NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
517495 | 2lbr | 17573 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H5' G 1 H5' G 1 15.549 -3.839 0.886 2 H5'' G 1 H5'' G 1 14.575 -4.374 -0.495 3 H4' G 1 H4' G 1 14.792 -1.456 0.287 4 H3' G 1 H3' G 1 12.910 -3.579 1.338 5 H2' G 1 H2'' G 1 11.090 -2.138 1.090 6 HO2' G 1 H2' G 1 12.423 0.196 0.473 7 H1' G 1 H1' G 1 11.926 -0.747 -1.150 8 H8 G 1 H8 G 1 11.366 -4.548 -0.309 9 H1 G 1 H1 G 1 8.011 -2.112 -5.204 10 H21 G 1 H21 G 1 8.587 0.003 -5.522 11 H22 G 1 H22 G 1 9.779 0.824 -4.560 12 HO5' G 1 H5T G 1 16.149 -2.300 -1.188 13 H5' G 2 H5' G 2 13.511 0.764 2.715 14 H5'' G 2 H5'' G 2 13.186 1.020 4.444 15 H4' G 2 H4' G 2 12.254 2.907 3.234 16 H3' G 2 H3' G 2 10.230 0.940 4.280 17 H2' G 2 H2'' G 2 8.542 2.100 3.236 18 HO2' G 2 H2' G 2 10.164 4.330 2.642 19 H1' G 2 H1' G 2 9.786 2.986 1.000 20 H8 G 2 H8 G 2 9.830 -0.708 2.295 21 H1 G 2 H1 G 2 5.911 0.670 -2.593 22 H21 G 2 H21 G 2 5.984 2.846 -3.034 23 H22 G 2 H22 G 2 6.991 3.954 -2.133 24 H5' G 3 H5' G 3 9.653 5.727 4.774 25 H5'' G 3 H5'' G 3 8.483 5.945 6.089 26 H4' G 3 H4' G 3 7.987 7.197 3.918 27 H3' G 3 H3' G 3 5.986 5.373 5.241 28 H2' G 3 H2'' G 3 4.436 5.779 3.485 29 HO2' G 3 H2' G 3 6.181 7.775 2.442 30 H1' G 3 H1' G 3 6.139 5.577 1.407 31 H8 G 3 H8 G 3 7.009 3.211 4.322 32 H1 G 3 H1 G 3 3.276 0.858 -0.335 33 H21 G 3 H21 G 3 2.670 2.478 -1.727 34 H22 G 3 H22 G 3 3.192 4.141 -1.506 35 H5' G 4 H5' G 4 2.994 8.784 6.393 36 H5'' G 4 H5'' G 4 2.323 7.726 7.652 37 H4' G 4 H4' G 4 1.059 8.194 5.297 38 H3' G 4 H3' G 4 1.050 5.700 7.000 39 H2' G 4 H2'' G 4 -0.172 4.553 5.343 40 HO2' G 4 H2' G 4 -1.643 5.576 4.220 41 H1' G 4 H1' G 4 1.095 5.586 3.137 42 H8 G 4 H8 G 4 3.773 4.923 5.725 43 H1 G 4 H1 G 4 1.869 -0.304 2.530 44 H21 G 4 H21 G 4 0.024 0.131 1.371 45 H22 G 4 H22 G 4 -0.732 1.717 1.386 46 H5' A 5 H5' A 5 -3.479 6.163 8.341 47 H5'' A 5 H5'' A 5 -3.128 5.127 9.739 48 H4' A 5 H4' A 5 -4.449 4.268 7.495 49 H3' A 5 H3' A 5 -2.756 2.731 9.471 50 H2' A 5 H2'' A 5 -2.822 0.828 8.092 51 HO2' A 5 H2' A 5 -4.497 1.528 6.107 52 H1' A 5 H1' A 5 -2.679 2.087 5.644 53 H8 A 5 H8 A 5 -0.200 3.908 7.779 54 H61 A 5 H61 A 5 3.746 -0.733 6.664 55 H62 A 5 H62 A 5 3.567 0.884 7.310 56 H2 A 5 H2 A 5 -0.323 -1.993 5.259 57 H5' C 6 H5' C 6 -5.369 0.085 8.628 58 H5'' C 6 H5'' C 6 -5.834 -0.994 9.962 59 H4' C 6 H4' C 6 -4.352 -2.037 8.176 60 H3' C 6 H3' C 6 -3.611 -2.027 11.092 61 H2' C 6 H2'' C 6 -1.544 -3.028 10.625 62 HO2' C 6 H2' C 6 -1.222 -4.363 8.977 63 H1' C 6 H1' C 6 -1.001 -1.772 8.223 64 H41 C 6 H41 C 6 2.332 1.541 12.544 65 H42 C 6 H42 C 6 0.919 2.508 12.894 66 H5 C 6 H5 C 6 -1.253 2.061 11.951 67 H6 C 6 H6 C 6 -2.538 0.589 10.469 68 H5' U 7 H5' U 7 -2.971 -6.188 11.838 69 H5'' U 7 H5'' U 7 -3.115 -5.851 13.569 70 H4' U 7 H4' U 7 -0.774 -5.647 11.970 71 H3' U 7 H3' U 7 -1.449 -4.802 14.794 72 H2' U 7 H2'' U 7 0.453 -3.427 14.884 73 HO2' U 7 H2' U 7 1.653 -3.913 12.505 74 H1' U 7 H1' U 7 0.345 -2.405 12.354 75 H3 U 7 H3 U 7 -0.861 0.877 15.363 76 H5 U 7 H5 U 7 -4.428 -1.091 14.275 77 H6 U 7 H6 U 7 -3.080 -2.783 13.173 78 H5' G 8 H5' G 8 3.743 -5.020 16.412 79 H5'' G 8 H5'' G 8 2.378 -5.520 17.426 80 H4' G 8 H4' G 8 2.848 -2.890 16.043 81 H3' G 8 H3' G 8 2.280 -3.771 18.898 82 H2' G 8 H2'' G 8 1.051 -1.858 19.294 83 HO2' G 8 H2' G 8 1.684 0.030 18.589 84 H1' G 8 H1' G 8 0.025 -1.468 16.767 85 H8 G 8 H8 G 8 -0.157 -4.950 18.425 86 H1 G 8 H1 G 8 -5.408 -1.320 19.058 87 H21 G 8 H21 G 8 -5.024 0.719 18.268 88 H22 G 8 H22 G 8 -3.482 1.186 17.586 89 H5' U 9 H5' U 9 7.557 -1.318 17.005 90 H5'' U 9 H5'' U 9 7.076 -2.492 18.250 91 H4' U 9 H4' U 9 8.362 0.209 18.560 92 H3' U 9 H3' U 9 9.419 -2.290 18.887 93 H2' U 9 H2'' U 9 8.014 -3.061 20.596 94 HO2' U 9 H2' U 9 9.646 -3.272 21.931 95 H1' U 9 H1' U 9 7.952 -0.417 22.011 96 H3 U 9 H3 U 9 4.903 -2.355 24.719 97 H5 U 9 H5 U 9 3.382 -3.122 20.862 98 H6 U 9 H6 U 9 5.383 -2.104 19.942 99 H5' A 10 H5' A 10 11.755 -0.533 15.962 100 H5'' A 10 H5'' A 10 10.267 -1.372 16.445 101 H4' A 10 H4' A 10 13.001 -2.677 16.198 102 H3' A 10 H3' A 10 10.681 -2.520 14.268 103 H2' A 10 H2'' A 10 10.943 -4.787 13.726 104 HO2' A 10 H2' A 10 12.975 -5.848 14.698 105 H1' A 10 H1' A 10 11.614 -5.736 16.226 106 H8 A 10 H8 A 10 8.819 -3.304 16.801 107 H61 A 10 H61 A 10 4.924 -7.865 15.262 108 H62 A 10 H62 A 10 5.068 -6.264 15.951 109 H2 A 10 H2 A 10 9.080 -9.158 14.182 110 H5' 6IA 11 H5' 6IA 11 13.706 -3.983 11.407 111 H5'' 6IA 11 H5'' 6IA 11 12.962 -3.657 9.829 112 H4' 6IA 11 H4' 6IA 11 12.958 -6.112 10.890 113 H3' 6IA 11 H3' 6IA 11 10.798 -4.760 9.274 114 H2' 6IA 11 H2'' 6IA 11 9.308 -6.535 9.682 115 HO2' 6IA 11 H2' 6IA 11 11.044 -8.195 11.064 116 H1' 6IA 11 H1' 6IA 11 9.879 -6.963 12.308 117 H8 6IA 11 H8 6IA 11 10.203 -3.254 11.995 118 HN6 6IA 11 H61 6IA 11 3.996 -2.921 12.004 119 H2 6IA 11 H2 6IA 11 5.155 -7.206 11.674 120 H121 6IA 11 H101 6IA 11 6.283 -1.539 11.154 121 H122 6IA 11 H102 6IA 11 6.221 -1.545 12.932 122 H132 6IA 11 H11 6IA 11 4.313 -0.198 11.016 123 H151 6IA 11 H143 6IA 11 3.250 1.295 14.370 124 H152 6IA 11 H141 6IA 11 5.016 1.078 14.329 125 H153 6IA 11 H142 6IA 11 4.182 1.844 12.956 126 H161 6IA 11 H131 6IA 11 2.443 -1.855 13.195 127 H162 6IA 11 H132 6IA 11 3.944 -2.174 14.106 128 H163 6IA 11 H133 6IA 11 2.755 -1.003 14.729 129 H5' A 12 H5' A 12 10.856 -8.369 6.477 130 H5'' A 12 H5'' A 12 9.861 -7.631 5.209 131 H4' A 12 H4' A 12 8.888 -9.337 7.130 132 H3' A 12 H3' A 12 7.519 -7.148 5.566 133 H2' A 12 H2'' A 12 5.587 -7.358 6.904 134 HO2' A 12 H2' A 12 6.069 -9.865 6.863 135 H1' A 12 H1' A 12 6.813 -7.686 9.325 136 H8 A 12 H8 A 12 9.032 -5.186 7.713 137 H61 A 12 H61 A 12 4.790 -0.863 8.995 138 H62 A 12 H62 A 12 6.431 -1.160 8.467 139 H2 A 12 H2 A 12 2.935 -4.886 9.694 140 HN1 PSU 13 H1 PSU 13 6.184 -4.609 4.950 141 HN3 PSU 13 H3 PSU 13 2.519 -3.074 5.670 142 H6 PSU 13 H6 PSU 13 5.247 -6.759 4.654 143 H1' PSU 13 H1' PSU 13 2.086 -7.802 5.675 144 H2' PSU 13 H2'' PSU 13 1.429 -6.678 3.236 145 HO2' PSU 13 H2' PSU 13 -0.170 -8.004 3.596 146 H3' PSU 13 H3' PSU 13 3.240 -7.539 1.997 147 H4' PSU 13 H4' PSU 13 3.022 -10.137 3.523 148 H5' PSU 13 H5' PSU 13 5.211 -10.505 2.978 149 H5'' PSU 13 H5'' PSU 13 4.890 -9.340 1.680 150 H5' C 14 H5' C 14 -0.114 -8.784 -1.255 151 H5'' C 14 H5'' C 14 0.627 -7.564 -2.312 152 H4' C 14 H4' C 14 -1.741 -7.221 -0.920 153 H3' C 14 H3' C 14 0.243 -5.169 -1.944 154 H2' C 14 H2'' C 14 -1.005 -3.481 -0.854 155 HO2' C 14 H2' C 14 -3.068 -4.135 -1.575 156 H1' C 14 H1' C 14 -1.673 -4.913 1.397 157 H41 C 14 H41 C 14 3.268 -1.250 3.088 158 H42 C 14 H42 C 14 4.302 -2.640 2.896 159 H5 C 14 H5 C 14 3.553 -4.725 1.953 160 H6 C 14 H6 C 14 1.644 -5.924 0.988 161 H5' C 15 H5' C 15 -2.243 -4.058 -5.964 162 H5'' C 15 H5'' C 15 -0.659 -3.567 -6.602 163 H4' C 15 H4' C 15 -2.613 -1.807 -5.795 164 H3' C 15 H3' C 15 0.397 -1.481 -5.881 165 H2' C 15 H2'' C 15 0.203 0.602 -4.789 166 HO2' C 15 H2' C 15 -1.395 1.672 -5.799 167 H1' C 15 H1' C 15 -1.805 -0.072 -3.043 168 H41 C 15 H41 C 15 3.562 -0.772 0.315 169 H42 C 15 H42 C 15 3.469 -2.484 0.028 170 H5 C 15 H5 C 15 1.877 -3.484 -1.477 171 H6 C 15 H6 C 15 0.032 -3.048 -3.032 172 H5' C 16 H5' C 16 -0.586 1.712 -7.859 173 H5'' C 16 H5'' C 16 0.103 2.042 -9.464 174 H4' C 16 H4' C 16 0.931 3.751 -8.028 175 H3' C 16 H3' C 16 2.954 1.579 -8.571 176 H2' C 16 H2'' C 16 4.514 2.669 -7.187 177 HO2' C 16 H2' C 16 2.892 4.927 -7.716 178 H1' C 16 H1' C 16 2.734 3.588 -5.270 179 H41 C 16 H41 C 16 5.154 -1.676 -2.606 180 H42 C 16 H42 C 16 4.089 -2.672 -3.565 181 H5 C 16 H5 C 16 2.642 -1.787 -5.275 182 H6 C 16 H6 C 16 1.905 0.245 -6.433 183 H5' C 17 H5' C 17 5.233 3.726 -12.111 184 H5'' C 17 H5'' C 17 5.583 2.088 -12.702 185 H4' C 17 H4' C 17 7.396 3.652 -11.370 186 H3' C 17 H3' C 17 7.152 0.633 -11.416 187 HO3' C 17 H3T C 17 8.280 2.574 -12.928 188 H2' C 17 H2'' C 17 8.938 0.491 -9.905 189 HO2' C 17 H2' C 17 10.007 2.369 -11.213 190 H1' C 17 H1' C 17 8.261 2.713 -8.386 191 H41 C 17 H41 C 17 6.253 -2.438 -5.162 192 H42 C 17 H42 C 17 4.671 -2.222 -5.883 193 H5 C 17 H5 C 17 4.199 -0.608 -7.605 194 H6 C 17 H6 C 17 5.145 1.159 -9.017 Start of MODEL 2 1 H5' G 1 H5' G 1 14.393 -4.639 -0.951 2 H5'' G 1 H5'' G 1 15.749 -3.499 -1.023 3 H4' G 1 H4' G 1 14.566 -1.820 0.164 4 H3' G 1 H3' G 1 12.670 -4.036 0.972 5 H2' G 1 H2'' G 1 10.860 -2.564 0.868 6 HO2' G 1 H2' G 1 12.298 -0.207 0.520 7 H1' G 1 H1' G 1 11.724 -0.965 -1.221 8 H8 G 1 H8 G 1 11.162 -4.830 -0.768 9 H1 G 1 H1 G 1 7.755 -1.911 -5.353 10 H21 G 1 H21 G 1 8.327 0.225 -5.458 11 H22 G 1 H22 G 1 9.527 0.946 -4.432 12 HO5' G 1 H5T G 1 15.417 -3.726 1.470 13 H5' G 2 H5' G 2 13.446 0.099 2.805 14 H5'' G 2 H5'' G 2 13.078 0.238 4.537 15 H4' G 2 H4' G 2 12.350 2.287 3.453 16 H3' G 2 H3' G 2 10.156 0.427 4.329 17 H2' G 2 H2'' G 2 8.582 1.790 3.352 18 HO2' G 2 H2' G 2 10.481 3.800 3.747 19 H1' G 2 H1' G 2 9.879 2.683 1.170 20 H8 G 2 H8 G 2 9.874 -1.059 2.263 21 H1 G 2 H1 G 2 5.751 0.633 -2.352 22 H21 G 2 H21 G 2 5.826 2.830 -2.668 23 H22 G 2 H22 G 2 6.884 3.875 -1.751 24 H5' G 3 H5' G 3 9.640 5.316 5.459 25 H5'' G 3 H5'' G 3 8.321 5.199 6.640 26 H4' G 3 H4' G 3 8.044 6.720 4.504 27 H3' G 3 H3' G 3 5.976 4.889 5.708 28 H2' G 3 H2'' G 3 4.480 5.355 3.925 29 HO2' G 3 H2' G 3 5.223 7.714 4.033 30 H1' G 3 H1' G 3 6.228 5.233 1.880 31 H8 G 3 H8 G 3 7.113 2.717 4.641 32 H1 G 3 H1 G 3 3.167 0.651 0.024 33 H21 G 3 H21 G 3 2.540 2.344 -1.267 34 H22 G 3 H22 G 3 3.102 3.985 -0.988 35 H5' G 4 H5' G 4 3.068 8.351 7.011 36 H5'' G 4 H5'' G 4 2.351 7.257 8.212 37 H4' G 4 H4' G 4 1.142 7.864 5.851 38 H3' G 4 H3' G 4 1.012 5.336 7.488 39 H2' G 4 H2'' G 4 -0.172 4.239 5.771 40 HO2' G 4 H2' G 4 -0.596 6.207 3.969 41 H1' G 4 H1' G 4 1.135 5.335 3.605 42 H8 G 4 H8 G 4 3.756 4.524 6.199 43 H1 G 4 H1 G 4 1.825 -0.561 2.797 44 H21 G 4 H21 G 4 0.014 -0.054 1.614 45 H22 G 4 H22 G 4 -0.712 1.546 1.665 46 H5' A 5 H5' A 5 -3.550 5.800 8.728 47 H5'' A 5 H5'' A 5 -3.183 4.771 10.127 48 H4' A 5 H4' A 5 -4.498 3.902 7.870 49 H3' A 5 H3' A 5 -2.829 2.384 9.884 50 H2' A 5 H2'' A 5 -2.853 0.473 8.521 51 HO2' A 5 H2' A 5 -4.616 1.306 6.576 52 H1' A 5 H1' A 5 -2.723 1.713 6.055 53 H8 A 5 H8 A 5 -0.244 3.538 8.187 54 H61 A 5 H61 A 5 3.711 -1.091 7.046 55 H62 A 5 H62 A 5 3.529 0.525 7.698 56 H2 A 5 H2 A 5 -0.359 -2.356 5.648 57 H5' C 6 H5' C 6 -5.688 -0.069 9.209 58 H5'' C 6 H5'' C 6 -6.295 -1.103 10.520 59 H4' C 6 H4' C 6 -4.938 -2.362 8.861 60 H3' C 6 H3' C 6 -3.984 -2.172 11.710 61 H2' C 6 H2'' C 6 -2.015 -3.333 11.181 62 HO2' C 6 H2' C 6 -1.961 -4.869 9.696 63 H1' C 6 H1' C 6 -1.602 -2.316 8.638 64 H41 C 6 H41 C 6 2.290 1.147 12.323 65 H42 C 6 H42 C 6 0.950 2.165 12.800 66 H5 C 6 H5 C 6 -1.331 1.735 12.152 67 H6 C 6 H6 C 6 -2.820 0.238 10.906 68 H5' U 7 H5' U 7 -3.591 -6.186 12.229 69 H5'' U 7 H5'' U 7 -3.661 -6.237 13.998 70 H4' U 7 H4' U 7 -1.355 -5.838 12.505 71 H3' U 7 H3' U 7 -2.050 -5.137 15.361 72 H2' U 7 H2'' U 7 -0.124 -3.819 15.553 73 HO2' U 7 H2' U 7 1.689 -4.295 14.540 74 H1' U 7 H1' U 7 -0.109 -2.732 13.024 75 H3 U 7 H3 U 7 -1.044 0.579 16.092 76 H5 U 7 H5 U 7 -4.751 -1.086 14.966 77 H6 U 7 H6 U 7 -3.536 -2.864 13.845 78 H5' G 8 H5' G 8 3.438 -6.310 16.678 79 H5'' G 8 H5'' G 8 2.053 -6.330 17.782 80 H4' G 8 H4' G 8 3.312 -4.018 16.325 81 H3' G 8 H3' G 8 2.421 -4.591 19.167 82 H2' G 8 H2'' G 8 1.856 -2.379 19.506 83 HO2' G 8 H2' G 8 3.500 -1.119 18.948 84 H1' G 8 H1' G 8 1.044 -1.733 16.936 85 H8 G 8 H8 G 8 -0.266 -4.975 18.552 86 H1 G 8 H1 G 8 -4.008 0.178 19.332 87 H21 G 8 H21 G 8 -2.966 1.993 18.592 88 H22 G 8 H22 G 8 -1.357 1.939 17.908 89 H5' U 9 H5' U 9 6.231 0.208 18.069 90 H5'' U 9 H5'' U 9 7.134 -1.138 17.357 91 H4' U 9 H4' U 9 8.168 0.192 19.346 92 H3' U 9 H3' U 9 8.698 -2.387 18.510 93 H2' U 9 H2'' U 9 7.299 -3.511 20.022 94 HO2' U 9 H2' U 9 9.868 -3.197 20.934 95 H1' U 9 H1' U 9 7.983 -1.556 22.219 96 H3 U 9 H3 U 9 4.807 -3.023 25.038 97 H5 U 9 H5 U 9 3.135 -3.897 21.268 98 H6 U 9 H6 U 9 5.113 -2.935 20.241 99 H5' A 10 H5' A 10 11.514 -1.133 16.093 100 H5'' A 10 H5'' A 10 10.109 -2.053 16.666 101 H4' A 10 H4' A 10 12.893 -3.233 16.421 102 H3' A 10 H3' A 10 10.662 -3.110 14.388 103 H2' A 10 H2'' A 10 11.026 -5.359 13.825 104 HO2' A 10 H2' A 10 12.955 -6.435 14.295 105 H1' A 10 H1' A 10 11.638 -6.319 16.344 106 H8 A 10 H8 A 10 8.704 -4.058 16.856 107 H61 A 10 H61 A 10 5.111 -8.750 15.013 108 H62 A 10 H62 A 10 5.145 -7.167 15.757 109 H2 A 10 H2 A 10 9.368 -9.803 14.073 110 H5' 6IA 11 H5' 6IA 11 13.723 -4.542 11.594 111 H5'' 6IA 11 H5'' 6IA 11 13.000 -4.133 10.027 112 H4' 6IA 11 H4' 6IA 11 12.943 -6.630 10.966 113 H3' 6IA 11 H3' 6IA 11 10.807 -5.167 9.425 114 H2' 6IA 11 H2'' 6IA 11 9.283 -6.916 9.769 115 HO2' 6IA 11 H2' 6IA 11 9.955 -8.918 9.719 116 H1' 6IA 11 H1' 6IA 11 9.914 -7.547 12.357 117 H8 6IA 11 H8 6IA 11 10.172 -3.806 12.134 118 HN6 6IA 11 H61 6IA 11 3.996 -3.579 12.617 119 H2 6IA 11 H2 6IA 11 5.180 -7.846 12.114 120 H121 6IA 11 H101 6IA 11 6.306 -2.197 11.698 121 H122 6IA 11 H102 6IA 11 6.175 -2.154 13.473 122 H132 6IA 11 H11 6IA 11 4.519 -0.689 11.509 123 H151 6IA 11 H143 6IA 11 4.588 0.534 14.490 124 H152 6IA 11 H141 6IA 11 3.193 -0.220 15.300 125 H153 6IA 11 H142 6IA 11 4.765 -1.054 15.273 126 H161 6IA 11 H131 6IA 11 2.133 -2.581 13.470 127 H162 6IA 11 H132 6IA 11 1.578 -0.905 13.688 128 H163 6IA 11 H133 6IA 11 2.054 -1.485 12.076 129 H5' A 12 H5' A 12 10.784 -8.713 6.575 130 H5'' A 12 H5'' A 12 9.790 -7.958 5.317 131 H4' A 12 H4' A 12 8.819 -9.639 7.279 132 H3' A 12 H3' A 12 7.454 -7.498 5.651 133 H2' A 12 H2'' A 12 5.535 -7.639 7.016 134 HO2' A 12 H2' A 12 5.479 -9.442 8.639 135 H1' A 12 H1' A 12 6.773 -7.946 9.439 136 H8 A 12 H8 A 12 9.002 -5.474 7.826 137 H61 A 12 H61 A 12 4.788 -1.121 9.099 138 H62 A 12 H62 A 12 6.431 -1.430 8.583 139 H2 A 12 H2 A 12 2.891 -5.132 9.758 140 HN1 PSU 13 H1 PSU 13 6.126 -4.909 5.066 141 HN3 PSU 13 H3 PSU 13 2.493 -3.411 5.998 142 H6 PSU 13 H6 PSU 13 5.178 -7.049 4.732 143 H1' PSU 13 H1' PSU 13 2.017 -8.111 5.803 144 H2' PSU 13 H2'' PSU 13 1.361 -6.922 3.392 145 HO2' PSU 13 H2' PSU 13 -0.245 -8.173 3.969 146 H3' PSU 13 H3' PSU 13 3.145 -7.787 2.117 147 H4' PSU 13 H4' PSU 13 2.918 -10.406 3.609 148 H5' PSU 13 H5' PSU 13 5.073 -10.799 2.987 149 H5'' PSU 13 H5'' PSU 13 4.814 -9.522 1.786 150 H5' C 14 H5' C 14 -0.154 -8.895 -1.299 151 H5'' C 14 H5'' C 14 0.664 -7.603 -2.202 152 H4' C 14 H4' C 14 -1.805 -7.378 -0.915 153 H3' C 14 H3' C 14 0.170 -5.270 -1.826 154 H2' C 14 H2'' C 14 -1.084 -3.626 -0.691 155 HO2' C 14 H2' C 14 -3.160 -3.871 -1.145 156 H1' C 14 H1' C 14 -1.811 -5.128 1.496 157 H41 C 14 H41 C 14 3.166 -1.547 3.333 158 H42 C 14 H42 C 14 4.182 -2.944 3.114 159 H5 C 14 H5 C 14 3.418 -4.998 2.123 160 H6 C 14 H6 C 14 1.504 -6.157 1.122 161 H5' C 15 H5' C 15 -2.326 -4.019 -5.803 162 H5'' C 15 H5'' C 15 -0.753 -3.483 -6.431 163 H4' C 15 H4' C 15 -2.717 -1.782 -5.532 164 H3' C 15 H3' C 15 0.285 -1.419 -5.630 165 H2' C 15 H2'' C 15 0.090 0.596 -4.418 166 HO2' C 15 H2' C 15 -2.702 0.480 -5.032 167 H1' C 15 H1' C 15 -1.913 -0.165 -2.702 168 H41 C 15 H41 C 15 3.552 -1.025 0.511 169 H42 C 15 H42 C 15 3.473 -2.715 0.108 170 H5 C 15 H5 C 15 1.850 -3.634 -1.413 171 H6 C 15 H6 C 15 -0.050 -3.122 -2.876 172 H5' C 16 H5' C 16 -0.857 1.901 -7.479 173 H5'' C 16 H5'' C 16 -0.148 2.328 -9.051 174 H4' C 16 H4' C 16 0.541 3.995 -7.463 175 H3' C 16 H3' C 16 2.695 2.034 -8.253 176 H2' C 16 H2'' C 16 4.207 3.060 -6.769 177 HO2' C 16 H2' C 16 3.973 5.162 -6.072 178 H1' C 16 H1' C 16 2.410 3.697 -4.751 179 H41 C 16 H41 C 16 5.152 -1.653 -2.608 180 H42 C 16 H42 C 16 4.114 -2.612 -3.631 181 H5 C 16 H5 C 16 2.586 -1.654 -5.227 182 H6 C 16 H6 C 16 1.725 0.433 -6.184 183 H5' C 17 H5' C 17 4.431 4.731 -9.003 184 H5'' C 17 H5'' C 17 4.849 5.791 -10.365 185 H4' C 17 H4' C 17 6.999 5.103 -10.123 186 H3' C 17 H3' C 17 5.796 2.451 -10.949 187 HO3' C 17 H3T C 17 6.507 3.159 -12.816 188 H2' C 17 H2'' C 17 7.796 1.377 -10.385 189 HO2' C 17 H2' C 17 9.740 2.380 -10.359 190 H1' C 17 H1' C 17 8.424 2.965 -8.182 191 H41 C 17 H41 C 17 5.971 -2.214 -5.374 192 H42 C 17 H42 C 17 4.391 -1.878 -6.061 193 H5 C 17 H5 C 17 3.955 -0.058 -7.572 194 H6 C 17 H6 C 17 4.937 1.848 -8.762 Start of MODEL 3 1 H5' G 1 H5' G 1 16.130 -3.583 0.591 2 H5'' G 1 H5'' G 1 15.099 -4.096 -0.758 3 H4' G 1 H4' G 1 15.103 -1.250 0.274 4 H3' G 1 H3' G 1 13.494 -3.622 1.261 5 H2' G 1 H2'' G 1 11.575 -2.281 1.341 6 HO2' G 1 H2' G 1 11.803 0.071 1.172 7 H1' G 1 H1' G 1 12.119 -0.641 -0.824 8 H8 G 1 H8 G 1 11.699 -4.520 -0.281 9 H1 G 1 H1 G 1 8.024 -1.747 -4.748 10 H21 G 1 H21 G 1 8.571 0.392 -4.941 11 H22 G 1 H22 G 1 9.819 1.146 -3.997 12 HO5' G 1 H5T G 1 17.372 -3.281 -1.143 13 H5' G 2 H5' G 2 13.769 0.656 3.230 14 H5'' G 2 H5'' G 2 13.356 0.589 4.956 15 H4' G 2 H4' G 2 12.214 2.482 3.850 16 H3' G 2 H3' G 2 10.520 0.204 4.902 17 H2' G 2 H2'' G 2 8.629 1.095 3.958 18 HO2' G 2 H2' G 2 9.919 3.614 3.663 19 H1' G 2 H1' G 2 9.691 2.435 1.802 20 H8 G 2 H8 G 2 9.950 -1.393 2.655 21 H1 G 2 H1 G 2 5.822 0.391 -1.920 22 H21 G 2 H21 G 2 5.867 2.598 -2.167 23 H22 G 2 H22 G 2 6.909 3.628 -1.211 24 H5' G 3 H5' G 3 9.789 4.842 5.535 25 H5'' G 3 H5'' G 3 8.752 5.192 6.929 26 H4' G 3 H4' G 3 8.163 6.535 4.909 27 H3' G 3 H3' G 3 6.100 4.640 6.040 28 H2' G 3 H2'' G 3 4.572 5.319 4.337 29 HO2' G 3 H2' G 3 4.668 7.251 3.467 30 H1' G 3 H1' G 3 6.255 5.168 2.259 31 H8 G 3 H8 G 3 7.285 2.606 4.890 32 H1 G 3 H1 G 3 3.282 0.584 0.304 33 H21 G 3 H21 G 3 2.474 2.315 -0.828 34 H22 G 3 H22 G 3 2.925 3.969 -0.453 35 H5' G 4 H5' G 4 3.249 8.143 7.141 36 H5'' G 4 H5'' G 4 2.515 7.212 8.463 37 H4' G 4 H4' G 4 1.146 7.701 6.255 38 H3' G 4 H3' G 4 1.237 5.100 7.786 39 H2' G 4 H2'' G 4 -0.145 4.082 6.160 40 HO2' G 4 H2' G 4 -0.567 6.421 4.675 41 H1' G 4 H1' G 4 1.024 5.169 3.941 42 H8 G 4 H8 G 4 3.793 4.439 6.430 43 H1 G 4 H1 G 4 1.912 -0.642 2.994 44 H21 G 4 H21 G 4 0.025 -0.185 1.916 45 H22 G 4 H22 G 4 -0.767 1.377 2.044 46 H5' A 5 H5' A 5 -3.193 5.456 9.331 47 H5'' A 5 H5'' A 5 -2.810 4.356 10.671 48 H4' A 5 H4' A 5 -4.214 3.600 8.452 49 H3' A 5 H3' A 5 -2.429 1.975 10.270 50 H2' A 5 H2'' A 5 -2.548 0.142 8.802 51 HO2' A 5 H2' A 5 -4.177 -0.022 7.208 52 H1' A 5 H1' A 5 -2.540 1.516 6.411 53 H8 A 5 H8 A 5 0.034 3.251 8.494 54 H61 A 5 H61 A 5 3.993 -1.180 6.743 55 H62 A 5 H62 A 5 3.828 0.389 7.504 56 H2 A 5 H2 A 5 -0.149 -2.486 5.622 57 H5' C 6 H5' C 6 -4.769 -1.103 9.043 58 H5'' C 6 H5'' C 6 -4.988 -2.126 10.480 59 H4' C 6 H4' C 6 -3.398 -2.963 8.606 60 H3' C 6 H3' C 6 -2.748 -2.918 11.541 61 H2' C 6 H2'' C 6 -0.563 -3.656 11.123 62 HO2' C 6 H2' C 6 -0.073 -4.947 9.509 63 H1' C 6 H1' C 6 -0.087 -2.251 8.812 64 H41 C 6 H41 C 6 2.520 1.367 13.368 65 H42 C 6 H42 C 6 0.963 2.096 13.690 66 H5 C 6 H5 C 6 -1.080 1.363 12.643 67 H6 C 6 H6 C 6 -2.070 -0.227 11.060 68 H5' U 7 H5' U 7 -1.668 -6.780 11.955 69 H5'' U 7 H5'' U 7 -1.936 -6.898 13.708 70 H4' U 7 H4' U 7 0.421 -6.060 12.568 71 H3' U 7 H3' U 7 -0.804 -5.415 15.257 72 H2' U 7 H2'' U 7 0.800 -3.732 15.634 73 HO2' U 7 H2' U 7 2.319 -5.345 13.998 74 H1' U 7 H1' U 7 0.957 -2.746 13.059 75 H3 U 7 H3 U 7 -1.127 0.578 15.401 76 H5 U 7 H5 U 7 -4.164 -2.194 14.466 77 H6 U 7 H6 U 7 -2.441 -3.720 13.692 78 H5' G 8 H5' G 8 3.286 -4.619 16.271 79 H5'' G 8 H5'' G 8 3.318 -5.186 17.951 80 H4' G 8 H4' G 8 3.281 -2.587 17.389 81 H3' G 8 H3' G 8 1.805 -4.033 19.592 82 H2' G 8 H2'' G 8 0.651 -2.081 20.152 83 HO2' G 8 H2' G 8 1.862 -0.264 18.500 84 H1' G 8 H1' G 8 0.230 -1.066 17.652 85 H8 G 8 H8 G 8 -0.103 -4.845 18.543 86 H1 G 8 H1 G 8 -5.608 -1.561 18.278 87 H21 G 8 H21 G 8 -5.196 0.583 17.873 88 H22 G 8 H22 G 8 -3.574 1.205 17.668 89 H5' U 9 H5' U 9 7.785 -3.263 19.178 90 H5'' U 9 H5'' U 9 6.873 -2.270 20.329 91 H4' U 9 H4' U 9 7.646 -1.558 17.482 92 H3' U 9 H3' U 9 9.140 -1.109 19.702 93 H2' U 9 H2'' U 9 7.596 0.117 20.966 94 HO2' U 9 H2' U 9 8.315 2.154 20.928 95 H1' U 9 H1' U 9 6.524 1.656 18.634 96 H3 U 9 H3 U 9 3.790 2.998 22.078 97 H5 U 9 H5 U 9 2.983 -1.109 21.565 98 H6 U 9 H6 U 9 4.820 -1.204 19.981 99 H5' A 10 H5' A 10 9.944 -0.681 14.191 100 H5'' A 10 H5'' A 10 8.965 -1.205 15.577 101 H4' A 10 H4' A 10 11.740 -2.255 15.501 102 H3' A 10 H3' A 10 9.725 -3.011 13.389 103 H2' A 10 H2'' A 10 10.346 -5.266 13.635 104 HO2' A 10 H2' A 10 12.337 -5.839 14.119 105 H1' A 10 H1' A 10 10.709 -5.257 16.373 106 H8 A 10 H8 A 10 7.550 -3.402 16.142 107 H61 A 10 H61 A 10 4.649 -8.739 14.942 108 H62 A 10 H62 A 10 4.450 -7.059 15.387 109 H2 A 10 H2 A 10 9.060 -9.420 14.498 110 H5' 6IA 11 H5' 6IA 11 12.882 -4.565 11.475 111 H5'' 6IA 11 H5'' 6IA 11 12.571 -4.669 9.731 112 H4' 6IA 11 H4' 6IA 11 12.175 -6.782 11.162 113 H3' 6IA 11 H3' 6IA 11 10.196 -5.668 9.174 114 H2' 6IA 11 H2'' 6IA 11 8.641 -7.326 9.764 115 HO2' 6IA 11 H2' 6IA 11 9.975 -9.135 9.674 116 H1' 6IA 11 H1' 6IA 11 9.145 -7.429 12.465 117 H8 6IA 11 H8 6IA 11 9.142 -3.805 11.303 118 HN6 6IA 11 H61 6IA 11 2.969 -3.954 12.151 119 H2 6IA 11 H2 6IA 11 4.560 -8.082 12.660 120 H121 6IA 11 H101 6IA 11 3.600 -1.893 11.467 121 H122 6IA 11 H102 6IA 11 5.087 -2.602 10.820 122 H132 6IA 11 H11 6IA 11 6.184 -2.440 12.989 123 H151 6IA 11 H143 6IA 11 5.908 0.262 14.469 124 H152 6IA 11 H141 6IA 11 5.134 0.614 12.906 125 H153 6IA 11 H142 6IA 11 4.189 0.718 14.411 126 H161 6IA 11 H131 6IA 11 2.813 -2.381 14.260 127 H162 6IA 11 H132 6IA 11 4.228 -2.746 15.278 128 H163 6IA 11 H133 6IA 11 3.347 -1.216 15.499 129 H5' A 12 H5' A 12 10.792 -9.374 6.587 130 H5'' A 12 H5'' A 12 10.080 -8.689 5.117 131 H4' A 12 H4' A 12 8.676 -10.308 6.680 132 H3' A 12 H3' A 12 7.700 -7.802 5.316 133 H2' A 12 H2'' A 12 5.572 -8.094 6.348 134 HO2' A 12 H2' A 12 4.862 -10.004 6.996 135 H1' A 12 H1' A 12 6.477 -8.575 8.833 136 H8 A 12 H8 A 12 9.067 -6.386 7.120 137 H61 A 12 H61 A 12 5.549 -1.519 8.628 138 H62 A 12 H62 A 12 7.085 -2.039 7.971 139 H2 A 12 H2 A 12 3.258 -5.250 9.604 140 HN1 PSU 13 H1 PSU 13 6.360 -4.940 4.551 141 HN3 PSU 13 H3 PSU 13 2.765 -3.525 5.747 142 H6 PSU 13 H6 PSU 13 5.444 -7.107 4.279 143 H1' PSU 13 H1' PSU 13 2.392 -8.241 5.589 144 H2' PSU 13 H2'' PSU 13 1.509 -7.061 3.265 145 HO2' PSU 13 H2' PSU 13 1.100 -9.482 4.562 146 H3' PSU 13 H3' PSU 13 3.328 -7.770 1.906 147 H4' PSU 13 H4' PSU 13 3.136 -10.468 3.273 148 H5' PSU 13 H5' PSU 13 5.324 -10.829 2.673 149 H5'' PSU 13 H5'' PSU 13 4.855 -9.766 1.333 150 H5' C 14 H5' C 14 -0.192 -8.929 -1.167 151 H5'' C 14 H5'' C 14 0.386 -7.695 -2.307 152 H4' C 14 H4' C 14 -1.833 -7.390 -0.742 153 H3' C 14 H3' C 14 0.091 -5.271 -1.742 154 H2' C 14 H2'' C 14 -1.153 -3.657 -0.531 155 HO2' C 14 H2' C 14 -3.162 -5.675 -0.397 156 H1' C 14 H1' C 14 -1.655 -5.208 1.682 157 H41 C 14 H41 C 14 3.281 -1.638 3.474 158 H42 C 14 H42 C 14 4.302 -3.024 3.205 159 H5 C 14 H5 C 14 3.543 -5.044 2.141 160 H6 C 14 H6 C 14 1.631 -6.172 1.100 161 H5' C 15 H5' C 15 -2.599 -3.866 -5.446 162 H5'' C 15 H5'' C 15 -1.086 -3.310 -6.191 163 H4' C 15 H4' C 15 -2.932 -1.642 -5.033 164 H3' C 15 H3' C 15 0.056 -1.300 -5.357 165 H2' C 15 H2'' C 15 -0.039 0.672 -4.063 166 HO2' C 15 H2' C 15 -1.675 1.960 -4.386 167 H1' C 15 H1' C 15 -1.911 -0.164 -2.234 168 H41 C 15 H41 C 15 3.596 -1.098 0.782 169 H42 C 15 H42 C 15 3.471 -2.788 0.382 170 H5 C 15 H5 C 15 1.812 -3.668 -1.126 171 H6 C 15 H6 C 15 -0.085 -3.110 -2.575 172 H5' C 16 H5' C 16 -1.024 2.132 -6.973 173 H5'' C 16 H5'' C 16 -0.298 2.545 -8.541 174 H4' C 16 H4' C 16 0.524 4.111 -6.918 175 H3' C 16 H3' C 16 2.535 2.013 -7.729 176 H2' C 16 H2'' C 16 4.131 3.030 -6.322 177 HO2' C 16 H2' C 16 3.578 5.204 -7.095 178 H1' C 16 H1' C 16 2.388 3.729 -4.274 179 H41 C 16 H41 C 16 5.071 -1.642 -2.137 180 H42 C 16 H42 C 16 4.002 -2.596 -3.137 181 H5 C 16 H5 C 16 2.469 -1.627 -4.724 182 H6 C 16 H6 C 16 1.632 0.465 -5.691 183 H5' C 17 H5' C 17 4.683 4.484 -11.084 184 H5'' C 17 H5'' C 17 5.110 2.920 -11.811 185 H4' C 17 H4' C 17 6.826 4.447 -10.298 186 H3' C 17 H3' C 17 6.766 1.435 -10.642 187 HO3' C 17 H3T C 17 7.890 2.024 -12.333 188 H2' C 17 H2'' C 17 8.574 1.287 -9.154 189 HO2' C 17 H2' C 17 9.446 3.403 -10.288 190 H1' C 17 H1' C 17 7.738 3.312 -7.448 191 H41 C 17 H41 C 17 6.257 -2.274 -4.709 192 H42 C 17 H42 C 17 4.630 -2.103 -5.342 193 H5 C 17 H5 C 17 3.975 -0.361 -6.870 194 H6 C 17 H6 C 17 4.737 1.601 -8.128 Start of MODEL 4 1 H5' G 1 H5' G 1 14.459 -4.557 -0.203 2 H5'' G 1 H5'' G 1 15.776 -3.375 -0.321 3 H4' G 1 H4' G 1 14.563 -1.717 0.871 4 H3' G 1 H3' G 1 12.728 -3.974 1.718 5 H2' G 1 H2'' G 1 10.882 -2.540 1.602 6 HO2' G 1 H2' G 1 12.185 -0.148 1.211 7 H1' G 1 H1' G 1 11.740 -0.912 -0.475 8 H8 G 1 H8 G 1 11.047 -4.774 -0.090 9 H1 G 1 H1 G 1 7.918 -1.655 -4.742 10 H21 G 1 H21 G 1 8.582 0.459 -4.800 11 H22 G 1 H22 G 1 9.778 1.112 -3.721 12 HO5' G 1 H5T G 1 14.906 -4.875 1.899 13 H5' G 2 H5' G 2 13.239 0.259 3.591 14 H5'' G 2 H5'' G 2 12.771 0.341 5.303 15 H4' G 2 H4' G 2 11.883 2.306 4.145 16 H3' G 2 H3' G 2 9.865 0.229 5.002 17 H2' G 2 H2'' G 2 8.183 1.354 3.922 18 HO2' G 2 H2' G 2 8.367 3.593 3.306 19 H1' G 2 H1' G 2 9.525 2.465 1.826 20 H8 G 2 H8 G 2 9.447 -1.316 2.887 21 H1 G 2 H1 G 2 5.714 0.483 -2.010 22 H21 G 2 H21 G 2 5.942 2.661 -2.381 23 H22 G 2 H22 G 2 7.009 3.668 -1.429 24 H5' G 3 H5' G 3 9.240 4.976 5.658 25 H5'' G 3 H5'' G 3 8.053 5.182 6.959 26 H4' G 3 H4' G 3 7.638 6.574 4.879 27 H3' G 3 H3' G 3 5.533 4.695 5.952 28 H2' G 3 H2'' G 3 4.073 5.335 4.177 29 HO2' G 3 H2' G 3 5.365 7.637 4.364 30 H1' G 3 H1' G 3 5.843 5.176 2.169 31 H8 G 3 H8 G 3 6.725 2.677 4.917 32 H1 G 3 H1 G 3 3.113 0.495 0.086 33 H21 G 3 H21 G 3 2.374 2.187 -1.149 34 H22 G 3 H22 G 3 2.779 3.856 -0.779 35 H5' G 4 H5' G 4 2.609 8.167 6.655 36 H5'' G 4 H5'' G 4 1.806 7.347 8.009 37 H4' G 4 H4' G 4 0.532 7.630 5.737 38 H3' G 4 H3' G 4 0.656 5.102 7.386 39 H2' G 4 H2'' G 4 -0.646 3.979 5.764 40 HO2' G 4 H2' G 4 -2.057 4.998 4.516 41 H1' G 4 H1' G 4 0.567 5.020 3.541 42 H8 G 4 H8 G 4 3.225 4.413 6.196 43 H1 G 4 H1 G 4 1.637 -0.784 2.786 44 H21 G 4 H21 G 4 -0.188 -0.385 1.583 45 H22 G 4 H22 G 4 -1.009 1.166 1.622 46 H5' A 5 H5' A 5 -3.854 5.371 8.541 47 H5'' A 5 H5'' A 5 -3.602 4.454 10.040 48 H4' A 5 H4' A 5 -4.816 3.368 7.906 49 H3' A 5 H3' A 5 -2.924 2.033 9.855 50 H2' A 5 H2'' A 5 -2.976 0.057 8.580 51 HO2' A 5 H2' A 5 -5.240 1.179 7.233 52 H1' A 5 H1' A 5 -2.984 1.210 6.081 53 H8 A 5 H8 A 5 -0.548 3.251 8.063 54 H61 A 5 H61 A 5 3.616 -1.205 6.991 55 H62 A 5 H62 A 5 3.368 0.425 7.577 56 H2 A 5 H2 A 5 -0.419 -2.749 5.788 57 H5' C 6 H5' C 6 -5.633 -0.513 9.489 58 H5'' C 6 H5'' C 6 -6.168 -1.545 10.832 59 H4' C 6 H4' C 6 -4.859 -2.826 9.185 60 H3' C 6 H3' C 6 -3.678 -2.453 11.933 61 H2' C 6 H2'' C 6 -1.744 -3.620 11.294 62 HO2' C 6 H2' C 6 -1.722 -5.139 9.762 63 H1' C 6 H1' C 6 -1.534 -2.668 8.712 64 H41 C 6 H41 C 6 2.416 1.025 12.114 65 H42 C 6 H42 C 6 1.072 2.043 12.578 66 H5 C 6 H5 C 6 -1.219 1.538 12.024 67 H6 C 6 H6 C 6 -2.714 -0.052 10.906 68 H5' U 7 H5' U 7 -3.210 -6.445 12.581 69 H5'' U 7 H5'' U 7 -3.093 -6.453 14.350 70 H4' U 7 H4' U 7 -0.945 -6.138 12.660 71 H3' U 7 H3' U 7 -1.387 -5.220 15.504 72 H2' U 7 H2'' U 7 0.552 -3.885 15.428 73 HO2' U 7 H2' U 7 1.207 -5.382 13.082 74 H1' U 7 H1' U 7 0.254 -2.892 12.899 75 H3 U 7 H3 U 7 -0.743 0.469 15.899 76 H5 U 7 H5 U 7 -4.359 -1.578 15.183 77 H6 U 7 H6 U 7 -3.086 -3.281 14.011 78 H5' G 8 H5' G 8 4.180 -6.101 16.389 79 H5'' G 8 H5'' G 8 2.909 -6.130 17.620 80 H4' G 8 H4' G 8 4.017 -3.815 16.047 81 H3' G 8 H3' G 8 3.270 -4.327 18.939 82 H2' G 8 H2'' G 8 2.635 -2.110 19.212 83 HO2' G 8 H2' G 8 3.315 -0.475 17.651 84 H1' G 8 H1' G 8 1.627 -1.591 16.696 85 H8 G 8 H8 G 8 0.660 -4.873 18.486 86 H1 G 8 H1 G 8 -3.386 0.023 19.386 87 H21 G 8 H21 G 8 -2.553 1.874 18.487 88 H22 G 8 H22 G 8 -1.007 1.906 17.668 89 H5' U 9 H5' U 9 9.224 -3.510 19.004 90 H5'' U 9 H5'' U 9 7.748 -3.400 19.974 91 H4' U 9 H4' U 9 8.365 -1.634 17.580 92 H3' U 9 H3' U 9 9.693 -1.369 19.959 93 H2' U 9 H2'' U 9 7.840 -1.082 21.363 94 HO2' U 9 H2' U 9 8.582 0.836 21.908 95 H1' U 9 H1' U 9 6.396 0.631 19.355 96 H3 U 9 H3 U 9 3.235 0.530 22.670 97 H5 U 9 H5 U 9 3.698 -3.495 21.503 98 H6 U 9 H6 U 9 5.552 -2.805 20.096 99 H5' A 10 H5' A 10 10.644 0.332 14.612 100 H5'' A 10 H5'' A 10 9.201 -0.650 14.300 101 H4' A 10 H4' A 10 11.847 -1.484 15.496 102 H3' A 10 H3' A 10 10.143 -2.419 13.192 103 H2' A 10 H2'' A 10 10.858 -4.630 13.525 104 HO2' A 10 H2' A 10 12.675 -5.073 14.935 105 H1' A 10 H1' A 10 10.907 -4.599 16.284 106 H8 A 10 H8 A 10 7.748 -2.811 15.554 107 H61 A 10 H61 A 10 5.134 -8.309 14.430 108 H62 A 10 H62 A 10 4.845 -6.607 14.710 109 H2 A 10 H2 A 10 9.577 -8.888 14.598 110 H5' 6IA 11 H5' 6IA 11 13.546 -3.646 10.869 111 H5'' 6IA 11 H5'' 6IA 11 12.853 -3.472 9.245 112 H4' 6IA 11 H4' 6IA 11 12.983 -5.850 10.366 113 H3' 6IA 11 H3' 6IA 11 10.636 -4.709 8.844 114 H2' 6IA 11 H2'' 6IA 11 9.383 -6.657 9.288 115 HO2' 6IA 11 H2' 6IA 11 11.528 -7.960 10.579 116 H1' 6IA 11 H1' 6IA 11 10.037 -6.919 11.908 117 H8 6IA 11 H8 6IA 11 9.973 -3.215 11.051 118 HN6 6IA 11 H61 6IA 11 3.850 -3.419 11.988 119 H2 6IA 11 H2 6IA 11 5.414 -7.607 12.110 120 H121 6IA 11 H101 6IA 11 5.818 -1.954 10.658 121 H122 6IA 11 H102 6IA 11 6.091 -1.802 12.406 122 H132 6IA 11 H11 6IA 11 3.756 -0.758 10.801 123 H151 6IA 11 H143 6IA 11 3.320 0.972 14.185 124 H152 6IA 11 H141 6IA 11 5.055 0.617 14.016 125 H153 6IA 11 H142 6IA 11 4.175 1.407 12.686 126 H161 6IA 11 H131 6IA 11 2.451 -2.373 13.193 127 H162 6IA 11 H132 6IA 11 3.951 -2.435 14.152 128 H163 6IA 11 H133 6IA 11 2.641 -1.326 14.619 129 H5' A 12 H5' A 12 10.994 -8.289 6.213 130 H5'' A 12 H5'' A 12 9.954 -7.786 4.869 131 H4' A 12 H4' A 12 9.108 -9.480 6.777 132 H3' A 12 H3' A 12 7.527 -7.347 5.336 133 H2' A 12 H2'' A 12 5.642 -7.847 6.683 134 HO2' A 12 H2' A 12 5.327 -9.783 7.523 135 H1' A 12 H1' A 12 6.943 -8.020 9.058 136 H8 A 12 H8 A 12 8.919 -5.374 7.350 137 H61 A 12 H61 A 12 4.325 -1.398 8.541 138 H62 A 12 H62 A 12 5.978 -1.568 7.996 139 H2 A 12 H2 A 12 2.847 -5.539 9.425 140 HN1 PSU 13 H1 PSU 13 5.951 -4.965 4.980 141 HN3 PSU 13 H3 PSU 13 2.179 -3.843 5.915 142 H6 PSU 13 H6 PSU 13 5.204 -7.152 4.488 143 H1' PSU 13 H1' PSU 13 2.142 -8.567 5.419 144 H2' PSU 13 H2'' PSU 13 1.412 -7.280 3.090 145 HO2' PSU 13 H2' PSU 13 0.146 -8.883 4.067 146 H3' PSU 13 H3' PSU 13 3.368 -7.804 1.857 147 H4' PSU 13 H4' PSU 13 3.288 -10.584 3.061 148 H5' PSU 13 H5' PSU 13 5.532 -10.738 2.611 149 H5'' PSU 13 H5'' PSU 13 5.111 -9.578 1.338 150 H5' C 14 H5' C 14 0.054 -9.176 -1.250 151 H5'' C 14 H5'' C 14 0.529 -8.012 -2.503 152 H4' C 14 H4' C 14 -1.692 -7.688 -1.032 153 H3' C 14 H3' C 14 0.213 -5.529 -1.971 154 H2' C 14 H2'' C 14 -1.134 -3.931 -0.853 155 HO2' C 14 H2' C 14 -3.084 -5.851 -1.272 156 H1' C 14 H1' C 14 -1.712 -5.458 1.358 157 H41 C 14 H41 C 14 3.025 -1.728 3.350 158 H42 C 14 H42 C 14 4.096 -3.090 3.159 159 H5 C 14 H5 C 14 3.447 -5.146 2.088 160 H6 C 14 H6 C 14 1.623 -6.339 0.966 161 H5' C 15 H5' C 15 -2.315 -4.301 -5.863 162 H5'' C 15 H5'' C 15 -0.785 -3.667 -6.503 163 H4' C 15 H4' C 15 -2.806 -2.107 -5.462 164 H3' C 15 H3' C 15 0.169 -1.578 -5.653 165 H2' C 15 H2'' C 15 -0.117 0.404 -4.399 166 HO2' C 15 H2' C 15 -1.937 1.204 -5.524 167 H1' C 15 H1' C 15 -1.981 -0.546 -2.629 168 H41 C 15 H41 C 15 3.434 -1.145 0.611 169 H42 C 15 H42 C 15 3.404 -2.843 0.241 170 H5 C 15 H5 C 15 1.858 -3.828 -1.319 171 H6 C 15 H6 C 15 0.005 -3.387 -2.863 172 H5' C 16 H5' C 16 -0.965 1.768 -8.026 173 H5'' C 16 H5'' C 16 0.164 1.920 -9.386 174 H4' C 16 H4' C 16 0.409 3.736 -7.707 175 H3' C 16 H3' C 16 2.741 1.857 -8.148 176 H2' C 16 H2'' C 16 3.992 3.111 -6.585 177 HO2' C 16 H2' C 16 3.772 5.203 -6.950 178 H1' C 16 H1' C 16 1.916 3.653 -4.832 179 H41 C 16 H41 C 16 5.016 -1.241 -2.173 180 H42 C 16 H42 C 16 4.080 -2.360 -3.130 181 H5 C 16 H5 C 16 2.549 -1.657 -4.854 182 H6 C 16 H6 C 16 1.588 0.270 -6.026 183 H5' C 17 H5' C 17 4.667 5.012 -9.649 184 H5'' C 17 H5'' C 17 5.287 4.824 -11.301 185 H4' C 17 H4' C 17 7.197 4.991 -9.899 186 H3' C 17 H3' C 17 6.629 2.095 -10.583 187 HO3' C 17 H3T C 17 8.775 3.775 -11.393 188 H2' C 17 H2'' C 17 8.553 1.485 -9.388 189 HO2' C 17 H2' C 17 9.825 3.531 -8.568 190 H1' C 17 H1' C 17 8.268 3.366 -7.356 191 H41 C 17 H41 C 17 6.120 -2.112 -4.871 192 H42 C 17 H42 C 17 4.561 -1.847 -5.630 193 H5 C 17 H5 C 17 4.114 -0.028 -7.143 194 H6 C 17 H6 C 17 5.062 1.937 -8.260 Start of MODEL 5 1 H5' G 1 H5' G 1 14.208 -5.304 0.999 2 H5'' G 1 H5'' G 1 13.342 -5.531 2.529 3 H4' G 1 H4' G 1 13.457 -3.135 1.603 4 H3' G 1 H3' G 1 10.880 -4.482 2.454 5 H2' G 1 H2'' G 1 9.669 -2.604 1.800 6 HO2' G 1 H2' G 1 12.139 -1.276 2.170 7 H1' G 1 H1' G 1 11.230 -1.809 -0.347 8 H8 G 1 H8 G 1 9.465 -5.219 0.529 9 H1 G 1 H1 G 1 7.242 -1.981 -4.544 10 H21 G 1 H21 G 1 8.455 -0.150 -4.857 11 H22 G 1 H22 G 1 9.800 0.281 -3.838 12 HO5' G 1 H5T G 1 12.563 -6.197 -0.090 13 H5' G 2 H5' G 2 12.732 -0.463 3.824 14 H5'' G 2 H5'' G 2 12.084 0.168 5.349 15 H4' G 2 H4' G 2 12.431 1.973 3.721 16 H3' G 2 H3' G 2 9.567 1.380 4.469 17 H2' G 2 H2'' G 2 8.887 3.158 3.024 18 HO2' G 2 H2' G 2 10.135 4.843 2.891 19 H1' G 2 H1' G 2 10.435 2.540 0.939 20 H8 G 2 H8 G 2 9.307 -0.608 2.862 21 H1 G 2 H1 G 2 5.866 1.054 -2.291 22 H21 G 2 H21 G 2 6.462 3.077 -2.988 23 H22 G 2 H22 G 2 7.705 4.014 -2.185 24 H5' G 3 H5' G 3 9.321 5.772 5.858 25 H5'' G 3 H5'' G 3 8.024 5.509 7.041 26 H4' G 3 H4' G 3 7.529 6.893 4.874 27 H3' G 3 H3' G 3 5.759 4.731 6.026 28 H2' G 3 H2'' G 3 4.241 5.056 4.220 29 HO2' G 3 H2' G 3 4.258 6.860 2.948 30 H1' G 3 H1' G 3 6.056 5.236 2.246 31 H8 G 3 H8 G 3 7.366 2.614 4.686 32 H1 G 3 H1 G 3 3.512 0.569 -0.017 33 H21 G 3 H21 G 3 2.484 2.291 -0.970 34 H22 G 3 H22 G 3 2.752 3.944 -0.447 35 H5' G 4 H5' G 4 2.343 7.654 7.430 36 H5'' G 4 H5'' G 4 1.845 6.418 8.603 37 H4' G 4 H4' G 4 0.432 6.926 6.365 38 H3' G 4 H3' G 4 0.864 4.274 7.748 39 H2' G 4 H2'' G 4 -0.303 3.175 6.018 40 HO2' G 4 H2' G 4 -2.090 4.337 5.621 41 H1' G 4 H1' G 4 0.715 4.603 3.905 42 H8 G 4 H8 G 4 3.562 4.047 6.333 43 H1 G 4 H1 G 4 2.300 -0.989 2.565 44 H21 G 4 H21 G 4 0.355 -0.704 1.527 45 H22 G 4 H22 G 4 -0.626 0.732 1.765 46 H5' A 5 H5' A 5 -3.657 3.990 8.938 47 H5'' A 5 H5'' A 5 -3.308 2.937 10.324 48 H4' A 5 H4' A 5 -4.433 2.003 8.062 49 H3' A 5 H3' A 5 -2.455 0.619 9.890 50 H2' A 5 H2'' A 5 -2.325 -1.199 8.406 51 HO2' A 5 H2' A 5 -4.345 -0.335 6.676 52 H1' A 5 H1' A 5 -2.433 0.218 6.044 53 H8 A 5 H8 A 5 -0.138 2.224 8.211 54 H61 A 5 H61 A 5 4.318 -1.832 6.780 55 H62 A 5 H62 A 5 3.960 -0.280 7.506 56 H2 A 5 H2 A 5 0.397 -3.528 5.415 57 H5' C 6 H5' C 6 -4.900 -1.861 9.078 58 H5'' C 6 H5'' C 6 -5.680 -3.108 10.073 59 H4' C 6 H4' C 6 -4.154 -4.232 8.607 60 H3' C 6 H3' C 6 -3.148 -4.008 11.439 61 H2' C 6 H2'' C 6 -1.134 -5.053 10.838 62 HO2' C 6 H2' C 6 -0.969 -6.470 9.215 63 H1' C 6 H1' C 6 -0.847 -3.945 8.317 64 H41 C 6 H41 C 6 2.889 -0.334 12.023 65 H42 C 6 H42 C 6 1.495 0.564 12.578 66 H5 C 6 H5 C 6 -0.768 -0.010 11.977 67 H6 C 6 H6 C 6 -2.180 -1.569 10.717 68 H5' U 7 H5' U 7 -2.445 -8.091 11.912 69 H5'' U 7 H5'' U 7 -2.365 -8.071 13.682 70 H4' U 7 H4' U 7 -0.220 -7.615 11.938 71 H3' U 7 H3' U 7 -0.643 -7.016 14.870 72 H2' U 7 H2'' U 7 1.246 -5.611 14.916 73 HO2' U 7 H2' U 7 2.703 -6.929 13.788 74 H1' U 7 H1' U 7 0.865 -4.355 12.522 75 H3 U 7 H3 U 7 -0.193 -1.545 16.059 76 H5 U 7 H5 U 7 -3.785 -3.373 14.820 77 H6 U 7 H6 U 7 -2.467 -4.879 13.446 78 H5' G 8 H5' G 8 4.946 -7.730 15.621 79 H5'' G 8 H5'' G 8 3.701 -7.993 16.852 80 H4' G 8 H4' G 8 4.651 -5.434 15.584 81 H3' G 8 H3' G 8 3.956 -6.347 18.390 82 H2' G 8 H2'' G 8 3.217 -4.214 18.937 83 HO2' G 8 H2' G 8 4.692 -2.766 18.374 84 H1' G 8 H1' G 8 2.148 -3.450 16.512 85 H8 G 8 H8 G 8 1.404 -6.977 17.896 86 H1 G 8 H1 G 8 -2.906 -2.483 19.441 87 H21 G 8 H21 G 8 -2.200 -0.488 18.768 88 H22 G 8 H22 G 8 -0.675 -0.262 17.941 89 H5' U 9 H5' U 9 9.849 -5.247 18.612 90 H5'' U 9 H5'' U 9 8.358 -5.321 19.562 91 H4' U 9 H4' U 9 8.894 -3.274 17.383 92 H3' U 9 H3' U 9 10.220 -3.200 19.773 93 H2' U 9 H2'' U 9 8.369 -3.157 21.208 94 HO2' U 9 H2' U 9 8.893 -1.263 21.989 95 H1' U 9 H1' U 9 6.814 -1.323 19.404 96 H3 U 9 H3 U 9 3.732 -1.983 22.734 97 H5 U 9 H5 U 9 4.335 -5.797 21.042 98 H6 U 9 H6 U 9 6.136 -4.852 19.717 99 H5' A 10 H5' A 10 11.055 -0.850 14.647 100 H5'' A 10 H5'' A 10 9.675 -1.876 14.219 101 H4' A 10 H4' A 10 12.376 -2.677 15.311 102 H3' A 10 H3' A 10 10.716 -3.445 12.916 103 H2' A 10 H2'' A 10 11.573 -5.629 12.992 104 HO2' A 10 H2' A 10 13.431 -6.100 14.361 105 H1' A 10 H1' A 10 11.666 -5.904 15.740 106 H8 A 10 H8 A 10 8.369 -4.299 15.233 107 H61 A 10 H61 A 10 6.172 -9.823 13.504 108 H62 A 10 H62 A 10 5.756 -8.192 13.978 109 H2 A 10 H2 A 10 10.649 -10.068 13.584 110 H5' 6IA 11 H5' 6IA 11 14.228 -4.280 10.648 111 H5'' 6IA 11 H5'' 6IA 11 13.645 -4.023 8.991 112 H4' 6IA 11 H4' 6IA 11 13.823 -6.464 9.923 113 H3' 6IA 11 H3' 6IA 11 11.508 -5.315 8.361 114 H2' 6IA 11 H2'' 6IA 11 10.296 -7.320 8.621 115 HO2' 6IA 11 H2' 6IA 11 11.400 -9.118 8.488 116 H1' 6IA 11 H1' 6IA 11 10.883 -7.793 11.235 117 H8 6IA 11 H8 6IA 11 10.636 -4.034 10.699 118 HN6 6IA 11 H61 6IA 11 4.533 -4.667 11.630 119 H2 6IA 11 H2 6IA 11 6.329 -8.745 11.343 120 H121 6IA 11 H101 6IA 11 6.432 -2.970 10.467 121 H122 6IA 11 H102 6IA 11 6.648 -2.962 12.230 122 H132 6IA 11 H11 6IA 11 4.283 -1.937 10.650 123 H151 6IA 11 H143 6IA 11 3.699 -0.495 14.149 124 H152 6IA 11 H141 6IA 11 5.452 -0.769 14.011 125 H153 6IA 11 H142 6IA 11 4.582 0.095 12.721 126 H161 6IA 11 H131 6IA 11 3.056 -3.818 12.893 127 H162 6IA 11 H132 6IA 11 4.547 -3.848 13.866 128 H163 6IA 11 H133 6IA 11 3.157 -2.874 14.400 129 H5' A 12 H5' A 12 12.040 -8.532 5.152 130 H5'' A 12 H5'' A 12 10.927 -7.747 4.016 131 H4' A 12 H4' A 12 10.231 -9.828 5.670 132 H3' A 12 H3' A 12 8.538 -7.620 4.491 133 H2' A 12 H2'' A 12 6.684 -8.375 5.760 134 HO2' A 12 H2' A 12 7.526 -10.461 7.127 135 H1' A 12 H1' A 12 7.998 -8.771 8.102 136 H8 A 12 H8 A 12 9.847 -5.837 6.792 137 H61 A 12 H61 A 12 5.034 -2.277 8.370 138 H62 A 12 H62 A 12 6.704 -2.295 7.850 139 H2 A 12 H2 A 12 3.753 -6.566 8.670 140 HN1 PSU 13 H1 PSU 13 6.861 -5.276 4.410 141 HN3 PSU 13 H3 PSU 13 3.033 -4.449 5.416 142 H6 PSU 13 H6 PSU 13 6.225 -7.427 3.666 143 H1' PSU 13 H1' PSU 13 3.239 -9.089 4.401 144 H2' PSU 13 H2'' PSU 13 2.443 -7.572 2.231 145 HO2' PSU 13 H2' PSU 13 1.966 -10.013 3.250 146 H3' PSU 13 H3' PSU 13 4.380 -7.895 0.918 147 H4' PSU 13 H4' PSU 13 4.477 -10.774 1.843 148 H5' PSU 13 H5' PSU 13 6.714 -10.747 1.345 149 H5'' PSU 13 H5'' PSU 13 6.224 -9.448 0.240 150 H5' C 14 H5' C 14 1.089 -9.083 -2.303 151 H5'' C 14 H5'' C 14 1.457 -7.690 -3.343 152 H4' C 14 H4' C 14 -0.715 -7.807 -1.700 153 H3' C 14 H3' C 14 0.892 -5.379 -2.538 154 H2' C 14 H2'' C 14 -0.484 -4.054 -1.139 155 HO2' C 14 H2' C 14 -2.541 -4.503 -1.078 156 H1' C 14 H1' C 14 -0.731 -5.864 0.917 157 H41 C 14 H41 C 14 3.770 -1.874 2.962 158 H42 C 14 H42 C 14 4.938 -3.111 2.584 159 H5 C 14 H5 C 14 4.403 -5.116 1.368 160 H6 C 14 H6 C 14 2.620 -6.372 0.246 161 H5' C 15 H5' C 15 -2.130 -3.975 -5.959 162 H5'' C 15 H5'' C 15 -0.729 -3.237 -6.763 163 H4' C 15 H4' C 15 -2.622 -1.799 -5.432 164 H3' C 15 H3' C 15 0.323 -1.203 -5.788 165 H2' C 15 H2'' C 15 0.088 0.681 -4.376 166 HO2' C 15 H2' C 15 -1.749 1.622 -5.213 167 H1' C 15 H1' C 15 -1.651 -0.424 -2.570 168 H41 C 15 H41 C 15 3.949 -1.107 0.328 169 H42 C 15 H42 C 15 3.959 -2.768 -0.192 170 H5 C 15 H5 C 15 2.364 -3.675 -1.750 171 H6 C 15 H6 C 15 0.411 -3.177 -3.147 172 H5' C 16 H5' C 16 -0.777 2.247 -8.398 173 H5'' C 16 H5'' C 16 0.343 2.038 -9.758 174 H4' C 16 H4' C 16 0.821 4.064 -8.379 175 H3' C 16 H3' C 16 2.910 1.882 -8.534 176 H2' C 16 H2'' C 16 4.337 3.202 -7.194 177 HO2' C 16 H2' C 16 2.598 5.437 -7.369 178 H1' C 16 H1' C 16 2.379 4.240 -5.532 179 H41 C 16 H41 C 16 4.969 -0.522 -2.181 180 H42 C 16 H42 C 16 3.881 -1.652 -2.940 181 H5 C 16 H5 C 16 2.393 -1.044 -4.735 182 H6 C 16 H6 C 16 1.631 0.780 -6.184 183 H5' C 17 H5' C 17 5.371 4.470 -10.498 184 H5'' C 17 H5'' C 17 5.940 3.760 -12.022 185 H4' C 17 H4' C 17 7.821 4.015 -10.520 186 H3' C 17 H3' C 17 6.899 1.152 -10.858 187 HO3' C 17 H3T C 17 8.253 2.895 -12.318 188 H2' C 17 H2'' C 17 8.652 0.451 -9.468 189 HO2' C 17 H2' C 17 10.110 2.105 -10.630 190 H1' C 17 H1' C 17 8.540 2.587 -7.697 191 H41 C 17 H41 C 17 5.419 -2.202 -4.835 192 H42 C 17 H42 C 17 3.959 -1.758 -5.692 193 H5 C 17 H5 C 17 3.884 -0.048 -7.386 194 H6 C 17 H6 C 17 5.196 1.610 -8.627 Start of MODEL 6 1 H5' G 1 H5' G 1 14.351 -4.500 0.891 2 H5'' G 1 H5'' G 1 13.457 -4.768 2.398 3 H4' G 1 H4' G 1 13.402 -2.397 1.314 4 H3' G 1 H3' G 1 10.999 -3.894 2.392 5 H2' G 1 H2'' G 1 9.594 -2.166 1.688 6 HO2' G 1 H2' G 1 11.943 -0.654 1.930 7 H1' G 1 H1' G 1 10.950 -1.414 -0.599 8 H8 G 1 H8 G 1 9.574 -4.895 0.632 9 H1 G 1 H1 G 1 6.912 -2.368 -4.630 10 H21 G 1 H21 G 1 7.913 -0.454 -5.127 11 H22 G 1 H22 G 1 9.220 0.209 -4.192 12 HO5' G 1 H5T G 1 12.068 -5.999 1.384 13 H5' G 2 H5' G 2 12.546 0.551 4.044 14 H5'' G 2 H5'' G 2 11.361 1.168 5.209 15 H4' G 2 H4' G 2 12.103 2.730 3.290 16 H3' G 2 H3' G 2 9.208 2.241 4.004 17 H2' G 2 H2'' G 2 8.587 3.752 2.261 18 HO2' G 2 H2' G 2 10.810 4.957 2.869 19 H1' G 2 H1' G 2 10.220 2.818 0.377 20 H8 G 2 H8 G 2 9.146 -0.122 2.571 21 H1 G 2 H1 G 2 5.351 1.234 -2.422 22 H21 G 2 H21 G 2 5.912 3.198 -3.292 23 H22 G 2 H22 G 2 7.216 4.172 -2.649 24 H5' G 3 H5' G 3 9.393 6.441 4.403 25 H5'' G 3 H5'' G 3 8.500 7.001 5.831 26 H4' G 3 H4' G 3 7.500 7.911 3.796 27 H3' G 3 H3' G 3 5.862 5.851 5.283 28 H2' G 3 H2'' G 3 4.143 6.086 3.653 29 HO2' G 3 H2' G 3 3.903 8.165 3.169 30 H1' G 3 H1' G 3 5.711 6.055 1.475 31 H8 G 3 H8 G 3 7.141 3.718 4.188 32 H1 G 3 H1 G 3 3.199 1.134 -0.164 33 H21 G 3 H21 G 3 2.209 2.733 -1.346 34 H22 G 3 H22 G 3 2.523 4.435 -1.062 35 H5' G 4 H5' G 4 2.638 8.939 6.635 36 H5'' G 4 H5'' G 4 2.139 7.862 7.957 37 H4' G 4 H4' G 4 0.653 8.174 5.742 38 H3' G 4 H3' G 4 1.080 5.649 7.347 39 H2' G 4 H2'' G 4 -0.226 4.447 5.785 40 HO2' G 4 H2' G 4 -1.940 5.924 5.568 41 H1' G 4 H1' G 4 0.754 5.618 3.512 42 H8 G 4 H8 G 4 3.693 5.196 5.853 43 H1 G 4 H1 G 4 2.067 -0.142 2.688 44 H21 G 4 H21 G 4 0.084 0.112 1.720 45 H22 G 4 H22 G 4 -0.834 1.602 1.854 46 H5' A 5 H5' A 5 -3.334 5.662 9.026 47 H5'' A 5 H5'' A 5 -2.841 4.653 10.402 48 H4' A 5 H4' A 5 -4.242 3.683 8.286 49 H3' A 5 H3' A 5 -2.210 2.294 10.039 50 H2' A 5 H2'' A 5 -2.268 0.398 8.645 51 HO2' A 5 H2' A 5 -4.142 0.897 6.830 52 H1' A 5 H1' A 5 -2.453 1.688 6.223 53 H8 A 5 H8 A 5 0.017 3.743 8.123 54 H61 A 5 H61 A 5 4.280 -0.487 6.612 55 H62 A 5 H62 A 5 4.006 1.112 7.268 56 H2 A 5 H2 A 5 0.238 -2.175 5.649 57 H5' C 6 H5' C 6 -4.365 -0.743 9.247 58 H5'' C 6 H5'' C 6 -4.596 -1.796 10.659 59 H4' C 6 H4' C 6 -3.112 -2.748 8.841 60 H3' C 6 H3' C 6 -2.151 -2.428 11.675 61 H2' C 6 H2'' C 6 -0.015 -3.198 11.088 62 HO2' C 6 H2' C 6 0.349 -4.570 9.487 63 H1' C 6 H1' C 6 0.195 -1.999 8.626 64 H41 C 6 H41 C 6 3.177 2.037 12.567 65 H42 C 6 H42 C 6 1.646 2.776 12.977 66 H5 C 6 H5 C 6 -0.475 1.932 12.205 67 H6 C 6 H6 C 6 -1.585 0.198 10.873 68 H5' U 7 H5' U 7 -1.024 -6.292 12.586 69 H5'' U 7 H5'' U 7 -1.125 -5.989 14.332 70 H4' U 7 H4' U 7 1.092 -5.454 12.709 71 H3' U 7 H3' U 7 0.285 -4.450 15.446 72 H2' U 7 H2'' U 7 1.916 -2.757 15.353 73 HO2' U 7 H2' U 7 3.018 -3.931 12.998 74 H1' U 7 H1' U 7 1.622 -2.055 12.726 75 H3 U 7 H3 U 7 -0.165 1.367 15.208 76 H5 U 7 H5 U 7 -3.266 -1.455 14.769 77 H6 U 7 H6 U 7 -1.641 -2.998 13.837 78 H5' G 8 H5' G 8 5.328 -3.366 17.043 79 H5'' G 8 H5'' G 8 4.134 -4.128 18.110 80 H4' G 8 H4' G 8 4.054 -1.453 16.736 81 H3' G 8 H3' G 8 3.286 -2.506 19.473 82 H2' G 8 H2'' G 8 1.625 -0.903 19.661 83 HO2' G 8 H2' G 8 2.032 1.073 19.059 84 H1' G 8 H1' G 8 0.847 -0.793 17.025 85 H8 G 8 H8 G 8 1.420 -4.121 18.942 86 H1 G 8 H1 G 8 -4.685 -2.200 18.498 87 H21 G 8 H21 G 8 -4.787 -0.208 17.523 88 H22 G 8 H22 G 8 -3.359 0.647 16.982 89 H5' U 9 H5' U 9 7.712 -0.158 16.938 90 H5'' U 9 H5'' U 9 6.814 -1.394 17.840 91 H4' U 9 H4' U 9 9.150 0.233 18.891 92 H3' U 9 H3' U 9 9.437 -1.947 17.246 93 H2' U 9 H2'' U 9 8.276 -3.505 18.579 94 HO2' U 9 H2' U 9 9.956 -4.484 20.042 95 H1' U 9 H1' U 9 9.478 -2.346 21.092 96 H3 U 9 H3 U 9 6.858 -4.729 23.843 97 H5 U 9 H5 U 9 4.411 -4.286 20.439 98 H6 U 9 H6 U 9 6.190 -2.996 19.409 99 H5' A 10 H5' A 10 11.763 0.397 14.937 100 H5'' A 10 H5'' A 10 10.175 -0.354 14.701 101 H4' A 10 H4' A 10 12.730 -1.633 15.693 102 H3' A 10 H3' A 10 10.889 -2.099 13.348 103 H2' A 10 H2'' A 10 11.333 -4.403 13.457 104 HO2' A 10 H2' A 10 13.132 -4.927 15.181 105 H1' A 10 H1' A 10 11.455 -4.633 16.212 106 H8 A 10 H8 A 10 8.521 -2.435 15.156 107 H61 A 10 H61 A 10 5.288 -7.692 14.663 108 H62 A 10 H62 A 10 5.207 -5.945 14.653 109 H2 A 10 H2 A 10 9.594 -8.761 15.310 110 H5' 6IA 11 H5' 6IA 11 14.275 -3.448 10.888 111 H5'' 6IA 11 H5'' 6IA 11 13.556 -3.204 9.284 112 H4' 6IA 11 H4' 6IA 11 13.602 -5.612 10.359 113 H3' 6IA 11 H3' 6IA 11 11.302 -4.336 8.871 114 H2' 6IA 11 H2'' 6IA 11 9.942 -6.217 9.315 115 HO2' 6IA 11 H2' 6IA 11 11.292 -7.974 10.625 116 H1' 6IA 11 H1' 6IA 11 10.624 -6.563 11.922 117 H8 6IA 11 H8 6IA 11 10.744 -2.841 11.143 118 HN6 6IA 11 H61 6IA 11 4.636 -2.752 12.250 119 H2 6IA 11 H2 6IA 11 5.989 -6.999 12.277 120 H121 6IA 11 H101 6IA 11 6.661 -1.399 10.862 121 H122 6IA 11 H102 6IA 11 6.914 -1.202 12.610 122 H132 6IA 11 H11 6IA 11 4.521 -0.259 10.969 123 H151 6IA 11 H143 6IA 11 4.556 2.011 14.095 124 H152 6IA 11 H141 6IA 11 6.225 1.605 13.630 125 H153 6IA 11 H142 6IA 11 5.078 2.196 12.404 126 H161 6IA 11 H131 6IA 11 3.589 -1.505 13.722 127 H162 6IA 11 H132 6IA 11 5.079 -1.199 14.648 128 H163 6IA 11 H133 6IA 11 3.670 -0.129 14.849 129 H5' A 12 H5' A 12 11.674 -7.767 5.895 130 H5'' A 12 H5'' A 12 10.638 -7.103 4.618 131 H4' A 12 H4' A 12 9.769 -8.960 6.379 132 H3' A 12 H3' A 12 8.236 -6.693 5.100 133 H2' A 12 H2'' A 12 6.337 -7.238 6.414 134 HO2' A 12 H2' A 12 7.141 -9.339 7.858 135 H1' A 12 H1' A 12 7.628 -7.599 8.769 136 H8 A 12 H8 A 12 9.689 -4.920 7.208 137 H61 A 12 H61 A 12 5.281 -0.864 8.774 138 H62 A 12 H62 A 12 6.917 -1.059 8.186 139 H2 A 12 H2 A 12 3.650 -4.998 9.379 140 HN1 PSU 13 H1 PSU 13 6.645 -4.278 4.644 141 HN3 PSU 13 H3 PSU 13 2.904 -3.174 5.707 142 H6 PSU 13 H6 PSU 13 5.904 -6.485 4.245 143 H1' PSU 13 H1' PSU 13 2.906 -7.913 5.337 144 H2' PSU 13 H2'' PSU 13 2.033 -6.683 3.030 145 HO2' PSU 13 H2' PSU 13 1.633 -9.038 4.324 146 H3' PSU 13 H3' PSU 13 3.931 -7.197 1.707 147 H4' PSU 13 H4' PSU 13 3.955 -9.959 2.948 148 H5' PSU 13 H5' PSU 13 6.197 -10.063 2.434 149 H5'' PSU 13 H5'' PSU 13 5.662 -8.999 1.119 150 H5' C 14 H5' C 14 0.462 -8.659 -1.170 151 H5'' C 14 H5'' C 14 0.779 -7.447 -2.429 152 H4' C 14 H4' C 14 -1.294 -7.252 -0.707 153 H3' C 14 H3' C 14 0.376 -5.001 -1.866 154 H2' C 14 H2'' C 14 -0.904 -3.474 -0.585 155 HO2' C 14 H2' C 14 -2.881 -5.021 -1.143 156 H1' C 14 H1' C 14 -1.154 -5.035 1.669 157 H41 C 14 H41 C 14 3.558 -1.005 3.088 158 H42 C 14 H42 C 14 4.679 -2.303 2.774 159 H5 C 14 H5 C 14 4.033 -4.405 1.798 160 H6 C 14 H6 C 14 2.164 -5.720 0.910 161 H5' C 15 H5' C 15 -2.721 -3.933 -5.371 162 H5'' C 15 H5'' C 15 -1.323 -3.373 -6.311 163 H4' C 15 H4' C 15 -3.109 -1.681 -5.154 164 H3' C 15 H3' C 15 -0.152 -1.281 -5.643 165 H2' C 15 H2'' C 15 -0.246 0.771 -4.481 166 HO2' C 15 H2' C 15 -2.298 1.744 -3.979 167 H1' C 15 H1' C 15 -2.034 0.018 -2.531 168 H41 C 15 H41 C 15 3.568 -0.484 0.408 169 H42 C 15 H42 C 15 3.520 -2.198 0.108 170 H5 C 15 H5 C 15 1.879 -3.248 -1.304 171 H6 C 15 H6 C 15 -0.075 -2.874 -2.737 172 H5' C 16 H5' C 16 -1.150 2.037 -7.887 173 H5'' C 16 H5'' C 16 -0.351 1.954 -9.471 174 H4' C 16 H4' C 16 0.589 3.801 -8.227 175 H3' C 16 H3' C 16 2.400 1.394 -8.468 176 H2' C 16 H2'' C 16 4.077 2.565 -7.294 177 HO2' C 16 H2' C 16 2.605 4.826 -8.136 178 H1' C 16 H1' C 16 2.399 3.856 -5.505 179 H41 C 16 H41 C 16 4.519 -1.154 -2.181 180 H42 C 16 H42 C 16 3.411 -2.207 -3.019 181 H5 C 16 H5 C 16 2.017 -1.474 -4.840 182 H6 C 16 H6 C 16 1.386 0.431 -6.249 183 H5' C 17 H5' C 17 4.916 3.229 -11.855 184 H5'' C 17 H5'' C 17 5.239 1.655 -12.611 185 H4' C 17 H4' C 17 7.123 2.906 -11.229 186 H3' C 17 H3' C 17 6.504 -0.055 -11.109 187 HO3' C 17 H3T C 17 8.711 1.438 -12.147 188 H2' C 17 H2'' C 17 8.239 -0.330 -9.557 189 HO2' C 17 H2' C 17 9.206 2.280 -9.648 190 H1' C 17 H1' C 17 7.823 2.037 -8.174 191 H41 C 17 H41 C 17 5.091 -2.614 -4.735 192 H42 C 17 H42 C 17 3.575 -2.281 -5.548 193 H5 C 17 H5 C 17 3.365 -0.747 -7.392 194 H6 C 17 H6 C 17 4.565 0.808 -8.860 Start of MODEL 7 1 H5' G 1 H5' G 1 15.549 -3.694 0.151 2 H5'' G 1 H5'' G 1 14.729 -3.944 -1.400 3 H4' G 1 H4' G 1 14.917 -1.158 -0.284 4 H3' G 1 H3' G 1 13.080 -3.343 0.721 5 H2' G 1 H2'' G 1 11.252 -1.895 0.636 6 HO2' G 1 H2' G 1 13.140 0.250 0.521 7 H1' G 1 H1' G 1 11.974 -0.393 -1.570 8 H8 G 1 H8 G 1 11.536 -4.238 -0.888 9 H1 G 1 H1 G 1 7.864 -1.663 -5.475 10 H21 G 1 H21 G 1 8.368 0.478 -5.717 11 H22 G 1 H22 G 1 9.587 1.286 -4.780 12 HO5' G 1 H5T G 1 16.670 -1.927 -1.131 13 H5' G 2 H5' G 2 13.716 0.947 2.417 14 H5'' G 2 H5'' G 2 13.373 1.027 4.159 15 H4' G 2 H4' G 2 12.439 3.014 3.075 16 H3' G 2 H3' G 2 10.468 0.976 4.087 17 H2' G 2 H2'' G 2 8.732 2.171 3.179 18 HO2' G 2 H2' G 2 10.119 4.470 2.472 19 H1' G 2 H1' G 2 9.862 3.192 0.945 20 H8 G 2 H8 G 2 10.061 -0.559 2.026 21 H1 G 2 H1 G 2 5.844 0.964 -2.562 22 H21 G 2 H21 G 2 5.833 3.160 -2.883 23 H22 G 2 H22 G 2 6.856 4.250 -1.977 24 H5' G 3 H5' G 3 9.844 5.750 4.947 25 H5'' G 3 H5'' G 3 8.665 5.823 6.268 26 H4' G 3 H4' G 3 8.161 7.212 4.155 27 H3' G 3 H3' G 3 6.197 5.340 5.469 28 H2' G 3 H2'' G 3 4.604 5.775 3.767 29 HO2' G 3 H2' G 3 4.934 8.067 3.734 30 H1' G 3 H1' G 3 6.243 5.670 1.634 31 H8 G 3 H8 G 3 7.257 3.196 4.397 32 H1 G 3 H1 G 3 3.256 1.017 -0.120 33 H21 G 3 H21 G 3 2.572 2.686 -1.414 34 H22 G 3 H22 G 3 3.108 4.341 -1.163 35 H5' G 4 H5' G 4 3.272 8.751 6.797 36 H5'' G 4 H5'' G 4 2.641 7.713 8.093 37 H4' G 4 H4' G 4 1.255 8.190 5.821 38 H3' G 4 H3' G 4 1.348 5.683 7.497 39 H2' G 4 H2'' G 4 0.087 4.512 5.890 40 HO2' G 4 H2' G 4 -0.738 6.036 4.036 41 H1' G 4 H1' G 4 1.176 5.627 3.617 42 H8 G 4 H8 G 4 4.008 4.908 6.024 43 H1 G 4 H1 G 4 1.974 -0.226 2.759 44 H21 G 4 H21 G 4 0.064 0.230 1.717 45 H22 G 4 H22 G 4 -0.703 1.807 1.829 46 H5' A 5 H5' A 5 -3.133 6.036 8.975 47 H5'' A 5 H5'' A 5 -2.698 5.086 10.412 48 H4' A 5 H4' A 5 -4.091 4.071 8.279 49 H3' A 5 H3' A 5 -2.254 2.690 10.242 50 H2' A 5 H2'' A 5 -2.322 0.719 8.968 51 HO2' A 5 H2' A 5 -4.766 1.798 8.098 52 H1' A 5 H1' A 5 -2.388 1.855 6.450 53 H8 A 5 H8 A 5 0.220 3.821 8.252 54 H61 A 5 H61 A 5 4.124 -0.857 7.126 55 H62 A 5 H62 A 5 3.978 0.804 7.668 56 H2 A 5 H2 A 5 -0.033 -2.248 6.180 57 H5' C 6 H5' C 6 -4.994 -0.166 9.966 58 H5'' C 6 H5'' C 6 -5.170 -1.074 11.483 59 H4' C 6 H4' C 6 -3.918 -2.247 9.573 60 H3' C 6 H3' C 6 -2.818 -1.940 12.373 61 H2' C 6 H2'' C 6 -0.763 -2.863 11.741 62 HO2' C 6 H2' C 6 -0.533 -4.324 10.170 63 H1' C 6 H1' C 6 -0.612 -1.868 9.163 64 H41 C 6 H41 C 6 3.144 1.955 12.621 65 H42 C 6 H42 C 6 1.756 2.920 13.064 66 H5 C 6 H5 C 6 -0.506 2.324 12.482 67 H6 C 6 H6 C 6 -1.922 0.675 11.349 68 H5' U 7 H5' U 7 -2.815 -6.486 12.931 69 H5'' U 7 H5'' U 7 -2.649 -6.415 14.692 70 H4' U 7 H4' U 7 -0.540 -6.789 13.000 71 H3' U 7 H3' U 7 -0.659 -5.478 15.719 72 H2' U 7 H2'' U 7 1.527 -4.644 15.485 73 HO2' U 7 H2' U 7 2.172 -5.843 13.075 74 H1' U 7 H1' U 7 1.427 -3.909 12.864 75 H3 U 7 H3 U 7 1.332 -0.111 15.461 76 H5 U 7 H5 U 7 -2.690 -1.277 14.971 77 H6 U 7 H6 U 7 -1.900 -3.356 14.000 78 H5' G 8 H5' G 8 4.268 -6.664 17.330 79 H5'' G 8 H5'' G 8 2.800 -6.584 18.320 80 H4' G 8 H4' G 8 4.108 -4.417 16.663 81 H3' G 8 H3' G 8 3.276 -4.719 19.557 82 H2' G 8 H2'' G 8 2.646 -2.478 19.653 83 HO2' G 8 H2' G 8 3.753 -0.969 18.644 84 H1' G 8 H1' G 8 1.668 -2.152 17.122 85 H8 G 8 H8 G 8 0.783 -5.319 19.160 86 H1 G 8 H1 G 8 -3.512 -0.564 19.472 87 H21 G 8 H21 G 8 -2.741 1.229 18.411 88 H22 G 8 H22 G 8 -1.177 1.256 17.629 89 H5' U 9 H5' U 9 9.156 -3.646 19.766 90 H5'' U 9 H5'' U 9 7.659 -3.655 20.705 91 H4' U 9 H4' U 9 8.121 -1.998 18.203 92 H3' U 9 H3' U 9 9.293 -1.388 20.603 93 H2' U 9 H2'' U 9 7.350 -1.205 21.900 94 HO2' U 9 H2' U 9 8.324 1.122 21.011 95 H1' U 9 H1' U 9 5.820 0.119 19.669 96 H3 U 9 H3 U 9 2.401 -0.045 22.688 97 H5 U 9 H5 U 9 3.597 -4.064 22.251 98 H6 U 9 H6 U 9 5.440 -3.296 20.871 99 H5' A 10 H5' A 10 11.254 -0.850 16.107 100 H5'' A 10 H5'' A 10 9.654 -1.605 15.966 101 H4' A 10 H4' A 10 12.274 -2.961 16.682 102 H3' A 10 H3' A 10 10.463 -3.050 14.267 103 H2' A 10 H2'' A 10 10.822 -5.359 14.051 104 HO2' A 10 H2' A 10 12.557 -6.418 15.090 105 H1' A 10 H1' A 10 10.870 -6.023 16.723 106 H8 A 10 H8 A 10 8.049 -3.618 16.539 107 H61 A 10 H61 A 10 4.544 -8.238 14.369 108 H62 A 10 H62 A 10 4.547 -6.615 15.022 109 H2 A 10 H2 A 10 8.829 -9.552 14.220 110 H5' 6IA 11 H5' 6IA 11 13.713 -4.772 11.833 111 H5'' 6IA 11 H5'' 6IA 11 13.028 -4.360 10.251 112 H4' 6IA 11 H4' 6IA 11 12.803 -6.829 11.305 113 H3' 6IA 11 H3' 6IA 11 10.858 -5.309 9.577 114 H2' 6IA 11 H2'' 6IA 11 9.187 -6.926 9.927 115 HO2' 6IA 11 H2' 6IA 11 9.743 -8.964 10.025 116 H1' 6IA 11 H1' 6IA 11 9.572 -7.366 12.581 117 H8 6IA 11 H8 6IA 11 10.335 -3.709 12.025 118 HN6 6IA 11 H61 6IA 11 4.228 -2.653 12.250 119 H2 6IA 11 H2 6IA 11 4.870 -7.062 12.288 120 H121 6IA 11 H101 6IA 11 6.690 -1.705 11.207 121 H122 6IA 11 H102 6IA 11 6.578 -1.415 12.957 122 H132 6IA 11 H11 6IA 11 4.689 -0.341 10.796 123 H151 6IA 11 H143 6IA 11 6.395 1.752 12.869 124 H152 6IA 11 H141 6IA 11 4.994 2.340 11.941 125 H153 6IA 11 H142 6IA 11 4.928 2.294 13.719 126 H161 6IA 11 H131 6IA 11 3.433 -1.127 13.633 127 H162 6IA 11 H132 6IA 11 4.631 -0.427 14.766 128 H163 6IA 11 H133 6IA 11 3.218 0.532 14.270 129 H5' A 12 H5' A 12 10.795 -8.930 6.716 130 H5'' A 12 H5'' A 12 9.902 -8.088 5.437 131 H4' A 12 H4' A 12 8.755 -9.760 7.316 132 H3' A 12 H3' A 12 7.572 -7.519 5.679 133 H2' A 12 H2'' A 12 5.598 -7.583 6.965 134 HO2' A 12 H2' A 12 4.857 -9.453 7.589 135 H1' A 12 H1' A 12 6.715 -7.989 9.425 136 H8 A 12 H8 A 12 9.117 -5.610 7.860 137 H61 A 12 H61 A 12 5.107 -1.074 9.148 138 H62 A 12 H62 A 12 6.734 -1.456 8.634 139 H2 A 12 H2 A 12 3.024 -4.996 9.781 140 HN1 PSU 13 H1 PSU 13 6.387 -4.815 5.082 141 HN3 PSU 13 H3 PSU 13 2.840 -3.228 6.183 142 H6 PSU 13 H6 PSU 13 5.344 -6.896 4.656 143 H1' PSU 13 H1' PSU 13 2.128 -7.865 5.715 144 H2' PSU 13 H2'' PSU 13 1.582 -6.570 3.333 145 HO2' PSU 13 H2' PSU 13 -0.077 -7.898 3.408 146 H3' PSU 13 H3' PSU 13 3.353 -7.477 2.069 147 H4' PSU 13 H4' PSU 13 2.958 -10.127 3.468 148 H5' PSU 13 H5' PSU 13 5.099 -10.622 2.870 149 H5'' PSU 13 H5'' PSU 13 4.935 -9.297 1.704 150 H5' C 14 H5' C 14 -0.130 -8.585 -1.184 151 H5'' C 14 H5'' C 14 0.537 -7.327 -2.249 152 H4' C 14 H4' C 14 -1.779 -7.063 -0.765 153 H3' C 14 H3' C 14 0.127 -4.944 -1.801 154 H2' C 14 H2'' C 14 -1.068 -3.310 -0.588 155 HO2' C 14 H2' C 14 -3.169 -3.443 -0.377 156 H1' C 14 H1' C 14 -1.637 -4.821 1.639 157 H41 C 14 H41 C 14 3.383 -1.193 3.210 158 H42 C 14 H42 C 14 4.405 -2.573 2.923 159 H5 C 14 H5 C 14 3.616 -4.630 1.958 160 H6 C 14 H6 C 14 1.665 -5.808 1.054 161 H5' C 15 H5' C 15 -2.455 -3.705 -5.728 162 H5'' C 15 H5'' C 15 -0.862 -3.210 -6.341 163 H4' C 15 H4' C 15 -2.820 -1.467 -5.459 164 H3' C 15 H3' C 15 0.186 -1.146 -5.622 165 H2' C 15 H2'' C 15 0.050 0.885 -4.441 166 HO2' C 15 H2' C 15 -2.765 0.823 -4.937 167 H1' C 15 H1' C 15 -1.933 0.192 -2.676 168 H41 C 15 H41 C 15 3.581 -0.644 0.441 169 H42 C 15 H42 C 15 3.466 -2.346 0.100 170 H5 C 15 H5 C 15 1.799 -3.291 -1.356 171 H6 C 15 H6 C 15 -0.121 -2.799 -2.799 172 H5' C 16 H5' C 16 -0.926 2.112 -7.505 173 H5'' C 16 H5'' C 16 -0.292 2.511 -9.117 174 H4' C 16 H4' C 16 0.533 4.181 -7.617 175 H3' C 16 H3' C 16 2.592 2.110 -8.386 176 H2' C 16 H2'' C 16 4.178 3.135 -6.986 177 HO2' C 16 H2' C 16 2.591 5.398 -6.448 178 H1' C 16 H1' C 16 2.455 3.919 -4.957 179 H41 C 16 H41 C 16 5.168 -1.388 -2.677 180 H42 C 16 H42 C 16 4.076 -2.370 -3.621 181 H5 C 16 H5 C 16 2.509 -1.452 -5.202 182 H6 C 16 H6 C 16 1.650 0.608 -6.217 183 H5' C 17 H5' C 17 4.635 4.454 -11.959 184 H5'' C 17 H5'' C 17 4.958 2.827 -12.597 185 H4' C 17 H4' C 17 6.827 4.400 -11.319 186 H3' C 17 H3' C 17 6.644 1.384 -11.517 187 HO3' C 17 H3T C 17 7.519 2.048 -13.347 188 H2' C 17 H2'' C 17 8.501 1.191 -10.106 189 HO2' C 17 H2' C 17 10.047 2.541 -10.682 190 H1' C 17 H1' C 17 7.890 3.322 -8.440 191 H41 C 17 H41 C 17 6.120 -1.990 -5.339 192 H42 C 17 H42 C 17 4.495 -1.752 -5.955 193 H5 C 17 H5 C 17 3.912 -0.070 -7.571 194 H6 C 17 H6 C 17 4.761 1.764 -8.958 Start of MODEL 8 1 H5' G 1 H5' G 1 14.405 -4.592 -1.100 2 H5'' G 1 H5'' G 1 15.730 -3.490 -1.519 3 H4' G 1 H4' G 1 14.767 -1.706 -0.190 4 H3' G 1 H3' G 1 12.834 -3.839 0.748 5 H2' G 1 H2'' G 1 11.062 -2.329 0.679 6 HO2' G 1 H2' G 1 12.668 -0.055 0.275 7 H1' G 1 H1' G 1 11.853 -0.802 -1.489 8 H8 G 1 H8 G 1 11.316 -4.656 -0.924 9 H1 G 1 H1 G 1 7.681 -1.849 -5.403 10 H21 G 1 H21 G 1 8.234 0.288 -5.577 11 H22 G 1 H22 G 1 9.476 1.037 -4.622 12 HO5' G 1 H5T G 1 16.635 -4.394 0.141 13 H5' G 2 H5' G 2 13.665 0.355 2.462 14 H5'' G 2 H5'' G 2 13.383 0.469 4.212 15 H4' G 2 H4' G 2 12.547 2.503 3.174 16 H3' G 2 H3' G 2 10.440 0.585 4.155 17 H2' G 2 H2'' G 2 8.788 1.911 3.274 18 HO2' G 2 H2' G 2 9.986 4.140 2.434 19 H1' G 2 H1' G 2 9.964 2.853 1.035 20 H8 G 2 H8 G 2 10.024 -0.903 2.095 21 H1 G 2 H1 G 2 5.761 0.801 -2.386 22 H21 G 2 H21 G 2 5.821 2.997 -2.692 23 H22 G 2 H22 G 2 6.900 4.045 -1.804 24 H5' G 3 H5' G 3 9.907 5.450 5.395 25 H5'' G 3 H5'' G 3 8.595 5.312 6.580 26 H4' G 3 H4' G 3 8.316 6.851 4.448 27 H3' G 3 H3' G 3 6.232 5.058 5.695 28 H2' G 3 H2'' G 3 4.730 5.531 3.923 29 HO2' G 3 H2' G 3 4.719 7.589 3.406 30 H1' G 3 H1' G 3 6.441 5.387 1.856 31 H8 G 3 H8 G 3 7.337 2.849 4.586 32 H1 G 3 H1 G 3 3.210 0.873 0.089 33 H21 G 3 H21 G 3 2.587 2.576 -1.185 34 H22 G 3 H22 G 3 3.193 4.206 -0.932 35 H5' G 4 H5' G 4 3.389 8.716 6.618 36 H5'' G 4 H5'' G 4 2.677 7.850 7.996 37 H4' G 4 H4' G 4 1.300 8.224 5.746 38 H3' G 4 H3' G 4 1.331 5.787 7.520 39 H2' G 4 H2'' G 4 0.010 4.593 5.981 40 HO2' G 4 H2' G 4 -1.198 5.638 4.364 41 H1' G 4 H1' G 4 1.107 5.565 3.645 42 H8 G 4 H8 G 4 3.895 4.868 6.141 43 H1 G 4 H1 G 4 1.885 -0.293 2.904 44 H21 G 4 H21 G 4 0.022 0.174 1.789 45 H22 G 4 H22 G 4 -0.721 1.766 1.843 46 H5' A 5 H5' A 5 -3.128 6.102 8.796 47 H5'' A 5 H5'' A 5 -2.781 5.035 10.172 48 H4' A 5 H4' A 5 -3.927 4.211 7.801 49 H3' A 5 H3' A 5 -2.357 2.676 9.881 50 H2' A 5 H2'' A 5 -2.241 0.811 8.461 51 HO2' A 5 H2' A 5 -3.800 1.485 6.376 52 H1' A 5 H1' A 5 -1.996 2.132 6.042 53 H8 A 5 H8 A 5 0.319 3.915 8.388 54 H61 A 5 H61 A 5 4.427 -0.590 7.298 55 H62 A 5 H62 A 5 4.177 0.993 8.003 56 H2 A 5 H2 A 5 0.476 -1.869 5.610 57 H5' C 6 H5' C 6 -5.177 -0.118 9.064 58 H5'' C 6 H5'' C 6 -5.472 -1.146 10.482 59 H4' C 6 H4' C 6 -4.069 -2.125 8.543 60 H3' C 6 H3' C 6 -3.312 -2.227 11.452 61 H2' C 6 H2'' C 6 -1.231 -3.181 10.949 62 HO2' C 6 H2' C 6 -0.914 -4.473 9.260 63 H1' C 6 H1' C 6 -0.714 -1.848 8.578 64 H41 C 6 H41 C 6 2.630 1.282 13.026 65 H42 C 6 H42 C 6 1.243 2.295 13.348 66 H5 C 6 H5 C 6 -0.918 1.925 12.347 67 H6 C 6 H6 C 6 -2.213 0.505 10.824 68 H5' U 7 H5' U 7 -2.582 -6.214 11.882 69 H5'' U 7 H5'' U 7 -2.822 -6.205 13.635 70 H4' U 7 H4' U 7 -0.432 -5.629 12.314 71 H3' U 7 H3' U 7 -1.420 -5.013 15.104 72 H2' U 7 H2'' U 7 0.370 -3.545 15.461 73 HO2' U 7 H2' U 7 1.603 -5.177 13.591 74 H1' U 7 H1' U 7 0.503 -2.428 12.947 75 H3 U 7 H3 U 7 -0.984 0.825 15.828 76 H5 U 7 H5 U 7 -4.421 -1.286 14.600 77 H6 U 7 H6 U 7 -2.962 -2.935 13.578 78 H5' G 8 H5' G 8 4.010 -5.826 16.871 79 H5'' G 8 H5'' G 8 2.546 -5.903 17.866 80 H4' G 8 H4' G 8 3.847 -3.535 16.541 81 H3' G 8 H3' G 8 2.701 -4.139 19.277 82 H2' G 8 H2'' G 8 2.010 -1.938 19.521 83 HO2' G 8 H2' G 8 4.220 -1.227 18.709 84 H1' G 8 H1' G 8 1.362 -1.357 16.900 85 H8 G 8 H8 G 8 0.192 -4.701 18.425 86 H1 G 8 H1 G 8 -4.013 0.122 18.885 87 H21 G 8 H21 G 8 -3.080 2.014 18.189 88 H22 G 8 H22 G 8 -1.430 2.089 17.613 89 H5' U 9 H5' U 9 6.213 -1.744 18.226 90 H5'' U 9 H5'' U 9 7.564 -2.235 17.189 91 H4' U 9 H4' U 9 8.565 -0.613 18.516 92 H3' U 9 H3' U 9 9.500 -3.131 19.038 93 H2' U 9 H2'' U 9 8.227 -3.623 20.938 94 HO2' U 9 H2' U 9 9.584 -3.470 22.626 95 H1' U 9 H1' U 9 8.395 -0.847 22.055 96 H3 U 9 H3 U 9 5.428 -2.382 25.124 97 H5 U 9 H5 U 9 3.593 -3.276 21.434 98 H6 U 9 H6 U 9 5.606 -2.502 20.321 99 H5' A 10 H5' A 10 11.348 -1.030 15.978 100 H5'' A 10 H5'' A 10 10.368 -2.071 17.029 101 H4' A 10 H4' A 10 13.135 -2.984 16.325 102 H3' A 10 H3' A 10 10.833 -2.873 14.370 103 H2' A 10 H2'' A 10 11.243 -5.080 13.700 104 HO2' A 10 H2' A 10 13.533 -4.758 13.436 105 H1' A 10 H1' A 10 11.984 -6.140 16.140 106 H8 A 10 H8 A 10 9.029 -4.016 16.938 107 H61 A 10 H61 A 10 5.446 -8.635 14.895 108 H62 A 10 H62 A 10 5.484 -7.115 15.760 109 H2 A 10 H2 A 10 9.674 -9.509 13.681 110 H5' 6IA 11 H5' 6IA 11 13.817 -4.080 11.349 111 H5'' 6IA 11 H5'' 6IA 11 12.952 -3.654 9.860 112 H4' 6IA 11 H4' 6IA 11 13.080 -6.185 10.759 113 H3' 6IA 11 H3' 6IA 11 10.839 -4.791 9.303 114 H2' 6IA 11 H2'' 6IA 11 9.392 -6.609 9.667 115 HO2' 6IA 11 H2' 6IA 11 10.412 -8.602 10.679 116 H1' 6IA 11 H1' 6IA 11 10.081 -7.206 12.234 117 H8 6IA 11 H8 6IA 11 10.315 -3.476 12.122 118 HN6 6IA 11 H61 6IA 11 4.127 -3.259 12.469 119 H2 6IA 11 H2 6IA 11 5.335 -7.518 11.923 120 H121 6IA 11 H101 6IA 11 6.430 -1.876 11.555 121 H122 6IA 11 H102 6IA 11 6.315 -1.827 13.330 122 H132 6IA 11 H11 6IA 11 4.411 -0.594 11.310 123 H151 6IA 11 H143 6IA 11 4.586 1.659 13.136 124 H152 6IA 11 H141 6IA 11 3.834 1.256 14.698 125 H153 6IA 11 H142 6IA 11 5.542 0.849 14.401 126 H161 6IA 11 H131 6IA 11 2.696 -2.044 13.493 127 H162 6IA 11 H132 6IA 11 3.743 -1.879 14.927 128 H163 6IA 11 H133 6IA 11 2.420 -0.723 14.659 129 H5' A 12 H5' A 12 10.852 -8.259 6.336 130 H5'' A 12 H5'' A 12 9.775 -7.489 5.157 131 H4' A 12 H4' A 12 8.965 -9.287 7.093 132 H3' A 12 H3' A 12 7.443 -7.159 5.585 133 H2' A 12 H2'' A 12 5.587 -7.426 7.004 134 HO2' A 12 H2' A 12 6.022 -9.888 6.881 135 H1' A 12 H1' A 12 6.913 -7.784 9.376 136 H8 A 12 H8 A 12 8.949 -5.118 7.810 137 H61 A 12 H61 A 12 4.544 -1.080 9.423 138 H62 A 12 H62 A 12 6.182 -1.268 8.838 139 H2 A 12 H2 A 12 2.903 -5.220 9.961 140 HN1 PSU 13 H1 PSU 13 5.989 -4.624 5.160 141 HN3 PSU 13 H3 PSU 13 2.293 -3.267 6.088 142 H6 PSU 13 H6 PSU 13 5.122 -6.791 4.786 143 H1' PSU 13 H1' PSU 13 2.014 -7.989 5.824 144 H2' PSU 13 H2'' PSU 13 1.290 -6.763 3.445 145 HO2' PSU 13 H2' PSU 13 -0.159 -8.426 3.332 146 H3' PSU 13 H3' PSU 13 3.065 -7.544 2.119 147 H4' PSU 13 H4' PSU 13 2.983 -10.201 3.562 148 H5' PSU 13 H5' PSU 13 5.141 -10.479 2.897 149 H5'' PSU 13 H5'' PSU 13 4.789 -9.196 1.724 150 H5' C 14 H5' C 14 -0.258 -8.575 -1.243 151 H5'' C 14 H5'' C 14 0.549 -7.253 -2.111 152 H4' C 14 H4' C 14 -1.895 -7.082 -0.754 153 H3' C 14 H3' C 14 0.044 -4.953 -1.698 154 H2' C 14 H2'' C 14 -1.175 -3.328 -0.505 155 HO2' C 14 H2' C 14 -3.247 -5.207 -0.767 156 H1' C 14 H1' C 14 -1.830 -4.852 1.691 157 H41 C 14 H41 C 14 3.218 -1.306 3.400 158 H42 C 14 H42 C 14 4.213 -2.716 3.166 159 H5 C 14 H5 C 14 3.403 -4.764 2.197 160 H6 C 14 H6 C 14 1.454 -5.902 1.240 161 H5' C 15 H5' C 15 -2.615 -3.656 -5.518 162 H5'' C 15 H5'' C 15 -1.083 -3.148 -6.261 163 H4' C 15 H4' C 15 -2.930 -1.404 -5.254 164 H3' C 15 H3' C 15 0.076 -1.129 -5.484 165 H2' C 15 H2'' C 15 0.000 0.877 -4.250 166 HO2' C 15 H2' C 15 -2.786 1.072 -4.170 167 H1' C 15 H1' C 15 -1.973 0.184 -2.463 168 H41 C 15 H41 C 15 3.571 -0.806 0.568 169 H42 C 15 H42 C 15 3.447 -2.493 0.166 170 H5 C 15 H5 C 15 1.753 -3.376 -1.302 171 H6 C 15 H6 C 15 -0.184 -2.823 -2.699 172 H5' C 16 H5' C 16 -1.004 2.226 -7.190 173 H5'' C 16 H5'' C 16 -0.403 2.660 -8.806 174 H4' C 16 H4' C 16 0.485 4.276 -7.293 175 H3' C 16 H3' C 16 2.488 2.188 -8.153 176 H2' C 16 H2'' C 16 4.127 3.135 -6.762 177 HO2' C 16 H2' C 16 2.455 5.443 -6.529 178 H1' C 16 H1' C 16 2.471 3.912 -4.670 179 H41 C 16 H41 C 16 5.058 -1.537 -2.589 180 H42 C 16 H42 C 16 3.942 -2.460 -3.564 181 H5 C 16 H5 C 16 2.389 -1.451 -5.104 182 H6 C 16 H6 C 16 1.572 0.663 -6.039 183 H5' C 17 H5' C 17 4.559 4.524 -11.708 184 H5'' C 17 H5'' C 17 4.841 2.889 -12.341 185 H4' C 17 H4' C 17 6.732 4.441 -11.039 186 H3' C 17 H3' C 17 6.529 1.436 -11.356 187 HO3' C 17 H3T C 17 7.932 1.847 -12.935 188 H2' C 17 H2'' C 17 8.371 1.162 -9.940 189 HO2' C 17 H2' C 17 8.881 3.955 -10.280 190 H1' C 17 H1' C 17 7.793 3.244 -8.194 191 H41 C 17 H41 C 17 5.928 -2.140 -5.277 192 H42 C 17 H42 C 17 4.305 -1.845 -5.872 193 H5 C 17 H5 C 17 3.754 -0.090 -7.424 194 H6 C 17 H6 C 17 4.639 1.772 -8.750
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