G 7 H4' G 7 -1.967 8.195 -4.848 69 H3' G 7 H3' G 7 -2.445 6.531 -2.444 70 H2' G 7 H2' G 7 -4.195 7.917 -1.615 71 HO2' G 7 HO2' G 7 -4.536 10.021 -2.445 72 H1' G 7 H1' G 7 -5.431 8.525 -4.038 73 H8 G 7 H8 G 7 -7.438 7.107 -4.326 74 H1 G 7 H1 G 7 -4.911 2.274 -0.988 75 H21 G 7 H21 G 7 -2.130 4.314 -0.736 76 H22 G 7 H22 G 7 -2.915 2.788 -0.309 77 H5' A 8 H5' A 8 -2.785 9.980 -0.871 78 H5'' A 8 H5'' A 8 -1.675 10.262 0.485 79 H4' A 8 H4' A 8 -3.854 8.576 1.311 80 H3' A 8 H3' A 8 -4.701 11.080 -0.127 81 H2' A 8 H2' A 8 -6.270 11.523 1.623 82 HO2' A 8 HO2' A 8 -7.096 9.456 1.876 83 H1' A 8 H1' A 8 -4.577 10.694 3.738 84 H8 A 8 H8 A 8 -2.752 12.823 1.205 85 H61 A 8 H61 A 8 -3.596 17.172 3.234 86 H62 A 8 H62 A 8 -4.635 17.691 4.553 87 H2 A 8 H2 A 8 -6.745 14.065 6.077 88 H5' A 9 H5' A 9 -9.086 8.588 1.297 89 H5'' A 9 H5'' A 9 -7.647 7.866 0.556 90 H4' A 9 H4' A 9 -9.914 8.400 -1.248 91 H3' A 9 H3' A 9 -10.757 7.220 1.051 92 H2' A 9 H2' A 9 -9.894 5.056 1.092 93 HO2' A 9 HO2' A 9 -11.654 5.124 -0.936 94 H1' A 9 H1' A 9 -8.645 4.712 -1.474 95 H8 A 9 H8 A 9 -6.527 7.212 -0.125 96 H61 A 9 H61 A 9 -3.727 4.645 2.857 97 H62 A 9 H62 A 9 -3.840 3.055 3.588 98 H2 A 9 H2 A 9 -7.670 1.271 2.041 99 H5' C 10 H5' C 10 -13.279 8.162 3.025 100 H5'' C 10 H5'' C 10 -11.754 7.808 2.188 101 H4' C 10 H4' C 10 -13.697 5.609 2.761 102 H3' C 10 H3' C 10 -11.945 6.904 4.830 103 H2' C 10 H2' C 10 -11.394 4.717 5.674 104 HO2' C 10 HO2' C 10 -13.750 4.095 4.963 105 H1' C 10 H1' C 10 -10.941 3.572 3.176 106 H41 C 10 H41 C 10 -5.532 7.197 3.987 107 H42 C 10 H42 C 10 -5.263 5.775 4.988 108 H5 C 10 H5 C 10 -7.636 7.625 2.872 109 H6 C 10 H6 C 10 -9.961 6.895 2.682 110 H5' A 11 H5' A 11 -14.434 4.578 7.388 111 H5'' A 11 H5'' A 11 -14.179 5.172 9.039 112 H4' A 11 H4' A 11 -13.128 2.919 8.229 113 H3' A 11 H3' A 11 -11.893 4.932 10.077 114 H2' A 11 H2' A 11 -9.861 3.648 10.116 115 HO2' A 11 HO2' A 11 -11.534 1.666 9.858 116 H1' A 11 H1' A 11 -9.862 2.976 7.389 117 H8 A 11 H8 A 11 -10.491 6.241 6.484 118 H61 A 11 H61 A 11 -6.469 8.621 7.859 119 H62 A 11 H62 A 11 -5.127 8.221 8.920 120 H2 A 11 H2 A 11 -5.925 4.079 10.457 121 H5' U 12 H5' U 12 -10.671 1.125 11.362 122 H5'' U 12 H5'' U 12 -11.544 0.896 12.890 123 H4' U 12 H4' U 12 -9.378 0.054 13.229 124 H3' U 12 H3' U 12 -9.791 2.714 14.556 125 H2' U 12 H2' U 12 -7.516 2.638 15.354 126 HO2' U 12 HO2' U 12 -7.555 0.336 15.770 127 H1' U 12 H1' U 12 -6.409 1.922 12.916 128 H3 U 12 H3 U 12 -5.769 6.394 13.791 129 H5 U 12 H5 U 12 -9.316 6.121 11.567 130 H6 U 12 H6 U 12 -9.187 3.726 11.802 131 H5' G 13 H5' G 13 -10.424 3.180 18.727 132 H5'' G 13 H5'' G 13 -10.054 4.621 17.759 133 H4' G 13 H4' G 13 -8.193 3.032 19.514 134 H3' G 13 H3' G 13 -9.324 5.810 19.743 135 H2' G 13 H2' G 13 -7.239 6.529 20.712 136 HO2' G 13 HO2' G 13 -7.138 4.208 21.697 137 H1' G 13 H1' G 13 -5.624 5.229 18.844 138 H8 G 13 H8 G 13 -8.894 6.615 17.442 139 H1 G 13 H1 G 13 -3.940 10.685 17.426 140 H21 G 13 H21 G 13 -2.337 8.215 19.223 141 H22 G 13 H22 G 13 -2.239 9.808 18.494 142 H5' U 14 H5' U 14 -10.666 7.651 23.896 143 H5'' U 14 H5'' U 14 -11.722 7.623 22.470 144 H4' U 14 H4' U 14 -9.121 9.142 22.559 145 H3' U 14 H3' U 14 -10.867 10.043 24.261 146 H2' U 14 H2' U 14 -12.879 9.739 22.942 147 HO2' U 14 HO2' U 14 -12.073 12.215 23.333 148 H1' U 14 H1' U 14 -11.657 11.042 20.488 149 H3 U 14 H3 U 14 -15.869 9.486 19.275 150 H5 U 14 H5 U 14 -13.177 6.282 19.009 151 H6 U 14 H6 U 14 -11.574 7.631 20.187 152 H5' U 15 H5' U 15 -7.474 12.403 22.872 153 H5'' U 15 H5'' U 15 -6.870 13.304 24.278 154 H4' U 15 H4' U 15 -6.095 14.200 22.114 155 H3' U 15 H3' U 15 -6.644 15.741 24.226 156 H2' U 15 H2' U 15 -9.007 16.056 23.714 157 HO2' U 15 HO2' U 15 -8.856 18.205 22.332 158 H1' U 15 H1' U 15 -8.139 16.577 20.807 159 H3 U 15 H3 U 15 -12.402 17.683 19.954 160 H5 U 15 H5 U 15 -12.680 13.825 21.578 161 H6 U 15 H6 U 15 -10.324 13.947 22.067 162 H5' U 16 H5' U 16 -4.597 18.096 20.545 163 H5'' U 16 H5'' U 16 -4.925 16.362 20.369 164 H4' U 16 H4' U 16 -2.642 16.048 19.495 165 H3' U 16 H3' U 16 -1.791 18.366 20.491 166 H2' U 16 H2' U 16 -3.334 19.793 19.264 167 HO2' U 16 HO2' U 16 -0.810 19.866 18.539 168 H1' U 16 H1' U 16 -2.678 18.141 16.758 169 H3 U 16 H3 U 16 -7.304 20.517 17.764 170 H5 U 16 H5 U 16 -5.594 20.153 13.953 171 H6 U 16 H6 U 16 -3.740 19.008 14.978 172 H5' C 17 H5' C 17 1.786 17.123 16.465 173 H5'' C 17 H5'' C 17 0.196 16.834 17.198 174 H4' C 17 H4' C 17 2.614 15.227 17.960 175 H3' C 17 H3' C 17 0.911 14.818 15.523 176 H2' C 17 H2' C 17 0.888 12.444 15.960 177 HO2' C 17 HO2' C 17 3.149 12.541 16.772 178 H1' C 17 H1' C 17 0.264 12.678 18.641 179 H41 C 17 H41 C 17 -5.243 14.261 15.362 180 H42 C 17 H42 C 17 -5.478 12.692 16.121 181 H5 C 17 H5 C 17 -3.118 15.433 15.477 182 H6 C 17 H6 C 17 -0.852 15.358 16.372 183 H5' A 18 H5' A 18 2.698 11.032 12.868 184 H5'' A 18 H5'' A 18 1.333 11.741 13.752 185 H4' A 18 H4' A 18 3.227 9.878 15.129 186 H3' A 18 H3' A 18 1.190 9.042 13.111 187 H2' A 18 H2' A 18 0.346 7.337 14.580 188 HO2' A 18 HO2' A 18 1.634 6.465 16.044 189 H1' A 18 H1' A 18 0.246 8.900 16.857 190 H8 A 18 H8 A 18 -0.701 11.619 14.858 191 H61 A 18 H61 A 18 -5.190 10.437 13.458 192 H62 A 18 H62 A 18 -6.109 8.938 13.490 193 H2 A 18 H2 A 18 -3.455 5.839 15.313 194 H5' U 19 H5' U 19 2.362 6.164 14.076 195 H5'' U 19 H5'' U 19 3.208 4.727 13.470 196 H4' U 19 H4' U 19 1.174 3.852 14.033 197 H3' U 19 H3' U 19 1.062 4.546 11.114 198 H2' U 19 H2' U 19 -1.240 3.939 11.048 199 HO2' U 19 HO2' U 19 -1.398 2.027 12.062 200 H1' U 19 H1' U 19 -1.866 4.783 13.709 201 H3 U 19 H3 U 19 -4.357 6.770 10.311 202 H5 U 19 H5 U 19 -1.286 9.410 11.409 203 H6 U 19 H6 U 19 -0.325 7.621 12.710 204 H5' G 20 H5' G 20 -0.524 0.441 12.559 205 H5'' G 20 H5'' G 20 0.317 -0.646 11.433 206 H4' G 20 H4' G 20 -1.938 -1.410 11.898 207 H3' G 20 H3' G 20 -1.100 -0.756 9.138 208 H2' G 20 H2' G 20 -3.297 -0.792 8.248 209 HO2' G 20 HO2' G 20 -3.643 -2.856 9.489 210 H1' G 20 H1' G 20 -4.711 0.161 10.489 211 H8 G 20 H8 G 20 -1.821 2.427 10.105 212 H1 G 20 H1 G 20 -6.610 3.687 6.038 213 H21 G 20 H21 G 20 -7.842 0.627 7.039 214 H22 G 20 H22 G 20 -8.056 2.047 6.028 215 H5' U 21 H5' U 21 -3.336 -5.795 7.913 216 H5'' U 21 H5'' U 21 -1.839 -5.474 7.017 217 H4' U 21 H4' U 21 -4.196 -5.711 5.828 218 H3' U 21 H3' U 21 -1.865 -4.000 5.028 219 H2' U 21 H2' U 21 -3.171 -2.946 3.346 220 HO2' U 21 HO2' U 21 -4.100 -5.321 3.014 221 H1' U 21 H1' U 21 -5.664 -3.032 4.753 222 H3 U 21 H3 U 21 -4.972 1.329 3.891 223 H5 U 21 H5 U 21 -2.182 0.432 6.902 224 H6 U 21 H6 U 21 -2.909 -1.857 6.782 225 H5' G 22 H5' G 22 -0.912 -9.133 3.077 226 H5'' G 22 H5'' G 22 0.332 -8.903 4.320 227 H4' G 22 H4' G 22 1.739 -9.434 2.676 228 H3' G 22 H3' G 22 1.255 -6.522 2.149 229 H2' G 22 H2' G 22 2.359 -6.682 0.049 230 HO2' G 22 HO2' G 22 4.012 -8.080 1.338 231 H1' G 22 H1' G 22 1.639 -9.411 -0.499 232 H8 G 22 H8 G 22 -0.967 -9.586 -1.464 233 H1 G 22 H1 G 22 -0.151 -3.445 -3.047 234 H21 G 22 H21 G 22 2.407 -3.528 -0.726 235 H22 G 22 H22 G 22 1.465 -2.604 -1.905 236 H5' G 23 H5' G 23 5.936 -4.599 3.984 237 H5'' G 23 H5'' G 23 5.764 -4.010 2.320 238 H4' G 23 H4' G 23 8.067 -4.897 3.391 239 H3' G 23 H3' G 23 7.175 -4.767 0.536 240 H2' G 23 H2' G 23 9.138 -5.989 -0.135 241 HO2' G 23 HO2' G 23 10.745 -6.502 1.550 242 H1' G 23 H1' G 23 9.036 -7.872 1.906 243 H8 G 23 H8 G 23 7.957 -9.972 1.070 244 H1 G 23 H1 G 23 4.303 -6.725 -3.055 245 H21 G 23 H21 G 23 5.805 -3.959 -1.695 246 H22 G 23 H22 G 23 4.663 -4.593 -2.871 247 H5' A 24 H5' A 24 9.808 -3.679 -2.680 248 H5'' A 24 H5'' A 24 8.857 -4.953 -1.892 249 H4' A 24 H4' A 24 10.581 -5.986 -3.160 250 H3' A 24 H3' A 24 10.240 -6.806 -0.671 251 H2' A 24 H2' A 24 11.662 -5.210 0.404 252 HO2' A 24 HO2' A 24 13.041 -7.623 -0.146 253 H1' A 24 H1' A 24 13.810 -5.707 -1.712 254 H8 A 24 H8 A 24 11.844 -3.066 0.239 255 H61 A 24 H61 A 24 15.482 0.128 0.876 256 H62 A 24 H62 A 24 17.151 0.143 0.330 257 H2 A 24 H2 A 24 17.824 -3.578 -2.031 258 H5' A 25 H5' A 25 11.056 -11.675 -0.550 259 H5'' A 25 H5'' A 25 11.425 -12.272 -2.181 260 H4' A 25 H4' A 25 9.010 -12.438 -1.085 261 H3' A 25 H3' A 25 9.869 -13.070 -3.550 262 H2' A 25 H2' A 25 9.755 -10.810 -4.448 263 HO2' A 25 HO2' A 25 7.191 -12.047 -4.812 264 H1' A 25 H1' A 25 7.032 -10.588 -3.022 265 H8 A 25 H8 A 25 9.814 -8.119 -2.357 266 H61 A 25 H61 A 25 8.083 -4.394 -4.928 267 H62 A 25 H62 A 25 6.750 -4.216 -6.048 268 H2 A 25 H2 A 25 4.773 -8.216 -6.361 269 H5' G 26 H5' G 26 7.250 -15.101 -6.764 270 H5'' G 26 H5'' G 26 7.679 -13.484 -6.173 271 H4' G 26 H4' G 26 4.813 -14.327 -6.322 272 H3' G 26 H3' G 26 6.496 -13.623 -8.700 273 H2' G 26 H2' G 26 4.735 -12.195 -9.528 274 HO2' G 26 HO2' G 26 3.204 -13.849 -8.170 275 H1' G 26 H1' G 26 4.275 -10.906 -7.133 276 H8 G 26 H8 G 26 7.911 -11.808 -7.229 277 H1 G 26 H1 G 26 6.454 -6.459 -10.430 278 H21 G 26 H21 G 26 3.188 -7.489 -9.995 279 H22 G 26 H22 G 26 4.275 -6.276 -10.648 280 H5' U 27 H5' U 27 2.940 -13.840 -10.006 281 H5'' U 27 H5'' U 27 2.688 -14.893 -11.411 282 H4' U 27 H4' U 27 1.792 -12.771 -11.937 283 H3' U 27 H3' U 27 4.379 -13.326 -13.371 284 H2' U 27 H2' U 27 4.103 -11.205 -14.499 285 HO2' U 27 HO2' U 27 1.542 -11.733 -14.047 286 H1' U 27 H1' U 27 3.370 -9.804 -12.189 287 H3 U 27 H3 U 27 7.576 -8.432 -13.238 288 H5 U 27 H5 U 27 8.082 -11.976 -11.053 289 H6 U 27 H6 U 27 5.698 -12.292 -11.169 290 H5' A 28 H5' A 28 1.696 -12.101 -15.675 291 H5'' A 28 H5'' A 28 1.143 -12.941 -17.138 292 H4' A 28 H4' A 28 1.459 -10.811 -17.911 293 H3' A 28 H3' A 28 3.971 -12.374 -18.438 294 H2' A 28 H2' A 28 4.962 -10.413 -19.388 295 HO2' A 28 HO2' A 28 3.643 -9.218 -20.522 296 H1' A 28 H1' A 28 3.913 -8.617 -17.474 297 H8 A 28 H8 A 28 5.136 -11.622 -15.634 298 H61 A 28 H61 A 28 9.784 -10.303 -15.098 299 H62 A 28 H62 A 28 10.762 -9.029 -15.803 300 H2 A 28 H2 A 28 8.091 -6.737 -18.573 301 H5' C 29 H5' C 29 2.825 -10.777 -21.801 302 H5'' C 29 H5'' C 29 2.893 -11.684 -23.327 303 H4' C 29 H4' C 29 4.228 -9.786 -23.646 304 H3' C 29 H3' C 29 5.881 -12.250 -23.176 305 HO3' C 29 H3T C 29 5.951 -10.707 -25.437 306 H2' C 29 H2' C 29 7.871 -10.939 -23.303 307 HO2' C 29 HO2' C 29 7.871 -8.909 -24.266 308 H1' C 29 H1' C 29 6.804 -8.652 -21.985 309 H41 C 29 H41 C 29 9.184 -12.505 -17.213 310 H42 C 29 H42 C 29 10.532 -11.542 -17.812 311 H5 C 29 H5 C 29 6.997 -12.433 -18.291 312 H6 C 29 H6 C 29 5.702 -11.425 -20.092 313 H1 B2R 101 H6 NCD 30 -2.036 -0.882 2.548 314 H2 B2R 101 H5 NCD 30 -3.645 -2.566 1.715 315 H3 B2R 101 H4 NCD 30 -5.524 -3.144 0.284 316 H4 B2R 101 H3 NCD 30 -7.215 -2.385 -1.440 317 H5 B2R 101 3H11 NCD 30 -1.529 2.396 1.106 318 H6 B2R 101 2H11 NCD 30 -0.948 1.098 2.190 319 H7 B2R 101 1H11 NCD 30 -2.239 2.207 2.720 320 H8 B2R 101 H23 NCD 30 -7.438 0.911 -2.680 321 H9 B2R 101 2H26 NCD 30 -10.637 -1.398 -3.867 322 H10 B2R 101 1H26 NCD 30 -10.911 0.095 -4.804 323 H11 B2R 101 2H27 NCD 30 -10.431 -1.201 -6.640 324 H12 B2R 101 1H27 NCD 30 -8.757 -0.934 -6.163 325 H13 B2R 101 2H28 NCD 30 -8.969 -3.109 -4.723 326 H14 B2R 101 1H28 NCD 30 -10.521 -3.368 -5.519 327 H30 B2R 101 1H35 NCD 30 -8.238 -2.960 -7.373 328 H16 B2R 101 1H34 NCD 30 -7.921 -4.809 -5.284 329 H17 B2R 101 2H34 NCD 30 -8.542 -5.759 -6.645 330 H18 B2R 101 2H33 NCD 30 -6.228 -3.852 -7.176 331 H19 B2R 101 1H33 NCD 30 -6.608 -5.430 -7.946 332 H20 B2R 101 2H32 NCD 30 -5.639 -6.667 -6.175 333 H21 B2R 101 1H32 NCD 30 -5.795 -5.342 -5.002 334 H22 B2R 101 H29 NCD 30 -2.389 -4.382 -5.407 335 H23 B2R 101 H14 NCD 30 -2.996 -1.127 -6.972 336 H24 B2R 101 H15 NCD 30 -1.617 0.863 -6.382 337 H25 B2R 101 H16 NCD 30 0.213 1.827 -4.983 338 H26 B2R 101 H17 NCD 30 1.923 1.488 -3.229 339 H27 B2R 101 1H22 NCD 30 3.111 -0.016 -1.810 340 H28 B2R 101 3H22 NCD 30 2.966 -1.743 -2.209 341 H29 B2R 101 2H22 NCD 30 1.944 -1.033 -0.928 342 H1 B2R 102 H6 NCD 31 2.455 -1.013 -5.743 343 H2 B2R 102 H5 NCD 31 0.830 -2.747 -6.360 344 H3 B2R 102 H4 NCD 31 0.031 -5.124 -6.172 345 H4 B2R 102 H3 NCD 31 0.422 -7.414 -5.136 346 H5 B2R 102 1H11 NCD 31 4.033 -0.283 -4.235 347 H6 B2R 102 2H11 NCD 31 4.896 -1.354 -3.097 348 H7 B2R 102 3H11 NCD 31 5.414 -1.258 -4.801 349 H8 B2R 102 H23 NCD 31 3.094 -8.167 -3.001 350 H9 B2R 102 2H26 NCD 31 1.871 -11.947 -1.843 351 H10 B2R 102 1H26 NCD 31 0.683 -10.702 -1.419 352 H11 B2R 102 1H27 NCD 31 0.538 -12.729 -3.628 353 H12 B2R 102 2H27 NCD 31 0.231 -11.086 -4.177 354 H13 B2R 102 1H28 NCD 31 -1.720 -12.688 -3.138 355 H14 B2R 102 2H28 NCD 31 -1.166 -11.938 -1.636 356 H30 B2R 102 1H35 NCD 31 -2.501 -10.662 -3.984 357 H16 B2R 102 1H34 NCD 31 -3.485 -11.242 -1.597 358 H17 B2R 102 2H34 NCD 31 -2.676 -9.731 -1.150 359 H18 B2R 102 1H33 NCD 31 -3.966 -8.762 -3.299 360 H19 B2R 102 2H33 NCD 31 -5.058 -10.158 -2.982 361 H20 B2R 102 1H32 NCD 31 -6.063 -8.494 -1.659 362 H21 B2R 102 2H32 NCD 31 -4.951 -9.205 -0.457 363 H22 B2R 102 H29 NCD 31 -3.603 -5.435 -0.953 364 H23 B2R 102 H14 NCD 31 -1.322 -6.587 1.741 365 H24 B2R 102 H15 NCD 31 0.292 -4.987 2.743 366 H25 B2R 102 H16 NCD 31 1.278 -2.655 2.757 367 H26 B2R 102 H17 NCD 31 1.300 -0.385 1.784 368 H27 B2R 102 1H22 NCD 31 -1.327 0.788 -0.403 369 H28 B2R 102 2H22 NCD 31 0.216 1.238 0.351 370 H29 B2R 102 3H22 NCD 31 0.198 0.480 -1.264 Start of MODEL 2 1 H5' G 1 H5' G 1 19.637 -8.349 -15.618 2 H5'' G 1 H5'' G 1 20.549 -6.907 -15.140 3 H4' G 1 H4' G 1 19.789 -5.910 -16.943 4 H3' G 1 H3' G 1 17.285 -5.948 -15.329 5 H2' G 1 H2' G 1 15.933 -5.446 -17.242 6 HO2' G 1 HO2' G 1 18.044 -4.145 -18.007 7 H1' G 1 H1' G 1 17.169 -7.177 -19.014 8 H8 G 1 H8 G 1 17.059 -8.570 -15.479 9 H1 G 1 H1 G 1 11.931 -9.867 -19.099 10 H21 G 1 H21 G 1 13.328 -7.612 -21.306 11 H22 G 1 H22 G 1 11.999 -8.706 -20.942 12 HO5' G 1 H5T G 1 18.634 -6.204 -13.992 13 H5' U 2 H5' U 2 17.024 -2.718 -17.289 14 H5'' U 2 H5'' U 2 16.566 -1.204 -16.485 15 H4' U 2 H4' U 2 14.904 -1.531 -18.065 16 H3' U 2 H3' U 2 13.902 -2.500 -15.395 17 H2' U 2 H2' U 2 11.792 -2.970 -16.474 18 HO2' U 2 HO2' U 2 11.226 -1.935 -18.231 19 H1' U 2 H1' U 2 12.954 -4.218 -18.685 20 H3 U 2 H3 U 2 11.096 -7.521 -16.233 21 H5 U 2 H5 U 2 14.643 -6.565 -14.205 22 H6 U 2 H6 U 2 14.995 -4.812 -15.800 23 H5' A 3 H5' A 3 11.377 -0.219 -17.186 24 H5'' A 3 H5'' A 3 10.318 0.909 -16.316 25 H4' A 3 H4' A 3 9.032 -0.653 -17.649 26 H3' A 3 H3' A 3 8.717 -0.781 -14.670 27 H2' A 3 H2' A 3 7.206 -2.617 -14.901 28 HO2' A 3 HO2' A 3 6.520 -1.277 -17.053 29 H1' A 3 H1' A 3 8.465 -3.756 -17.193 30 H8 A 3 H8 A 3 11.279 -3.513 -14.917 31 H61 A 3 H61 A 3 10.530 -7.467 -12.204 32 H62 A 3 H62 A 3 9.177 -8.552 -11.988 33 H2 A 3 H2 A 3 5.925 -7.049 -14.699 34 H5' C 4 H5' C 4 5.348 -0.735 -15.944 35 H5'' C 4 H5'' C 4 4.077 0.422 -15.502 36 H4' C 4 H4' C 4 3.080 -1.535 -14.911 37 H3' C 4 H3' C 4 4.501 -0.490 -12.483 38 H2' C 4 H2' C 4 3.975 -2.478 -11.279 39 HO2' C 4 HO2' C 4 1.883 -2.940 -11.617 40 H1' C 4 H1' C 4 4.077 -4.240 -13.527 41 H41 C 4 H41 C 4 10.095 -4.487 -10.892 42 H42 C 4 H42 C 4 9.096 -5.660 -10.033 43 H5 C 4 H5 C 4 9.108 -2.971 -12.539 44 H6 C 4 H6 C 4 7.056 -2.388 -13.720 45 H5' U 5 H5' U 5 0.468 -1.918 -12.265 46 H5'' U 5 H5'' U 5 -0.613 -0.797 -11.419 47 H4' U 5 H4' U 5 -1.329 -2.928 -10.798 48 H3' U 5 H3' U 5 0.183 -1.517 -8.658 49 H2' U 5 H2' U 5 0.251 -3.447 -7.264 50 HO2' U 5 HO2' U 5 -2.101 -3.821 -8.217 51 H1' U 5 H1' U 5 0.627 -5.385 -9.257 52 H3 U 5 H3 U 5 4.555 -5.520 -7.068 53 H5 U 5 H5 U 5 4.621 -1.781 -8.952 54 H6 U 5 H6 U 5 2.427 -2.258 -9.820 55 H5' G 6 H5' G 6 -4.727 1.285 -9.481 56 H5'' G 6 H5'' G 6 -3.390 2.036 -8.592 57 H4' G 6 H4' G 6 -5.774 2.350 -7.719 58 H3' G 6 H3' G 6 -3.443 1.626 -5.967 59 H2' G 6 H2' G 6 -4.923 1.495 -4.089 60 HO2' G 6 HO2' G 6 -5.986 3.541 -5.107 61 H1' G 6 H1' G 6 -7.185 0.530 -5.559 62 H8 G 6 H8 G 6 -7.152 -2.147 -5.928 63 H1 G 6 H1 G 6 -2.482 -2.318 -1.560 64 H21 G 6 H21 G 6 -2.123 1.034 -2.310 65 H22 G 6 H22 G 6 -1.591 -0.374 -1.376 66 H5' G 7 H5' G 7 -1.420 6.491 -5.562 67 H5'' G 7 H5'' G 7 -1.188 5.774 -3.957 68 H4' G 7 H4' G 7 -1.833 8.302 -4.264 69 H3' G 7 H3' G 7 -2.513 6.426 -2.075 70 H2' G 7 H2' G 7 -4.240 7.817 -1.184 71 HO2' G 7 HO2' G 7 -2.656 9.699 -2.060 72 H1' G 7 H1' G 7 -5.380 8.636 -3.572 73 H8 G 7 H8 G 7 -7.269 7.132 -4.293 74 H1 G 7 H1 G 7 -4.955 2.223 -0.902 75 H21 G 7 H21 G 7 -2.297 4.342 -0.248 76 H22 G 7 H22 G 7 -3.058 2.769 0.015 77 H5' A 8 H5' A 8 -2.768 10.100 -0.181 78 H5'' A 8 H5'' A 8 -1.981 9.960 1.403 79 H4' A 8 H4' A 8 -4.418 8.553 1.569 80 H3' A 8 H3' A 8 -4.744 10.975 -0.108 81 H2' A 8 H2' A 8 -6.426 11.928 1.299 82 HO2' A 8 HO2' A 8 -7.510 9.928 1.684 83 H1' A 8 H1' A 8 -5.200 11.482 3.717 84 H8 A 8 H8 A 8 -4.604 12.968 0.281 85 H61 A 8 H61 A 8 -1.695 16.637 1.626 86 H62 A 8 H62 A 8 -0.910 17.035 3.144 87 H2 A 8 H2 A 8 -2.010 13.867 6.087 88 H5' A 9 H5' A 9 -9.780 9.386 -2.342 89 H5'' A 9 H5'' A 9 -9.825 9.277 -0.572 90 H4' A 9 H4' A 9 -10.789 7.418 -2.358 91 H3' A 9 H3' A 9 -10.328 7.408 0.579 92 H2' A 9 H2' A 9 -10.362 5.022 0.709 93 HO2' A 9 HO2' A 9 -12.114 5.240 -1.161 94 H1' A 9 H1' A 9 -8.904 4.491 -1.603 95 H8 A 9 H8 A 9 -7.268 7.502 -0.043 96 H61 A 9 H61 A 9 -4.211 5.142 2.874 97 H62 A 9 H62 A 9 -4.104 3.481 3.411 98 H2 A 9 H2 A 9 -7.454 1.255 1.452 99 H5' C 10 H5' C 10 -11.754 8.116 3.656 100 H5'' C 10 H5'' C 10 -10.810 7.457 2.307 101 H4' C 10 H4' C 10 -12.694 5.518 3.313 102 H3' C 10 H3' C 10 -11.097 6.920 5.394 103 H2' C 10 H2' C 10 -10.248 4.870 6.290 104 HO2' C 10 HO2' C 10 -12.554 3.966 5.648 105 H1' C 10 H1' C 10 -9.756 3.579 3.876 106 H41 C 10 H41 C 10 -4.688 7.740 4.164 107 H42 C 10 H42 C 10 -4.235 6.379 5.183 108 H5 C 10 H5 C 10 -6.911 7.928 3.165 109 H6 C 10 H6 C 10 -9.155 6.974 3.163 110 H5' A 11 H5' A 11 -12.239 6.782 9.966 111 H5'' A 11 H5'' A 11 -11.183 6.930 8.547 112 H4' A 11 H4' A 11 -12.200 4.263 9.454 113 H3' A 11 H3' A 11 -10.150 5.865 10.866 114 H2' A 11 H2' A 11 -8.482 4.162 10.756 115 HO2' A 11 HO2' A 11 -10.444 2.585 11.100 116 H1' A 11 H1' A 11 -8.950 3.281 8.171 117 H8 A 11 H8 A 11 -9.356 6.491 6.988 118 H61 A 11 H61 A 11 -4.950 8.484 7.487 119 H62 A 11 H62 A 11 -3.507 8.014 8.365 120 H2 A 11 H2 A 11 -4.503 4.218 10.538 121 H5' U 12 H5' U 12 -10.358 2.853 13.377 122 H5'' U 12 H5'' U 12 -10.742 3.201 15.074 123 H4' U 12 H4' U 12 -8.617 2.190 15.050 124 H3' U 12 H3' U 12 -8.480 5.145 15.566 125 H2' U 12 H2' U 12 -6.087 5.004 15.662 126 HO2' U 12 HO2' U 12 -6.374 2.861 16.823 127 H1' U 12 H1' U 12 -5.805 3.231 13.493 128 H3 U 12 H3 U 12 -4.196 7.505 12.697 129 H5 U 12 H5 U 12 -8.045 7.282 11.057 130 H6 U 12 H6 U 12 -8.320 5.169 12.188 131 H5' G 13 H5' G 13 -6.849 5.026 20.988 132 H5'' G 13 H5'' G 13 -6.868 6.329 19.785 133 H4' G 13 H4' G 13 -4.667 4.338 20.313 134 H3' G 13 H3' G 13 -4.892 7.289 20.854 135 H2' G 13 H2' G 13 -2.551 7.515 20.336 136 HO2' G 13 HO2' G 13 -2.363 5.159 21.320 137 H1' G 13 H1' G 13 -2.631 5.880 18.064 138 H8 G 13 H8 G 13 -5.822 7.706 17.890 139 H1 G 13 H1 G 13 -0.774 11.345 16.317 140 H21 G 13 H21 G 13 1.080 8.815 17.729 141 H22 G 13 H22 G 13 1.065 10.380 16.936 142 H5' U 14 H5' U 14 -3.969 8.816 21.822 143 H5'' U 14 H5'' U 14 -2.283 8.524 22.294 144 H4' U 14 H4' U 14 -2.219 10.649 22.880 145 H3' U 14 H3' U 14 -2.748 9.484 25.211 146 H2' U 14 H2' U 14 -5.174 9.507 25.017 147 HO2' U 14 HO2' U 14 -4.037 11.283 26.669 148 H1' U 14 H1' U 14 -4.975 12.412 24.036 149 H3 U 14 H3 U 14 -9.501 12.241 24.157 150 H5 U 14 H5 U 14 -8.393 9.347 21.324 151 H6 U 14 H6 U 14 -6.109 9.670 22.006 152 H5' U 15 H5' U 15 -1.014 13.163 24.480 153 H5'' U 15 H5'' U 15 0.670 12.994 25.010 154 H4' U 15 H4' U 15 0.143 15.298 24.523 155 H3' U 15 H3' U 15 1.577 14.627 26.684 156 H2' U 15 H2' U 15 -0.265 14.510 28.259 157 HO2' U 15 HO2' U 15 1.088 16.919 28.169 158 H1' U 15 H1' U 15 -1.392 17.071 26.987 159 H3 U 15 H3 U 15 -4.846 17.068 29.775 160 H5 U 15 H5 U 15 -4.573 13.034 28.660 161 H6 U 15 H6 U 15 -2.591 13.595 27.413 162 H5' U 16 H5' U 16 2.904 17.728 22.923 163 H5'' U 16 H5'' U 16 1.195 17.280 22.763 164 H4' U 16 H4' U 16 2.431 15.087 21.738 165 H3' U 16 H3' U 16 4.644 16.579 21.762 166 H2' U 16 H2' U 16 3.681 18.504 20.621 167 HO2' U 16 HO2' U 16 5.498 17.259 19.370 168 H1' U 16 H1' U 16 2.427 16.501 18.651 169 H3 U 16 H3 U 16 0.346 21.194 19.946 170 H5 U 16 H5 U 16 0.219 19.517 16.102 171 H6 U 16 H6 U 16 1.454 17.638 16.964 172 H5' C 17 H5' C 17 6.699 15.657 17.298 173 H5'' C 17 H5'' C 17 4.994 15.696 17.787 174 H4' C 17 H4' C 17 6.088 13.208 16.573 175 H3' C 17 H3' C 17 6.055 15.711 15.095 176 H2' C 17 H2' C 17 3.984 15.394 14.078 177 HO2' C 17 HO2' C 17 5.672 13.524 13.035 178 H1' C 17 H1' C 17 3.889 12.486 15.035 179 H41 C 17 H41 C 17 -2.236 14.790 14.228 180 H42 C 17 H42 C 17 -2.376 13.371 15.248 181 H5 C 17 H5 C 17 -0.060 15.706 13.597 182 H6 C 17 H6 C 17 2.353 15.450 13.825 183 H5' A 18 H5' A 18 6.324 10.507 13.330 184 H5'' A 18 H5'' A 18 4.919 11.585 13.208 185 H4' A 18 H4' A 18 5.042 9.450 15.303 186 H3' A 18 H3' A 18 4.377 8.981 12.408 187 H2' A 18 H2' A 18 2.536 7.620 13.079 188 HO2' A 18 HO2' A 18 4.154 6.754 14.818 189 H1' A 18 H1' A 18 1.967 9.098 15.482 190 H8 A 18 H8 A 18 1.853 11.609 12.805 191 H61 A 18 H61 A 18 -2.722 10.879 11.231 192 H62 A 18 H62 A 18 -3.887 9.596 11.530 193 H2 A 18 H2 A 18 -1.960 6.650 14.259 194 H5' U 19 H5' U 19 3.984 5.502 10.432 195 H5'' U 19 H5'' U 19 3.390 6.732 11.564 196 H4' U 19 H4' U 19 3.424 4.056 12.705 197 H3' U 19 H3' U 19 2.044 4.385 10.082 198 H2' U 19 H2' U 19 0.013 3.424 10.944 199 HO2' U 19 HO2' U 19 1.546 2.038 12.425 200 H1' U 19 H1' U 19 -0.100 4.925 13.228 201 H3 U 19 H3 U 19 -2.701 6.600 9.751 202 H5 U 19 H5 U 19 0.807 8.890 9.940 203 H6 U 19 H6 U 19 1.675 7.281 11.509 204 H5' G 20 H5' G 20 1.738 0.580 11.212 205 H5'' G 20 H5'' G 20 2.299 -0.739 10.171 206 H4' G 20 H4' G 20 0.172 -1.395 10.792 207 H3' G 20 H3' G 20 0.125 -0.213 8.039 208 H2' G 20 H2' G 20 -2.264 -0.466 7.957 209 HO2' G 20 HO2' G 20 -2.075 -2.568 9.145 210 H1' G 20 H1' G 20 -2.766 0.494 10.510 211 H8 G 20 H8 G 20 -0.007 2.685 9.524 212 H1 G 20 H1 G 20 -5.431 3.977 6.365 213 H21 G 20 H21 G 20 -6.517 0.970 7.703 214 H22 G 20 H22 G 20 -6.894 2.368 6.703 215 H5' U 21 H5' U 21 -2.694 -5.139 7.849 216 H5'' U 21 H5'' U 21 -1.437 -5.183 6.598 217 H4' U 21 H4' U 21 -3.898 -5.575 5.936 218 H3' U 21 H3' U 21 -1.863 -4.008 4.440 219 H2' U 21 H2' U 21 -3.448 -2.971 3.036 220 HO2' U 21 HO2' U 21 -4.444 -5.384 3.062 221 H1' U 21 H1' U 21 -5.704 -3.029 4.810 222 H3 U 21 H3 U 21 -5.149 1.237 3.363 223 H5 U 21 H5 U 21 -2.235 0.705 6.340 224 H6 U 21 H6 U 21 -2.873 -1.605 6.451 225 H5' G 22 H5' G 22 -0.964 -9.517 2.985 226 H5'' G 22 H5'' G 22 0.164 -8.836 4.172 227 H4' G 22 H4' G 22 1.569 -9.519 2.493 228 H3' G 22 H3' G 22 1.030 -6.594 2.085 229 H2' G 22 H2' G 22 2.279 -6.649 0.053 230 HO2' G 22 HO2' G 22 3.890 -8.018 1.350 231 H1' G 22 H1' G 22 1.600 -9.353 -0.657 232 H8 G 22 H8 G 22 -0.966 -9.486 -1.759 233 H1 G 22 H1 G 22 -0.089 -3.286 -3.034 234 H21 G 22 H21 G 22 2.357 -3.469 -0.605 235 H22 G 22 H22 G 22 1.453 -2.494 -1.771 236 H5' G 23 H5' G 23 5.709 -4.492 3.465 237 H5'' G 23 H5'' G 23 5.664 -4.383 1.696 238 H4' G 23 H4' G 23 7.810 -5.145 3.275 239 H3' G 23 H3' G 23 7.302 -5.135 0.338 240 H2' G 23 H2' G 23 9.091 -6.661 -0.078 241 HO2' G 23 HO2' G 23 10.390 -5.475 1.611 242 H1' G 23 H1' G 23 8.665 -8.347 2.097 243 H8 G 23 H8 G 23 7.663 -10.403 1.135 244 H1 G 23 H1 G 23 4.135 -7.055 -3.036 245 H21 G 23 H21 G 23 5.635 -4.333 -1.612 246 H22 G 23 H22 G 23 4.516 -4.943 -2.822 247 H5' A 24 H5' A 24 11.132 -4.466 -2.363 248 H5'' A 24 H5'' A 24 9.705 -5.490 -2.124 249 H4' A 24 H4' A 24 11.424 -6.937 -2.758 250 H3' A 24 H3' A 24 10.318 -7.309 -0.211 251 H2' A 24 H2' A 24 12.230 -6.948 1.077 252 HO2' A 24 HO2' A 24 12.874 -9.393 -0.262 253 H1' A 24 H1' A 24 14.015 -7.739 -1.285 254 H8 A 24 H8 A 24 13.380 -5.135 1.461 255 H61 A 24 H61 A 24 18.039 -4.094 2.444 256 H62 A 24 H62 A 24 19.556 -4.645 1.749 257 H2 A 24 H2 A 24 18.537 -7.527 -1.506 258 H5' A 25 H5' A 25 10.908 -11.037 -0.794 259 H5'' A 25 H5'' A 25 11.301 -12.543 -1.645 260 H4' A 25 H4' A 25 8.983 -12.557 -1.210 261 H3' A 25 H3' A 25 9.812 -13.016 -3.733 262 H2' A 25 H2' A 25 9.487 -10.774 -4.585 263 HO2' A 25 HO2' A 25 7.074 -12.284 -4.775 264 H1' A 25 H1' A 25 6.874 -10.648 -2.966 265 H8 A 25 H8 A 25 9.545 -8.261 -2.127 266 H61 A 25 H61 A 25 8.037 -4.355 -4.568 267 H62 A 25 H62 A 25 6.780 -4.099 -5.773 268 H2 A 25 H2 A 25 4.798 -8.047 -6.455 269 H5' G 26 H5' G 26 7.203 -15.382 -6.831 270 H5'' G 26 H5'' G 26 7.589 -13.714 -6.366 271 H4' G 26 H4' G 26 4.763 -14.716 -6.370 272 H3' G 26 H3' G 26 6.357 -14.059 -8.801 273 H2' G 26 H2' G 26 4.665 -12.586 -9.638 274 HO2' G 26 HO2' G 26 3.091 -14.264 -8.379 275 H1' G 26 H1' G 26 4.027 -11.352 -7.235 276 H8 G 26 H8 G 26 7.708 -11.935 -7.180 277 H1 G 26 H1 G 26 5.951 -6.739 -10.482 278 H21 G 26 H21 G 26 2.764 -8.045 -10.215 279 H22 G 26 H22 G 26 3.783 -6.742 -10.798 280 H5' U 27 H5' U 27 3.012 -14.697 -10.145 281 H5'' U 27 H5'' U 27 2.698 -15.803 -11.496 282 H4' U 27 H4' U 27 1.922 -13.780 -12.279 283 H3' U 27 H3' U 27 4.722 -14.148 -13.329 284 H2' U 27 H2' U 27 4.434 -12.049 -14.506 285 HO2' U 27 HO2' U 27 1.864 -12.737 -14.353 286 H1' U 27 H1' U 27 3.344 -10.716 -12.308 287 H3 U 27 H3 U 27 7.559 -9.115 -12.785 288 H5 U 27 H5 U 27 7.976 -12.676 -10.602 289 H6 U 27 H6 U 27 5.655 -13.116 -11.050 290 H5' A 28 H5' A 28 2.240 -12.935 -16.045 291 H5'' A 28 H5'' A 28 2.100 -13.839 -17.566 292 H4' A 28 H4' A 28 2.220 -11.625 -18.234 293 H3' A 28 H3' A 28 4.914 -12.928 -18.517 294 H2' A 28 H2' A 28 5.790 -10.843 -19.332 295 HO2' A 28 HO2' A 28 3.446 -10.598 -20.360 296 H1' A 28 H1' A 28 4.372 -9.217 -17.509 297 H8 A 28 H8 A 28 5.677 -12.105 -15.551 298 H61 A 28 H61 A 28 10.084 -10.372 -14.508 299 H62 A 28 H62 A 28 11.021 -9.015 -15.079 300 H2 A 28 H2 A 28 8.462 -6.919 -18.125 301 H5' C 29 H5' C 29 4.190 -11.344 -21.897 302 H5'' C 29 H5'' C 29 4.417 -12.215 -23.427 303 H4' C 29 H4' C 29 5.807 -10.381 -23.635 304 H3' C 29 H3' C 29 7.433 -12.749 -22.740 305 HO3' C 29 H3T C 29 6.883 -12.976 -24.749 306 H2' C 29 H2' C 29 9.383 -11.351 -22.725 307 HO2' C 29 HO2' C 29 8.237 -10.216 -24.711 308 H1' C 29 H1' C 29 8.091 -9.110 -21.589 309 H41 C 29 H41 C 29 9.661 -12.987 -16.499 310 H42 C 29 H42 C 29 11.096 -12.033 -16.873 311 H5 C 29 H5 C 29 7.675 -12.893 -17.911 312 H6 C 29 H6 C 29 6.692 -11.871 -19.892 313 H1 B2R 101 H6 NCD 30 -1.829 -0.860 2.478 314 H2 B2R 101 H5 NCD 30 -3.404 -2.591 1.671 315 H3 B2R 101 H4 NCD 30 -5.321 -3.210 0.308 316 H4 B2R 101 H3 NCD 30 -7.130 -2.425 -1.348 317 H5 B2R 101 1H11 NCD 30 -0.873 1.151 2.188 318 H6 B2R 101 2H11 NCD 30 -1.473 2.412 1.077 319 H7 B2R 101 3H11 NCD 30 -2.179 2.243 2.704 320 H8 B2R 101 H23 NCD 30 -7.576 0.790 -2.475 321 H9 B2R 101 2H26 NCD 30 -10.282 -0.398 -5.428 322 H10 B2R 101 1H26 NCD 30 -8.617 -0.993 -5.586 323 H11 B2R 101 2H27 NCD 30 -9.681 -2.743 -3.680 324 H12 B2R 101 1H27 NCD 30 -11.099 -2.411 -4.667 325 H13 B2R 101 2H28 NCD 30 -10.353 -4.136 -5.953 326 H14 B2R 101 1H28 NCD 30 -9.260 -2.953 -6.662 327 H30 B2R 101 1H35 NCD 30 -8.600 -4.898 -4.432 328 H16 B2R 101 1H34 NCD 30 -7.851 -6.284 -6.043 329 H17 B2R 101 2H34 NCD 30 -8.507 -5.162 -7.240 330 H18 B2R 101 2H33 NCD 30 -6.271 -3.831 -7.009 331 H19 B2R 101 1H33 NCD 30 -6.198 -5.423 -7.834 332 H20 B2R 101 2H32 NCD 30 -5.275 -6.485 -5.831 333 H21 B2R 101 1H32 NCD 30 -5.506 -5.006 -4.867 334 H22 B2R 101 H29 NCD 30 -2.253 -4.076 -5.451 335 H23 B2R 101 H14 NCD 30 -2.918 -0.725 -6.818 336 H24 B2R 101 H15 NCD 30 -1.498 1.210 -6.116 337 H25 B2R 101 H16 NCD 30 0.394 2.050 -4.677 338 H26 B2R 101 H17 NCD 30 2.129 1.561 -2.997 339 H27 B2R 101 1H22 NCD 30 3.378 -0.095 -1.784 340 H28 B2R 101 3H22 NCD 30 3.082 -1.800 -2.194 341 H29 B2R 101 2H22 NCD 30 2.173 -1.031 -0.864 342 H1 B2R 102 H6 NCD 31 2.599 -1.066 -5.614 343 H2 B2R 102 H5 NCD 31 0.999 -2.757 -6.362 344 H3 B2R 102 H4 NCD 31 0.157 -5.117 -6.281 345 H4 B2R 102 H3 NCD 31 0.421 -7.422 -5.309 346 H5 B2R 102 1H11 NCD 31 5.044 -1.562 -2.940 347 H6 B2R 102 2H11 NCD 31 5.359 -1.223 -4.657 348 H7 B2R 102 3H11 NCD 31 4.005 -0.405 -3.830 349 H8 B2R 102 H23 NCD 31 2.958 -8.341 -2.995 350 H9 B2R 102 2H26 NCD 31 0.455 -11.527 -4.127 351 H10 B2R 102 1H26 NCD 31 1.812 -12.397 -3.372 352 H11 B2R 102 1H27 NCD 31 0.404 -11.049 -1.247 353 H12 B2R 102 2H27 NCD 31 0.582 -12.775 -1.508 354 H13 B2R 102 1H28 NCD 31 -1.611 -11.207 -2.985 355 H14 B2R 102 2H28 NCD 31 -1.439 -12.949 -2.806 356 H30 B2R 102 1H35 NCD 31 -1.662 -12.360 -0.230 357 H16 B2R 102 1H34 NCD 31 -3.004 -10.587 0.403 358 H17 B2R 102 2H34 NCD 31 -2.000 -9.828 -0.813 359 H18 B2R 102 1H33 NCD 31 -4.312 -10.989 -2.152 360 H19 B2R 102 2H33 NCD 31 -4.878 -10.065 -0.723 361 H20 B2R 102 1H32 NCD 31 -2.939 -8.799 -2.717 362 H21 B2R 102 2H32 NCD 31 -4.676 -8.866 -3.056 363 H22 B2R 102 H29 NCD 31 -3.621 -5.513 -1.182 364 H23 B2R 102 H14 NCD 31 -1.441 -6.565 1.550 365 H24 B2R 102 H15 NCD 31 0.164 -5.006 2.639 366 H25 B2R 102 H16 NCD 31 1.189 -2.705 2.716 367 H26 B2R 102 H17 NCD 31 1.293 -0.431 1.770 368 H27 B2R 102 1H22 NCD 31 0.531 1.163 0.258 369 H28 B2R 102 2H22 NCD 31 0.180 0.506 -1.358 370 H29 B2R 102 3H22 NCD 31 -1.154 0.945 -0.263 Start of MODEL 3 1 H5' G 1 H5' G 1 19.251 -9.041 -18.813 2 H5'' G 1 H5'' G 1 17.933 -9.119 -17.630 3 H4' G 1 H4' G 1 17.945 -8.078 -20.307 4 H3' G 1 H3' G 1 16.064 -7.922 -17.972 5 H2' G 1 H2' G 1 14.307 -7.221 -19.473 6 HO2' G 1 HO2' G 1 16.347 -6.308 -20.877 7 H1' G 1 H1' G 1 14.821 -9.147 -21.401 8 H8 G 1 H8 G 1 15.463 -10.356 -17.844 9 H1 G 1 H1 G 1 9.495 -11.211 -20.013 10 H21 G 1 H21 G 1 10.543 -9.284 -22.677 11 H22 G 1 H22 G 1 9.231 -10.174 -21.913 12 HO5' G 1 H5T G 1 17.372 -10.912 -19.447 13 H5' U 2 H5' U 2 15.532 -4.998 -20.087 14 H5'' U 2 H5'' U 2 15.582 -3.305 -19.558 15 H4' U 2 H4' U 2 13.543 -3.439 -20.606 16 H3' U 2 H3' U 2 13.178 -3.763 -17.654 17 H2' U 2 H2' U 2 10.848 -4.196 -17.944 18 HO2' U 2 HO2' U 2 9.836 -3.151 -19.472 19 H1' U 2 H1' U 2 11.080 -5.754 -20.275 20 H3 U 2 H3 U 2 9.637 -8.711 -17.213 21 H5 U 2 H5 U 2 13.648 -8.051 -16.198 22 H6 U 2 H6 U 2 13.746 -6.410 -17.941 23 H5' A 3 H5' A 3 10.464 -1.443 -18.904 24 H5'' A 3 H5'' A 3 9.990 0.021 -18.021 25 H4' A 3 H4' A 3 8.060 -1.289 -18.136 26 H3' A 3 H3' A 3 9.316 -1.548 -15.408 27 H2' A 3 H2' A 3 7.501 -2.980 -14.797 28 HO2' A 3 HO2' A 3 5.666 -2.138 -15.530 29 H1' A 3 H1' A 3 7.295 -4.226 -17.355 30 H8 A 3 H8 A 3 10.873 -4.413 -16.282 31 H61 A 3 H61 A 3 10.596 -8.449 -13.550 32 H62 A 3 H62 A 3 9.252 -9.413 -12.977 33 H2 A 3 H2 A 3 5.514 -7.461 -14.487 34 H5' C 4 H5' C 4 5.232 0.052 -14.870 35 H5'' C 4 H5'' C 4 5.090 0.795 -13.266 36 H4' C 4 H4' C 4 3.596 -1.185 -13.740 37 H3' C 4 H3' C 4 5.363 -1.080 -11.317 38 H2' C 4 H2' C 4 4.613 -3.227 -10.653 39 HO2' C 4 HO2' C 4 2.292 -2.667 -11.325 40 H1' C 4 H1' C 4 4.330 -4.237 -13.309 41 H41 C 4 H41 C 4 10.428 -5.926 -11.560 42 H42 C 4 H42 C 4 9.381 -6.946 -10.576 43 H5 C 4 H5 C 4 9.510 -4.121 -12.927 44 H6 C 4 H6 C 4 7.458 -3.022 -13.647 45 H5' U 5 H5' U 5 0.288 -2.700 -12.410 46 H5'' U 5 H5'' U 5 -0.880 -1.582 -11.678 47 H4' U 5 H4' U 5 -1.392 -3.689 -10.808 48 H3' U 5 H3' U 5 0.037 -1.968 -8.822 49 H2' U 5 H2' U 5 0.117 -3.766 -7.250 50 HO2' U 5 HO2' U 5 -2.172 -4.372 -8.360 51 H1' U 5 H1' U 5 0.624 -5.831 -9.101 52 H3 U 5 H3 U 5 4.538 -5.815 -6.925 53 H5 U 5 H5 U 5 4.422 -2.021 -8.712 54 H6 U 5 H6 U 5 2.271 -2.595 -9.618 55 H5' G 6 H5' G 6 -4.909 0.680 -9.582 56 H5'' G 6 H5'' G 6 -3.539 1.578 -8.902 57 H4' G 6 H4' G 6 -5.810 1.954 -7.852 58 H3' G 6 H3' G 6 -3.373 1.328 -6.207 59 H2' G 6 H2' G 6 -4.721 1.377 -4.237 60 HO2' G 6 HO2' G 6 -5.835 3.333 -5.435 61 H1' G 6 H1' G 6 -7.095 0.347 -5.481 62 H8 G 6 H8 G 6 -7.041 -2.404 -5.679 63 H1 G 6 H1 G 6 -2.291 -2.144 -1.408 64 H21 G 6 H21 G 6 -2.065 1.170 -2.349 65 H22 G 6 H22 G 6 -1.473 -0.167 -1.351 66 H5' G 7 H5' G 7 -1.669 6.366 -6.096 67 H5'' G 7 H5'' G 7 -1.148 5.779 -4.503 68 H4' G 7 H4' G 7 -2.183 8.165 -4.813 69 H3' G 7 H3' G 7 -2.386 6.315 -2.501 70 H2' G 7 H2' G 7 -4.192 7.490 -1.505 71 HO2' G 7 HO2' G 7 -2.932 9.528 -2.030 72 H1' G 7 H1' G 7 -5.472 8.388 -3.865 73 H8 G 7 H8 G 7 -7.579 7.108 -4.155 74 H1 G 7 H1 G 7 -5.236 2.009 -1.088 75 H21 G 7 H21 G 7 -2.346 3.862 -0.847 76 H22 G 7 H22 G 7 -3.211 2.376 -0.441 77 H5' A 8 H5' A 8 -2.208 8.081 1.558 78 H5'' A 8 H5'' A 8 -3.556 7.738 0.455 79 H4' A 8 H4' A 8 -4.245 9.182 2.279 80 H3' A 8 H3' A 8 -5.117 9.606 -0.189 81 H2' A 8 H2' A 8 -3.353 11.028 -0.957 82 HO2' A 8 HO2' A 8 -5.619 12.254 -0.464 83 H1' A 8 H1' A 8 -3.400 12.600 1.667 84 H8 A 8 H8 A 8 -1.239 10.881 -1.022 85 H61 A 8 H61 A 8 2.555 13.926 -0.776 86 H62 A 8 H62 A 8 2.922 15.291 0.269 87 H2 A 8 H2 A 8 -0.502 15.756 3.090 88 H5' A 9 H5' A 9 -9.452 9.457 1.266 89 H5'' A 9 H5'' A 9 -8.648 7.891 1.483 90 H4' A 9 H4' A 9 -10.042 8.976 -0.945 91 H3' A 9 H3' A 9 -11.197 7.461 0.903 92 H2' A 9 H2' A 9 -9.954 5.471 1.013 93 HO2' A 9 HO2' A 9 -11.600 5.394 -1.160 94 H1' A 9 H1' A 9 -8.685 5.356 -1.620 95 H8 A 9 H8 A 9 -6.585 7.681 -0.027 96 H61 A 9 H61 A 9 -3.865 4.875 2.843 97 H62 A 9 H62 A 9 -4.052 3.236 3.437 98 H2 A 9 H2 A 9 -7.815 1.609 1.668 99 H5' C 10 H5' C 10 -14.189 7.913 2.429 100 H5'' C 10 H5'' C 10 -12.480 7.989 1.960 101 H4' C 10 H4' C 10 -13.872 5.360 2.344 102 H3' C 10 H3' C 10 -12.877 7.145 4.541 103 H2' C 10 H2' C 10 -11.825 5.290 5.597 104 HO2' C 10 HO2' C 10 -13.967 4.097 4.932 105 H1' C 10 H1' C 10 -11.226 3.862 3.177 106 H41 C 10 H41 C 10 -5.705 7.198 4.241 107 H42 C 10 H42 C 10 -5.580 5.785 5.278 108 H5 C 10 H5 C 10 -7.725 7.729 2.998 109 H6 C 10 H6 C 10 -10.071 7.115 2.676 110 H5' A 11 H5' A 11 -15.120 6.840 8.398 111 H5'' A 11 H5'' A 11 -13.523 7.530 8.749 112 H4' A 11 H4' A 11 -14.350 4.731 8.320 113 H3' A 11 H3' A 11 -12.511 6.190 10.154 114 H2' A 11 H2' A 11 -10.967 4.375 10.224 115 HO2' A 11 HO2' A 11 -13.057 2.938 10.198 116 H1' A 11 H1' A 11 -11.172 3.594 7.535 117 H8 A 11 H8 A 11 -10.822 6.779 6.421 118 H61 A 11 H61 A 11 -6.373 8.085 7.753 119 H62 A 11 H62 A 11 -5.161 7.426 8.837 120 H2 A 11 H2 A 11 -7.046 3.751 10.651 121 H5' U 12 H5' U 12 -12.987 3.179 12.193 122 H5'' U 12 H5'' U 12 -13.696 3.213 13.820 123 H4' U 12 H4' U 12 -11.576 2.302 14.110 124 H3' U 12 H3' U 12 -11.594 5.196 14.916 125 H2' U 12 H2' U 12 -9.253 5.059 15.410 126 HO2' U 12 HO2' U 12 -9.828 2.691 16.181 127 H1' U 12 H1' U 12 -8.578 3.424 13.202 128 H3 U 12 H3 U 12 -6.769 7.697 13.042 129 H5 U 12 H5 U 12 -10.230 7.670 10.663 130 H6 U 12 H6 U 12 -10.749 5.505 11.586 131 H5' G 13 H5' G 13 -11.651 5.794 19.746 132 H5'' G 13 H5'' G 13 -10.925 7.093 18.780 133 H4' G 13 H4' G 13 -9.679 5.147 20.628 134 H3' G 13 H3' G 13 -9.467 8.072 20.123 135 H2' G 13 H2' G 13 -7.104 8.083 20.567 136 HO2' G 13 HO2' G 13 -7.655 6.207 22.197 137 H1' G 13 H1' G 13 -6.454 5.940 18.987 138 H8 G 13 H8 G 13 -9.414 7.107 17.197 139 H1 G 13 H1 G 13 -4.381 10.956 16.287 140 H21 G 13 H21 G 13 -3.041 9.313 19.007 141 H22 G 13 H22 G 13 -2.851 10.559 17.779 142 H5' U 14 H5' U 14 -11.687 9.902 24.351 143 H5'' U 14 H5'' U 14 -12.026 10.579 22.748 144 H4' U 14 H4' U 14 -11.162 12.188 24.470 145 H3' U 14 H3' U 14 -9.944 11.915 21.753 146 H2' U 14 H2' U 14 -8.210 13.470 22.324 147 HO2' U 14 HO2' U 14 -9.833 14.777 23.552 148 H1' U 14 H1' U 14 -7.676 12.449 24.858 149 H3 U 14 H3 U 14 -4.323 9.928 23.463 150 H5 U 14 H5 U 14 -7.022 9.646 20.260 151 H6 U 14 H6 U 14 -8.549 11.007 21.534 152 H5' U 15 H5' U 15 -8.857 15.461 19.857 153 H5'' U 15 H5'' U 15 -7.989 15.436 21.404 154 H4' U 15 H4' U 15 -9.000 17.699 19.814 155 H3' U 15 H3' U 15 -6.597 17.168 21.517 156 H2' U 15 H2' U 15 -6.424 19.504 22.053 157 HO2' U 15 HO2' U 15 -6.993 20.244 19.922 158 H1' U 15 H1' U 15 -9.116 19.888 22.599 159 H3 U 15 H3 U 15 -6.601 19.612 26.469 160 H5 U 15 H5 U 15 -8.192 15.801 25.752 161 H6 U 15 H6 U 15 -8.858 16.574 23.572 162 H5' U 16 H5' U 16 -5.786 18.637 16.808 163 H5'' U 16 H5'' U 16 -6.038 16.921 17.180 164 H4' U 16 H4' U 16 -3.810 16.461 16.144 165 H3' U 16 H3' U 16 -3.160 19.049 16.150 166 H2' U 16 H2' U 16 -4.970 19.848 14.756 167 HO2' U 16 HO2' U 16 -2.598 19.341 13.389 168 H1' U 16 H1' U 16 -4.538 17.444 12.902 169 H3 U 16 H3 U 16 -9.153 19.820 13.948 170 H5 U 16 H5 U 16 -8.134 18.100 10.259 171 H6 U 16 H6 U 16 -6.011 17.489 11.220 172 H5' C 17 H5' C 17 1.795 17.148 14.229 173 H5'' C 17 H5'' C 17 0.225 16.589 13.623 174 H4' C 17 H4' C 17 1.883 15.520 15.877 175 H3' C 17 H3' C 17 0.766 14.337 13.353 176 H2' C 17 H2' C 17 0.487 12.232 14.485 177 HO2' C 17 HO2' C 17 2.532 12.475 15.644 178 H1' C 17 H1' C 17 -0.549 13.310 16.842 179 H41 C 17 H41 C 17 -5.485 13.215 12.460 180 H42 C 17 H42 C 17 -5.850 12.061 13.739 181 H5 C 17 H5 C 17 -3.405 14.476 12.417 182 H6 C 17 H6 C 17 -1.292 14.866 13.572 183 H5' A 18 H5' A 18 2.842 10.021 12.445 184 H5'' A 18 H5'' A 18 1.344 10.889 12.822 185 H4' A 18 H4' A 18 2.905 9.368 14.893 186 H3' A 18 H3' A 18 1.042 8.235 12.864 187 H2' A 18 H2' A 18 -0.193 7.023 14.536 188 HO2' A 18 HO2' A 18 2.112 7.000 15.752 189 H1' A 18 H1' A 18 -0.460 9.093 16.319 190 H8 A 18 H8 A 18 -0.436 11.165 13.383 191 H61 A 18 H61 A 18 -4.912 10.489 11.669 192 H62 A 18 H62 A 18 -6.189 9.338 12.019 193 H2 A 18 H2 A 18 -4.594 6.636 15.239 194 H5' U 19 H5' U 19 1.608 5.490 14.669 195 H5'' U 19 H5'' U 19 2.407 3.955 14.278 196 H4' U 19 H4' U 19 0.299 3.315 14.973 197 H3' U 19 H3' U 19 0.478 3.304 11.990 198 H2' U 19 H2' U 19 -1.857 2.905 11.770 199 HO2' U 19 HO2' U 19 -1.484 1.298 13.658 200 H1' U 19 H1' U 19 -2.701 4.330 14.092 201 H3 U 19 H3 U 19 -4.671 5.946 10.247 202 H5 U 19 H5 U 19 -1.217 8.237 10.943 203 H6 U 19 H6 U 19 -0.618 6.664 12.665 204 H5' G 20 H5' G 20 -2.081 -0.250 13.301 205 H5'' G 20 H5'' G 20 -1.135 -1.547 12.548 206 H4' G 20 H4' G 20 -3.372 -1.972 11.994 207 H3' G 20 H3' G 20 -1.841 -0.811 9.685 208 H2' G 20 H2' G 20 -3.820 -0.907 8.345 209 HO2' G 20 HO2' G 20 -4.324 -3.070 9.312 210 H1' G 20 H1' G 20 -5.606 -0.140 10.400 211 H8 G 20 H8 G 20 -2.560 2.055 10.433 212 H1 G 20 H1 G 20 -7.027 3.718 6.145 213 H21 G 20 H21 G 20 -8.482 0.702 6.992 214 H22 G 20 H22 G 20 -8.570 2.166 6.025 215 H5' U 21 H5' U 21 -3.664 -5.474 7.892 216 H5'' U 21 H5'' U 21 -2.146 -5.399 6.978 217 H4' U 21 H4' U 21 -4.311 -5.805 5.687 218 H3' U 21 H3' U 21 -2.207 -3.827 4.886 219 H2' U 21 H2' U 21 -3.570 -3.019 3.114 220 HO2' U 21 HO2' U 21 -4.191 -5.509 2.877 221 H1' U 21 H1' U 21 -6.084 -3.347 4.430 222 H3 U 21 H3 U 21 -5.717 1.060 3.397 223 H5 U 21 H5 U 21 -3.241 0.540 6.739 224 H6 U 21 H6 U 21 -3.678 -1.821 6.615 225 H5' G 22 H5' G 22 -1.110 -8.130 2.229 226 H5'' G 22 H5'' G 22 -0.414 -8.814 3.710 227 H4' G 22 H4' G 22 1.677 -8.850 2.897 228 H3' G 22 H3' G 22 1.126 -6.241 1.539 229 H2' G 22 H2' G 22 2.705 -6.761 -0.196 230 HO2' G 22 HO2' G 22 4.105 -7.809 1.524 231 H1' G 22 H1' G 22 1.939 -9.407 -0.563 232 H8 G 22 H8 G 22 -0.654 -9.724 -1.558 233 H1 G 22 H1 G 22 -0.161 -3.528 -3.082 234 H21 G 22 H21 G 22 2.423 -3.548 -0.783 235 H22 G 22 H22 G 22 1.448 -2.625 -1.942 236 H5' G 23 H5' G 23 6.046 -4.305 3.756 237 H5'' G 23 H5'' G 23 5.979 -3.899 2.031 238 H4' G 23 H4' G 23 8.152 -4.880 3.287 239 H3' G 23 H3' G 23 7.369 -4.966 0.397 240 H2' G 23 H2' G 23 9.185 -6.452 -0.073 241 HO2' G 23 HO2' G 23 10.559 -5.184 1.467 242 H1' G 23 H1' G 23 8.904 -8.045 2.209 243 H8 G 23 H8 G 23 7.887 -10.183 1.390 244 H1 G 23 H1 G 23 4.255 -7.081 -2.879 245 H21 G 23 H21 G 23 5.732 -4.275 -1.604 246 H22 G 23 H22 G 23 4.608 -4.944 -2.774 247 H5' A 24 H5' A 24 10.873 -4.419 -2.639 248 H5'' A 24 H5'' A 24 9.540 -5.484 -2.156 249 H4' A 24 H4' A 24 11.275 -6.881 -2.886 250 H3' A 24 H3' A 24 10.393 -7.163 -0.264 251 H2' A 24 H2' A 24 12.336 -6.518 0.863 252 HO2' A 24 HO2' A 24 13.101 -9.036 -0.265 253 H1' A 24 H1' A 24 14.055 -7.426 -1.508 254 H8 A 24 H8 A 24 13.351 -4.571 0.957 255 H61 A 24 H61 A 24 17.969 -3.173 1.648 256 H62 A 24 H62 A 24 19.496 -3.719 0.968 257 H2 A 24 H2 A 24 18.553 -7.013 -1.895 258 H5' A 25 H5' A 25 11.203 -10.888 -0.631 259 H5'' A 25 H5'' A 25 11.709 -12.407 -1.396 260 H4' A 25 H4' A 25 9.416 -12.610 -0.906 261 H3' A 25 H3' A 25 10.207 -13.120 -3.426 262 H2' A 25 H2' A 25 9.715 -10.934 -4.341 263 HO2' A 25 HO2' A 25 7.258 -11.257 -4.981 264 H1' A 25 H1' A 25 7.110 -10.954 -2.702 265 H8 A 25 H8 A 25 9.620 -8.331 -2.046 266 H61 A 25 H61 A 25 7.783 -4.696 -4.618 267 H62 A 25 H62 A 25 6.475 -4.561 -5.773 268 H2 A 25 H2 A 25 4.776 -8.682 -6.256 269 H5' G 26 H5' G 26 7.009 -15.594 -6.384 270 H5'' G 26 H5'' G 26 7.522 -13.931 -6.047 271 H4' G 26 H4' G 26 4.726 -14.850 -5.476 272 H3' G 26 H3' G 26 5.843 -14.293 -8.177 273 H2' G 26 H2' G 26 4.068 -12.767 -8.719 274 HO2' G 26 HO2' G 26 2.705 -14.299 -7.114 275 H1' G 26 H1' G 26 4.112 -11.341 -6.378 276 H8 G 26 H8 G 26 7.609 -12.555 -6.864 277 H1 G 26 H1 G 26 6.209 -7.302 -10.241 278 H21 G 26 H21 G 26 2.952 -7.996 -9.353 279 H22 G 26 H22 G 26 4.057 -6.933 -10.209 280 H5' U 27 H5' U 27 2.109 -14.046 -8.932 281 H5'' U 27 H5'' U 27 1.619 -15.172 -10.213 282 H4' U 27 H4' U 27 0.943 -13.011 -10.881 283 H3' U 27 H3' U 27 3.346 -13.997 -12.401 284 H2' U 27 H2' U 27 3.269 -11.969 -13.695 285 HO2' U 27 HO2' U 27 1.412 -11.000 -13.999 286 H1' U 27 H1' U 27 2.833 -10.290 -11.492 287 H3 U 27 H3 U 27 7.079 -9.487 -12.864 288 H5 U 27 H5 U 27 7.335 -12.983 -10.561 289 H6 U 27 H6 U 27 4.926 -13.008 -10.484 290 H5' A 28 H5' A 28 0.502 -12.709 -14.572 291 H5'' A 28 H5'' A 28 -0.234 -13.594 -15.923 292 H4' A 28 H4' A 28 0.115 -11.527 -16.841 293 H3' A 28 H3' A 28 2.466 -13.266 -17.541 294 H2' A 28 H2' A 28 3.425 -11.404 -18.730 295 HO2' A 28 HO2' A 28 1.013 -10.823 -19.283 296 H1' A 28 H1' A 28 2.790 -9.490 -16.770 297 H8 A 28 H8 A 28 3.911 -12.535 -14.921 298 H61 A 28 H61 A 28 8.682 -11.640 -14.897 299 H62 A 28 H62 A 28 9.702 -10.503 -15.761 300 H2 A 28 H2 A 28 6.990 -8.102 -18.400 301 H5' C 29 H5' C 29 1.050 -11.936 -21.072 302 H5'' C 29 H5'' C 29 1.100 -13.062 -22.442 303 H4' C 29 H4' C 29 2.444 -11.157 -22.956 304 H3' C 29 H3' C 29 3.996 -13.684 -22.458 305 HO3' C 29 H3T C 29 3.949 -12.271 -24.809 306 H2' C 29 H2' C 29 6.033 -12.486 -22.827 307 HO2' C 29 HO2' C 29 6.035 -10.479 -23.859 308 H1' C 29 H1' C 29 5.199 -10.097 -21.532 309 H41 C 29 H41 C 29 7.653 -13.892 -16.752 310 H42 C 29 H42 C 29 9.033 -13.131 -17.541 311 H5 C 29 H5 C 29 5.393 -13.640 -17.635 312 H6 C 29 H6 C 29 4.046 -12.605 -19.383 313 H1 B2R 101 H6 NCD 30 -1.929 -0.881 2.446 314 H2 B2R 101 H5 NCD 30 -3.386 -2.645 1.569 315 H3 B2R 101 H4 NCD 30 -5.302 -3.331 0.194 316 H4 B2R 101 H3 NCD 30 -7.176 -2.608 -1.359 317 H5 B2R 101 1H11 NCD 30 -1.070 1.194 2.224 318 H6 B2R 101 2H11 NCD 30 -1.838 2.520 1.298 319 H7 B2R 101 3H11 NCD 30 -2.425 2.103 2.927 320 H8 B2R 101 H23 NCD 30 -7.833 0.694 -2.277 321 H9 B2R 101 2H26 NCD 30 -9.429 0.607 -5.366 322 H10 B2R 101 1H26 NCD 30 -8.164 -0.635 -5.186 323 H11 B2R 101 2H27 NCD 30 -11.117 -1.356 -4.943 324 H12 B2R 101 1H27 NCD 30 -10.371 -1.214 -6.539 325 H13 B2R 101 2H28 NCD 30 -8.958 -2.930 -4.467 326 H14 B2R 101 1H28 NCD 30 -10.456 -3.558 -5.154 327 H30 B2R 101 1H35 NCD 30 -8.250 -2.618 -6.980 328 H16 B2R 101 1H34 NCD 30 -7.990 -4.753 -5.195 329 H17 B2R 101 2H34 NCD 30 -8.608 -5.514 -6.669 330 H18 B2R 101 2H33 NCD 30 -6.265 -3.613 -6.992 331 H19 B2R 101 1H33 NCD 30 -6.642 -5.137 -7.867 332 H20 B2R 101 2H32 NCD 30 -5.762 -6.494 -6.104 333 H21 B2R 101 1H32 NCD 30 -5.828 -5.177 -4.912 334 H22 B2R 101 H29 NCD 30 -2.406 -4.344 -5.333 335 H23 B2R 101 H14 NCD 30 -2.916 -1.074 -6.912 336 H24 B2R 101 H15 NCD 30 -1.490 0.881 -6.330 337 H25 B2R 101 H16 NCD 30 0.364 1.810 -4.929 338 H26 B2R 101 H17 NCD 30 2.058 1.439 -3.169 339 H27 B2R 101 1H22 NCD 30 3.022 -1.810 -2.066 340 H28 B2R 101 3H22 NCD 30 2.012 -1.006 -0.846 341 H29 B2R 101 2H22 NCD 30 3.230 -0.074 -1.759 342 H1 B2R 102 H6 NCD 31 2.427 -1.181 -5.488 343 H2 B2R 102 H5 NCD 31 0.796 -2.917 -6.121 344 H3 B2R 102 H4 NCD 31 0.070 -5.290 -6.033 345 H4 B2R 102 H3 NCD 31 0.555 -7.633 -5.177 346 H5 B2R 102 1H11 NCD 31 4.082 -0.481 -4.153 347 H6 B2R 102 2H11 NCD 31 4.945 -1.526 -2.993 348 H7 B2R 102 3H11 NCD 31 5.482 -1.443 -4.692 349 H8 B2R 102 H23 NCD 31 3.333 -8.507 -3.271 350 H9 B2R 102 2H26 NCD 31 1.305 -11.783 -4.709 351 H10 B2R 102 1H26 NCD 31 2.365 -12.583 -3.517 352 H11 B2R 102 1H27 NCD 31 0.629 -11.477 -1.768 353 H12 B2R 102 2H27 NCD 31 0.325 -13.055 -2.498 354 H13 B2R 102 1H28 NCD 31 -0.746 -10.447 -3.724 355 H14 B2R 102 2H28 NCD 31 -1.169 -12.096 -4.180 356 H30 B2R 102 1H35 NCD 31 -1.753 -11.242 -1.366 357 H16 B2R 102 1H34 NCD 31 -2.741 -9.824 -3.575 358 H17 B2R 102 2H34 NCD 31 -3.995 -11.017 -3.226 359 H18 B2R 102 1H33 NCD 31 -4.695 -9.928 -1.323 360 H19 B2R 102 2H33 NCD 31 -3.041 -9.473 -0.808 361 H20 B2R 102 1H32 NCD 31 -3.164 -7.796 -2.884 362 H21 B2R 102 2H32 NCD 31 -4.916 -8.056 -2.745 363 H22 B2R 102 H29 NCD 31 -3.382 -5.150 -0.728 364 H23 B2R 102 H14 NCD 31 -0.823 -6.260 1.691 365 H24 B2R 102 H15 NCD 31 0.815 -4.614 2.598 366 H25 B2R 102 H16 NCD 31 1.693 -2.231 2.591 367 H26 B2R 102 H17 NCD 31 1.519 0.058 1.693 368 H27 B2R 102 1H22 NCD 31 0.000 0.925 -1.242 369 H28 B2R 102 2H22 NCD 31 -1.334 1.183 -0.102 370 H29 B2R 102 3H22 NCD 31 0.332 1.642 0.361 Start of MODEL 4 1 H5' G 1 H5' G 1 18.029 -8.869 -17.773 2 H5'' G 1 H5'' G 1 19.085 -8.917 -19.196 3 H4' G 1 H4' G 1 17.782 -7.139 -20.237 4 H3' G 1 H3' G 1 16.147 -7.184 -17.706 5 H2' G 1 H2' G 1 14.205 -6.722 -19.043 6 HO2' G 1 HO2' G 1 14.427 -5.589 -20.814 7 H1' G 1 H1' G 1 14.903 -8.511 -21.101 8 H8 G 1 H8 G 1 15.462 -9.555 -17.452 9 H1 G 1 H1 G 1 9.866 -11.298 -20.046 10 H21 G 1 H21 G 1 10.884 -9.359 -22.716 11 H22 G 1 H22 G 1 9.635 -10.381 -22.017 12 HO5' G 1 H5T G 1 18.685 -6.422 -17.980 13 H5' U 2 H5' U 2 15.301 -4.170 -19.944 14 H5'' U 2 H5'' U 2 15.121 -2.530 -19.291 15 H4' U 2 H4' U 2 13.168 -2.821 -20.470 16 H3' U 2 H3' U 2 12.610 -3.520 -17.594 17 H2' U 2 H2' U 2 10.308 -3.883 -18.235 18 HO2' U 2 HO2' U 2 9.528 -2.852 -19.909 19 H1' U 2 H1' U 2 10.953 -5.411 -20.474 20 H3 U 2 H3 U 2 9.507 -8.463 -17.502 21 H5 U 2 H5 U 2 13.289 -7.357 -16.066 22 H6 U 2 H6 U 2 13.421 -5.765 -17.849 23 H5' A 3 H5' A 3 10.019 -1.232 -19.080 24 H5'' A 3 H5'' A 3 9.265 0.130 -18.227 25 H4' A 3 H4' A 3 7.533 -1.284 -18.998 26 H3' A 3 H3' A 3 7.960 -1.445 -16.025 27 H2' A 3 H2' A 3 6.142 -3.017 -15.908 28 HO2' A 3 HO2' A 3 5.209 -1.588 -17.842 29 H1' A 3 H1' A 3 6.803 -4.369 -18.300 30 H8 A 3 H8 A 3 10.058 -4.166 -16.599 31 H61 A 3 H61 A 3 9.616 -7.937 -13.567 32 H62 A 3 H62 A 3 8.277 -8.949 -13.086 33 H2 A 3 H2 A 3 4.681 -7.432 -15.309 34 H5' C 4 H5' C 4 4.252 -0.770 -16.678 35 H5'' C 4 H5'' C 4 3.310 0.403 -15.737 36 H4' C 4 H4' C 4 2.222 -1.653 -15.467 37 H3' C 4 H3' C 4 3.830 -0.906 -13.045 38 H2' C 4 H2' C 4 3.237 -2.972 -12.001 39 HO2' C 4 HO2' C 4 1.202 -3.515 -12.300 40 H1' C 4 H1' C 4 3.258 -4.531 -14.375 41 H41 C 4 H41 C 4 9.410 -4.906 -12.082 42 H42 C 4 H42 C 4 8.449 -6.005 -11.095 43 H5 C 4 H5 C 4 8.346 -3.424 -13.718 44 H6 C 4 H6 C 4 6.220 -2.785 -14.732 45 H5' U 5 H5' U 5 -0.149 -2.434 -12.469 46 H5'' U 5 H5'' U 5 -1.066 -1.321 -11.432 47 H4' U 5 H4' U 5 -1.644 -3.539 -10.820 48 H3' U 5 H3' U 5 -0.039 -2.013 -8.829 49 H2' U 5 H2' U 5 0.217 -3.915 -7.414 50 HO2' U 5 HO2' U 5 -2.160 -4.443 -8.143 51 H1' U 5 H1' U 5 0.601 -5.844 -9.401 52 H3 U 5 H3 U 5 4.571 -5.457 -7.280 53 H5 U 5 H5 U 5 4.357 -2.025 -9.677 54 H6 U 5 H6 U 5 2.172 -2.749 -10.380 55 H5' G 6 H5' G 6 -4.132 1.268 -9.101 56 H5'' G 6 H5'' G 6 -2.966 1.125 -7.774 57 H4' G 6 H4' G 6 -5.680 1.761 -7.613 58 H3' G 6 H3' G 6 -3.556 1.244 -5.559 59 H2' G 6 H2' G 6 -5.207 0.968 -3.872 60 HO2' G 6 HO2' G 6 -6.275 2.973 -4.969 61 H1' G 6 H1' G 6 -7.264 -0.059 -5.607 62 H8 G 6 H8 G 6 -7.340 -2.698 -5.649 63 H1 G 6 H1 G 6 -2.637 -2.751 -1.308 64 H21 G 6 H21 G 6 -2.203 0.544 -2.264 65 H22 G 6 H22 G 6 -1.688 -0.819 -1.260 66 H5' G 7 H5' G 7 -2.038 6.324 -6.306 67 H5'' G 7 H5'' G 7 -1.187 5.800 -4.840 68 H4' G 7 H4' G 7 -2.041 8.165 -4.859 69 H3' G 7 H3' G 7 -2.471 6.251 -2.630 70 H2' G 7 H2' G 7 -4.028 7.674 -1.514 71 HO2' G 7 HO2' G 7 -4.347 9.878 -2.338 72 H1' G 7 H1' G 7 -5.413 8.576 -3.753 73 H8 G 7 H8 G 7 -7.431 7.157 -4.291 74 H1 G 7 H1 G 7 -5.109 2.226 -0.957 75 H21 G 7 H21 G 7 -2.328 4.234 -0.534 76 H22 G 7 H22 G 7 -3.146 2.704 -0.188 77 H5' A 8 H5' A 8 -2.418 9.544 -0.579 78 H5'' A 8 H5'' A 8 -1.484 9.359 0.919 79 H4' A 8 H4' A 8 -3.892 7.773 0.984 80 H3' A 8 H3' A 8 -4.290 10.511 -0.032 81 H2' A 8 H2' A 8 -5.682 11.237 1.750 82 HO2' A 8 HO2' A 8 -6.967 9.322 1.717 83 H1' A 8 H1' A 8 -4.399 10.017 3.878 84 H8 A 8 H8 A 8 -1.942 11.203 1.221 85 H61 A 8 H61 A 8 -1.043 15.602 3.092 86 H62 A 8 H62 A 8 -1.767 16.502 4.413 87 H2 A 8 H2 A 8 -4.997 13.964 6.146 88 H5' A 9 H5' A 9 -9.623 9.329 -1.918 89 H5'' A 9 H5'' A 9 -9.282 9.115 -0.192 90 H4' A 9 H4' A 9 -10.561 7.339 -1.960 91 H3' A 9 H3' A 9 -9.878 7.291 0.943 92 H2' A 9 H2' A 9 -10.182 4.902 1.028 93 HO2' A 9 HO2' A 9 -11.895 5.344 -0.866 94 H1' A 9 H1' A 9 -8.722 4.322 -1.243 95 H8 A 9 H8 A 9 -7.124 7.367 0.028 96 H61 A 9 H61 A 9 -4.033 5.452 3.273 97 H62 A 9 H62 A 9 -3.870 3.858 3.979 98 H2 A 9 H2 A 9 -7.061 1.305 2.138 99 H5' C 10 H5' C 10 -13.016 5.489 0.645 100 H5'' C 10 H5'' C 10 -14.562 5.750 1.476 101 H4' C 10 H4' C 10 -14.045 3.619 2.112 102 H3' C 10 H3' C 10 -13.186 5.531 4.232 103 H2' C 10 H2' C 10 -12.073 3.809 5.460 104 HO2' C 10 HO2' C 10 -14.014 2.373 4.744 105 H1' C 10 H1' C 10 -11.010 2.418 3.264 106 H41 C 10 H41 C 10 -6.699 7.317 3.997 107 H42 C 10 H42 C 10 -6.153 6.011 5.047 108 H5 C 10 H5 C 10 -8.808 7.197 2.791 109 H6 C 10 H6 C 10 -10.870 5.906 2.527 110 H5' A 11 H5' A 11 -15.477 4.590 8.756 111 H5'' A 11 H5'' A 11 -14.207 5.418 7.830 112 H4' A 11 H4' A 11 -14.319 2.461 8.405 113 H3' A 11 H3' A 11 -12.924 4.663 9.878 114 H2' A 11 H2' A 11 -10.947 3.322 10.071 115 HO2' A 11 HO2' A 11 -12.675 1.375 10.170 116 H1' A 11 H1' A 11 -11.020 2.262 7.478 117 H8 A 11 H8 A 11 -11.711 5.426 6.215 118 H61 A 11 H61 A 11 -7.626 7.891 7.073 119 H62 A 11 H62 A 11 -6.216 7.605 8.070 120 H2 A 11 H2 A 11 -6.941 3.685 10.154 121 H5' U 12 H5' U 12 -12.573 1.755 12.226 122 H5'' U 12 H5'' U 12 -13.250 1.723 13.867 123 H4' U 12 H4' U 12 -11.015 1.227 14.183 124 H3' U 12 H3' U 12 -11.526 4.121 14.784 125 H2' U 12 H2' U 12 -9.192 4.475 15.165 126 HO2' U 12 HO2' U 12 -9.199 2.297 16.301 127 H1' U 12 H1' U 12 -8.263 2.780 13.094 128 H3 U 12 H3 U 12 -7.197 7.230 12.444 129 H5 U 12 H5 U 12 -10.746 6.493 10.348 130 H6 U 12 H6 U 12 -10.860 4.349 11.448 131 H5' G 13 H5' G 13 -11.616 5.818 18.846 132 H5'' G 13 H5'' G 13 -11.145 7.006 17.615 133 H4' G 13 H4' G 13 -9.447 4.873 18.889 134 H3' G 13 H3' G 13 -9.462 7.863 19.101 135 H2' G 13 H2' G 13 -7.057 7.883 19.141 136 HO2' G 13 HO2' G 13 -7.265 5.670 20.351 137 H1' G 13 H1' G 13 -6.715 6.102 17.038 138 H8 G 13 H8 G 13 -9.630 7.755 15.732 139 H1 G 13 H1 G 13 -4.596 11.720 15.920 140 H21 G 13 H21 G 13 -3.233 9.352 18.017 141 H22 G 13 H22 G 13 -3.045 10.899 17.209 142 H5' U 14 H5' U 14 -7.607 9.907 20.837 143 H5'' U 14 H5'' U 14 -8.136 9.445 22.466 144 H4' U 14 H4' U 14 -8.084 11.950 21.674 145 H3' U 14 H3' U 14 -9.125 10.848 23.893 146 H2' U 14 H2' U 14 -11.299 10.291 22.991 147 HO2' U 14 HO2' U 14 -11.157 12.513 24.493 148 H1' U 14 H1' U 14 -11.300 12.991 21.525 149 H3 U 14 H3 U 14 -15.501 11.769 20.339 150 H5 U 14 H5 U 14 -13.008 8.861 18.618 151 H6 U 14 H6 U 14 -11.179 9.809 19.862 152 H5' U 15 H5' U 15 -7.951 14.511 23.111 153 H5'' U 15 H5'' U 15 -6.417 14.764 23.965 154 H4' U 15 H4' U 15 -7.045 16.854 23.116 155 H3' U 15 H3' U 15 -6.533 16.732 25.742 156 H2' U 15 H2' U 15 -8.829 16.370 26.453 157 HO2' U 15 HO2' U 15 -9.614 18.559 27.055 158 H1' U 15 H1' U 15 -9.640 18.549 24.436 159 H3 U 15 H3 U 15 -13.767 18.190 26.228 160 H5 U 15 H5 U 15 -12.923 14.344 24.789 161 H6 U 15 H6 U 15 -10.675 15.086 24.347 162 H5' U 16 H5' U 16 -3.864 20.007 22.539 163 H5'' U 16 H5'' U 16 -5.215 20.311 21.431 164 H4' U 16 H4' U 16 -3.865 17.686 21.221 165 H3' U 16 H3' U 16 -2.018 19.623 21.326 166 H2' U 16 H2' U 16 -3.089 21.081 19.686 167 HO2' U 16 HO2' U 16 -0.879 19.827 18.950 168 H1' U 16 H1' U 16 -3.507 18.536 18.003 169 H3 U 16 H3 U 16 -6.715 22.743 17.833 170 H5 U 16 H5 U 16 -5.545 20.506 14.481 171 H6 U 16 H6 U 16 -4.197 19.157 15.950 172 H5' C 17 H5' C 17 -1.267 15.691 19.518 173 H5'' C 17 H5'' C 17 0.095 14.996 20.415 174 H4' C 17 H4' C 17 0.882 13.989 18.627 175 H3' C 17 H3' C 17 1.300 16.615 17.673 176 H2' C 17 H2' C 17 -0.420 16.602 16.045 177 HO2' C 17 HO2' C 17 1.830 15.265 15.137 178 H1' C 17 H1' C 17 -0.152 13.535 15.948 179 H41 C 17 H41 C 17 -5.712 15.017 12.801 180 H42 C 17 H42 C 17 -6.112 13.587 13.749 181 H5 C 17 H5 C 17 -3.590 16.189 13.117 182 H6 C 17 H6 C 17 -1.479 16.189 14.340 183 H5' A 18 H5' A 18 2.481 11.972 15.085 184 H5'' A 18 H5'' A 18 0.913 12.693 14.669 185 H4' A 18 H4' A 18 1.204 10.185 16.311 186 H3' A 18 H3' A 18 1.015 10.396 13.309 187 H2' A 18 H2' A 18 -0.407 8.473 13.335 188 HO2' A 18 HO2' A 18 1.093 7.487 14.978 189 H1' A 18 H1' A 18 -1.687 9.148 15.810 190 H8 A 18 H8 A 18 -1.787 12.022 13.353 191 H61 A 18 H61 A 18 -5.987 10.813 11.140 192 H62 A 18 H62 A 18 -7.019 9.390 11.241 193 H2 A 18 H2 A 18 -5.089 6.563 14.098 194 H5' U 19 H5' U 19 1.491 6.446 11.126 195 H5'' U 19 H5'' U 19 0.409 7.622 11.896 196 H4' U 19 H4' U 19 0.674 5.046 13.291 197 H3' U 19 H3' U 19 -0.305 5.086 10.467 198 H2' U 19 H2' U 19 -2.238 3.785 11.072 199 HO2' U 19 HO2' U 19 -0.621 2.984 13.050 200 H1' U 19 H1' U 19 -2.944 5.288 13.256 201 H3 U 19 H3 U 19 -5.355 6.343 9.421 202 H5 U 19 H5 U 19 -2.349 9.244 9.879 203 H6 U 19 H6 U 19 -1.411 7.873 11.626 204 H5' G 20 H5' G 20 -0.660 1.582 12.023 205 H5'' G 20 H5'' G 20 0.437 0.300 11.479 206 H4' G 20 H4' G 20 -1.525 -0.834 11.821 207 H3' G 20 H3' G 20 -1.045 -0.272 8.970 208 H2' G 20 H2' G 20 -3.266 -0.727 8.263 209 HO2' G 20 HO2' G 20 -3.277 -2.711 9.577 210 H1' G 20 H1' G 20 -4.675 0.230 10.475 211 H8 G 20 H8 G 20 -2.057 2.772 9.864 212 H1 G 20 H1 G 20 -7.100 3.261 5.942 213 H21 G 20 H21 G 20 -7.922 0.126 7.135 214 H22 G 20 H22 G 20 -8.343 1.465 6.078 215 H5' U 21 H5' U 21 -3.060 -5.470 8.142 216 H5'' U 21 H5'' U 21 -1.527 -5.209 7.287 217 H4' U 21 H4' U 21 -3.861 -5.424 6.036 218 H3' U 21 H3' U 21 -1.408 -3.909 5.258 219 H2' U 21 H2' U 21 -2.562 -2.686 3.593 220 HO2' U 21 HO2' U 21 -3.635 -5.050 3.232 221 H1' U 21 H1' U 21 -5.187 -2.793 4.797 222 H3 U 21 H3 U 21 -4.667 1.573 3.933 223 H5 U 21 H5 U 21 -1.832 0.825 6.935 224 H6 U 21 H6 U 21 -2.470 -1.495 6.852 225 H5' G 22 H5' G 22 -1.174 -8.699 2.864 226 H5'' G 22 H5'' G 22 -0.054 -9.152 4.161 227 H4' G 22 H4' G 22 1.551 -9.481 2.698 228 H3' G 22 H3' G 22 1.239 -6.571 2.111 229 H2' G 22 H2' G 22 2.231 -6.795 -0.035 230 HO2' G 22 HO2' G 22 3.844 -8.305 1.259 231 H1' G 22 H1' G 22 1.437 -9.507 -0.542 232 H8 G 22 H8 G 22 -1.187 -9.643 -1.461 233 H1 G 22 H1 G 22 -0.313 -3.510 -3.060 234 H21 G 22 H21 G 22 2.288 -3.641 -0.781 235 H22 G 22 H22 G 22 1.345 -2.699 -1.943 236 H5' G 23 H5' G 23 5.962 -5.235 4.412 237 H5'' G 23 H5'' G 23 5.853 -4.211 2.969 238 H4' G 23 H4' G 23 8.126 -5.251 3.699 239 H3' G 23 H3' G 23 7.125 -4.914 0.897 240 H2' G 23 H2' G 23 9.060 -6.068 0.058 241 HO2' G 23 HO2' G 23 10.723 -6.723 1.647 242 H1' G 23 H1' G 23 9.054 -8.100 1.954 243 H8 G 23 H8 G 23 7.905 -10.130 1.044 244 H1 G 23 H1 G 23 4.258 -6.596 -2.841 245 H21 G 23 H21 G 23 5.816 -3.931 -1.348 246 H22 G 23 H22 G 23 4.659 -4.475 -2.555 247 H5' A 24 H5' A 24 9.628 -3.619 -2.324 248 H5'' A 24 H5'' A 24 8.718 -4.950 -1.587 249 H4' A 24 H4' A 24 10.382 -5.882 -3.000 250 H3' A 24 H3' A 24 10.168 -6.875 -0.559 251 H2' A 24 H2' A 24 11.662 -5.372 0.550 252 HO2' A 24 HO2' A 24 12.979 -7.740 -0.260 253 H1' A 24 H1' A 24 13.678 -5.697 -1.725 254 H8 A 24 H8 A 24 11.843 -3.223 0.550 255 H61 A 24 H61 A 24 15.517 -0.075 1.193 256 H62 A 24 H62 A 24 17.148 -0.010 0.543 257 H2 A 24 H2 A 24 17.661 -3.537 -2.139 258 H5' A 25 H5' A 25 10.878 -11.739 -0.848 259 H5'' A 25 H5'' A 25 11.045 -12.226 -2.547 260 H4' A 25 H4' A 25 8.721 -12.219 -1.172 261 H3' A 25 H3' A 25 9.269 -12.984 -3.679 262 H2' A 25 H2' A 25 9.378 -10.697 -4.569 263 HO2' A 25 HO2' A 25 6.717 -11.735 -4.834 264 H1' A 25 H1' A 25 6.762 -10.261 -2.990 265 H8 A 25 H8 A 25 9.597 -7.932 -2.364 266 H61 A 25 H61 A 25 8.112 -4.149 -5.055 267 H62 A 25 H62 A 25 6.811 -3.955 -6.227 268 H2 A 25 H2 A 25 4.685 -7.859 -6.519 269 H5' G 26 H5' G 26 6.704 -14.923 -6.385 270 H5'' G 26 H5'' G 26 7.038 -13.321 -5.699 271 H4' G 26 H4' G 26 4.206 -14.141 -5.756 272 H3' G 26 H3' G 26 5.737 -13.876 -8.319 273 H2' G 26 H2' G 26 3.982 -12.511 -9.239 274 HO2' G 26 HO2' G 26 2.489 -13.948 -7.635 275 H1' G 26 H1' G 26 3.601 -10.938 -6.973 276 H8 G 26 H8 G 26 7.247 -11.671 -7.207 277 H1 G 26 H1 G 26 5.340 -6.881 -11.008 278 H21 G 26 H21 G 26 2.159 -7.993 -10.266 279 H22 G 26 H22 G 26 3.152 -6.827 -11.124 280 H5' U 27 H5' U 27 2.129 -14.362 -9.326 281 H5'' U 27 H5'' U 27 1.750 -15.610 -10.528 282 H4' U 27 H4' U 27 0.834 -13.626 -11.358 283 H3' U 27 H3' U 27 3.405 -14.284 -12.778 284 H2' U 27 H2' U 27 3.027 -12.332 -14.162 285 HO2' U 27 HO2' U 27 0.479 -12.830 -13.500 286 H1' U 27 H1' U 27 2.331 -10.668 -12.029 287 H3 U 27 H3 U 27 6.463 -9.342 -13.319 288 H5 U 27 H5 U 27 7.107 -12.605 -10.750 289 H6 U 27 H6 U 27 4.734 -12.988 -10.789 290 H5' A 28 H5' A 28 0.696 -13.360 -15.161 291 H5'' A 28 H5'' A 28 0.106 -14.416 -16.460 292 H4' A 28 H4' A 28 0.351 -12.436 -17.569 293 H3' A 28 H3' A 28 2.905 -13.984 -17.916 294 H2' A 28 H2' A 28 3.814 -12.158 -19.163 295 HO2' A 28 HO2' A 28 2.497 -11.096 -20.418 296 H1' A 28 H1' A 28 2.689 -10.123 -17.546 297 H8 A 28 H8 A 28 4.133 -12.739 -15.305 298 H61 A 28 H61 A 28 8.696 -11.095 -15.108 299 H62 A 28 H62 A 28 9.583 -9.881 -16.000 300 H2 A 28 H2 A 28 6.714 -8.153 -18.984 301 H5' C 29 H5' C 29 1.771 -12.820 -21.296 302 H5'' C 29 H5'' C 29 1.655 -13.855 -22.734 303 H4' C 29 H4' C 29 3.063 -12.184 -23.442 304 H3' C 29 H3' C 29 4.755 -14.477 -22.477 305 HO3' C 29 H3T C 29 3.847 -14.952 -24.310 306 H2' C 29 H2' C 29 6.716 -13.195 -22.990 307 HO2' C 29 HO2' C 29 5.285 -12.305 -24.912 308 H1' C 29 H1' C 29 5.691 -10.750 -22.011 309 H41 C 29 H41 C 29 8.020 -13.910 -16.722 310 H42 C 29 H42 C 29 9.375 -13.044 -17.443 311 H5 C 29 H5 C 29 5.840 -13.986 -17.812 312 H6 C 29 H6 C 29 4.555 -13.234 -19.741 313 H1 B2R 101 H6 NCD 30 -2.227 -1.050 2.371 314 H2 B2R 101 H5 NCD 30 -3.890 -2.709 1.640 315 H3 B2R 101 H4 NCD 30 -5.842 -3.259 0.316 316 H4 B2R 101 H3 NCD 30 -7.627 -2.523 -1.326 317 H5 B2R 101 1H11 NCD 30 -1.142 0.889 2.021 318 H6 B2R 101 2H11 NCD 30 -1.691 2.171 0.896 319 H7 B2R 101 3H11 NCD 30 -2.387 2.052 2.524 320 H8 B2R 101 H23 NCD 30 -7.774 0.901 -2.545 321 H9 B2R 101 2H26 NCD 30 -10.089 1.042 -5.642 322 H10 B2R 101 1H26 NCD 30 -8.343 0.777 -5.512 323 H11 B2R 101 2H27 NCD 30 -9.282 -1.798 -5.121 324 H12 B2R 101 1H27 NCD 30 -10.587 -1.157 -6.111 325 H13 B2R 101 2H28 NCD 30 -9.136 -0.679 -7.980 326 H14 B2R 101 1H28 NCD 30 -7.664 -0.894 -7.038 327 H30 B2R 101 1H35 NCD 30 -9.232 -2.877 -8.453 328 H16 B2R 101 1H34 NCD 30 -7.051 -3.326 -8.975 329 H17 B2R 101 2H34 NCD 30 -6.477 -2.487 -7.531 330 H18 B2R 101 2H33 NCD 30 -7.624 -5.354 -7.568 331 H19 B2R 101 1H33 NCD 30 -6.967 -4.509 -6.128 332 H20 B2R 101 2H32 NCD 30 -5.085 -4.715 -8.459 333 H21 B2R 101 1H32 NCD 30 -5.521 -6.253 -7.679 334 H22 B2R 101 H29 NCD 30 -2.597 -4.361 -5.385 335 H23 B2R 101 H14 NCD 30 -3.159 -1.083 -6.772 336 H24 B2R 101 H15 NCD 30 -1.744 0.902 -6.165 337 H25 B2R 101 H16 NCD 30 0.130 1.822 -4.788 338 H26 B2R 101 H17 NCD 30 1.881 1.424 -3.092 339 H27 B2R 101 1H22 NCD 30 1.951 -1.307 -0.904 340 H28 B2R 101 3H22 NCD 30 2.997 -0.054 -1.622 341 H29 B2R 101 2H22 NCD 30 3.055 -1.731 -2.223 342 H1 B2R 102 H6 NCD 31 2.660 -0.880 -5.709 343 H2 B2R 102 H5 NCD 31 1.121 -2.645 -6.463 344 H3 B2R 102 H4 NCD 31 0.332 -5.011 -6.296 345 H4 B2R 102 H3 NCD 31 0.599 -7.272 -5.187 346 H5 B2R 102 1H11 NCD 31 5.042 -1.269 -2.905 347 H6 B2R 102 2H11 NCD 31 5.356 -0.899 -4.615 348 H7 B2R 102 3H11 NCD 31 3.981 -0.127 -3.782 349 H8 B2R 102 H23 NCD 31 3.025 -7.966 -2.748 350 H9 B2R 102 2H26 NCD 31 1.857 -11.340 -4.295 351 H10 B2R 102 1H26 NCD 31 2.698 -11.891 -2.819 352 H11 B2R 102 1H27 NCD 31 0.384 -11.397 -1.627 353 H12 B2R 102 2H27 NCD 31 0.599 -12.913 -2.508 354 H13 B2R 102 1H28 NCD 31 -0.745 -10.381 -3.639 355 H14 B2R 102 2H28 NCD 31 -0.484 -11.876 -4.535 356 H30 B2R 102 1H35 NCD 31 -1.916 -13.067 -2.881 357 H16 B2R 102 1H34 NCD 31 -3.015 -12.154 -1.109 358 H17 B2R 102 2H34 NCD 31 -1.644 -11.042 -1.130 359 H18 B2R 102 1H33 NCD 31 -2.973 -9.389 -2.468 360 H19 B2R 102 2H33 NCD 31 -4.330 -10.557 -2.580 361 H20 B2R 102 1H32 NCD 31 -5.150 -9.926 -0.553 362 H21 B2R 102 2H32 NCD 31 -3.558 -10.068 0.233 363 H22 B2R 102 H29 NCD 31 -3.551 -5.964 -0.644 364 H23 B2R 102 H14 NCD 31 -1.239 -6.723 2.078 365 H24 B2R 102 H15 NCD 31 0.325 -5.040 3.004 366 H25 B2R 102 H16 NCD 31 1.256 -2.714 2.904 367 H26 B2R 102 H17 NCD 31 1.257 -0.504 1.824 368 H27 B2R 102 1H22 NCD 31 0.003 0.151 -1.333 369 H28 B2R 102 2H22 NCD 31 -1.323 0.604 -0.258 370 H29 B2R 102 3H22 NCD 31 0.365 0.958 0.216 Start of MODEL 5 1 H5' G 1 H5' G 1 19.568 -5.841 -16.775 2 H5'' G 1 H5'' G 1 20.846 -5.262 -17.859 3 H4' G 1 H4' G 1 19.437 -3.623 -18.812 4 H3' G 1 H3' G 1 17.492 -4.182 -16.581 5 H2' G 1 H2' G 1 15.717 -3.616 -18.109 6 HO2' G 1 HO2' G 1 16.127 -2.198 -19.625 7 H1' G 1 H1' G 1 16.782 -5.090 -20.239 8 H8 G 1 H8 G 1 17.168 -6.625 -16.767 9 H1 G 1 H1 G 1 11.794 -8.194 -19.883 10 H21 G 1 H21 G 1 12.810 -5.806 -22.158 11 H22 G 1 H22 G 1 11.591 -6.985 -21.686 12 HO5' G 1 H5T G 1 19.713 -3.325 -16.202 13 H5' U 2 H5' U 2 16.752 -0.966 -18.377 14 H5'' U 2 H5'' U 2 16.410 0.594 -17.603 15 H4' U 2 H4' U 2 14.646 0.335 -19.061 16 H3' U 2 H3' U 2 13.810 -0.495 -16.307 17 H2' U 2 H2' U 2 11.647 -1.128 -17.152 18 HO2' U 2 HO2' U 2 12.191 0.785 -18.886 19 H1' U 2 H1' U 2 12.575 -2.373 -19.470 20 H3 U 2 H3 U 2 11.154 -5.824 -16.949 21 H5 U 2 H5 U 2 14.876 -4.796 -15.319 22 H6 U 2 H6 U 2 14.927 -2.914 -16.799 23 H5' A 3 H5' A 3 10.954 1.407 -17.689 24 H5'' A 3 H5'' A 3 10.081 2.628 -16.744 25 H4' A 3 H4' A 3 8.493 1.002 -17.290 26 H3' A 3 H3' A 3 9.396 0.630 -14.438 27 H2' A 3 H2' A 3 7.810 -1.164 -14.272 28 HO2' A 3 HO2' A 3 6.303 0.245 -15.652 29 H1' A 3 H1' A 3 8.263 -2.128 -16.913 30 H8 A 3 H8 A 3 11.604 -1.672 -15.393 31 H61 A 3 H61 A 3 11.944 -5.874 -12.947 32 H62 A 3 H62 A 3 10.779 -7.143 -12.600 33 H2 A 3 H2 A 3 6.889 -5.913 -14.409 34 H5' C 4 H5' C 4 4.997 1.140 -14.412 35 H5'' C 4 H5'' C 4 4.542 1.722 -12.799 36 H4' C 4 H4' C 4 3.498 -0.438 -13.494 37 H3' C 4 H3' C 4 5.141 -0.334 -10.973 38 H2' C 4 H2' C 4 4.495 -2.595 -10.551 39 HO2' C 4 HO2' C 4 2.460 -2.039 -12.408 40 H1' C 4 H1' C 4 4.800 -3.384 -13.244 41 H41 C 4 H41 C 4 10.836 -3.816 -10.649 42 H42 C 4 H42 C 4 9.903 -5.096 -9.871 43 H5 C 4 H5 C 4 9.746 -2.183 -12.118 44 H6 C 4 H6 C 4 7.626 -1.531 -13.135 45 H5' U 5 H5' U 5 0.497 -2.591 -12.312 46 H5'' U 5 H5'' U 5 -0.851 -1.572 -11.769 47 H4' U 5 H4' U 5 -1.360 -3.595 -10.822 48 H3' U 5 H3' U 5 0.033 -1.893 -8.797 49 H2' U 5 H2' U 5 0.086 -3.701 -7.235 50 HO2' U 5 HO2' U 5 -2.184 -4.284 -8.337 51 H1' U 5 H1' U 5 0.675 -5.745 -9.073 52 H3 U 5 H3 U 5 4.548 -5.587 -6.822 53 H5 U 5 H5 U 5 4.380 -1.840 -8.684 54 H6 U 5 H6 U 5 2.261 -2.478 -9.625 55 H5' G 6 H5' G 6 -3.959 1.565 -9.074 56 H5'' G 6 H5'' G 6 -2.799 1.466 -7.737 57 H4' G 6 H4' G 6 -5.533 1.989 -7.591 58 H3' G 6 H3' G 6 -3.441 1.470 -5.494 59 H2' G 6 H2' G 6 -5.159 1.270 -3.863 60 HO2' G 6 HO2' G 6 -6.201 3.231 -5.030 61 H1' G 6 H1' G 6 -7.109 0.135 -5.644 62 H8 G 6 H8 G 6 -7.113 -2.507 -5.561 63 H1 G 6 H1 G 6 -2.452 -2.242 -1.190 64 H21 G 6 H21 G 6 -2.144 1.040 -2.221 65 H22 G 6 H22 G 6 -1.600 -0.279 -1.173 66 H5' G 7 H5' G 7 -2.018 6.550 -6.449 67 H5'' G 7 H5'' G 7 -1.003 6.128 -5.057 68 H4' G 7 H4' G 7 -1.918 8.425 -4.995 69 H3' G 7 H3' G 7 -2.278 6.509 -2.759 70 H2' G 7 H2' G 7 -3.873 7.874 -1.630 71 HO2' G 7 HO2' G 7 -2.436 9.783 -2.330 72 H1' G 7 H1' G 7 -5.284 8.792 -3.843 73 H8 G 7 H8 G 7 -7.263 7.333 -4.452 74 H1 G 7 H1 G 7 -4.946 2.477 -0.998 75 H21 G 7 H21 G 7 -2.154 4.476 -0.635 76 H22 G 7 H22 G 7 -2.978 2.956 -0.247 77 H5' A 8 H5' A 8 -2.079 7.097 1.101 78 H5'' A 8 H5'' A 8 -3.189 7.008 -0.279 79 H4' A 8 H4' A 8 -4.377 7.734 1.672 80 H3' A 8 H3' A 8 -4.090 9.800 -0.487 81 H2' A 8 H2' A 8 -5.281 11.367 0.889 82 HO2' A 8 HO2' A 8 -6.834 9.987 1.768 83 H1' A 8 H1' A 8 -3.868 10.834 3.219 84 H8 A 8 H8 A 8 -1.600 10.439 0.246 85 H61 A 8 H61 A 8 -0.031 15.029 -0.098 86 H62 A 8 H62 A 8 -0.532 16.523 0.678 87 H2 A 8 H2 A 8 -3.887 15.514 3.440 88 H5' A 9 H5' A 9 -8.984 8.814 -2.429 89 H5'' A 9 H5'' A 9 -10.093 9.404 -1.175 90 H4' A 9 H4' A 9 -10.838 7.271 -1.980 91 H3' A 9 H3' A 9 -9.866 7.344 0.852 92 H2' A 9 H2' A 9 -10.261 4.977 1.056 93 HO2' A 9 HO2' A 9 -12.147 5.422 -0.647 94 H1' A 9 H1' A 9 -9.096 4.279 -1.368 95 H8 A 9 H8 A 9 -7.045 7.141 -0.183 96 H61 A 9 H61 A 9 -4.043 4.757 2.812 97 H62 A 9 H62 A 9 -4.052 3.134 3.480 98 H2 A 9 H2 A 9 -7.653 1.059 1.811 99 H5' C 10 H5' C 10 -13.654 6.280 1.077 100 H5'' C 10 H5'' C 10 -14.750 6.654 2.423 101 H4' C 10 H4' C 10 -14.016 4.364 2.551 102 H3' C 10 H3' C 10 -13.194 6.225 4.730 103 H2' C 10 H2' C 10 -11.712 4.647 5.680 104 HO2' C 10 HO2' C 10 -13.682 3.083 5.287 105 H1' C 10 H1' C 10 -11.154 3.165 3.267 106 H41 C 10 H41 C 10 -5.967 7.106 3.807 107 H42 C 10 H42 C 10 -5.607 5.716 4.826 108 H5 C 10 H5 C 10 -8.147 7.417 2.765 109 H6 C 10 H6 C 10 -10.422 6.531 2.622 110 H5' A 11 H5' A 11 -15.281 5.556 8.618 111 H5'' A 11 H5'' A 11 -13.906 6.632 8.932 112 H4' A 11 H4' A 11 -14.018 3.713 8.659 113 H3' A 11 H3' A 11 -12.376 5.682 10.207 114 H2' A 11 H2' A 11 -10.529 4.176 10.252 115 HO2' A 11 HO2' A 11 -12.287 2.422 10.626 116 H1' A 11 H1' A 11 -10.933 3.069 7.668 117 H8 A 11 H8 A 11 -10.996 6.233 6.361 118 H61 A 11 H61 A 11 -6.494 7.910 7.037 119 H62 A 11 H62 A 11 -5.118 7.356 7.967 120 H2 A 11 H2 A 11 -6.496 3.693 10.181 121 H5' U 12 H5' U 12 -12.821 2.766 13.461 122 H5'' U 12 H5'' U 12 -12.980 3.737 14.937 123 H4' U 12 H4' U 12 -10.952 2.347 14.894 124 H3' U 12 H3' U 12 -10.688 5.323 15.150 125 H2' U 12 H2' U 12 -8.294 5.111 15.146 126 HO2' U 12 HO2' U 12 -8.497 3.103 16.478 127 H1' U 12 H1' U 12 -8.157 3.211 13.094 128 H3 U 12 H3 U 12 -6.687 7.474 11.928 129 H5 U 12 H5 U 12 -10.560 6.954 10.401 130 H6 U 12 H6 U 12 -10.730 4.956 11.736 131 H5' G 13 H5' G 13 -10.052 7.554 18.757 132 H5'' G 13 H5'' G 13 -9.295 8.253 17.313 133 H4' G 13 H4' G 13 -7.985 6.728 19.550 134 H3' G 13 H3' G 13 -7.981 9.605 18.781 135 H2' G 13 H2' G 13 -5.609 9.792 19.057 136 HO2' G 13 HO2' G 13 -5.873 8.213 20.966 137 H1' G 13 H1' G 13 -4.908 7.460 17.753 138 H8 G 13 H8 G 13 -8.017 8.762 16.102 139 H1 G 13 H1 G 13 -2.625 11.631 14.166 140 H21 G 13 H21 G 13 -1.156 9.911 16.765 141 H22 G 13 H22 G 13 -0.954 11.024 15.418 142 H5' U 14 H5' U 14 -7.564 12.500 23.082 143 H5'' U 14 H5'' U 14 -8.839 12.777 21.881 144 H4' U 14 H4' U 14 -5.926 13.501 21.721 145 H3' U 14 H3' U 14 -7.830 15.097 22.715 146 H2' U 14 H2' U 14 -9.332 14.977 20.814 147 HO2' U 14 HO2' U 14 -8.086 17.233 21.190 148 H1' U 14 H1' U 14 -6.869 15.317 19.001 149 H3 U 14 H3 U 14 -9.671 15.451 15.504 150 H5 U 14 H5 U 14 -10.774 11.935 17.501 151 H6 U 14 H6 U 14 -9.234 12.537 19.252 152 H5' U 15 H5' U 15 -4.409 18.400 20.278 153 H5'' U 15 H5'' U 15 -4.170 16.906 21.206 154 H4' U 15 H4' U 15 -3.334 19.494 22.413 155 H3' U 15 H3' U 15 -2.023 18.375 19.994 156 H2' U 15 H2' U 15 0.148 18.352 21.000 157 HO2' U 15 HO2' U 15 -0.687 20.464 22.177 158 H1' U 15 H1' U 15 -0.577 17.341 23.466 159 H3 U 15 H3 U 15 1.336 13.946 21.078 160 H5 U 15 H5 U 15 -2.751 13.815 20.169 161 H6 U 15 H6 U 15 -2.993 15.930 21.292 162 H5' U 16 H5' U 16 0.972 21.424 17.414 163 H5'' U 16 H5'' U 16 -0.691 21.439 16.795 164 H4' U 16 H4' U 16 0.172 18.737 17.122 165 H3' U 16 H3' U 16 2.491 20.003 16.613 166 H2' U 16 H2' U 16 1.710 21.194 14.638 167 HO2' U 16 HO2' U 16 3.438 19.333 14.234 168 H1' U 16 H1' U 16 0.358 18.551 13.821 169 H3 U 16 H3 U 16 -1.289 23.376 12.381 170 H5 U 16 H5 U 16 -1.642 19.930 10.021 171 H6 U 16 H6 U 16 -0.566 18.701 11.788 172 H5' C 17 H5' C 17 2.056 15.611 15.839 173 H5'' C 17 H5'' C 17 3.418 14.763 16.597 174 H4' C 17 H4' C 17 3.750 13.447 14.845 175 H3' C 17 H3' C 17 4.143 15.786 13.373 176 H2' C 17 H2' C 17 1.942 15.882 12.448 177 HO2' C 17 HO2' C 17 3.640 14.216 10.992 178 H1' C 17 H1' C 17 1.969 12.799 12.572 179 H41 C 17 H41 C 17 -4.146 14.382 10.854 180 H42 C 17 H42 C 17 -4.384 13.283 12.205 181 H5 C 17 H5 C 17 -1.919 15.225 10.288 182 H6 C 17 H6 C 17 0.444 15.166 10.892 183 H5' A 18 H5' A 18 4.013 10.412 11.687 184 H5'' A 18 H5'' A 18 2.536 11.333 11.339 185 H4' A 18 H4' A 18 2.794 9.384 13.624 186 H3' A 18 H3' A 18 1.769 8.832 10.833 187 H2' A 18 H2' A 18 0.234 7.295 11.865 188 HO2' A 18 HO2' A 18 1.047 6.225 13.508 189 H1' A 18 H1' A 18 -0.268 9.010 14.088 190 H8 A 18 H8 A 18 -0.474 10.982 10.907 191 H61 A 18 H61 A 18 -5.180 10.125 9.849 192 H62 A 18 H62 A 18 -6.360 9.015 10.520 193 H2 A 18 H2 A 18 -4.306 6.663 13.715 194 H5' U 19 H5' U 19 2.804 5.336 12.793 195 H5'' U 19 H5'' U 19 3.221 3.932 11.791 196 H4' U 19 H4' U 19 1.311 3.540 13.301 197 H3' U 19 H3' U 19 0.983 3.197 10.345 198 H2' U 19 H2' U 19 -1.351 2.759 10.613 199 HO2' U 19 HO2' U 19 -0.704 1.396 12.568 200 H1' U 19 H1' U 19 -1.790 4.543 12.778 201 H3 U 19 H3 U 19 -4.334 5.772 9.146 202 H5 U 19 H5 U 19 -0.703 7.858 8.859 203 H6 U 19 H6 U 19 0.148 6.466 10.626 204 H5' G 20 H5' G 20 -1.062 -0.560 12.622 205 H5'' G 20 H5'' G 20 -0.388 -1.765 11.507 206 H4' G 20 H4' G 20 -2.840 -1.944 11.911 207 H3' G 20 H3' G 20 -1.599 -1.884 9.226 208 H2' G 20 H2' G 20 -3.592 -1.372 8.075 209 HO2' G 20 HO2' G 20 -4.450 -3.291 9.452 210 H1' G 20 H1' G 20 -5.071 -0.181 10.242 211 H8 G 20 H8 G 20 -1.921 1.699 9.572 212 H1 G 20 H1 G 20 -6.852 3.339 5.811 213 H21 G 20 H21 G 20 -8.319 0.477 7.092 214 H22 G 20 H22 G 20 -8.470 1.850 6.015 215 H5' U 21 H5' U 21 -1.519 -4.866 6.351 216 H5'' U 21 H5'' U 21 -2.491 -3.410 6.641 217 H4' U 21 H4' U 21 -3.697 -6.097 6.020 218 H3' U 21 H3' U 21 -2.446 -4.228 4.115 219 H2' U 21 H2' U 21 -4.389 -3.873 2.796 220 HO2' U 21 HO2' U 21 -4.772 -6.413 3.449 221 H1' U 21 H1' U 21 -6.335 -3.889 4.784 222 H3 U 21 H3 U 21 -5.846 0.411 3.178 223 H5 U 21 H5 U 21 -3.108 0.013 6.310 224 H6 U 21 H6 U 21 -3.673 -2.315 6.438 225 H5' G 22 H5' G 22 -0.544 -9.647 3.375 226 H5'' G 22 H5'' G 22 0.589 -8.630 4.289 227 H4' G 22 H4' G 22 1.796 -9.540 2.485 228 H3' G 22 H3' G 22 1.137 -6.640 2.022 229 H2' G 22 H2' G 22 2.262 -6.769 -0.087 230 HO2' G 22 HO2' G 22 3.953 -8.115 1.126 231 H1' G 22 H1' G 22 1.489 -9.475 -0.633 232 H8 G 22 H8 G 22 -1.172 -9.604 -1.534 233 H1 G 22 H1 G 22 -0.305 -3.431 -2.976 234 H21 G 22 H21 G 22 2.293 -3.622 -0.718 235 H22 G 22 H22 G 22 1.350 -2.652 -1.863 236 H5' G 23 H5' G 23 5.979 -4.463 3.379 237 H5'' G 23 H5'' G 23 5.830 -4.426 1.611 238 H4' G 23 H4' G 23 8.056 -5.159 3.141 239 H3' G 23 H3' G 23 7.461 -5.069 0.219 240 H2' G 23 H2' G 23 9.270 -6.552 -0.282 241 HO2' G 23 HO2' G 23 10.582 -5.393 1.406 242 H1' G 23 H1' G 23 8.911 -8.302 1.859 243 H8 G 23 H8 G 23 8.036 -10.343 0.778 244 H1 G 23 H1 G 23 4.066 -6.997 -2.980 245 H21 G 23 H21 G 23 5.434 -4.265 -1.438 246 H22 G 23 H22 G 23 4.294 -4.878 -2.625 247 H5' A 24 H5' A 24 11.505 -4.120 -2.377 248 H5'' A 24 H5'' A 24 10.114 -5.219 -2.330 249 H4' A 24 H4' A 24 11.949 -6.538 -2.901 250 H3' A 24 H3' A 24 10.636 -7.180 -0.540 251 H2' A 24 H2' A 24 12.361 -6.646 0.963 252 HO2' A 24 HO2' A 24 13.158 -9.113 -0.241 253 H1' A 24 H1' A 24 14.421 -7.353 -1.202 254 H8 A 24 H8 A 24 13.425 -4.856 1.527 255 H61 A 24 H61 A 24 17.918 -3.688 3.029 256 H62 A 24 H62 A 24 19.515 -4.172 2.481 257 H2 A 24 H2 A 24 18.951 -6.994 -0.928 258 H5' A 25 H5' A 25 11.927 -11.299 -1.694 259 H5'' A 25 H5'' A 25 12.341 -12.268 -3.122 260 H4' A 25 H4' A 25 10.064 -12.670 -2.615 261 H3' A 25 H3' A 25 10.486 -11.026 -5.083 262 H2' A 25 H2' A 25 8.126 -10.727 -5.330 263 HO2' A 25 HO2' A 25 6.827 -12.309 -4.783 264 H1' A 25 H1' A 25 7.511 -10.563 -2.573 265 H8 A 25 H8 A 25 10.030 -8.186 -2.344 266 H61 A 25 H61 A 25 8.126 -4.336 -4.615 267 H62 A 25 H62 A 25 6.760 -4.137 -5.700 268 H2 A 25 H2 A 25 4.925 -8.174 -6.247 269 H5' G 26 H5' G 26 8.026 -13.869 -5.468 270 H5'' G 26 H5'' G 26 8.010 -15.220 -6.619 271 H4' G 26 H4' G 26 5.852 -14.460 -6.737 272 H3' G 26 H3' G 26 7.456 -13.335 -8.979 273 H2' G 26 H2' G 26 5.679 -11.886 -9.660 274 HO2' G 26 HO2' G 26 3.662 -12.462 -9.340 275 H1' G 26 H1' G 26 4.903 -11.048 -7.131 276 H8 G 26 H8 G 26 8.586 -11.372 -6.929 277 H1 G 26 H1 G 26 6.670 -6.069 -9.967 278 H21 G 26 H21 G 26 3.564 -7.569 -9.941 279 H22 G 26 H22 G 26 4.530 -6.173 -10.394 280 H5' U 27 H5' U 27 4.201 -13.918 -10.301 281 H5'' U 27 H5'' U 27 3.809 -14.840 -11.764 282 H4' U 27 H4' U 27 2.893 -12.730 -12.123 283 H3' U 27 H3' U 27 5.505 -12.999 -13.593 284 H2' U 27 H2' U 27 5.183 -10.782 -14.450 285 HO2' U 27 HO2' U 27 3.224 -10.067 -14.791 286 H1' U 27 H1' U 27 4.162 -9.714 -12.030 287 H3 U 27 H3 U 27 8.169 -7.705 -12.971 288 H5 U 27 H5 U 27 9.099 -11.212 -10.880 289 H6 U 27 H6 U 27 6.794 -11.870 -11.113 290 H5' A 28 H5' A 28 2.671 -11.762 -15.747 291 H5'' A 28 H5'' A 28 2.188 -12.440 -17.314 292 H4' A 28 H4' A 28 2.324 -10.198 -17.772 293 H3' A 28 H3' A 28 4.939 -11.470 -18.541 294 H2' A 28 H2' A 28 5.720 -9.309 -19.249 295 HO2' A 28 HO2' A 28 3.219 -8.953 -19.858 296 H1' A 28 H1' A 28 4.572 -7.898 -17.083 297 H8 A 28 H8 A 28 6.118 -10.918 -15.573 298 H61 A 28 H61 A 28 10.628 -9.231 -14.996 299 H62 A 28 H62 A 28 11.481 -7.829 -15.612 300 H2 A 28 H2 A 28 8.572 -5.586 -18.182 301 H5' C 29 H5' C 29 3.810 -9.637 -21.629 302 H5'' C 29 H5'' C 29 3.776 -10.374 -23.243 303 H4' C 29 H4' C 29 5.206 -8.593 -23.525 304 H3' C 29 H3' C 29 6.861 -11.048 -22.969 305 HO3' C 29 H3T C 29 6.042 -11.154 -24.897 306 H2' C 29 H2' C 29 8.834 -9.693 -23.130 307 HO2' C 29 HO2' C 29 7.489 -8.449 -24.910 308 H1' C 29 H1' C 29 7.733 -7.475 -21.752 309 H41 C 29 H41 C 29 9.975 -11.537 -17.073 310 H42 C 29 H42 C 29 11.335 -10.545 -17.593 311 H5 C 29 H5 C 29 7.816 -11.414 -18.210 312 H6 C 29 H6 C 29 6.567 -10.313 -19.988 313 H1 B2R 101 H6 NCD 30 -2.175 -0.648 2.483 314 H2 B2R 101 H5 NCD 30 -3.790 -2.330 1.738 315 H3 B2R 101 H4 NCD 30 -5.728 -2.947 0.365 316 H4 B2R 101 H3 NCD 30 -7.469 -2.247 -1.322 317 H5 B2R 101 1H11 NCD 30 -2.337 2.353 2.671 318 H6 B2R 101 2H11 NCD 30 -1.070 1.267 2.057 319 H7 B2R 101 3H11 NCD 30 -1.695 2.619 1.046 320 H8 B2R 101 H23 NCD 30 -7.632 1.160 -2.600 321 H9 B2R 101 2H26 NCD 30 -9.959 1.181 -5.741 322 H10 B2R 101 1H26 NCD 30 -8.208 0.965 -5.634 323 H11 B2R 101 2H27 NCD 30 -9.083 -1.634 -5.191 324 H12 B2R 101 1H27 NCD 30 -10.404 -1.030 -6.178 325 H13 B2R 101 2H28 NCD 30 -8.829 -0.309 -7.967 326 H14 B2R 101 1H28 NCD 30 -7.446 -0.889 -7.061 327 H30 B2R 101 1H35 NCD 30 -8.172 -2.401 -8.883 328 H16 B2R 101 1H34 NCD 30 -8.157 -3.433 -6.091 329 H17 B2R 101 2H34 NCD 30 -8.737 -4.517 -7.354 330 H18 B2R 101 2H33 NCD 30 -6.042 -3.108 -7.676 331 H19 B2R 101 1H33 NCD 30 -6.642 -4.585 -8.493 332 H20 B2R 101 2H32 NCD 30 -6.135 -5.974 -6.694 333 H21 B2R 101 1H32 NCD 30 -6.358 -4.705 -5.476 334 H22 B2R 101 H29 NCD 30 -2.521 -4.190 -5.398 335 H23 B2R 101 H14 NCD 30 -3.035 -0.829 -6.721 336 H24 B2R 101 H15 NCD 30 -1.600 1.092 -6.041 337 H25 B2R 101 H16 NCD 30 0.272 1.932 -4.627 338 H26 B2R 101 H17 NCD 30 2.007 1.456 -2.925 339 H27 B2R 101 1H22 NCD 30 3.204 -0.194 -1.641 340 H28 B2R 101 3H22 NCD 30 2.935 -1.888 -2.121 341 H29 B2R 101 2H22 NCD 30 1.996 -1.185 -0.775 342 H1 B2R 102 H6 NCD 31 2.317 -1.216 -5.533 343 H2 B2R 102 H5 NCD 31 0.693 -2.903 -6.220 344 H3 B2R 102 H4 NCD 31 -0.147 -5.290 -6.123 345 H4 B2R 102 H3 NCD 31 0.184 -7.604 -5.173 346 H5 B2R 102 1H11 NCD 31 3.896 -0.546 -4.000 347 H6 B2R 102 2H11 NCD 31 4.701 -1.656 -2.857 348 H7 B2R 102 3H11 NCD 31 5.275 -1.541 -4.540 349 H8 B2R 102 H23 NCD 31 2.851 -8.491 -2.982 350 H9 B2R 102 2H26 NCD 31 -0.014 -11.537 -3.472 351 H10 B2R 102 1H26 NCD 31 1.397 -12.550 -3.091 352 H11 B2R 102 1H27 NCD 31 0.534 -10.747 -0.856 353 H12 B2R 102 2H27 NCD 31 1.068 -12.421 -0.810 354 H13 B2R 102 1H28 NCD 31 -1.695 -11.789 -1.967 355 H14 B2R 102 2H28 NCD 31 -1.078 -13.297 -1.312 356 H30 B2R 102 1H35 NCD 31 -1.000 -12.077 0.946 357 H16 B2R 102 1H34 NCD 31 -2.556 -10.319 1.403 358 H17 B2R 102 2H34 NCD 31 -1.459 -9.752 0.160 359 H18 B2R 102 1H33 NCD 31 -3.130 -9.917 -1.566 360 H19 B2R 102 2H33 NCD 31 -4.158 -11.015 -0.583 361 H20 B2R 102 1H32 NCD 31 -5.333 -8.990 -0.416 362 H21 B2R 102 2H32 NCD 31 -4.320 -8.899 1.045 363 H22 B2R 102 H29 NCD 31 -3.353 -5.466 -0.517 364 H23 B2R 102 H14 NCD 31 -0.873 -6.270 1.983 365 H24 B2R 102 H15 NCD 31 0.741 -4.572 2.880 366 H25 B2R 102 H16 NCD 31 1.605 -2.178 2.776 367 H26 B2R 102 H17 NCD 31 1.457 0.052 1.757 368 H27 B2R 102 1H22 NCD 31 0.298 1.571 0.338 369 H28 B2R 102 2H22 NCD 31 0.094 0.787 -1.249 370 H29 B2R 102 3H22 NCD 31 -1.327 1.056 -0.210 Start of MODEL 6 1 H5' G 1 H5' G 1 21.298 -3.983 -13.388 2 H5'' G 1 H5'' G 1 19.728 -4.569 -12.809 3 H4' G 1 H4' G 1 20.416 -3.268 -15.280 4 H3' G 1 H3' G 1 17.866 -3.876 -13.821 5 H2' G 1 H2' G 1 16.631 -3.569 -15.869 6 HO2' G 1 HO2' G 1 18.684 -1.988 -16.449 7 H1' G 1 H1' G 1 18.343 -5.060 -17.456 8 H8 G 1 H8 G 1 18.037 -6.384 -13.894 9 H1 G 1 H1 G 1 13.781 -8.711 -18.083 10 H21 G 1 H21 G 1 15.044 -6.302 -20.203 11 H22 G 1 H22 G 1 13.894 -7.610 -19.960 12 HO5' G 1 H5T G 1 20.513 -6.203 -14.727 13 H5' U 2 H5' U 2 17.186 -1.049 -16.137 14 H5'' U 2 H5'' U 2 16.403 0.444 -15.586 15 H4' U 2 H4' U 2 15.119 -0.285 -17.384 16 H3' U 2 H3' U 2 13.787 -0.958 -14.778 17 H2' U 2 H2' U 2 11.975 -1.968 -16.007 18 HO2' U 2 HO2' U 2 12.719 -0.178 -17.828 19 H1' U 2 H1' U 2 13.595 -3.251 -17.897 20 H3 U 2 H3 U 2 11.999 -6.677 -15.467 21 H5 U 2 H5 U 2 14.950 -4.957 -13.034 22 H6 U 2 H6 U 2 15.215 -3.244 -14.691 23 H5' A 3 H5' A 3 11.221 0.285 -17.120 24 H5'' A 3 H5'' A 3 10.057 1.549 -16.686 25 H4' A 3 H4' A 3 8.744 -0.223 -17.401 26 H3' A 3 H3' A 3 8.838 -0.185 -14.396 27 H2' A 3 H2' A 3 7.434 -2.110 -14.372 28 HO2' A 3 HO2' A 3 5.855 -2.113 -15.778 29 H1' A 3 H1' A 3 8.515 -3.268 -16.751 30 H8 A 3 H8 A 3 11.308 -2.523 -14.360 31 H61 A 3 H61 A 3 11.071 -6.600 -11.696 32 H62 A 3 H62 A 3 9.957 -7.949 -11.664 33 H2 A 3 H2 A 3 6.813 -7.090 -14.745 34 H5' C 4 H5' C 4 5.257 -0.347 -15.675 35 H5'' C 4 H5'' C 4 3.940 0.700 -15.114 36 H4' C 4 H4' C 4 3.052 -1.401 -14.840 37 H3' C 4 H3' C 4 4.206 -0.503 -12.217 38 H2' C 4 H2' C 4 3.635 -2.613 -11.248 39 HO2' C 4 HO2' C 4 1.739 -3.400 -11.857 40 H1' C 4 H1' C 4 4.127 -4.153 -13.592 41 H41 C 4 H41 C 4 9.871 -4.120 -10.401 42 H42 C 4 H42 C 4 8.922 -5.434 -9.720 43 H5 C 4 H5 C 4 8.906 -2.568 -12.014 44 H6 C 4 H6 C 4 6.922 -2.048 -13.327 45 H5' U 5 H5' U 5 0.325 -2.333 -12.257 46 H5'' U 5 H5'' U 5 -0.837 -1.259 -11.451 47 H4' U 5 H4' U 5 -1.459 -3.395 -10.786 48 H3' U 5 H3' U 5 0.045 -1.937 -8.660 49 H2' U 5 H2' U 5 0.100 -3.861 -7.251 50 HO2' U 5 HO2' U 5 -2.219 -4.300 -8.344 51 H1' U 5 H1' U 5 0.575 -5.776 -9.241 52 H3 U 5 H3 U 5 4.479 -5.753 -7.011 53 H5 U 5 H5 U 5 4.415 -2.016 -8.895 54 H6 U 5 H6 U 5 2.256 -2.581 -9.792 55 H5' G 6 H5' G 6 -4.690 1.038 -9.516 56 H5'' G 6 H5'' G 6 -3.316 1.664 -8.583 57 H4' G 6 H4' G 6 -5.759 2.072 -7.789 58 H3' G 6 H3' G 6 -3.422 1.422 -6.015 59 H2' G 6 H2' G 6 -4.884 1.354 -4.133 60 HO2' G 6 HO2' G 6 -5.941 3.389 -5.084 61 H1' G 6 H1' G 6 -7.165 0.358 -5.562 62 H8 G 6 H8 G 6 -7.137 -2.354 -5.788 63 H1 G 6 H1 G 6 -2.447 -2.289 -1.441 64 H21 G 6 H21 G 6 -2.143 1.043 -2.309 65 H22 G 6 H22 G 6 -1.585 -0.318 -1.331 66 H5' G 7 H5' G 7 -1.816 6.475 -6.375 67 H5'' G 7 H5'' G 7 -1.027 6.022 -4.852 68 H4' G 7 H4' G 7 -2.035 8.339 -4.997 69 H3' G 7 H3' G 7 -2.452 6.459 -2.718 70 H2' G 7 H2' G 7 -4.050 7.934 -1.701 71 HO2' G 7 HO2' G 7 -2.601 9.739 -3.059 72 H1' G 7 H1' G 7 -5.417 8.615 -4.023 73 H8 G 7 H8 G 7 -7.402 7.124 -4.422 74 H1 G 7 H1 G 7 -4.859 2.397 -0.944 75 H21 G 7 H21 G 7 -2.118 4.486 -0.673 76 H22 G 7 H22 G 7 -2.888 2.953 -0.238 77 H5' A 8 H5' A 8 -2.510 7.548 1.182 78 H5'' A 8 H5'' A 8 -3.650 7.520 -0.175 79 H4' A 8 H4' A 8 -4.377 8.653 1.995 80 H3' A 8 H3' A 8 -5.426 9.069 -0.397 81 H2' A 8 H2' A 8 -3.804 10.641 -1.221 82 HO2' A 8 HO2' A 8 -6.135 11.653 -0.669 83 H1' A 8 H1' A 8 -3.861 12.167 1.427 84 H8 A 8 H8 A 8 -1.754 10.711 -1.439 85 H61 A 8 H61 A 8 1.854 13.982 -1.265 86 H62 A 8 H62 A 8 2.201 15.313 -0.171 87 H2 A 8 H2 A 8 -1.055 15.411 2.876 88 H5' A 9 H5' A 9 -9.919 8.930 0.996 89 H5'' A 9 H5'' A 9 -9.250 7.339 1.402 90 H4' A 9 H4' A 9 -10.318 8.361 -1.192 91 H3' A 9 H3' A 9 -11.576 6.751 0.491 92 H2' A 9 H2' A 9 -10.205 4.849 0.732 93 HO2' A 9 HO2' A 9 -11.731 4.650 -1.470 94 H1' A 9 H1' A 9 -8.714 4.837 -1.795 95 H8 A 9 H8 A 9 -6.834 7.214 -0.174 96 H61 A 9 H61 A 9 -4.131 4.669 2.902 97 H62 A 9 H62 A 9 -4.242 3.060 3.581 98 H2 A 9 H2 A 9 -7.908 1.193 1.785 99 H5' C 10 H5' C 10 -14.679 6.428 1.694 100 H5'' C 10 H5'' C 10 -12.950 6.747 1.463 101 H4' C 10 H4' C 10 -14.072 3.961 1.652 102 H3' C 10 H3' C 10 -13.367 5.787 3.931 103 H2' C 10 H2' C 10 -12.252 3.989 5.029 104 HO2' C 10 HO2' C 10 -14.213 2.629 4.208 105 H1' C 10 H1' C 10 -11.329 2.706 2.630 106 H41 C 10 H41 C 10 -6.362 6.688 4.117 107 H42 C 10 H42 C 10 -6.112 5.329 5.190 108 H5 C 10 H5 C 10 -8.311 6.961 2.728 109 H6 C 10 H6 C 10 -10.526 6.062 2.225 110 H5' A 11 H5' A 11 -15.533 5.144 8.242 111 H5'' A 11 H5'' A 11 -14.228 5.683 7.167 112 H4' A 11 H4' A 11 -14.714 2.801 7.882 113 H3' A 11 H3' A 11 -13.166 4.846 9.422 114 H2' A 11 H2' A 11 -11.351 3.303 9.716 115 HO2' A 11 HO2' A 11 -13.249 1.531 9.692 116 H1' A 11 H1' A 11 -11.334 2.332 7.110 117 H8 A 11 H8 A 11 -11.751 5.516 5.809 118 H61 A 11 H61 A 11 -7.652 7.786 7.037 119 H62 A 11 H62 A 11 -6.348 7.420 8.148 120 H2 A 11 H2 A 11 -7.446 3.561 10.161 121 H5' U 12 H5' U 12 -13.176 2.008 11.843 122 H5'' U 12 H5'' U 12 -13.925 2.100 13.450 123 H4' U 12 H4' U 12 -11.736 1.455 13.864 124 H3' U 12 H3' U 12 -12.087 4.389 14.382 125 H2' U 12 H2' U 12 -9.755 4.565 14.926 126 HO2' U 12 HO2' U 12 -10.079 2.224 15.886 127 H1' U 12 H1' U 12 -8.840 2.885 12.862 128 H3 U 12 H3 U 12 -7.691 7.346 12.315 129 H5 U 12 H5 U 12 -11.100 6.606 9.979 130 H6 U 12 H6 U 12 -11.294 4.471 11.079 131 H5' G 13 H5' G 13 -13.135 5.345 19.357 132 H5'' G 13 H5'' G 13 -13.061 5.883 17.666 133 H4' G 13 H4' G 13 -10.842 4.450 19.119 134 H3' G 13 H3' G 13 -11.266 7.411 18.759 135 H2' G 13 H2' G 13 -8.891 7.637 18.429 136 HO2' G 13 HO2' G 13 -8.692 5.758 20.111 137 H1' G 13 H1' G 13 -8.649 5.366 16.785 138 H8 G 13 H8 G 13 -11.432 6.360 15.014 139 H1 G 13 H1 G 13 -7.081 11.063 14.781 140 H21 G 13 H21 G 13 -5.731 9.488 17.537 141 H22 G 13 H22 G 13 -5.637 10.827 16.416 142 H5' U 14 H5' U 14 -8.639 9.128 22.371 143 H5'' U 14 H5'' U 14 -10.228 9.421 23.104 144 H4' U 14 H4' U 14 -8.397 11.300 22.112 145 H3' U 14 H3' U 14 -10.360 11.467 23.933 146 H2' U 14 H2' U 14 -12.202 11.372 22.348 147 HO2' U 14 HO2' U 14 -12.469 13.883 21.877 148 H1' U 14 H1' U 14 -10.591 13.341 20.613 149 H3 U 14 H3 U 14 -14.473 13.517 18.232 150 H5 U 14 H5 U 14 -13.063 9.591 17.775 151 H6 U 14 H6 U 14 -11.416 10.071 19.466 152 H5' U 15 H5' U 15 -7.737 14.471 22.176 153 H5'' U 15 H5'' U 15 -6.127 14.702 22.883 154 H4' U 15 H4' U 15 -6.802 16.735 21.847 155 H3' U 15 H3' U 15 -5.810 16.827 24.324 156 H2' U 15 H2' U 15 -7.937 16.636 25.488 157 HO2' U 15 HO2' U 15 -8.542 19.003 25.884 158 H1' U 15 H1' U 15 -9.070 18.688 23.499 159 H3 U 15 H3 U 15 -12.718 18.537 26.178 160 H5 U 15 H5 U 15 -12.350 14.649 24.649 161 H6 U 15 H6 U 15 -10.219 15.295 23.734 162 H5' U 16 H5' U 16 -4.400 19.660 20.193 163 H5'' U 16 H5'' U 16 -5.957 19.019 19.632 164 H4' U 16 H4' U 16 -3.351 17.543 19.339 165 H3' U 16 H3' U 16 -3.623 19.817 17.943 166 H2' U 16 H2' U 16 -5.814 19.302 17.017 167 HO2' U 16 HO2' U 16 -3.885 19.395 15.363 168 H1' U 16 H1' U 16 -4.721 16.476 16.473 169 H3 U 16 H3 U 16 -9.807 17.691 17.327 170 H5 U 16 H5 U 16 -8.482 14.589 14.835 171 H6 U 16 H6 U 16 -6.224 15.216 15.384 172 H5' C 17 H5' C 17 -1.607 17.484 13.403 173 H5'' C 17 H5'' C 17 -2.916 17.785 14.562 174 H4' C 17 H4' C 17 -0.985 16.176 15.857 175 H3' C 17 H3' C 17 -1.550 15.198 13.063 176 H2' C 17 H2' C 17 -1.699 12.969 13.967 177 HO2' C 17 HO2' C 17 0.052 13.175 15.447 178 H1' C 17 H1' C 17 -3.196 13.733 16.220 179 H41 C 17 H41 C 17 -7.376 13.123 11.140 180 H42 C 17 H42 C 17 -7.836 11.982 12.391 181 H5 C 17 H5 C 17 -5.425 14.574 11.371 182 H6 C 17 H6 C 17 -3.581 15.210 12.833 183 H5' A 18 H5' A 18 2.587 11.246 13.595 184 H5'' A 18 H5'' A 18 1.146 11.422 12.577 185 H4' A 18 H4' A 18 1.294 10.510 15.444 186 H3' A 18 H3' A 18 0.756 9.086 12.874 187 H2' A 18 H2' A 18 -1.093 7.920 13.787 188 HO2' A 18 HO2' A 18 0.469 7.568 15.730 189 H1' A 18 H1' A 18 -1.835 9.897 15.750 190 H8 A 18 H8 A 18 -2.044 11.846 12.793 191 H61 A 18 H61 A 18 -6.288 10.418 10.947 192 H62 A 18 H62 A 18 -7.365 9.073 11.270 193 H2 A 18 H2 A 18 -5.415 6.662 14.515 194 H5' U 19 H5' U 19 1.203 4.859 12.056 195 H5'' U 19 H5'' U 19 0.258 6.348 12.239 196 H4' U 19 H4' U 19 -0.045 4.331 14.371 197 H3' U 19 H3' U 19 -0.557 3.575 11.578 198 H2' U 19 H2' U 19 -2.879 3.199 11.818 199 HO2' U 19 HO2' U 19 -2.089 2.054 13.969 200 H1' U 19 H1' U 19 -3.468 5.015 13.893 201 H3 U 19 H3 U 19 -5.636 5.842 9.799 202 H5 U 19 H5 U 19 -2.566 8.643 10.361 203 H6 U 19 H6 U 19 -1.787 7.313 12.208 204 H5' G 20 H5' G 20 -1.754 0.388 13.175 205 H5'' G 20 H5'' G 20 -0.952 -1.161 12.854 206 H4' G 20 H4' G 20 -3.027 -1.604 12.044 207 H3' G 20 H3' G 20 -1.420 -0.563 9.734 208 H2' G 20 H2' G 20 -3.354 -0.590 8.349 209 HO2' G 20 HO2' G 20 -3.919 -2.766 9.153 210 H1' G 20 H1' G 20 -5.232 0.074 10.400 211 H8 G 20 H8 G 20 -2.401 2.506 10.441 212 H1 G 20 H1 G 20 -6.896 3.730 6.031 213 H21 G 20 H21 G 20 -8.095 0.629 6.893 214 H22 G 20 H22 G 20 -8.303 2.054 5.894 215 H5' U 21 H5' U 21 -3.010 -5.699 7.813 216 H5'' U 21 H5'' U 21 -1.650 -5.060 6.871 217 H4' U 21 H4' U 21 -4.097 -5.636 5.866 218 H3' U 21 H3' U 21 -1.941 -3.814 4.865 219 H2' U 21 H2' U 21 -3.413 -2.854 3.269 220 HO2' U 21 HO2' U 21 -4.235 -5.295 3.051 221 H1' U 21 H1' U 21 -5.809 -3.073 4.827 222 H3 U 21 H3 U 21 -5.291 1.298 3.745 223 H5 U 21 H5 U 21 -2.582 0.634 6.893 224 H6 U 21 H6 U 21 -3.153 -1.699 6.784 225 H5' G 22 H5' G 22 -0.852 -9.063 3.017 226 H5'' G 22 H5'' G 22 0.297 -8.707 4.320 227 H4' G 22 H4' G 22 1.818 -9.245 2.777 228 H3' G 22 H3' G 22 1.263 -6.367 2.149 229 H2' G 22 H2' G 22 2.529 -6.537 0.130 230 HO2' G 22 HO2' G 22 4.167 -7.773 1.470 231 H1' G 22 H1' G 22 1.862 -9.254 -0.461 232 H8 G 22 H8 G 22 -0.704 -9.485 -1.522 233 H1 G 22 H1 G 22 -0.041 -3.282 -2.920 234 H21 G 22 H21 G 22 2.443 -3.362 -0.512 235 H22 G 22 H22 G 22 1.496 -2.419 -1.673 236 H5' G 23 H5' G 23 5.975 -4.170 3.208 237 H5'' G 23 H5'' G 23 5.871 -4.264 1.440 238 H4' G 23 H4' G 23 8.068 -4.851 3.035 239 H3' G 23 H3' G 23 7.482 -5.125 0.126 240 H2' G 23 H2' G 23 9.257 -6.687 -0.194 241 HO2' G 23 HO2' G 23 10.611 -5.362 1.340 242 H1' G 23 H1' G 23 8.880 -8.169 2.129 243 H8 G 23 H8 G 23 7.905 -10.292 1.301 244 H1 G 23 H1 G 23 4.097 -7.227 -2.847 245 H21 G 23 H21 G 23 5.571 -4.412 -1.609 246 H22 G 23 H22 G 23 4.427 -5.095 -2.750 247 H5' A 24 H5' A 24 11.417 -4.601 -2.659 248 H5'' A 24 H5'' A 24 9.951 -5.582 -2.489 249 H4' A 24 H4' A 24 11.617 -7.117 -2.959 250 H3' A 24 H3' A 24 10.501 -7.307 -0.380 251 H2' A 24 H2' A 24 12.447 -7.001 0.876 252 HO2' A 24 HO2' A 24 12.937 -9.505 -0.414 253 H1' A 24 H1' A 24 14.156 -7.918 -1.497 254 H8 A 24 H8 A 24 13.677 -5.245 1.214 255 H61 A 24 H61 A 24 18.391 -4.316 2.039 256 H62 A 24 H62 A 24 19.867 -4.919 1.304 257 H2 A 24 H2 A 24 18.675 -7.824 -1.870 258 H5' A 25 H5' A 25 11.033 -11.139 -0.825 259 H5'' A 25 H5'' A 25 11.292 -12.666 -1.692 260 H4' A 25 H4' A 25 9.016 -12.554 -1.014 261 H3' A 25 H3' A 25 9.574 -13.216 -3.551 262 H2' A 25 H2' A 25 9.402 -10.954 -4.454 263 HO2' A 25 HO2' A 25 6.931 -12.365 -4.577 264 H1' A 25 H1' A 25 6.860 -10.670 -2.738 265 H8 A 25 H8 A 25 9.609 -8.321 -2.129 266 H61 A 25 H61 A 25 8.001 -4.438 -4.527 267 H62 A 25 H62 A 25 6.699 -4.191 -5.684 268 H2 A 25 H2 A 25 4.682 -8.135 -6.249 269 H5' G 26 H5' G 26 7.652 -15.368 -6.357 270 H5'' G 26 H5'' G 26 7.796 -13.671 -5.863 271 H4' G 26 H4' G 26 5.160 -14.884 -6.637 272 H3' G 26 H3' G 26 7.302 -13.925 -8.499 273 H2' G 26 H2' G 26 5.660 -12.777 -9.818 274 HO2' G 26 HO2' G 26 3.644 -13.465 -9.875 275 H1' G 26 H1' G 26 4.256 -11.700 -7.664 276 H8 G 26 H8 G 26 7.953 -11.759 -6.931 277 H1 G 26 H1 G 26 5.992 -6.669 -10.285 278 H21 G 26 H21 G 26 2.980 -8.358 -10.481 279 H22 G 26 H22 G 26 3.901 -6.919 -10.893 280 H5' U 27 H5' U 27 4.574 -15.092 -10.528 281 H5'' U 27 H5'' U 27 4.669 -16.302 -11.821 282 H4' U 27 H4' U 27 3.707 -14.537 -12.906 283 H3' U 27 H3' U 27 6.673 -14.309 -13.382 284 H2' U 27 H2' U 27 6.192 -12.360 -14.745 285 HO2' U 27 HO2' U 27 3.819 -13.577 -14.977 286 H1' U 27 H1' U 27 4.461 -11.219 -12.884 287 H3 U 27 H3 U 27 8.291 -8.805 -12.617 288 H5 U 27 H5 U 27 8.949 -12.177 -10.203 289 H6 U 27 H6 U 27 6.892 -13.087 -11.064 290 H5' A 28 H5' A 28 4.621 -13.852 -16.491 291 H5'' A 28 H5'' A 28 4.838 -14.772 -17.993 292 H4' A 28 H4' A 28 4.689 -12.608 -18.745 293 H3' A 28 H3' A 28 7.597 -13.331 -18.487 294 H2' A 28 H2' A 28 8.164 -11.119 -19.248 295 HO2' A 28 HO2' A 28 6.011 -11.375 -20.644 296 H1' A 28 H1' A 28 6.178 -9.800 -17.741 297 H8 A 28 H8 A 28 7.620 -12.393 -15.495 298 H61 A 28 H61 A 28 11.354 -9.835 -13.726 299 H62 A 28 H62 A 28 12.110 -8.325 -14.187 300 H2 A 28 H2 A 28 9.834 -6.800 -17.740 301 H5' C 29 H5' C 29 7.171 -11.972 -21.985 302 H5'' C 29 H5'' C 29 7.800 -12.789 -23.431 303 H4' C 29 H4' C 29 8.827 -10.729 -23.507 304 H3' C 29 H3' C 29 10.718 -12.683 -22.213 305 HO3' C 29 H3T C 29 10.561 -13.087 -24.266 306 H2' C 29 H2' C 29 12.314 -10.904 -21.986 307 HO2' C 29 HO2' C 29 11.310 -10.110 -24.199 308 H1' C 29 H1' C 29 10.410 -8.956 -21.222 309 H41 C 29 H41 C 29 11.934 -12.209 -15.698 310 H42 C 29 H42 C 29 13.152 -10.954 -15.915 311 H5 C 29 H5 C 29 10.229 -12.620 -17.403 312 H6 C 29 H6 C 29 9.382 -11.912 -19.574 313 H1 B2R 101 H6 NCD 30 -1.937 -0.667 2.571 314 H2 B2R 101 H5 NCD 30 -3.511 -2.391 1.753 315 H3 B2R 101 H4 NCD 30 -5.394 -3.013 0.377 316 H4 B2R 101 H3 NCD 30 -7.161 -2.298 -1.287 317 H5 B2R 101 1H11 NCD 30 -2.248 2.422 2.791 318 H6 B2R 101 2H11 NCD 30 -0.945 1.316 2.272 319 H7 B2R 101 3H11 NCD 30 -1.524 2.609 1.181 320 H8 B2R 101 H23 NCD 30 -7.582 0.965 -2.487 321 H9 B2R 101 2H26 NCD 30 -10.164 0.019 -5.526 322 H10 B2R 101 1H26 NCD 30 -8.434 -0.355 -5.654 323 H11 B2R 101 2H27 NCD 30 -9.036 -2.573 -4.381 324 H12 B2R 101 1H27 NCD 30 -10.712 -2.191 -4.756 325 H13 B2R 101 2H28 NCD 30 -10.516 -2.828 -6.955 326 H14 B2R 101 1H28 NCD 30 -8.937 -2.070 -7.170 327 H30 B2R 101 1H35 NCD 30 -9.542 -4.843 -6.730 328 H16 B2R 101 1H34 NCD 30 -7.755 -4.624 -8.198 329 H17 B2R 101 2H34 NCD 30 -7.077 -3.260 -7.290 330 H18 B2R 101 2H33 NCD 30 -7.035 -6.218 -6.414 331 H19 B2R 101 1H33 NCD 30 -6.381 -4.850 -5.451 332 H20 B2R 101 2H32 NCD 30 -5.194 -4.724 -8.094 333 H21 B2R 101 1H32 NCD 30 -5.026 -6.389 -7.469 334 H22 B2R 101 H29 NCD 30 -2.334 -4.218 -5.295 335 H23 B2R 101 H14 NCD 30 -2.909 -0.958 -6.840 336 H24 B2R 101 H15 NCD 30 -1.471 1.010 -6.271 337 H25 B2R 101 H16 NCD 30 0.415 1.930 -4.895 338 H26 B2R 101 H17 NCD 30 2.144 1.552 -3.179 339 H27 B2R 101 1H22 NCD 30 3.368 -0.004 -1.841 340 H28 B2R 101 3H22 NCD 30 3.089 -1.734 -2.145 341 H29 B2R 101 2H22 NCD 30 2.164 -0.892 -0.870 342 H1 B2R 102 H6 NCD 31 2.446 -1.220 -5.510 343 H2 B2R 102 H5 NCD 31 0.824 -2.924 -6.167 344 H3 B2R 102 H4 NCD 31 0.053 -5.309 -6.082 345 H4 B2R 102 H3 NCD 31 0.474 -7.635 -5.211 346 H5 B2R 102 1H11 NCD 31 4.043 -0.530 -4.127 347 H6 B2R 102 2H11 NCD 31 4.903 -1.580 -2.965 348 H7 B2R 102 3H11 NCD 31 5.450 -1.493 -4.660 349 H8 B2R 102 H23 NCD 31 3.195 -8.596 -3.211 350 H9 B2R 102 2H26 NCD 31 1.736 -12.187 -1.995 351 H10 B2R 102 1H26 NCD 31 0.953 -10.671 -1.494 352 H11 B2R 102 1H27 NCD 31 0.161 -12.556 -3.781 353 H12 B2R 102 2H27 NCD 31 -0.400 -10.886 -3.753 354 H13 B2R 102 1H28 NCD 31 -1.220 -13.215 -2.049 355 H14 B2R 102 2H28 NCD 31 -1.114 -11.683 -1.185 356 H30 B2R 102 1H35 NCD 31 -3.366 -12.041 -2.068 357 H16 B2R 102 1H34 NCD 31 -1.794 -9.767 -3.031 358 H17 B2R 102 2H34 NCD 31 -3.212 -10.102 -4.029 359 H18 B2R 102 1H33 NCD 31 -4.655 -10.024 -1.917 360 H19 B2R 102 2H33 NCD 31 -3.199 -9.496 -1.006 361 H20 B2R 102 1H32 NCD 31 -3.118 -7.646 -3.010 362 H21 B2R 102 2H32 NCD 31 -4.865 -7.988 -3.029 363 H22 B2R 102 H29 NCD 31 -3.471 -5.251 -0.864 364 H23 B2R 102 H14 NCD 31 -1.088 -6.348 1.722 365 H24 B2R 102 H15 NCD 31 0.527 -4.728 2.704 366 H25 B2R 102 H16 NCD 31 1.464 -2.358 2.714 367 H26 B2R 102 H17 NCD 31 1.400 -0.087 1.772 368 H27 B2R 102 1H22 NCD 31 0.329 1.510 0.365 369 H28 B2R 102 2H22 NCD 31 0.127 0.794 -1.250 370 H29 B2R 102 3H22 NCD 31 -1.299 1.102 -0.226 Start of MODEL 7 1 H5' G 1 H5' G 1 21.086 -5.419 -14.978 2 H5'' G 1 H5'' G 1 19.560 -5.890 -14.207 3 H4' G 1 H4' G 1 20.023 -4.516 -16.688 4 H3' G 1 H3' G 1 17.647 -4.991 -14.921 5 H2' G 1 H2' G 1 16.184 -4.460 -16.762 6 HO2' G 1 HO2' G 1 18.239 -2.993 -17.522 7 H1' G 1 H1' G 1 17.541 -5.975 -18.651 8 H8 G 1 H8 G 1 17.483 -7.435 -15.115 9 H1 G 1 H1 G 1 12.706 -9.277 -18.968 10 H21 G 1 H21 G 1 13.963 -6.894 -21.121 11 H22 G 1 H22 G 1 12.738 -8.116 -20.812 12 HO5' G 1 H5T G 1 19.907 -7.481 -16.282 13 H5' U 2 H5' U 2 16.967 -1.859 -16.995 14 H5'' U 2 H5'' U 2 16.376 -0.391 -16.193 15 H4' U 2 H4' U 2 14.834 -0.807 -17.881 16 H3' U 2 H3' U 2 13.741 -1.776 -15.249 17 H2' U 2 H2' U 2 11.710 -2.380 -16.426 18 HO2' U 2 HO2' U 2 12.527 -0.462 -18.076 19 H1' U 2 H1' U 2 13.035 -3.631 -18.527 20 H3 U 2 H3 U 2 11.410 -7.073 -16.133 21 H5 U 2 H5 U 2 14.720 -5.742 -13.921 22 H6 U 2 H6 U 2 14.969 -3.963 -15.510 23 H5' A 3 H5' A 3 11.184 0.107 -17.115 24 H5'' A 3 H5'' A 3 10.125 1.358 -16.435 25 H4' A 3 H4' A 3 8.717 -0.236 -17.430 26 H3' A 3 H3' A 3 8.740 -0.472 -14.432 27 H2' A 3 H2' A 3 7.200 -2.295 -14.602 28 HO2' A 3 HO2' A 3 6.302 -0.868 -16.587 29 H1' A 3 H1' A 3 8.270 -3.340 -17.028 30 H8 A 3 H8 A 3 11.176 -2.985 -14.775 31 H61 A 3 H61 A 3 10.740 -7.121 -12.263 32 H62 A 3 H62 A 3 9.501 -8.350 -12.162 33 H2 A 3 H2 A 3 6.197 -7.038 -14.903 34 H5' C 4 H5' C 4 5.005 -0.115 -15.530 35 H5'' C 4 H5'' C 4 3.892 0.921 -14.613 36 H4' C 4 H4' C 4 2.975 -1.243 -14.573 37 H3' C 4 H3' C 4 4.242 -0.496 -11.954 38 H2' C 4 H2' C 4 3.722 -2.661 -11.088 39 HO2' C 4 HO2' C 4 1.755 -3.340 -11.621 40 H1' C 4 H1' C 4 4.033 -4.050 -13.569 41 H41 C 4 H41 C 4 9.938 -4.487 -10.739 42 H42 C 4 H42 C 4 8.950 -5.725 -9.974 43 H5 C 4 H5 C 4 8.978 -2.869 -12.283 44 H6 C 4 H6 C 4 6.945 -2.198 -13.447 45 H5' U 5 H5' U 5 0.500 -2.164 -12.036 46 H5'' U 5 H5'' U 5 -0.791 -1.147 -11.370 47 H4' U 5 H4' U 5 -1.488 -3.243 -10.770 48 H3' U 5 H3' U 5 -0.152 -1.862 -8.527 49 H2' U 5 H2' U 5 0.168 -3.799 -7.213 50 HO2' U 5 HO2' U 5 -2.201 -4.346 -8.146 51 H1' U 5 H1' U 5 0.519 -5.721 -9.248 52 H3 U 5 H3 U 5 4.475 -5.855 -7.136 53 H5 U 5 H5 U 5 4.447 -2.054 -8.901 54 H6 U 5 H6 U 5 2.242 -2.532 -9.736 55 H5' G 6 H5' G 6 -5.040 0.705 -9.522 56 H5'' G 6 H5'' G 6 -3.498 1.327 -8.904 57 H4' G 6 H4' G 6 -5.750 1.993 -7.781 58 H3' G 6 H3' G 6 -3.167 1.399 -6.375 59 H2' G 6 H2' G 6 -4.258 1.585 -4.264 60 HO2' G 6 HO2' G 6 -5.320 3.595 -5.187 61 H1' G 6 H1' G 6 -6.819 0.614 -5.145 62 H8 G 6 H8 G 6 -6.796 -2.186 -5.369 63 H1 G 6 H1 G 6 -1.923 -1.885 -1.240 64 H21 G 6 H21 G 6 -1.706 1.413 -2.224 65 H22 G 6 H22 G 6 -1.104 0.088 -1.216 66 H5' G 7 H5' G 7 -1.532 6.390 -5.456 67 H5'' G 7 H5'' G 7 -1.659 5.686 -3.833 68 H4' G 7 H4' G 7 -2.449 8.181 -4.499 69 H3' G 7 H3' G 7 -3.221 6.401 -2.230 70 H2' G 7 H2' G 7 -5.051 7.825 -1.638 71 HO2' G 7 HO2' G 7 -3.786 9.780 -1.961 72 H1' G 7 H1' G 7 -5.892 8.422 -4.240 73 H8 G 7 H8 G 7 -7.987 7.148 -4.586 74 H1 G 7 H1 G 7 -5.799 2.131 -1.264 75 H21 G 7 H21 G 7 -2.974 4.018 -0.882 76 H22 G 7 H22 G 7 -3.809 2.516 -0.517 77 H5' A 8 H5' A 8 -4.030 9.625 1.558 78 H5'' A 8 H5'' A 8 -4.826 8.738 0.246 79 H4' A 8 H4' A 8 -5.398 11.300 1.104 80 H3' A 8 H3' A 8 -6.371 9.565 -1.024 81 H2' A 8 H2' A 8 -6.203 11.113 -2.748 82 HO2' A 8 HO2' A 8 -8.246 11.864 -1.802 83 H1' A 8 H1' A 8 -5.432 13.377 -0.861 84 H8 A 8 H8 A 8 -3.775 11.146 -3.584 85 H61 A 8 H61 A 8 -2.067 14.792 -6.309 86 H62 A 8 H62 A 8 -2.171 16.541 -6.163 87 H2 A 8 H2 A 8 -4.513 17.426 -2.471 88 H5' A 9 H5' A 9 -10.841 8.615 0.758 89 H5'' A 9 H5'' A 9 -9.897 7.180 1.201 90 H4' A 9 H4' A 9 -11.195 7.880 -1.399 91 H3' A 9 H3' A 9 -12.170 6.207 0.421 92 H2' A 9 H2' A 9 -10.553 4.516 0.690 93 HO2' A 9 HO2' A 9 -11.994 4.048 -1.592 94 H1' A 9 H1' A 9 -9.150 4.597 -1.885 95 H8 A 9 H8 A 9 -7.521 7.244 -0.339 96 H61 A 9 H61 A 9 -4.483 5.012 2.737 97 H62 A 9 H62 A 9 -4.423 3.396 3.404 98 H2 A 9 H2 A 9 -7.877 1.144 1.654 99 H5' C 10 H5' C 10 -15.459 5.904 1.617 100 H5'' C 10 H5'' C 10 -13.766 6.393 1.419 101 H4' C 10 H4' C 10 -14.681 3.562 1.908 102 H3' C 10 H3' C 10 -13.859 5.659 3.904 103 H2' C 10 H2' C 10 -12.667 3.983 5.121 104 HO2' C 10 HO2' C 10 -14.609 2.524 4.659 105 H1' C 10 H1' C 10 -11.836 2.508 2.805 106 H41 C 10 H41 C 10 -7.004 6.860 3.741 107 H42 C 10 H42 C 10 -6.588 5.481 4.741 108 H5 C 10 H5 C 10 -9.095 6.994 2.520 109 H6 C 10 H6 C 10 -11.299 5.964 2.249 110 H5' A 11 H5' A 11 -15.679 4.669 8.591 111 H5'' A 11 H5'' A 11 -14.437 5.372 7.538 112 H4' A 11 H4' A 11 -14.723 2.422 8.071 113 H3' A 11 H3' A 11 -13.209 4.463 9.651 114 H2' A 11 H2' A 11 -11.300 3.020 9.759 115 HO2' A 11 HO2' A 11 -13.043 1.152 9.875 116 H1' A 11 H1' A 11 -11.437 2.096 7.117 117 H8 A 11 H8 A 11 -11.962 5.338 6.002 118 H61 A 11 H61 A 11 -7.770 7.549 6.957 119 H62 A 11 H62 A 11 -6.371 7.153 7.935 120 H2 A 11 H2 A 11 -7.288 3.195 9.862 121 H5' U 12 H5' U 12 -13.019 1.455 12.110 122 H5'' U 12 H5'' U 12 -13.524 1.702 13.794 123 H4' U 12 H4' U 12 -11.234 1.007 13.743 124 H3' U 12 H3' U 12 -11.755 3.806 14.660 125 H2' U 12 H2' U 12 -9.422 4.266 14.793 126 HO2' U 12 HO2' U 12 -9.324 1.878 15.686 127 H1' U 12 H1' U 12 -8.616 2.677 12.572 128 H3 U 12 H3 U 12 -7.682 7.216 12.138 129 H5 U 12 H5 U 12 -11.230 6.404 10.052 130 H6 U 12 H6 U 12 -11.246 4.224 11.085 131 H5' G 13 H5' G 13 -13.239 4.500 18.575 132 H5'' G 13 H5'' G 13 -13.123 5.906 17.500 133 H4' G 13 H4' G 13 -10.986 4.248 18.730 134 H3' G 13 H3' G 13 -11.456 7.193 18.372 135 H2' G 13 H2' G 13 -9.074 7.543 18.360 136 HO2' G 13 HO2' G 13 -9.010 5.586 19.982 137 H1' G 13 H1' G 13 -8.493 5.413 16.652 138 H8 G 13 H8 G 13 -11.478 6.425 14.969 139 H1 G 13 H1 G 13 -6.952 10.936 14.523 140 H21 G 13 H21 G 13 -5.490 9.228 17.153 141 H22 G 13 H22 G 13 -5.393 10.590 16.057 142 H5' U 14 H5' U 14 -9.502 9.093 21.820 143 H5'' U 14 H5'' U 14 -11.047 9.126 22.692 144 H4' U 14 H4' U 14 -9.582 11.284 21.631 145 H3' U 14 H3' U 14 -11.274 11.139 23.675 146 H2' U 14 H2' U 14 -13.267 10.693 22.335 147 HO2' U 14 HO2' U 14 -14.205 12.989 22.096 148 H1' U 14 H1' U 14 -12.344 12.986 20.499 149 H3 U 14 H3 U 14 -16.491 12.271 18.688 150 H5 U 14 H5 U 14 -14.187 8.914 17.682 151 H6 U 14 H6 U 14 -12.503 9.710 19.207 152 H5' U 15 H5' U 15 -9.986 14.293 21.403 153 H5'' U 15 H5'' U 15 -8.238 14.259 21.098 154 H4' U 15 H4' U 15 -8.627 16.388 20.494 155 H3' U 15 H3' U 15 -7.296 16.456 22.790 156 H2' U 15 H2' U 15 -9.218 16.438 24.278 157 HO2' U 15 HO2' U 15 -8.142 18.929 23.726 158 H1' U 15 H1' U 15 -10.558 18.537 22.488 159 H3 U 15 H3 U 15 -14.209 18.501 25.007 160 H5 U 15 H5 U 15 -13.264 14.425 24.725 161 H6 U 15 H6 U 15 -11.286 15.049 23.502 162 H5' U 16 H5' U 16 -5.974 19.646 18.897 163 H5'' U 16 H5'' U 16 -7.454 19.082 18.097 164 H4' U 16 H4' U 16 -5.273 17.195 17.810 165 H3' U 16 H3' U 16 -4.076 19.584 17.742 166 H2' U 16 H2' U 16 -5.639 20.618 16.186 167 HO2' U 16 HO2' U 16 -3.257 20.256 15.328 168 H1' U 16 H1' U 16 -5.437 18.030 14.533 169 H3 U 16 H3 U 16 -9.653 21.233 14.685 170 H5 U 16 H5 U 16 -8.358 19.161 11.276 171 H6 U 16 H6 U 16 -6.551 18.274 12.595 172 H5' C 17 H5' C 17 -1.752 17.579 13.172 173 H5'' C 17 H5'' C 17 -3.133 17.585 14.286 174 H4' C 17 H4' C 17 -0.934 16.070 15.374 175 H3' C 17 H3' C 17 -1.767 15.288 12.584 176 H2' C 17 H2' C 17 -1.667 12.985 13.297 177 HO2' C 17 HO2' C 17 0.215 13.215 14.615 178 H1' C 17 H1' C 17 -2.993 13.443 15.719 179 H41 C 17 H41 C 17 -7.475 13.085 10.873 180 H42 C 17 H42 C 17 -7.867 11.883 12.093 181 H5 C 17 H5 C 17 -5.536 14.547 11.074 182 H6 C 17 H6 C 17 -3.623 15.131 12.463 183 H5' A 18 H5' A 18 1.647 11.537 11.330 184 H5'' A 18 H5'' A 18 -0.089 11.871 11.468 185 H4' A 18 H4' A 18 1.630 10.546 13.562 186 H3' A 18 H3' A 18 -0.083 9.363 11.418 187 H2' A 18 H2' A 18 -1.003 7.766 12.972 188 HO2' A 18 HO2' A 18 1.293 7.933 14.101 189 H1' A 18 H1' A 18 -1.531 9.575 14.987 190 H8 A 18 H8 A 18 -2.047 11.777 12.138 191 H61 A 18 H61 A 18 -6.500 10.477 10.773 192 H62 A 18 H62 A 18 -7.565 9.137 11.165 193 H2 A 18 H2 A 18 -5.307 6.610 14.123 194 H5' U 19 H5' U 19 1.584 6.267 12.813 195 H5'' U 19 H5'' U 19 2.312 5.053 11.743 196 H4' U 19 H4' U 19 0.536 4.051 12.994 197 H3' U 19 H3' U 19 -0.014 4.355 10.054 198 H2' U 19 H2' U 19 -2.163 3.337 10.390 199 HO2' U 19 HO2' U 19 -0.835 2.101 12.338 200 H1' U 19 H1' U 19 -2.713 4.628 12.842 201 H3 U 19 H3 U 19 -5.500 5.851 9.314 202 H5 U 19 H5 U 19 -2.534 8.799 9.717 203 H6 U 19 H6 U 19 -1.399 7.338 11.256 204 H5' G 20 H5' G 20 -1.211 0.425 11.677 205 H5'' G 20 H5'' G 20 -0.167 -0.675 10.752 206 H4' G 20 H4' G 20 -2.214 -1.768 10.897 207 H3' G 20 H3' G 20 -1.816 -0.525 8.204 208 H2' G 20 H2' G 20 -4.018 -1.246 7.529 209 HO2' G 20 HO2' G 20 -3.588 -3.192 9.175 210 H1' G 20 H1' G 20 -5.313 -0.400 9.812 211 H8 G 20 H8 G 20 -2.585 2.080 9.420 212 H1 G 20 H1 G 20 -7.520 3.060 5.455 213 H21 G 20 H21 G 20 -8.514 -0.102 6.438 214 H22 G 20 H22 G 20 -8.851 1.322 5.466 215 H5' U 21 H5' U 21 -2.777 -4.264 7.605 216 H5'' U 21 H5'' U 21 -1.740 -5.392 6.710 217 H4' U 21 H4' U 21 -3.759 -5.660 5.660 218 H3' U 21 H3' U 21 -2.023 -3.815 4.112 219 H2' U 21 H2' U 21 -3.779 -3.049 2.715 220 HO2' U 21 HO2' U 21 -4.506 -5.531 2.868 221 H1' U 21 H1' U 21 -5.889 -3.115 4.587 222 H3 U 21 H3 U 21 -5.332 1.208 3.348 223 H5 U 21 H5 U 21 -2.309 0.502 6.179 224 H6 U 21 H6 U 21 -2.971 -1.811 6.189 225 H5' G 22 H5' G 22 -0.477 -9.430 3.268 226 H5'' G 22 H5'' G 22 0.531 -8.357 4.255 227 H4' G 22 H4' G 22 1.947 -9.203 2.604 228 H3' G 22 H3' G 22 1.139 -6.394 1.878 229 H2' G 22 H2' G 22 2.518 -6.594 -0.082 230 HO2' G 22 HO2' G 22 4.165 -7.748 1.285 231 H1' G 22 H1' G 22 1.838 -9.306 -0.600 232 H8 G 22 H8 G 22 -0.801 -9.558 -1.528 233 H1 G 22 H1 G 22 -0.153 -3.394 -3.109 234 H21 G 22 H21 G 22 2.440 -3.446 -0.835 235 H22 G 22 H22 G 22 1.460 -2.522 -1.986 236 H5' G 23 H5' G 23 6.117 -6.016 4.395 237 H5'' G 23 H5'' G 23 6.244 -4.558 3.394 238 H4' G 23 H4' G 23 8.378 -5.744 3.628 239 H3' G 23 H3' G 23 7.227 -5.441 0.869 240 H2' G 23 H2' G 23 9.176 -6.574 -0.003 241 HO2' G 23 HO2' G 23 10.853 -7.220 1.580 242 H1' G 23 H1' G 23 9.156 -8.600 1.899 243 H8 G 23 H8 G 23 7.909 -10.613 1.056 244 H1 G 23 H1 G 23 4.373 -7.047 -2.902 245 H21 G 23 H21 G 23 6.063 -4.403 -1.487 246 H22 G 23 H22 G 23 4.869 -4.925 -2.671 247 H5' A 24 H5' A 24 9.655 -4.243 -2.499 248 H5'' A 24 H5'' A 24 8.782 -5.548 -1.677 249 H4' A 24 H4' A 24 10.458 -6.499 -3.086 250 H3' A 24 H3' A 24 10.230 -7.412 -0.609 251 H2' A 24 H2' A 24 11.721 -5.875 0.451 252 HO2' A 24 HO2' A 24 13.021 -8.278 -0.262 253 H1' A 24 H1' A 24 13.734 -6.278 -1.814 254 H8 A 24 H8 A 24 11.906 -3.721 0.368 255 H61 A 24 H61 A 24 15.613 -0.605 0.983 256 H62 A 24 H62 A 24 17.255 -0.580 0.359 257 H2 A 24 H2 A 24 17.764 -4.191 -2.208 258 H5' A 25 H5' A 25 10.933 -12.282 -0.744 259 H5'' A 25 H5'' A 25 11.187 -12.821 -2.416 260 H4' A 25 H4' A 25 8.819 -12.889 -1.165 261 H3' A 25 H3' A 25 9.504 -13.593 -3.656 262 H2' A 25 H2' A 25 9.524 -11.308 -4.536 263 HO2' A 25 HO2' A 25 6.907 -12.438 -4.866 264 H1' A 25 H1' A 25 6.852 -10.976 -3.034 265 H8 A 25 H8 A 25 9.678 -8.602 -2.387 266 H61 A 25 H61 A 25 8.035 -4.781 -4.870 267 H62 A 25 H62 A 25 6.702 -4.549 -5.982 268 H2 A 25 H2 A 25 4.656 -8.500 -6.419 269 H5' G 26 H5' G 26 7.282 -15.670 -6.625 270 H5'' G 26 H5'' G 26 7.608 -14.001 -6.120 271 H4' G 26 H4' G 26 4.827 -14.943 -6.736 272 H3' G 26 H3' G 26 6.925 -14.204 -8.748 273 H2' G 26 H2' G 26 5.330 -12.879 -9.945 274 HO2' G 26 HO2' G 26 3.254 -13.319 -9.867 275 H1' G 26 H1' G 26 4.149 -11.715 -7.694 276 H8 G 26 H8 G 26 7.882 -12.064 -7.276 277 H1 G 26 H1 G 26 6.024 -6.797 -10.409 278 H21 G 26 H21 G 26 2.890 -8.254 -10.338 279 H22 G 26 H22 G 26 3.870 -6.881 -10.824 280 H5' U 27 H5' U 27 3.849 -15.082 -10.538 281 H5'' U 27 H5'' U 27 3.732 -16.241 -11.874 282 H4' U 27 H4' U 27 2.795 -14.350 -12.775 283 H3' U 27 H3' U 27 5.694 -14.363 -13.595 284 H2' U 27 H2' U 27 5.223 -12.341 -14.852 285 HO2' U 27 HO2' U 27 2.766 -13.356 -14.869 286 H1' U 27 H1' U 27 3.826 -11.121 -12.767 287 H3 U 27 H3 U 27 7.831 -9.013 -12.936 288 H5 U 27 H5 U 27 8.533 -12.515 -10.723 289 H6 U 27 H6 U 27 6.320 -13.236 -11.331 290 H5' A 28 H5' A 28 3.271 -13.556 -16.535 291 H5'' A 28 H5'' A 28 3.409 -14.469 -18.050 292 H4' A 28 H4' A 28 3.251 -12.240 -18.702 293 H3' A 28 H3' A 28 6.102 -13.186 -18.811 294 H2' A 28 H2' A 28 6.759 -11.002 -19.569 295 HO2' A 28 HO2' A 28 4.477 -11.032 -20.747 296 H1' A 28 H1' A 28 5.048 -9.583 -17.833 297 H8 A 28 H8 A 28 6.542 -12.312 -15.798 298 H61 A 28 H61 A 28 10.628 -10.075 -14.443 299 H62 A 28 H62 A 28 11.441 -8.617 -14.961 300 H2 A 28 H2 A 28 8.892 -6.843 -18.206 301 H5' C 29 H5' C 29 5.409 -11.726 -22.273 302 H5'' C 29 H5'' C 29 5.870 -12.577 -23.760 303 H4' C 29 H4' C 29 7.021 -10.571 -23.880 304 H3' C 29 H3' C 29 8.862 -12.721 -22.856 305 HO3' C 29 H3T C 29 8.486 -13.020 -24.895 306 H2' C 29 H2' C 29 10.616 -11.088 -22.723 307 HO2' C 29 HO2' C 29 9.476 -10.115 -24.795 308 H1' C 29 H1' C 29 8.971 -9.024 -21.706 309 H41 C 29 H41 C 29 10.701 -12.611 -16.460 310 H42 C 29 H42 C 29 12.024 -11.487 -16.771 311 H5 C 29 H5 C 29 8.807 -12.787 -17.993 312 H6 C 29 H6 C 29 7.829 -11.920 -20.050 313 H1 B2R 101 H6 NCD 30 -1.233 -0.443 2.889 314 H2 B2R 101 H5 NCD 30 -2.770 -2.201 2.127 315 H3 B2R 101 H4 NCD 30 -4.716 -2.894 0.742 316 H4 B2R 101 H3 NCD 30 -6.508 -2.179 -0.924 317 H5 B2R 101 1H11 NCD 30 -0.259 1.565 2.465 318 H6 B2R 101 2H11 NCD 30 -0.972 2.845 1.441 319 H7 B2R 101 3H11 NCD 30 -1.573 2.589 3.101 320 H8 B2R 101 H23 NCD 30 -6.915 1.077 -2.108 321 H9 B2R 101 2H26 NCD 30 -9.879 -1.536 -3.403 322 H10 B2R 101 1H26 NCD 30 -10.503 0.048 -3.932 323 H11 B2R 101 2H27 NCD 30 -9.904 -0.386 -6.076 324 H12 B2R 101 1H27 NCD 30 -8.224 -0.568 -5.593 325 H13 B2R 101 2H28 NCD 30 -8.805 -3.043 -4.964 326 H14 B2R 101 1H28 NCD 30 -10.396 -2.740 -5.645 327 H30 B2R 101 1H35 NCD 30 -9.067 -2.061 -7.789 328 H16 B2R 101 1H34 NCD 30 -7.083 -3.253 -8.319 329 H17 B2R 101 2H34 NCD 30 -6.747 -2.330 -6.861 330 H18 B2R 101 2H33 NCD 30 -7.676 -5.247 -6.679 331 H19 B2R 101 1H33 NCD 30 -6.758 -4.287 -5.470 332 H20 B2R 101 2H32 NCD 30 -5.371 -4.660 -8.106 333 H21 B2R 101 1H32 NCD 30 -5.614 -6.145 -7.157 334 H22 B2R 101 H29 NCD 30 -2.508 -4.077 -5.283 335 H23 B2R 101 H14 NCD 30 -2.813 -0.817 -6.981 336 H24 B2R 101 H15 NCD 30 -1.232 1.044 -6.473 337 H25 B2R 101 H16 NCD 30 0.725 1.868 -5.100 338 H26 B2R 101 H17 NCD 30 2.394 1.410 -3.352 339 H27 B2R 101 1H22 NCD 30 3.124 -1.855 -2.165 340 H28 B2R 101 3H22 NCD 30 2.188 -0.943 -0.964 341 H29 B2R 101 2H22 NCD 30 3.454 -0.128 -1.920 342 H1 B2R 102 H6 NCD 31 2.582 -1.375 -5.491 343 H2 B2R 102 H5 NCD 31 0.910 -3.039 -6.183 344 H3 B2R 102 H4 NCD 31 0.087 -5.355 -6.129 345 H4 B2R 102 H3 NCD 31 0.406 -7.696 -5.291 346 H5 B2R 102 1H11 NCD 31 5.101 -1.872 -2.969 347 H6 B2R 102 2H11 NCD 31 5.508 -1.678 -4.687 348 H7 B2R 102 3H11 NCD 31 4.156 -0.743 -3.991 349 H8 B2R 102 H23 NCD 31 3.064 -8.743 -3.272 350 H9 B2R 102 2H26 NCD 31 1.931 -11.680 -1.532 351 H10 B2R 102 1H26 NCD 31 0.819 -10.295 -1.602 352 H11 B2R 102 1H27 NCD 31 -0.239 -12.699 -1.688 353 H12 B2R 102 2H27 NCD 31 0.444 -12.813 -3.308 354 H13 B2R 102 1H28 NCD 31 -0.901 -10.449 -3.610 355 H14 B2R 102 2H28 NCD 31 -1.594 -12.024 -3.961 356 H30 B2R 102 1H35 NCD 31 -1.943 -10.981 -1.174 357 H16 B2R 102 1H34 NCD 31 -2.726 -9.421 -3.309 358 H17 B2R 102 2H34 NCD 31 -4.120 -10.490 -3.111 359 H18 B2R 102 1H33 NCD 31 -4.773 -9.512 -1.098 360 H19 B2R 102 2H33 NCD 31 -3.100 -9.111 -0.593 361 H20 B2R 102 1H32 NCD 31 -3.242 -7.417 -2.690 362 H21 B2R 102 2H32 NCD 31 -4.990 -7.591 -2.421 363 H22 B2R 102 H29 NCD 31 -3.123 -4.839 -0.480 364 H23 B2R 102 H14 NCD 31 -0.528 -6.055 1.829 365 H24 B2R 102 H15 NCD 31 1.227 -4.468 2.653 366 H25 B2R 102 H16 NCD 31 2.204 -2.106 2.575 367 H26 B2R 102 H17 NCD 31 2.081 0.171 1.655 368 H27 B2R 102 1H22 NCD 31 0.860 1.803 0.420 369 H28 B2R 102 2H22 NCD 31 0.559 1.110 -1.193 370 H29 B2R 102 3H22 NCD 31 -0.798 1.387 -0.065 Start of MODEL 8 1 H5' G 1 H5' G 1 20.588 -4.734 -11.940 2 H5'' G 1 H5'' G 1 21.987 -3.967 -12.712 3 H4' G 1 H4' G 1 20.613 -2.499 -13.965 4 H3' G 1 H3' G 1 18.309 -3.412 -12.251 5 H2' G 1 H2' G 1 16.873 -3.083 -14.145 6 HO2' G 1 HO2' G 1 17.340 -1.557 -15.522 7 H1' G 1 H1' G 1 18.700 -4.159 -16.016 8 H8 G 1 H8 G 1 18.145 -5.885 -12.633 9 H1 G 1 H1 G 1 14.581 -8.035 -17.505 10 H21 G 1 H21 G 1 15.947 -5.385 -19.237 11 H22 G 1 H22 G 1 14.848 -6.759 -19.251 12 HO5' G 1 H5T G 1 20.317 -2.176 -11.432 13 H5' U 2 H5' U 2 17.482 -0.105 -14.293 14 H5'' U 2 H5'' U 2 16.557 1.180 -13.492 15 H4' U 2 H4' U 2 15.412 0.749 -15.473 16 H3' U 2 H3' U 2 14.009 -0.638 -13.194 17 H2' U 2 H2' U 2 12.300 -1.249 -14.816 18 HO2' U 2 HO2' U 2 13.283 0.891 -16.091 19 H1' U 2 H1' U 2 14.145 -2.173 -16.675 20 H3 U 2 H3 U 2 12.475 -5.955 -14.889 21 H5 U 2 H5 U 2 15.085 -4.487 -11.947 22 H6 U 2 H6 U 2 15.453 -2.569 -13.333 23 H5' A 3 H5' A 3 11.703 1.248 -15.365 24 H5'' A 3 H5'' A 3 10.380 2.300 -14.830 25 H4' A 3 H4' A 3 9.467 0.729 -16.339 26 H3' A 3 H3' A 3 8.727 0.229 -13.475 27 H2' A 3 H2' A 3 7.517 -1.727 -14.123 28 HO2' A 3 HO2' A 3 6.953 -0.245 -16.183 29 H1' A 3 H1' A 3 9.251 -2.464 -16.258 30 H8 A 3 H8 A 3 11.520 -2.024 -13.402 31 H61 A 3 H61 A 3 10.954 -6.329 -11.232 32 H62 A 3 H62 A 3 9.838 -7.651 -11.422 33 H2 A 3 H2 A 3 7.071 -6.448 -14.774 34 H5' C 4 H5' C 4 5.410 0.259 -15.223 35 H5'' C 4 H5'' C 4 4.047 1.246 -14.666 36 H4' C 4 H4' C 4 3.199 -0.880 -14.519 37 H3' C 4 H3' C 4 4.253 -0.092 -11.820 38 H2' C 4 H2' C 4 3.748 -2.269 -10.978 39 HO2' C 4 HO2' C 4 1.837 -2.972 -11.654 40 H1' C 4 H1' C 4 4.333 -3.672 -13.388 41 H41 C 4 H41 C 4 9.986 -3.597 -10.033 42 H42 C 4 H42 C 4 9.048 -4.954 -9.414 43 H5 C 4 H5 C 4 9.028 -2.027 -11.631 44 H6 C 4 H6 C 4 7.074 -1.532 -13.002 45 H5' U 5 H5' U 5 0.346 -2.074 -12.116 46 H5'' U 5 H5'' U 5 -0.821 -1.060 -11.244 47 H4' U 5 H4' U 5 -1.410 -3.282 -10.775 48 H3' U 5 H3' U 5 -0.158 -1.811 -8.524 49 H2' U 5 H2' U 5 0.151 -3.746 -7.189 50 HO2' U 5 HO2' U 5 -2.148 -4.374 -8.277 51 H1' U 5 H1' U 5 0.683 -5.623 -9.224 52 H3 U 5 H3 U 5 4.549 -5.584 -6.959 53 H5 U 5 H5 U 5 4.410 -1.768 -8.682 54 H6 U 5 H6 U 5 2.270 -2.347 -9.619 55 H5' G 6 H5' G 6 -4.688 1.017 -9.323 56 H5'' G 6 H5'' G 6 -3.263 1.340 -8.316 57 H4' G 6 H4' G 6 -5.811 1.847 -7.582 58 H3' G 6 H3' G 6 -3.368 1.373 -5.906 59 H2' G 6 H2' G 6 -4.709 1.261 -3.945 60 HO2' G 6 HO2' G 6 -5.928 3.220 -4.904 61 H1' G 6 H1' G 6 -7.030 0.142 -5.211 62 H8 G 6 H8 G 6 -6.864 -2.587 -5.432 63 H1 G 6 H1 G 6 -2.092 -2.205 -1.192 64 H21 G 6 H21 G 6 -1.950 1.111 -2.166 65 H22 G 6 H22 G 6 -1.297 -0.189 -1.170 66 H5' G 7 H5' G 7 -1.926 6.460 -6.160 67 H5'' G 7 H5'' G 7 -1.325 6.068 -4.537 68 H4' G 7 H4' G 7 -2.442 8.360 -4.995 69 H3' G 7 H3' G 7 -2.674 6.667 -2.566 70 H2' G 7 H2' G 7 -4.478 7.945 -1.671 71 HO2' G 7 HO2' G 7 -5.092 9.949 -2.700 72 H1' G 7 H1' G 7 -5.876 8.358 -4.039 73 H8 G 7 H8 G 7 -7.716 6.692 -4.273 74 H1 G 7 H1 G 7 -4.639 2.377 -0.698 75 H21 G 7 H21 G 7 -2.044 4.668 -0.715 76 H22 G 7 H22 G 7 -2.664 3.102 -0.173 77 H5' A 8 H5' A 8 -3.339 10.115 -1.025 78 H5'' A 8 H5'' A 8 -2.239 10.496 0.313 79 H4' A 8 H4' A 8 -4.272 8.634 1.158 80 H3' A 8 H3' A 8 -5.314 11.065 -0.262 81 H2' A 8 H2' A 8 -6.847 11.467 1.524 82 HO2' A 8 HO2' A 8 -7.279 9.082 1.608 83 H1' A 8 H1' A 8 -5.095 10.697 3.617 84 H8 A 8 H8 A 8 -3.381 12.919 1.105 85 H61 A 8 H61 A 8 -4.396 17.210 3.172 86 H62 A 8 H62 A 8 -5.457 17.686 4.490 87 H2 A 8 H2 A 8 -7.433 13.963 5.974 88 H5' A 9 H5' A 9 -9.615 8.985 -2.534 89 H5'' A 9 H5'' A 9 -10.635 9.136 -1.091 90 H4' A 9 H4' A 9 -10.739 6.992 -2.543 91 H3' A 9 H3' A 9 -10.957 7.243 0.394 92 H2' A 9 H2' A 9 -10.479 4.978 0.849 93 HO2' A 9 HO2' A 9 -12.099 4.666 -1.150 94 H1' A 9 H1' A 9 -8.915 4.365 -1.473 95 H8 A 9 H8 A 9 -7.234 7.227 -0.048 96 H61 A 9 H61 A 9 -4.460 5.026 3.280 97 H62 A 9 H62 A 9 -4.489 3.425 3.994 98 H2 A 9 H2 A 9 -7.900 1.219 2.125 99 H5' C 10 H5' C 10 -14.029 7.978 2.749 100 H5'' C 10 H5'' C 10 -12.462 7.706 1.962 101 H4' C 10 H4' C 10 -14.339 5.413 2.225 102 H3' C 10 H3' C 10 -13.043 6.712 4.581 103 H2' C 10 H2' C 10 -12.232 4.609 5.381 104 HO2' C 10 HO2' C 10 -14.440 3.728 4.447 105 H1' C 10 H1' C 10 -11.505 3.538 2.900 106 H41 C 10 H41 C 10 -6.376 7.400 4.142 107 H42 C 10 H42 C 10 -6.118 5.983 5.153 108 H5 C 10 H5 C 10 -8.421 7.743 2.889 109 H6 C 10 H6 C 10 -10.680 6.898 2.517 110 H5' A 11 H5' A 11 -15.859 4.611 7.315 111 H5'' A 11 H5'' A 11 -15.321 5.412 8.805 112 H4' A 11 H4' A 11 -14.419 3.015 7.888 113 H3' A 11 H3' A 11 -13.190 4.969 9.812 114 H2' A 11 H2' A 11 -11.166 3.700 9.801 115 HO2' A 11 HO2' A 11 -12.741 1.698 9.703 116 H1' A 11 H1' A 11 -11.270 2.978 7.054 117 H8 A 11 H8 A 11 -11.585 6.303 6.218 118 H61 A 11 H61 A 11 -7.367 8.278 7.643 119 H62 A 11 H62 A 11 -6.062 7.717 8.674 120 H2 A 11 H2 A 11 -7.214 3.622 10.092 121 H5' U 12 H5' U 12 -13.290 1.265 11.594 122 H5'' U 12 H5'' U 12 -14.105 1.089 13.159 123 H4' U 12 H4' U 12 -12.096 0.016 13.493 124 H3' U 12 H3' U 12 -11.943 2.790 14.607 125 H2' U 12 H2' U 12 -9.622 2.468 15.154 126 HO2' U 12 HO2' U 12 -9.842 0.281 15.858 127 H1' U 12 H1' U 12 -8.895 1.316 12.736 128 H3 U 12 H3 U 12 -7.551 5.740 13.066 129 H5 U 12 H5 U 12 -11.122 5.669 10.870 130 H6 U 12 H6 U 12 -11.376 3.362 11.506 131 H5' G 13 H5' G 13 -12.272 3.625 18.741 132 H5'' G 13 H5'' G 13 -11.570 4.931 17.765 133 H4' G 13 H4' G 13 -10.210 3.028 19.642 134 H3' G 13 H3' G 13 -10.543 6.002 19.582 135 H2' G 13 H2' G 13 -8.298 6.302 20.404 136 HO2' G 13 HO2' G 13 -8.664 4.147 21.649 137 H1' G 13 H1' G 13 -7.106 4.569 18.626 138 H8 G 13 H8 G 13 -10.139 5.979 16.919 139 H1 G 13 H1 G 13 -5.040 9.861 16.824 140 H21 G 13 H21 G 13 -3.680 7.600 19.034 141 H22 G 13 H22 G 13 -3.482 9.094 18.127 142 H5' U 14 H5' U 14 -11.630 7.800 24.093 143 H5'' U 14 H5'' U 14 -12.990 7.902 22.959 144 H4' U 14 H4' U 14 -10.507 9.612 23.024 145 H3' U 14 H3' U 14 -12.582 10.185 24.537 146 H2' U 14 H2' U 14 -14.292 9.814 22.842 147 HO2' U 14 HO2' U 14 -14.750 12.102 22.056 148 H1' U 14 H1' U 14 -12.661 11.542 20.905 149 H3 U 14 H3 U 14 -16.488 10.713 18.480 150 H5 U 14 H5 U 14 -14.266 7.158 18.476 151 H6 U 14 H6 U 14 -12.848 8.132 20.159 152 H5' U 15 H5' U 15 -9.429 13.096 22.842 153 H5'' U 15 H5'' U 15 -8.228 13.203 24.146 154 H4' U 15 H4' U 15 -8.013 15.157 22.846 155 H3' U 15 H3' U 15 -8.271 15.477 25.475 156 H2' U 15 H2' U 15 -10.691 15.664 25.531 157 HO2' U 15 HO2' U 15 -9.293 18.050 25.523 158 H1' U 15 H1' U 15 -10.527 17.544 23.108 159 H3 U 15 H3 U 15 -14.943 17.964 22.997 160 H5 U 15 H5 U 15 -14.438 13.858 23.684 161 H6 U 15 H6 U 15 -12.068 14.250 23.813 162 H5' U 16 H5' U 16 -4.556 18.015 22.416 163 H5'' U 16 H5'' U 16 -6.077 18.418 21.595 164 H4' U 16 H4' U 16 -4.466 15.993 20.865 165 H3' U 16 H3' U 16 -3.243 18.379 20.532 166 H2' U 16 H2' U 16 -4.973 19.436 19.220 167 HO2' U 16 HO2' U 16 -2.884 18.453 17.825 168 H1' U 16 H1' U 16 -5.346 16.762 17.750 169 H3 U 16 H3 U 16 -9.092 20.407 18.610 170 H5 U 16 H5 U 16 -8.923 17.911 15.245 171 H6 U 16 H6 U 16 -6.931 16.926 16.171 172 H5' C 17 H5' C 17 -0.998 14.663 20.179 173 H5'' C 17 H5'' C 17 0.706 15.151 20.080 174 H4' C 17 H4' C 17 0.749 13.022 19.238 175 H3' C 17 H3' C 17 1.169 15.045 17.321 176 H2' C 17 H2' C 17 -0.606 14.534 15.878 177 HO2' C 17 HO2' C 17 1.469 12.799 15.478 178 H1' C 17 H1' C 17 -0.679 11.652 16.930 179 H41 C 17 H41 C 17 -6.468 13.207 14.168 180 H42 C 17 H42 C 17 -6.731 11.763 15.133 181 H5 C 17 H5 C 17 -4.322 14.370 14.188 182 H6 C 17 H6 C 17 -2.088 14.409 15.157 183 H5' A 18 H5' A 18 2.289 10.016 16.034 184 H5'' A 18 H5'' A 18 0.777 10.740 15.449 185 H4' A 18 H4' A 18 0.925 8.391 17.332 186 H3' A 18 H3' A 18 0.858 8.390 14.333 187 H2' A 18 H2' A 18 -0.812 6.701 14.334 188 HO2' A 18 HO2' A 18 0.560 5.566 16.027 189 H1' A 18 H1' A 18 -2.027 7.464 16.831 190 H8 A 18 H8 A 18 -2.079 10.393 14.523 191 H61 A 18 H61 A 18 -6.299 9.422 12.274 192 H62 A 18 H62 A 18 -7.336 8.011 12.256 193 H2 A 18 H2 A 18 -5.422 4.920 14.845 194 H5' U 19 H5' U 19 1.465 4.990 11.874 195 H5'' U 19 H5'' U 19 0.334 6.117 12.648 196 H4' U 19 H4' U 19 0.232 3.253 13.437 197 H3' U 19 H3' U 19 -0.521 4.196 10.702 198 H2' U 19 H2' U 19 -2.607 3.018 10.820 199 HO2' U 19 HO2' U 19 -2.694 1.240 11.978 200 H1' U 19 H1' U 19 -3.302 3.870 13.348 201 H3 U 19 H3 U 19 -5.454 6.139 9.913 202 H5 U 19 H5 U 19 -2.258 8.534 11.204 203 H6 U 19 H6 U 19 -1.508 6.668 12.536 204 H5' G 20 H5' G 20 -0.991 0.362 11.487 205 H5'' G 20 H5'' G 20 -0.173 -0.887 10.529 206 H4' G 20 H4' G 20 -2.254 -1.796 10.937 207 H3' G 20 H3' G 20 -2.091 -0.651 8.188 208 H2' G 20 H2' G 20 -4.430 -1.066 7.804 209 HO2' G 20 HO2' G 20 -4.086 -3.100 9.279 210 H1' G 20 H1' G 20 -5.344 -0.084 10.206 211 H8 G 20 H8 G 20 -2.405 2.057 9.578 212 H1 G 20 H1 G 20 -7.475 3.660 6.010 213 H21 G 20 H21 G 20 -8.763 0.634 7.060 214 H22 G 20 H22 G 20 -9.003 2.081 6.093 215 H5' U 21 H5' U 21 -2.982 -4.660 7.663 216 H5'' U 21 H5'' U 21 -1.869 -5.672 6.721 217 H4' U 21 H4' U 21 -3.846 -6.034 5.635 218 H3' U 21 H3' U 21 -2.303 -3.919 4.216 219 H2' U 21 H2' U 21 -4.141 -3.323 2.825 220 HO2' U 21 HO2' U 21 -4.682 -5.922 3.152 221 H1' U 21 H1' U 21 -6.195 -3.614 4.720 222 H3 U 21 H3 U 21 -5.838 0.799 3.588 223 H5 U 21 H5 U 21 -2.996 0.187 6.598 224 H6 U 21 H6 U 21 -3.514 -2.157 6.517 225 H5' G 22 H5' G 22 -0.554 -9.507 3.061 226 H5'' G 22 H5'' G 22 0.419 -8.570 4.211 227 H4' G 22 H4' G 22 1.975 -9.215 2.656 228 H3' G 22 H3' G 22 1.087 -6.451 1.862 229 H2' G 22 H2' G 22 2.607 -6.592 -0.006 230 HO2' G 22 HO2' G 22 4.215 -7.679 1.414 231 H1' G 22 H1' G 22 2.018 -9.289 -0.617 232 H8 G 22 H8 G 22 -0.636 -9.602 -1.545 233 H1 G 22 H1 G 22 -0.110 -3.412 -3.054 234 H21 G 22 H21 G 22 2.475 -3.431 -0.776 235 H22 G 22 H22 G 22 1.486 -2.519 -1.925 236 H5' G 23 H5' G 23 6.229 -4.353 3.429 237 H5'' G 23 H5'' G 23 5.985 -4.398 1.672 238 H4' G 23 H4' G 23 8.194 -5.307 3.137 239 H3' G 23 H3' G 23 7.454 -5.355 0.234 240 H2' G 23 H2' G 23 9.171 -6.960 -0.203 241 HO2' G 23 HO2' G 23 10.595 -5.754 1.360 242 H1' G 23 H1' G 23 8.778 -8.499 2.112 243 H8 G 23 H8 G 23 7.863 -10.605 1.155 244 H1 G 23 H1 G 23 4.000 -7.396 -2.833 245 H21 G 23 H21 G 23 5.440 -4.628 -1.471 246 H22 G 23 H22 G 23 4.302 -5.275 -2.637 247 H5' A 24 H5' A 24 11.491 -4.777 -2.542 248 H5'' A 24 H5'' A 24 10.000 -5.735 -2.468 249 H4' A 24 H4' A 24 11.650 -7.277 -2.969 250 H3' A 24 H3' A 24 10.453 -7.576 -0.437 251 H2' A 24 H2' A 24 12.372 -7.382 0.888 252 HO2' A 24 HO2' A 24 12.858 -9.823 -0.524 253 H1' A 24 H1' A 24 14.121 -8.213 -1.488 254 H8 A 24 H8 A 24 13.632 -5.675 1.347 255 H61 A 24 H61 A 24 18.343 -4.917 2.351 256 H62 A 24 H62 A 24 19.824 -5.521 1.627 257 H2 A 24 H2 A 24 18.652 -8.226 -1.725 258 H5' A 25 H5' A 25 10.997 -11.433 -1.070 259 H5'' A 25 H5'' A 25 11.237 -12.898 -2.041 260 H4' A 25 H4' A 25 8.961 -12.809 -1.375 261 H3' A 25 H3' A 25 9.531 -13.245 -3.967 262 H2' A 25 H2' A 25 9.353 -10.915 -4.665 263 HO2' A 25 HO2' A 25 6.882 -10.813 -5.259 264 H1' A 25 H1' A 25 6.829 -10.796 -2.905 265 H8 A 25 H8 A 25 9.545 -8.438 -2.147 266 H61 A 25 H61 A 25 7.810 -4.435 -4.263 267 H62 A 25 H62 A 25 6.505 -4.151 -5.409 268 H2 A 25 H2 A 25 4.605 -8.106 -6.243 269 H5' G 26 H5' G 26 7.878 -14.974 -6.876 270 H5'' G 26 H5'' G 26 7.735 -13.378 -6.114 271 H4' G 26 H4' G 26 5.278 -14.731 -7.117 272 H3' G 26 H3' G 26 7.422 -13.686 -8.912 273 H2' G 26 H2' G 26 5.833 -12.446 -10.207 274 HO2' G 26 HO2' G 26 4.223 -14.409 -9.358 275 H1' G 26 H1' G 26 4.321 -11.494 -8.073 276 H8 G 26 H8 G 26 7.992 -11.565 -7.184 277 H1 G 26 H1 G 26 6.064 -6.278 -10.247 278 H21 G 26 H21 G 26 3.094 -8.000 -10.663 279 H22 G 26 H22 G 26 3.994 -6.515 -10.938 280 H5' U 27 H5' U 27 4.771 -14.733 -11.167 281 H5'' U 27 H5'' U 27 4.970 -15.908 -12.479 282 H4' U 27 H4' U 27 4.156 -14.117 -13.625 283 H3' U 27 H3' U 27 7.151 -13.882 -13.739 284 H2' U 27 H2' U 27 6.878 -11.859 -15.020 285 HO2' U 27 HO2' U 27 5.137 -11.575 -16.192 286 H1' U 27 H1' U 27 4.887 -10.797 -13.372 287 H3 U 27 H3 U 27 8.602 -8.380 -12.507 288 H5 U 27 H5 U 27 9.079 -11.920 -10.283 289 H6 U 27 H6 U 27 7.126 -12.773 -11.401 290 H5' A 28 H5' A 28 5.337 -13.291 -17.117 291 H5'' A 28 H5'' A 28 5.868 -14.064 -18.624 292 H4' A 28 H4' A 28 5.575 -11.813 -19.159 293 H3' A 28 H3' A 28 8.485 -12.467 -18.784 294 H2' A 28 H2' A 28 9.020 -10.181 -19.298 295 HO2' A 28 HO2' A 28 7.015 -10.347 -20.886 296 H1' A 28 H1' A 28 6.869 -9.068 -17.844 297 H8 A 28 H8 A 28 8.299 -11.742 -15.689 298 H61 A 28 H61 A 28 11.795 -9.158 -13.537 299 H62 A 28 H62 A 28 12.505 -7.591 -13.833 300 H2 A 28 H2 A 28 10.371 -5.912 -17.414 301 H5' C 29 H5' C 29 8.291 -10.863 -22.226 302 H5'' C 29 H5'' C 29 9.086 -11.573 -23.646 303 H4' C 29 H4' C 29 10.056 -9.484 -23.468 304 H3' C 29 H3' C 29 11.863 -11.517 -22.183 305 HO3' C 29 H3T C 29 11.912 -11.735 -24.267 306 H2' C 29 H2' C 29 13.399 -9.747 -21.653 307 HO2' C 29 HO2' C 29 12.577 -8.759 -23.865 308 H1' C 29 H1' C 29 11.407 -7.903 -20.877 309 H41 C 29 H41 C 29 12.405 -11.690 -15.582 310 H42 C 29 H42 C 29 13.657 -10.448 -15.562 311 H5 C 29 H5 C 29 10.875 -11.912 -17.467 312 H6 C 29 H6 C 29 10.236 -10.986 -19.629 313 H1 B2R 101 H6 NCD 30 -1.560 -0.336 3.049 314 H2 B2R 101 H5 NCD 30 -3.067 -2.145 2.339 315 H3 B2R 101 H4 NCD 30 -4.915 -2.934 0.926 316 H4 B2R 101 H3 NCD 30 -6.621 -2.385 -0.876 317 H5 B2R 101 1H11 NCD 30 -0.517 1.622 2.466 318 H6 B2R 101 2H11 NCD 30 -1.243 2.883 1.424 319 H7 B2R 101 3H11 NCD 30 -1.847 2.636 3.082 320 H8 B2R 101 H23 NCD 30 -6.968 0.776 -2.350 321 H9 B2R 101 2H26 NCD 30 -9.498 -2.130 -3.944 322 H10 B2R 101 1H26 NCD 30 -10.450 -0.651 -4.219 323 H11 B2R 101 2H27 NCD 30 -9.633 -0.352 -6.347 324 H12 B2R 101 1H27 NCD 30 -7.991 -0.800 -5.906 325 H13 B2R 101 2H28 NCD 30 -8.975 -3.297 -5.817 326 H14 B2R 101 1H28 NCD 30 -10.315 -2.603 -6.719 327 H30 B2R 101 1H35 NCD 30 -8.549 -1.797 -8.401 328 H16 B2R 101 1H34 NCD 30 -6.504 -2.997 -8.668 329 H17 B2R 101 2H34 NCD 30 -6.481 -2.300 -7.057 330 H18 B2R 101 2H33 NCD 30 -7.493 -5.165 -7.495 331 H19 B2R 101 1H33 NCD 30 -6.837 -4.429 -5.995 332 H20 B2R 101 2H32 NCD 30 -4.961 -4.635 -8.358 333 H21 B2R 101 1H32 NCD 30 -5.396 -6.142 -7.522 334 H22 B2R 101 H29 NCD 30 -2.413 -4.205 -5.305 335 H23 B2R 101 H14 NCD 30 -2.857 -0.926 -6.857 336 H24 B2R 101 H15 NCD 30 -1.388 1.016 -6.291 337 H25 B2R 101 H16 NCD 30 0.509 1.911 -4.897 338 H26 B2R 101 H17 NCD 30 2.204 1.518 -3.161 339 H27 B2R 101 1H22 NCD 30 3.354 -0.036 -1.763 340 H28 B2R 101 3H22 NCD 30 3.088 -1.763 -2.103 341 H29 B2R 101 2H22 NCD 30 2.131 -0.949 -0.841 342 H1 B2R 102 H6 NCD 31 2.438 -1.332 -5.360 343 H2 B2R 102 H5 NCD 31 0.813 -2.994 -6.095 344 H3 B2R 102 H4 NCD 31 0.035 -5.382 -6.115 345 H4 B2R 102 H3 NCD 31 0.455 -7.740 -5.337 346 H5 B2R 102 1H11 NCD 31 4.013 -0.693 -3.985 347 H6 B2R 102 2H11 NCD 31 4.868 -1.768 -2.834 348 H7 B2R 102 3H11 NCD 31 5.430 -1.640 -4.520 349 H8 B2R 102 H23 NCD 31 3.155 -8.799 -3.377 350 H9 B2R 102 2H26 NCD 31 1.700 -12.322 -2.187 351 H10 B2R 102 1H26 NCD 31 1.005 -10.763 -1.696 352 H11 B2R 102 1H27 NCD 31 -0.104 -12.807 -3.668 353 H12 B2R 102 2H27 NCD 31 -0.380 -11.109 -4.024 354 H13 B2R 102 1H28 NCD 31 -1.992 -12.686 -2.389 355 H14 B2R 102 2H28 NCD 31 -1.006 -11.854 -1.187 356 H30 B2R 102 1H35 NCD 31 -3.029 -10.742 -3.065 357 H16 B2R 102 1H34 NCD 31 -2.972 -10.944 -0.378 358 H17 B2R 102 2H34 NCD 31 -2.201 -9.363 -0.569 359 H18 B2R 102 1H33 NCD 31 -4.359 -9.053 -2.273 360 H19 B2R 102 2H33 NCD 31 -5.055 -10.159 -1.034 361 H20 B2R 102 1H32 NCD 31 -5.487 -7.876 -0.309 362 H21 B2R 102 2H32 NCD 31 -4.190 -8.508 0.746 363 H22 B2R 102 H29 NCD 31 -3.028 -5.133 -0.471 364 H23 B2R 102 H14 NCD 31 -0.411 -6.108 1.870 365 H24 B2R 102 H15 NCD 31 1.225 -4.415 2.746 366 H25 B2R 102 H16 NCD 31 2.044 -1.981 2.689 367 H26 B2R 102 H17 NCD 31 1.783 0.277 1.765 368 H27 B2R 102 1H22 NCD 31 -1.148 1.269 -0.101 369 H28 B2R 102 2H22 NCD 31 0.416 1.833 0.527 370 H29 B2R 102 3H22 NCD 31 0.317 1.105 -1.097 Start of MODEL 9 1 H5' G 1 H5' G 1 18.280 -8.711 -18.890 2 H5'' G 1 H5'' G 1 19.327 -7.299 -18.664 3 H4' G 1 H4' G 1 18.146 -6.264 -20.204 4 H3' G 1 H3' G 1 16.111 -6.291 -18.014 5 H2' G 1 H2' G 1 14.388 -5.633 -19.548 6 HO2' G 1 HO2' G 1 14.986 -4.354 -21.132 7 H1' G 1 H1' G 1 15.073 -7.405 -21.561 8 H8 G 1 H8 G 1 15.708 -8.752 -18.053 9 H1 G 1 H1 G 1 9.859 -9.879 -20.414 10 H21 G 1 H21 G 1 10.839 -7.765 -22.959 11 H22 G 1 H22 G 1 9.573 -8.773 -22.269 12 HO5' G 1 H5T G 1 17.761 -6.550 -17.072 13 H5' U 2 H5' U 2 15.660 -3.153 -19.951 14 H5'' U 2 H5'' U 2 15.531 -1.539 -19.228 15 H4' U 2 H4' U 2 13.598 -1.729 -20.472 16 H3' U 2 H3' U 2 13.019 -2.330 -17.593 17 H2' U 2 H2' U 2 10.727 -2.798 -18.158 18 HO2' U 2 HO2' U 2 11.220 -1.029 -20.043 19 H1' U 2 H1' U 2 11.279 -4.242 -20.488 20 H3 U 2 H3 U 2 9.824 -7.397 -17.615 21 H5 U 2 H5 U 2 13.762 -6.619 -16.413 22 H6 U 2 H6 U 2 13.840 -4.861 -18.042 23 H5' A 3 H5' A 3 10.265 -0.179 -18.796 24 H5'' A 3 H5'' A 3 9.650 1.222 -17.899 25 H4' A 3 H4' A 3 7.813 -0.186 -18.134 26 H3' A 3 H3' A 3 8.986 -0.514 -15.377 27 H2' A 3 H2' A 3 7.261 -2.100 -14.907 28 HO2' A 3 HO2' A 3 5.397 -1.339 -15.645 29 H1' A 3 H1' A 3 7.214 -3.217 -17.531 30 H8 A 3 H8 A 3 10.761 -3.206 -16.411 31 H61 A 3 H61 A 3 10.757 -7.373 -13.856 32 H62 A 3 H62 A 3 9.468 -8.445 -13.344 33 H2 A 3 H2 A 3 5.624 -6.705 -14.806 34 H5' C 4 H5' C 4 4.791 0.813 -14.805 35 H5'' C 4 H5'' C 4 4.621 1.431 -13.150 36 H4' C 4 H4' C 4 3.250 -0.605 -13.758 37 H3' C 4 H3' C 4 5.043 -0.584 -11.345 38 H2' C 4 H2' C 4 4.343 -2.795 -10.828 39 HO2' C 4 HO2' C 4 2.173 -2.195 -12.542 40 H1' C 4 H1' C 4 4.233 -3.648 -13.533 41 H41 C 4 H41 C 4 10.420 -4.900 -11.737 42 H42 C 4 H42 C 4 9.434 -6.039 -10.819 43 H5 C 4 H5 C 4 9.372 -3.114 -13.049 44 H6 C 4 H6 C 4 7.244 -2.161 -13.763 45 H5' U 5 H5' U 5 0.203 -2.573 -12.342 46 H5'' U 5 H5'' U 5 -1.076 -1.516 -11.712 47 H4' U 5 H4' U 5 -1.548 -3.541 -10.729 48 H3' U 5 H3' U 5 -0.075 -1.796 -8.804 49 H2' U 5 H2' U 5 0.098 -3.570 -7.215 50 HO2' U 5 HO2' U 5 -2.221 -4.182 -8.064 51 H1' U 5 H1' U 5 0.606 -5.651 -9.027 52 H3 U 5 H3 U 5 4.579 -5.388 -7.017 53 H5 U 5 H5 U 5 4.278 -1.700 -8.993 54 H6 U 5 H6 U 5 2.106 -2.385 -9.771 55 H5' G 6 H5' G 6 -4.425 1.426 -9.120 56 H5'' G 6 H5'' G 6 -3.124 1.555 -7.923 57 H4' G 6 H4' G 6 -5.781 1.949 -7.448 58 H3' G 6 H3' G 6 -3.522 1.344 -5.557 59 H2' G 6 H2' G 6 -5.103 1.101 -3.795 60 HO2' G 6 HO2' G 6 -6.217 3.117 -4.788 61 H1' G 6 H1' G 6 -7.216 0.074 -5.457 62 H8 G 6 H8 G 6 -7.289 -2.558 -5.491 63 H1 G 6 H1 G 6 -2.421 -2.605 -1.346 64 H21 G 6 H21 G 6 -2.005 0.677 -2.317 65 H22 G 6 H22 G 6 -1.464 -0.683 -1.331 66 H5' G 7 H5' G 7 -1.911 6.362 -6.314 67 H5'' G 7 H5'' G 7 -1.066 5.955 -4.808 68 H4' G 7 H4' G 7 -1.970 8.298 -4.993 69 H3' G 7 H3' G 7 -2.370 6.517 -2.655 70 H2' G 7 H2' G 7 -3.992 7.948 -1.644 71 HO2' G 7 HO2' G 7 -4.407 10.067 -2.614 72 H1' G 7 H1' G 7 -5.423 8.584 -3.922 73 H8 G 7 H8 G 7 -7.300 6.977 -4.407 74 H1 G 7 H1 G 7 -4.621 2.401 -0.835 75 H21 G 7 H21 G 7 -1.962 4.590 -0.556 76 H22 G 7 H22 G 7 -2.682 3.022 -0.128 77 H5' A 8 H5' A 8 -2.249 7.182 1.190 78 H5'' A 8 H5'' A 8 -3.262 7.038 -0.259 79 H4' A 8 H4' A 8 -4.587 7.831 1.574 80 H3' A 8 H3' A 8 -4.137 9.824 -0.625 81 H2' A 8 H2' A 8 -5.424 11.443 0.604 82 HO2' A 8 HO2' A 8 -7.026 10.052 1.407 83 H1' A 8 H1' A 8 -4.178 10.988 3.045 84 H8 A 8 H8 A 8 -1.780 10.524 0.136 85 H61 A 8 H61 A 8 -0.083 15.073 -0.078 86 H62 A 8 H62 A 8 -0.552 16.565 0.726 87 H2 A 8 H2 A 8 -3.997 15.596 3.392 88 H5' A 9 H5' A 9 -9.751 9.033 -2.527 89 H5'' A 9 H5'' A 9 -9.540 9.078 -0.766 90 H4' A 9 H4' A 9 -10.603 7.010 -2.348 91 H3' A 9 H3' A 9 -10.159 7.425 0.566 92 H2' A 9 H2' A 9 -10.148 5.093 1.029 93 HO2' A 9 HO2' A 9 -12.031 5.066 -0.702 94 H1' A 9 H1' A 9 -8.943 4.210 -1.384 95 H8 A 9 H8 A 9 -6.892 7.036 -0.133 96 H61 A 9 H61 A 9 -3.964 4.555 2.837 97 H62 A 9 H62 A 9 -4.007 2.929 3.492 98 H2 A 9 H2 A 9 -7.685 0.973 1.855 99 H5' C 10 H5' C 10 -12.358 8.495 3.569 100 H5'' C 10 H5'' C 10 -11.148 7.895 2.419 101 H4' C 10 H4' C 10 -13.395 6.082 3.033 102 H3' C 10 H3' C 10 -11.532 6.971 5.194 103 H2' C 10 H2' C 10 -11.142 4.688 5.858 104 HO2' C 10 HO2' C 10 -13.575 4.376 4.912 105 H1' C 10 H1' C 10 -10.770 3.674 3.310 106 H41 C 10 H41 C 10 -5.200 7.045 4.088 107 H42 C 10 H42 C 10 -4.994 5.632 5.115 108 H5 C 10 H5 C 10 -7.298 7.555 2.980 109 H6 C 10 H6 C 10 -9.642 6.908 2.791 110 H5' A 11 H5' A 11 -13.788 4.752 7.059 111 H5'' A 11 H5'' A 11 -14.377 5.080 8.701 112 H4' A 11 H4' A 11 -12.820 3.250 8.742 113 H3' A 11 H3' A 11 -11.877 5.772 10.078 114 H2' A 11 H2' A 11 -9.793 4.737 10.567 115 HO2' A 11 HO2' A 11 -10.890 2.795 11.338 116 H1' A 11 H1' A 11 -9.693 3.120 8.204 117 H8 A 11 H8 A 11 -10.030 6.301 6.602 118 H61 A 11 H61 A 11 -5.658 8.289 7.476 119 H62 A 11 H62 A 11 -4.341 7.853 8.553 120 H2 A 11 H2 A 11 -5.602 4.149 10.733 121 H5' U 12 H5' U 12 -11.498 1.988 13.286 122 H5'' U 12 H5'' U 12 -12.043 3.014 14.627 123 H4' U 12 H4' U 12 -9.988 1.627 15.046 124 H3' U 12 H3' U 12 -10.059 4.578 15.560 125 H2' U 12 H2' U 12 -7.751 4.527 16.213 126 HO2' U 12 HO2' U 12 -8.095 2.452 17.359 127 H1' U 12 H1' U 12 -6.887 2.803 14.177 128 H3 U 12 H3 U 12 -5.354 7.114 13.594 129 H5 U 12 H5 U 12 -8.899 6.761 11.372 130 H6 U 12 H6 U 12 -9.251 4.624 12.423 131 H5' G 13 H5' G 13 -9.420 6.002 19.864 132 H5'' G 13 H5'' G 13 -8.580 7.058 18.712 133 H4' G 13 H4' G 13 -7.614 4.444 19.853 134 H3' G 13 H3' G 13 -6.957 7.266 20.502 135 H2' G 13 H2' G 13 -4.591 6.878 20.431 136 HO2' G 13 HO2' G 13 -5.266 4.522 21.247 137 H1' G 13 H1' G 13 -4.526 5.450 18.086 138 H8 G 13 H8 G 13 -7.404 7.556 17.334 139 H1 G 13 H1 G 13 -1.916 10.861 17.245 140 H21 G 13 H21 G 13 -0.608 8.106 18.857 141 H22 G 13 H22 G 13 -0.326 9.703 18.194 142 H5' U 14 H5' U 14 -7.443 7.768 25.665 143 H5'' U 14 H5'' U 14 -8.445 8.543 24.422 144 H4' U 14 H4' U 14 -5.555 9.188 25.001 145 H3' U 14 H3' U 14 -7.387 9.986 26.731 146 H2' U 14 H2' U 14 -8.991 10.828 25.104 147 HO2' U 14 HO2' U 14 -7.456 12.700 26.413 148 H1' U 14 H1' U 14 -6.679 12.261 23.683 149 H3 U 14 H3 U 14 -10.109 13.890 21.171 150 H5 U 14 H5 U 14 -9.989 9.779 20.350 151 H6 U 14 H6 U 14 -8.403 9.545 22.148 152 H5' U 15 H5' U 15 -3.938 12.843 29.841 153 H5'' U 15 H5'' U 15 -3.926 13.756 28.319 154 H4' U 15 H4' U 15 -1.709 13.341 29.546 155 H3' U 15 H3' U 15 -2.040 14.026 27.001 156 H2' U 15 H2' U 15 -2.414 11.818 26.085 157 HO2' U 15 HO2' U 15 0.163 12.777 25.895 158 H1' U 15 H1' U 15 -0.118 10.725 27.791 159 H3 U 15 H3 U 15 -1.307 6.427 27.839 160 H5 U 15 H5 U 15 -4.380 8.243 25.639 161 H6 U 15 H6 U 15 -3.394 10.375 26.168 162 H5' U 16 H5' U 16 1.704 16.495 24.868 163 H5'' U 16 H5'' U 16 -0.041 16.389 24.565 164 H4' U 16 H4' U 16 1.091 14.115 23.388 165 H3' U 16 H3' U 16 3.252 15.750 23.455 166 H2' U 16 H2' U 16 2.282 17.603 22.255 167 HO2' U 16 HO2' U 16 3.995 16.262 20.930 168 H1' U 16 H1' U 16 0.888 15.558 20.431 169 H3 U 16 H3 U 16 -0.857 20.408 21.653 170 H5 U 16 H5 U 16 -1.660 18.432 18.044 171 H6 U 16 H6 U 16 -0.389 16.562 18.874 172 H5' C 17 H5' C 17 2.942 12.651 20.534 173 H5'' C 17 H5'' C 17 4.141 11.347 20.619 174 H4' C 17 H4' C 17 4.575 11.402 18.437 175 H3' C 17 H3' C 17 4.958 14.197 18.751 176 H2' C 17 H2' C 17 2.961 14.869 17.709 177 HO2' C 17 HO2' C 17 4.615 13.865 15.627 178 H1' C 17 H1' C 17 2.925 12.163 16.236 179 H41 C 17 H41 C 17 -2.993 14.785 15.304 180 H42 C 17 H42 C 17 -3.398 13.229 16.020 181 H5 C 17 H5 C 17 -0.682 15.570 15.194 182 H6 C 17 H6 C 17 1.627 15.051 15.779 183 H5' A 18 H5' A 18 5.183 10.444 14.039 184 H5'' A 18 H5'' A 18 3.679 11.279 13.603 185 H4' A 18 H4' A 18 3.995 9.514 16.024 186 H3' A 18 H3' A 18 3.162 8.740 13.245 187 H2' A 18 H2' A 18 1.383 7.430 14.127 188 HO2' A 18 HO2' A 18 3.115 6.723 15.828 189 H1' A 18 H1' A 18 0.925 9.073 16.447 190 H8 A 18 H8 A 18 0.558 11.439 13.731 191 H61 A 18 H61 A 18 -3.979 10.413 12.288 192 H62 A 18 H62 A 18 -5.077 9.093 12.638 193 H2 A 18 H2 A 18 -2.928 6.303 15.388 194 H5' U 19 H5' U 19 2.756 5.451 11.414 195 H5'' U 19 H5'' U 19 2.107 6.617 12.585 196 H4' U 19 H4' U 19 2.089 3.905 13.608 197 H3' U 19 H3' U 19 0.902 4.292 10.901 198 H2' U 19 H2' U 19 -1.176 3.279 11.584 199 HO2' U 19 HO2' U 19 0.387 2.017 13.274 200 H1' U 19 H1' U 19 -1.483 4.716 13.890 201 H3 U 19 H3 U 19 -3.770 6.446 10.198 202 H5 U 19 H5 U 19 -0.404 8.849 10.901 203 H6 U 19 H6 U 19 0.344 7.193 12.487 204 H5' G 20 H5' G 20 -0.327 0.809 12.366 205 H5'' G 20 H5'' G 20 0.606 -0.495 11.605 206 H4' G 20 H4' G 20 -1.504 -1.396 11.924 207 H3' G 20 H3' G 20 -0.912 -0.683 9.122 208 H2' G 20 H2' G 20 -3.158 -0.857 8.373 209 HO2' G 20 HO2' G 20 -3.287 -2.904 9.706 210 H1' G 20 H1' G 20 -4.478 0.142 10.619 211 H8 G 20 H8 G 20 -1.556 2.370 10.225 212 H1 G 20 H1 G 20 -6.318 3.633 6.129 213 H21 G 20 H21 G 20 -7.604 0.612 7.199 214 H22 G 20 H22 G 20 -7.804 2.016 6.163 215 H5' U 21 H5' U 21 -2.829 -5.639 8.252 216 H5'' U 21 H5'' U 21 -1.487 -5.486 7.100 217 H4' U 21 H4' U 21 -3.870 -6.037 6.249 218 H3' U 21 H3' U 21 -1.937 -4.139 4.960 219 H2' U 21 H2' U 21 -3.588 -3.504 3.359 220 HO2' U 21 HO2' U 21 -4.261 -6.020 3.612 221 H1' U 21 H1' U 21 -5.818 -3.608 5.116 222 H3 U 21 H3 U 21 -5.383 0.676 3.622 223 H5 U 21 H5 U 21 -2.590 0.300 6.735 224 H6 U 21 H6 U 21 -3.131 -2.038 6.846 225 H5' G 22 H5' G 22 -0.578 -9.330 3.404 226 H5'' G 22 H5'' G 22 0.765 -8.804 4.438 227 H4' G 22 H4' G 22 1.904 -9.545 2.617 228 H3' G 22 H3' G 22 1.459 -6.609 2.184 229 H2' G 22 H2' G 22 2.356 -6.776 -0.014 230 HO2' G 22 HO2' G 22 4.060 -8.290 1.129 231 H1' G 22 H1' G 22 1.529 -9.497 -0.480 232 H8 G 22 H8 G 22 -1.106 -9.629 -1.312 233 H1 G 22 H1 G 22 -0.265 -3.514 -2.998 234 H21 G 22 H21 G 22 2.349 -3.599 -0.751 235 H22 G 22 H22 G 22 1.383 -2.677 -1.914 236 H5' G 23 H5' G 23 6.119 -4.712 3.965 237 H5'' G 23 H5'' G 23 5.929 -4.072 2.321 238 H4' G 23 H4' G 23 8.260 -4.918 3.342 239 H3' G 23 H3' G 23 7.325 -4.771 0.505 240 H2' G 23 H2' G 23 9.279 -5.968 -0.228 241 HO2' G 23 HO2' G 23 10.925 -6.506 1.405 242 H1' G 23 H1' G 23 9.218 -7.903 1.752 243 H8 G 23 H8 G 23 8.009 -9.959 0.960 244 H1 G 23 H1 G 23 4.398 -6.546 -3.070 245 H21 G 23 H21 G 23 6.066 -3.845 -1.729 246 H22 G 23 H22 G 23 4.872 -4.413 -2.888 247 H5' A 24 H5' A 24 9.775 -3.681 -2.791 248 H5'' A 24 H5'' A 24 8.875 -4.950 -1.939 249 H4' A 24 H4' A 24 10.536 -5.977 -3.303 250 H3' A 24 H3' A 24 10.307 -6.797 -0.798 251 H2' A 24 H2' A 24 11.791 -5.219 0.206 252 HO2' A 24 HO2' A 24 13.103 -7.646 -0.400 253 H1' A 24 H1' A 24 13.825 -5.724 -2.020 254 H8 A 24 H8 A 24 11.994 -3.075 0.048 255 H61 A 24 H61 A 24 15.695 0.075 0.511 256 H62 A 24 H62 A 24 17.333 0.077 -0.121 257 H2 A 24 H2 A 24 17.841 -3.638 -2.535 258 H5' A 25 H5' A 25 11.064 -11.668 -0.712 259 H5'' A 25 H5'' A 25 11.376 -12.275 -2.350 260 H4' A 25 H4' A 25 8.994 -12.413 -1.170 261 H3' A 25 H3' A 25 9.772 -13.095 -3.642 262 H2' A 25 H2' A 25 9.673 -10.846 -4.572 263 HO2' A 25 HO2' A 25 7.070 -12.024 -4.864 264 H1' A 25 H1' A 25 6.985 -10.563 -3.096 265 H8 A 25 H8 A 25 9.816 -8.125 -2.518 266 H61 A 25 H61 A 25 8.063 -4.397 -5.079 267 H62 A 25 H62 A 25 6.704 -4.220 -6.170 268 H2 A 25 H2 A 25 4.689 -8.201 -6.410 269 H5' G 26 H5' G 26 7.064 -15.147 -6.724 270 H5'' G 26 H5'' G 26 7.523 -13.544 -6.118 271 H4' G 26 H4' G 26 4.648 -14.341 -6.145 272 H3' G 26 H3' G 26 6.216 -13.712 -8.620 273 H2' G 26 H2' G 26 4.433 -12.273 -9.381 274 HO2' G 26 HO2' G 26 2.962 -13.868 -7.878 275 H1' G 26 H1' G 26 4.133 -10.928 -6.994 276 H8 G 26 H8 G 26 7.743 -11.916 -7.298 277 H1 G 26 H1 G 26 6.201 -6.563 -10.452 278 H21 G 26 H21 G 26 2.951 -7.507 -9.777 279 H22 G 26 H22 G 26 4.016 -6.324 -10.516 280 H5' U 27 H5' U 27 2.655 -13.955 -9.686 281 H5'' U 27 H5'' U 27 2.236 -15.024 -11.039 282 H4' U 27 H4' U 27 1.351 -12.911 -11.553 283 H3' U 27 H3' U 27 3.846 -13.468 -13.147 284 H2' U 27 H2' U 27 3.458 -11.358 -14.276 285 HO2' U 27 HO2' U 27 0.947 -11.894 -13.609 286 H1' U 27 H1' U 27 2.931 -9.945 -11.925 287 H3 U 27 H3 U 27 7.077 -8.656 -13.298 288 H5 U 27 H5 U 27 7.677 -12.186 -11.116 289 H6 U 27 H6 U 27 5.285 -12.465 -11.068 290 H5' A 28 H5' A 28 0.970 -12.274 -15.248 291 H5'' A 28 H5'' A 28 0.330 -13.120 -16.671 292 H4' A 28 H4' A 28 0.520 -10.958 -17.418 293 H3' A 28 H3' A 28 2.984 -12.469 -18.244 294 H2' A 28 H2' A 28 3.814 -10.460 -19.274 295 HO2' A 28 HO2' A 28 1.365 -10.021 -19.809 296 H1' A 28 H1' A 28 3.003 -8.740 -17.194 297 H8 A 28 H8 A 28 4.384 -11.742 -15.498 298 H61 A 28 H61 A 28 9.070 -10.490 -15.458 299 H62 A 28 H62 A 28 9.997 -9.239 -16.264 300 H2 A 28 H2 A 28 7.092 -6.933 -18.785 301 H5' C 29 H5' C 29 1.500 -11.058 -21.717 302 H5'' C 29 H5'' C 29 1.641 -12.122 -23.130 303 H4' C 29 H4' C 29 2.890 -10.131 -23.538 304 H3' C 29 H3' C 29 4.564 -12.589 -23.102 305 HO3' C 29 H3T C 29 4.509 -11.083 -25.392 306 H2' C 29 H2' C 29 6.542 -11.273 -23.361 307 HO2' C 29 HO2' C 29 6.470 -9.232 -24.321 308 H1' C 29 H1' C 29 5.548 -8.981 -22.004 309 H41 C 29 H41 C 29 8.090 -12.828 -17.313 310 H42 C 29 H42 C 29 9.448 -11.965 -18.033 311 H5 C 29 H5 C 29 5.844 -12.654 -18.237 312 H6 C 29 H6 C 29 4.482 -11.618 -19.971 313 H1 B2R 101 H6 NCD 30 -1.879 -0.676 2.747 314 H2 B2R 101 H5 NCD 30 -3.552 -2.356 2.062 315 H3 B2R 101 H4 NCD 30 -5.447 -2.982 0.688 316 H4 B2R 101 H3 NCD 30 -7.113 -2.334 -1.100 317 H5 B2R 101 1H11 NCD 30 -1.927 2.355 2.710 318 H6 B2R 101 2H11 NCD 30 -0.692 1.179 2.181 319 H7 B2R 101 3H11 NCD 30 -1.258 2.465 1.071 320 H8 B2R 101 H23 NCD 30 -7.182 0.898 -2.632 321 H9 B2R 101 2H26 NCD 30 -9.847 -1.875 -4.333 322 H10 B2R 101 1H26 NCD 30 -10.723 -0.378 -4.722 323 H11 B2R 101 2H27 NCD 30 -9.660 -0.099 -6.746 324 H12 B2R 101 1H27 NCD 30 -8.111 -0.675 -6.160 325 H13 B2R 101 2H28 NCD 30 -9.321 -3.092 -6.192 326 H14 B2R 101 1H28 NCD 30 -10.468 -2.270 -7.236 327 H30 B2R 101 1H35 NCD 30 -8.605 -1.700 -8.783 328 H16 B2R 101 1H34 NCD 30 -6.430 -2.226 -8.561 329 H17 B2R 101 2H34 NCD 30 -6.780 -2.374 -6.857 330 H18 B2R 101 2H33 NCD 30 -5.756 -4.358 -8.623 331 H19 B2R 101 1H33 NCD 30 -7.430 -4.890 -8.277 332 H20 B2R 101 2H32 NCD 30 -6.365 -5.976 -6.560 333 H21 B2R 101 1H32 NCD 30 -6.630 -4.441 -5.721 334 H22 B2R 101 H29 NCD 30 -2.628 -4.341 -5.346 335 H23 B2R 101 H14 NCD 30 -3.141 -1.034 -6.740 336 H24 B2R 101 H15 NCD 30 -1.699 0.917 -6.149 337 H25 B2R 101 H16 NCD 30 0.186 1.811 -4.797 338 H26 B2R 101 H17 NCD 30 1.948 1.410 -3.111 339 H27 B2R 101 1H22 NCD 30 3.161 -0.129 -1.770 340 H28 B2R 101 3H22 NCD 30 2.981 -1.850 -2.175 341 H29 B2R 101 2H22 NCD 30 2.012 -1.138 -0.858 342 H1 B2R 102 H6 NCD 31 2.419 -1.054 -5.675 343 H2 B2R 102 H5 NCD 31 0.773 -2.777 -6.285 344 H3 B2R 102 H4 NCD 31 -0.049 -5.141 -6.088 345 H4 B2R 102 H3 NCD 31 0.317 -7.434 -5.047 346 H5 B2R 102 1H11 NCD 31 4.002 -0.340 -4.147 347 H6 B2R 102 2H11 NCD 31 4.878 -1.428 -3.038 348 H7 B2R 102 3H11 NCD 31 5.367 -1.316 -4.750 349 H8 B2R 102 H23 NCD 31 2.998 -8.180 -2.914 350 H9 B2R 102 2H26 NCD 31 1.802 -11.995 -1.797 351 H10 B2R 102 1H26 NCD 31 0.668 -10.749 -1.251 352 H11 B2R 102 1H27 NCD 31 0.373 -12.670 -3.552 353 H12 B2R 102 2H27 NCD 31 -0.027 -11.005 -3.951 354 H13 B2R 102 1H28 NCD 31 -1.782 -12.796 -2.775 355 H14 B2R 102 2H28 NCD 31 -1.165 -11.966 -1.343 356 H30 B2R 102 1H35 NCD 31 -2.790 -10.875 -3.597 357 H16 B2R 102 1H34 NCD 31 -3.587 -11.375 -1.160 358 H17 B2R 102 2H34 NCD 31 -2.702 -9.893 -0.754 359 H18 B2R 102 1H33 NCD 31 -4.151 -8.887 -2.809 360 H19 B2R 102 2H33 NCD 31 -5.259 -10.222 -2.334 361 H20 B2R 102 1H32 NCD 31 -6.041 -8.499 -0.945 362 H21 B2R 102 2H32 NCD 31 -4.809 -9.203 0.138 363 H22 B2R 102 H29 NCD 31 -3.513 -5.472 -0.602 364 H23 B2R 102 H14 NCD 31 -1.141 -6.543 2.013 365 H24 B2R 102 H15 NCD 31 0.531 -4.927 2.909 366 H25 B2R 102 H16 NCD 31 1.533 -2.583 2.807 367 H26 B2R 102 H17 NCD 31 1.523 -0.357 1.765 368 H27 B2R 102 1H22 NCD 31 0.478 1.201 0.296 369 H28 B2R 102 2H22 NCD 31 0.232 0.421 -1.284 370 H29 B2R 102 3H22 NCD 31 -1.168 0.802 -0.251 Start of MODEL 10 1 H5' G 1 H5' G 1 20.918 -7.556 -15.461 2 H5'' G 1 H5'' G 1 19.391 -7.869 -14.615 3 H4' G 1 H4' G 1 19.864 -6.649 -17.174 4 H3' G 1 H3' G 1 17.530 -6.847 -15.299 5 H2' G 1 H2' G 1 16.043 -6.275 -17.108 6 HO2' G 1 HO2' G 1 18.177 -5.017 -18.007 7 H1' G 1 H1' G 1 17.199 -7.975 -18.974 8 H8 G 1 H8 G 1 17.141 -9.269 -15.373 9 H1 G 1 H1 G 1 12.119 -10.899 -19.003 10 H21 G 1 H21 G 1 13.492 -8.723 -21.300 11 H22 G 1 H22 G 1 12.182 -9.828 -20.898 12 HO5' G 1 H5T G 1 19.528 -9.572 -16.624 13 H5' U 2 H5' U 2 17.015 -3.738 -17.540 14 H5'' U 2 H5'' U 2 16.515 -2.222 -16.766 15 H4' U 2 H4' U 2 14.935 -2.650 -18.440 16 H3' U 2 H3' U 2 13.834 -3.333 -15.724 17 H2' U 2 H2' U 2 11.738 -3.866 -16.816 18 HO2' U 2 HO2' U 2 12.671 -2.149 -18.629 19 H1' U 2 H1' U 2 12.917 -5.360 -18.847 20 H3 U 2 H3 U 2 11.083 -8.496 -16.193 21 H5 U 2 H5 U 2 14.526 -7.274 -14.133 22 H6 U 2 H6 U 2 14.882 -5.638 -15.848 23 H5' A 3 H5' A 3 11.413 -1.482 -17.680 24 H5'' A 3 H5'' A 3 10.506 -0.044 -17.175 25 H4' A 3 H4' A 3 8.882 -1.534 -17.916 26 H3' A 3 H3' A 3 9.049 -1.528 -14.919 27 H2' A 3 H2' A 3 7.372 -3.213 -14.826 28 HO2' A 3 HO2' A 3 5.751 -2.908 -16.147 29 H1' A 3 H1' A 3 8.136 -4.533 -17.239 30 H8 A 3 H8 A 3 11.174 -4.294 -15.117 31 H61 A 3 H61 A 3 10.487 -8.228 -12.357 32 H62 A 3 H62 A 3 9.160 -9.344 -12.132 33 H2 A 3 H2 A 3 5.881 -7.923 -14.866 34 H5' C 4 H5' C 4 5.477 -1.106 -15.984 35 H5'' C 4 H5'' C 4 4.377 0.156 -15.394 36 H4' C 4 H4' C 4 3.198 -1.754 -14.934 37 H3' C 4 H3' C 4 4.701 -0.942 -12.469 38 H2' C 4 H2' C 4 3.958 -2.915 -11.342 39 HO2' C 4 HO2' C 4 1.895 -3.358 -11.718 40 H1' C 4 H1' C 4 3.970 -4.604 -13.635 41 H41 C 4 H41 C 4 9.962 -5.303 -11.023 42 H42 C 4 H42 C 4 8.916 -6.448 -10.194 43 H5 C 4 H5 C 4 9.069 -3.681 -12.603 44 H6 C 4 H6 C 4 7.058 -2.925 -13.749 45 H5' U 5 H5' U 5 0.629 -2.037 -12.248 46 H5'' U 5 H5'' U 5 -0.392 -0.869 -11.386 47 H4' U 5 H4' U 5 -1.221 -2.958 -10.777 48 H3' U 5 H3' U 5 0.399 -1.674 -8.637 49 H2' U 5 H2' U 5 0.385 -3.625 -7.276 50 HO2' U 5 HO2' U 5 -2.007 -3.848 -8.183 51 H1' U 5 H1' U 5 0.586 -5.558 -9.309 52 H3 U 5 H3 U 5 4.530 -6.001 -7.162 53 H5 U 5 H5 U 5 4.821 -2.245 -8.989 54 H6 U 5 H6 U 5 2.594 -2.559 -9.846 55 H5' G 6 H5' G 6 -4.512 1.259 -9.323 56 H5'' G 6 H5'' G 6 -3.087 2.070 -8.645 57 H4' G 6 H4' G 6 -5.294 2.552 -7.536 58 H3' G 6 H3' G 6 -2.909 1.660 -5.938 59 H2' G 6 H2' G 6 -4.249 1.747 -3.955 60 HO2' G 6 HO2' G 6 -5.164 3.837 -4.770 61 H1' G 6 H1' G 6 -6.665 0.857 -5.193 62 H8 G 6 H8 G 6 -6.691 -1.877 -5.607 63 H1 G 6 H1 G 6 -1.884 -2.031 -1.396 64 H21 G 6 H21 G 6 -1.551 1.316 -2.185 65 H22 G 6 H22 G 6 -0.981 -0.085 -1.264 66 H5' G 7 H5' G 7 -1.760 6.515 -3.857 67 H5'' G 7 H5'' G 7 -2.561 5.837 -2.427 68 H4' G 7 H4' G 7 -3.014 8.315 -3.639 69 H3' G 7 H3' G 7 -4.235 6.874 -1.334 70 H2' G 7 H2' G 7 -6.249 8.167 -1.449 71 HO2' G 7 HO2' G 7 -4.741 10.075 -2.038 72 H1' G 7 H1' G 7 -6.486 8.266 -4.220 73 H8 G 7 H8 G 7 -8.633 7.053 -4.222 74 H1 G 7 H1 G 7 -6.091 1.947 -1.332 75 H21 G 7 H21 G 7 -3.313 3.916 -0.959 76 H22 G 7 H22 G 7 -4.071 2.364 -0.662 77 H5' A 8 H5' A 8 -5.520 10.630 1.925 78 H5'' A 8 H5'' A 8 -6.614 9.451 1.180 79 H4' A 8 H4' A 8 -7.744 11.534 1.394 80 H3' A 8 H3' A 8 -7.812 10.221 -0.952 81 H2' A 8 H2' A 8 -6.188 11.403 -2.206 82 HO2' A 8 HO2' A 8 -8.577 12.213 -2.713 83 H1' A 8 H1' A 8 -6.772 14.078 -0.908 84 H8 A 8 H8 A 8 -3.887 11.533 -0.716 85 H61 A 8 H61 A 8 -0.464 14.344 -2.718 86 H62 A 8 H62 A 8 -0.492 15.963 -3.406 87 H2 A 8 H2 A 8 -4.693 17.446 -3.084 88 H5' A 9 H5' A 9 -9.157 8.168 -2.608 89 H5'' A 9 H5'' A 9 -10.656 8.999 -3.067 90 H4' A 9 H4' A 9 -11.681 7.107 -2.556 91 H3' A 9 H3' A 9 -12.056 8.496 -0.334 92 H2' A 9 H2' A 9 -9.927 7.878 0.696 93 HO2' A 9 HO2' A 9 -12.017 7.149 1.916 94 H1' A 9 H1' A 9 -10.581 4.962 -0.043 95 H8 A 9 H8 A 9 -7.756 7.580 -0.054 96 H61 A 9 H61 A 9 -4.282 4.806 1.788 97 H62 A 9 H62 A 9 -4.196 3.130 2.309 98 H2 A 9 H2 A 9 -8.245 1.373 1.493 99 H5' C 10 H5' C 10 -12.208 4.851 0.867 100 H5'' C 10 H5'' C 10 -13.573 3.877 0.297 101 H4' C 10 H4' C 10 -13.790 2.751 2.245 102 H3' C 10 H3' C 10 -12.819 5.180 3.731 103 H2' C 10 H2' C 10 -12.019 3.745 5.478 104 HO2' C 10 HO2' C 10 -13.871 2.380 5.509 105 H1' C 10 H1' C 10 -11.054 1.714 3.758 106 H41 C 10 H41 C 10 -6.239 6.200 4.132 107 H42 C 10 H42 C 10 -5.763 4.837 5.135 108 H5 C 10 H5 C 10 -8.386 6.302 2.974 109 H6 C 10 H6 C 10 -10.567 5.207 2.772 110 H5' A 11 H5' A 11 -15.465 4.068 8.547 111 H5'' A 11 H5'' A 11 -14.087 5.031 7.981 112 H4' A 11 H4' A 11 -14.189 2.065 8.501 113 H3' A 11 H3' A 11 -12.837 4.339 9.919 114 H2' A 11 H2' A 11 -10.916 2.970 10.310 115 HO2' A 11 HO2' A 11 -12.352 1.125 10.842 116 H1' A 11 H1' A 11 -10.946 1.664 7.804 117 H8 A 11 H8 A 11 -11.371 4.951 6.508 118 H61 A 11 H61 A 11 -6.999 6.882 7.218 119 H62 A 11 H62 A 11 -5.579 6.409 8.130 120 H2 A 11 H2 A 11 -6.665 2.546 10.165 121 H5' U 12 H5' U 12 -12.747 1.136 13.183 122 H5'' U 12 H5'' U 12 -12.964 2.163 14.614 123 H4' U 12 H4' U 12 -10.891 0.736 14.557 124 H3' U 12 H3' U 12 -10.786 3.690 15.088 125 H2' U 12 H2' U 12 -8.390 3.546 15.263 126 HO2' U 12 HO2' U 12 -8.787 1.329 16.328 127 H1' U 12 H1' U 12 -8.043 1.833 13.067 128 H3 U 12 H3 U 12 -6.528 6.155 12.356 129 H5 U 12 H5 U 12 -10.347 5.827 10.622 130 H6 U 12 H6 U 12 -10.578 3.710 11.747 131 H5' G 13 H5' G 13 -9.891 3.635 20.027 132 H5'' G 13 H5'' G 13 -9.763 5.348 19.583 133 H4' G 13 H4' G 13 -7.712 3.512 20.317 134 H3' G 13 H3' G 13 -7.880 6.457 19.862 135 H2' G 13 H2' G 13 -5.512 6.600 19.492 136 HO2' G 13 HO2' G 13 -4.932 5.103 21.139 137 H1' G 13 H1' G 13 -5.318 4.431 17.793 138 H8 G 13 H8 G 13 -8.530 5.358 16.605 139 H1 G 13 H1 G 13 -4.263 9.939 15.232 140 H21 G 13 H21 G 13 -2.304 8.377 17.608 141 H22 G 13 H22 G 13 -2.471 9.684 16.448 142 H5' U 14 H5' U 14 -6.707 8.710 19.878 143 H5'' U 14 H5'' U 14 -5.789 9.181 21.322 144 H4' U 14 H4' U 14 -6.932 11.081 20.346 145 H3' U 14 H3' U 14 -6.834 10.753 22.976 146 H2' U 14 H2' U 14 -8.843 9.418 23.228 147 HO2' U 14 HO2' U 14 -9.110 12.122 23.694 148 H1' U 14 H1' U 14 -10.310 11.316 21.319 149 H3 U 14 H3 U 14 -13.815 8.617 22.316 150 H5 U 14 H5 U 14 -11.092 6.154 20.289 151 H6 U 14 H6 U 14 -9.491 7.947 20.426 152 H5' U 15 H5' U 15 -4.440 14.589 20.113 153 H5'' U 15 H5'' U 15 -5.642 15.572 20.972 154 H4' U 15 H4' U 15 -5.542 14.744 18.105 155 H3' U 15 H3' U 15 -4.902 17.124 19.038 156 H2' U 15 H2' U 15 -6.875 17.502 20.389 157 HO2' U 15 HO2' U 15 -6.614 19.013 18.335 158 H1' U 15 H1' U 15 -8.657 16.564 18.086 159 H3 U 15 H3 U 15 -12.092 17.316 20.863 160 H5 U 15 H5 U 15 -9.614 14.736 23.051 161 H6 U 15 H6 U 15 -7.985 14.933 21.288 162 H5' U 16 H5' U 16 -4.464 16.177 15.252 163 H5'' U 16 H5'' U 16 -2.974 15.774 16.125 164 H4' U 16 H4' U 16 -1.759 16.145 14.331 165 H3' U 16 H3' U 16 -1.953 18.703 14.912 166 H2' U 16 H2' U 16 -4.184 19.084 14.012 167 HO2' U 16 HO2' U 16 -2.066 19.831 12.412 168 H1' U 16 H1' U 16 -3.415 17.583 11.460 169 H3 U 16 H3 U 16 -7.615 18.466 10.146 170 H5 U 16 H5 U 16 -8.116 16.407 13.764 171 H6 U 16 H6 U 16 -5.725 16.487 14.049 172 H5' C 17 H5' C 17 1.033 16.079 11.778 173 H5'' C 17 H5'' C 17 -0.454 16.254 12.730 174 H4' C 17 H4' C 17 1.853 14.925 14.032 175 H3' C 17 H3' C 17 0.407 13.662 11.715 176 H2' C 17 H2' C 17 0.364 11.589 12.932 177 HO2' C 17 HO2' C 17 2.588 12.018 13.739 178 H1' C 17 H1' C 17 -0.295 12.744 15.404 179 H41 C 17 H41 C 17 -5.878 12.171 11.935 180 H42 C 17 H42 C 17 -5.923 10.959 13.204 181 H5 C 17 H5 C 17 -3.977 13.629 11.583 182 H6 C 17 H6 C 17 -1.738 14.201 12.357 183 H5' A 18 H5' A 18 2.395 9.406 10.532 184 H5'' A 18 H5'' A 18 0.993 10.259 11.203 185 H4' A 18 H4' A 18 2.977 8.882 12.980 186 H3' A 18 H3' A 18 0.906 7.514 11.327 187 H2' A 18 H2' A 18 0.108 6.265 13.228 188 HO2' A 18 HO2' A 18 2.586 6.572 14.053 189 H1' A 18 H1' A 18 -0.072 8.397 14.946 190 H8 A 18 H8 A 18 -0.783 10.413 12.121 191 H61 A 18 H61 A 18 -5.317 9.135 11.054 192 H62 A 18 H62 A 18 -6.362 7.812 11.517 193 H2 A 18 H2 A 18 -3.911 5.244 14.286 194 H5' U 19 H5' U 19 1.934 5.101 13.104 195 H5'' U 19 H5'' U 19 2.903 3.613 13.092 196 H4' U 19 H4' U 19 0.949 2.712 13.741 197 H3' U 19 H3' U 19 0.889 2.692 10.755 198 H2' U 19 H2' U 19 -1.402 2.082 10.720 199 HO2' U 19 HO2' U 19 -2.047 0.626 12.125 200 H1' U 19 H1' U 19 -2.178 3.430 13.115 201 H3 U 19 H3 U 19 -4.679 4.837 9.505 202 H5 U 19 H5 U 19 -1.369 7.400 9.791 203 H6 U 19 H6 U 19 -0.440 5.899 11.423 204 H5' G 20 H5' G 20 -0.474 -0.571 12.291 205 H5'' G 20 H5'' G 20 0.232 -2.168 11.973 206 H4' G 20 H4' G 20 -1.970 -2.643 11.702 207 H3' G 20 H3' G 20 -0.856 -1.936 9.022 208 H2' G 20 H2' G 20 -3.024 -1.973 8.030 209 HO2' G 20 HO2' G 20 -3.414 -3.997 9.411 210 H1' G 20 H1' G 20 -4.446 -0.933 10.247 211 H8 G 20 H8 G 20 -1.386 1.143 9.570 212 H1 G 20 H1 G 20 -6.546 2.651 6.069 213 H21 G 20 H21 G 20 -7.792 -0.329 7.295 214 H22 G 20 H22 G 20 -8.067 1.069 6.275 215 H5' U 21 H5' U 21 -1.107 -3.858 5.635 216 H5'' U 21 H5'' U 21 -2.176 -2.858 6.636 217 H4' U 21 H4' U 21 -3.382 -5.363 5.735 218 H3' U 21 H3' U 21 -2.094 -3.683 3.696 219 H2' U 21 H2' U 21 -4.057 -3.094 2.525 220 HO2' U 21 HO2' U 21 -4.684 -5.593 3.218 221 H1' U 21 H1' U 21 -5.914 -3.041 4.632 222 H3 U 21 H3 U 21 -5.528 1.185 2.937 223 H5 U 21 H5 U 21 -2.363 0.771 5.668 224 H6 U 21 H6 U 21 -2.996 -1.535 5.940 225 H5' G 22 H5' G 22 -0.752 -9.400 3.135 226 H5'' G 22 H5'' G 22 0.340 -8.433 4.144 227 H4' G 22 H4' G 22 1.693 -9.388 2.500 228 H3' G 22 H3' G 22 1.151 -6.515 1.760 229 H2' G 22 H2' G 22 2.578 -6.853 -0.151 230 HO2' G 22 HO2' G 22 4.000 -8.205 1.338 231 H1' G 22 H1' G 22 1.637 -9.479 -0.697 232 H8 G 22 H8 G 22 -0.884 -9.480 -1.861 233 H1 G 22 H1 G 22 0.216 -3.287 -3.003 234 H21 G 22 H21 G 22 2.596 -3.629 -0.495 235 H22 G 22 H22 G 22 1.762 -2.568 -1.643 236 H5' G 23 H5' G 23 6.215 -4.588 3.330 237 H5'' G 23 H5'' G 23 6.037 -4.650 1.567 238 H4' G 23 H4' G 23 8.206 -5.506 3.119 239 H3' G 23 H3' G 23 7.577 -5.536 0.200 240 H2' G 23 H2' G 23 9.256 -7.182 -0.220 241 HO2' G 23 HO2' G 23 10.685 -6.033 1.381 242 H1' G 23 H1' G 23 8.792 -8.755 2.039 243 H8 G 23 H8 G 23 7.690 -10.798 1.150 244 H1 G 23 H1 G 23 4.193 -7.407 -3.012 245 H21 G 23 H21 G 23 5.842 -4.719 -1.710 246 H22 G 23 H22 G 23 4.667 -5.317 -2.868 247 H5' A 24 H5' A 24 11.403 -5.169 -2.617 248 H5'' A 24 H5'' A 24 9.910 -6.088 -2.353 249 H4' A 24 H4' A 24 11.502 -7.671 -2.967 250 H3' A 24 H3' A 24 10.442 -7.898 -0.385 251 H2' A 24 H2' A 24 12.407 -7.630 0.846 252 HO2' A 24 HO2' A 24 12.859 -10.149 -0.434 253 H1' A 24 H1' A 24 14.070 -8.610 -1.535 254 H8 A 24 H8 A 24 13.692 -5.894 1.150 255 H61 A 24 H61 A 24 18.434 -5.147 1.978 256 H62 A 24 H62 A 24 19.891 -5.819 1.258 257 H2 A 24 H2 A 24 18.590 -8.711 -1.885 258 H5' A 25 H5' A 25 10.790 -11.688 -0.878 259 H5'' A 25 H5'' A 25 11.054 -13.231 -1.710 260 H4' A 25 H4' A 25 8.755 -13.076 -1.186 261 H3' A 25 H3' A 25 9.464 -13.660 -3.723 262 H2' A 25 H2' A 25 9.251 -11.423 -4.627 263 HO2' A 25 HO2' A 25 6.746 -12.781 -4.690 264 H1' A 25 H1' A 25 6.714 -11.091 -2.921 265 H8 A 25 H8 A 25 9.546 -8.852 -2.235 266 H61 A 25 H61 A 25 8.209 -4.926 -4.736 267 H62 A 25 H62 A 25 6.928 -4.619 -5.899 268 H2 A 25 H2 A 25 4.686 -8.448 -6.426 269 H5' G 26 H5' G 26 6.905 -15.876 -6.676 270 H5'' G 26 H5'' G 26 7.261 -14.209 -6.181 271 H4' G 26 H4' G 26 4.438 -15.188 -6.298 272 H3' G 26 H3' G 26 6.133 -14.637 -8.686 273 H2' G 26 H2' G 26 4.486 -13.183 -9.641 274 HO2' G 26 HO2' G 26 2.849 -14.788 -8.320 275 H1' G 26 H1' G 26 3.777 -11.855 -7.309 276 H8 G 26 H8 G 26 7.453 -12.487 -7.124 277 H1 G 26 H1 G 26 5.858 -7.346 -10.590 278 H21 G 26 H21 G 26 2.637 -8.576 -10.352 279 H22 G 26 H22 G 26 3.699 -7.318 -10.956 280 H5' U 27 H5' U 27 2.944 -15.252 -10.117 281 H5'' U 27 H5'' U 27 2.566 -16.492 -11.329 282 H4' U 27 H4' U 27 1.921 -14.610 -12.432 283 H3' U 27 H3' U 27 4.797 -15.058 -13.196 284 H2' U 27 H2' U 27 4.652 -13.084 -14.577 285 HO2' U 27 HO2' U 27 2.774 -12.589 -15.416 286 H1' U 27 H1' U 27 3.337 -11.545 -12.647 287 H3 U 27 H3 U 27 7.548 -9.920 -12.871 288 H5 U 27 H5 U 27 7.842 -13.322 -10.426 289 H6 U 27 H6 U 27 5.552 -13.811 -10.985 290 H5' A 28 H5' A 28 2.460 -14.316 -16.100 291 H5'' A 28 H5'' A 28 2.354 -15.251 -17.605 292 H4' A 28 H4' A 28 2.497 -13.066 -18.338 293 H3' A 28 H3' A 28 5.218 -14.340 -18.447 294 H2' A 28 H2' A 28 6.111 -12.285 -19.285 295 HO2' A 28 HO2' A 28 4.868 -11.228 -20.625 296 H1' A 28 H1' A 28 4.555 -10.607 -17.614 297 H8 A 28 H8 A 28 5.894 -13.379 -15.504 298 H61 A 28 H61 A 28 10.188 -11.406 -14.369 299 H62 A 28 H62 A 28 11.082 -10.030 -14.969 300 H2 A 28 H2 A 28 8.551 -8.180 -18.179 301 H5' C 29 H5' C 29 4.494 -12.938 -21.994 302 H5'' C 29 H5'' C 29 4.889 -13.873 -23.451 303 H4' C 29 H4' C 29 6.100 -11.881 -23.633 304 H3' C 29 H3' C 29 7.849 -14.165 -22.768 305 HO3' C 29 H3T C 29 8.182 -12.694 -25.052 306 H2' C 29 H2' C 29 9.715 -12.680 -22.620 307 HO2' C 29 HO2' C 29 9.713 -10.696 -23.662 308 H1' C 29 H1' C 29 8.255 -10.468 -21.592 309 H41 C 29 H41 C 29 10.016 -14.002 -16.330 310 H42 C 29 H42 C 29 11.384 -12.964 -16.728 311 H5 C 29 H5 C 29 8.052 -14.116 -17.776 312 H6 C 29 H6 C 29 7.036 -13.259 -19.818 313 H1 B2R 101 H6 NCD 30 -1.450 -0.703 2.398 314 H2 B2R 101 H5 NCD 30 -2.900 -2.493 1.593 315 H3 B2R 101 H4 NCD 30 -4.865 -3.226 0.253 316 H4 B2R 101 H3 NCD 30 -6.790 -2.504 -1.294 317 H5 B2R 101 1H11 NCD 30 -0.643 1.331 2.200 318 H6 B2R 101 2H11 NCD 30 -1.339 2.619 1.167 319 H7 B2R 101 3H11 NCD 30 -1.989 2.330 2.799 320 H8 B2R 101 H23 NCD 30 -7.447 0.761 -2.220 321 H9 B2R 101 2H26 NCD 30 -9.092 0.727 -5.251 322 H10 B2R 101 1H26 NCD 30 -7.799 -0.490 -5.109 323 H11 B2R 101 2H27 NCD 30 -10.757 -1.252 -4.977 324 H12 B2R 101 1H27 NCD 30 -9.944 -1.082 -6.533 325 H13 B2R 101 2H28 NCD 30 -8.554 -2.826 -4.492 326 H14 B2R 101 1H28 NCD 30 -10.093 -3.431 -5.098 327 H30 B2R 101 1H35 NCD 30 -8.005 -2.557 -7.073 328 H16 B2R 101 1H34 NCD 30 -7.620 -4.606 -5.179 329 H17 B2R 101 2H34 NCD 30 -8.135 -5.424 -6.663 330 H18 B2R 101 2H33 NCD 30 -5.967 -3.321 -6.948 331 H19 B2R 101 1H33 NCD 30 -6.174 -4.884 -7.812 332 H20 B2R 101 2H32 NCD 30 -5.282 -6.134 -5.942 333 H21 B2R 101 1H32 NCD 30 -5.385 -4.733 -4.848 334 H22 B2R 101 H29 NCD 30 -2.029 -3.936 -5.426 335 H23 B2R 101 H14 NCD 30 -2.503 -0.536 -6.737 336 H24 B2R 101 H15 NCD 30 -0.948 1.299 -6.057 337 H25 B2R 101 H16 NCD 30 1.051 1.995 -4.635 338 H26 B2R 101 H17 NCD 30 2.780 1.349 -3.005 339 H27 B2R 101 1H22 NCD 30 3.955 -0.440 -1.889 340 H28 B2R 101 3H22 NCD 30 3.464 -2.112 -2.252 341 H29 B2R 101 2H22 NCD 30 2.692 -1.225 -0.906 342 H1 B2R 102 H6 NCD 31 2.895 -1.385 -5.624 343 H2 B2R 102 H5 NCD 31 1.177 -2.968 -6.327 344 H3 B2R 102 H4 NCD 31 0.225 -5.291 -6.261 345 H4 B2R 102 H3 NCD 31 0.429 -7.625 -5.371 346 H5 B2R 102 1H11 NCD 31 5.396 -2.017 -3.072 347 H6 B2R 102 2H11 NCD 31 5.736 -1.746 -4.795 348 H7 B2R 102 3H11 NCD 31 4.439 -0.816 -3.992 349 H8 B2R 102 H23 NCD 31 3.047 -8.727 -3.234 350 H9 B2R 102 2H26 NCD 31 0.309 -11.799 -4.137 351 H10 B2R 102 1H26 NCD 31 1.647 -12.726 -3.416 352 H11 B2R 102 1H27 NCD 31 0.493 -11.053 -1.342 353 H12 B2R 102 2H27 NCD 31 0.601 -12.805 -1.403 354 H13 B2R 102 1H28 NCD 31 -1.643 -11.305 -2.879 355 H14 B2R 102 2H28 NCD 31 -1.508 -13.032 -2.575 356 H30 B2R 102 1H35 NCD 31 -1.593 -12.370 -0.072 357 H16 B2R 102 1H34 NCD 31 -2.891 -10.451 0.559 358 H17 B2R 102 2H34 NCD 31 -1.508 -9.879 -0.364 359 H18 B2R 102 1H33 NCD 31 -2.846 -9.324 -2.269 360 H19 B2R 102 2H33 NCD 31 -4.165 -10.443 -1.786 361 H20 B2R 102 1H32 NCD 31 -5.205 -8.513 -1.101 362 H21 B2R 102 2H32 NCD 31 -4.169 -8.653 0.338 363 H22 B2R 102 H29 NCD 31 -3.026 -5.100 -0.914 364 H23 B2R 102 H14 NCD 31 -0.718 -6.146 1.666 365 H24 B2R 102 H15 NCD 31 0.923 -4.593 2.729 366 H25 B2R 102 H16 NCD 31 1.912 -2.238 2.791 367 H26 B2R 102 H17 NCD 31 1.918 0.047 1.875 368 H27 B2R 102 1H22 NCD 31 0.648 0.940 -1.192 369 H28 B2R 102 2H22 NCD 31 -0.722 1.276 -0.117 370 H29 B2R 102 3H22 NCD 31 0.943 1.655 0.421
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