NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
468030 | 2kye | 17088 | 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 9.995 -8.132 -11.532 2 H5'' G 1 H5'' G 1 9.741 -6.492 -12.162 3 H4' G 1 H4' G 1 8.186 -7.850 -13.340 4 H3' G 1 H3' G 1 6.967 -6.299 -11.040 5 H2' G 1 H2' G 1 4.867 -7.278 -11.430 6 HO2' G 1 HO2' G 1 4.638 -8.551 -13.512 7 H1' G 1 H1' G 1 5.712 -9.805 -12.221 8 H8 G 1 H8 G 1 7.202 -8.117 -9.097 9 H1 G 1 H1 G 1 2.066 -11.716 -7.948 10 H21 G 1 H21 G 1 1.211 -12.449 -9.858 11 H22 G 1 H22 G 1 1.908 -12.053 -11.413 12 H5' A 2 H5' A 2 5.244 -5.690 -15.604 13 H5'' A 2 H5'' A 2 4.213 -4.246 -15.517 14 H4' A 2 H4' A 2 3.201 -6.310 -16.661 15 H3' A 2 H3' A 2 1.905 -4.765 -14.396 16 H2' A 2 H2' A 2 0.036 -6.246 -14.450 17 HO2' A 2 HO2' A 2 -0.527 -7.258 -16.241 18 H1' A 2 H1' A 2 1.435 -8.556 -14.565 19 H8 A 2 H8 A 2 3.438 -6.064 -12.559 20 H61 A 2 H61 A 2 -0.019 -7.562 -7.686 21 H62 A 2 H62 A 2 1.398 -6.687 -8.224 22 H2 A 2 H2 A 2 -1.847 -9.452 -11.329 23 H5' G 3 H5' G 3 -1.547 -4.315 -16.975 24 H5'' G 3 H5'' G 3 -2.193 -2.752 -16.438 25 H4' G 3 H4' G 3 -3.511 -4.901 -15.821 26 H3' G 3 H3' G 3 -2.736 -2.700 -13.866 27 H2' G 3 H2' G 3 -3.968 -3.856 -12.190 28 HO2' G 3 HO2' G 3 -4.944 -5.966 -13.596 29 H1' G 3 H1' G 3 -3.135 -6.396 -12.866 30 H8 G 3 H8 G 3 -0.011 -4.535 -13.111 31 H1 G 3 H1 G 3 -1.976 -4.692 -7.051 32 H21 G 3 H21 G 3 -4.084 -5.370 -6.952 33 H22 G 3 H22 G 3 -5.007 -5.780 -8.379 34 H5' A 4 H5' A 4 -7.394 -1.912 -14.689 35 H5'' A 4 H5'' A 4 -7.619 -0.230 -14.164 36 H4' A 4 H4' A 4 -8.897 -2.092 -12.881 37 H3' A 4 H3' A 4 -7.287 0.167 -11.669 38 H2' A 4 H2' A 4 -7.772 -0.654 -9.486 39 HO2' A 4 HO2' A 4 -9.663 -1.534 -9.140 40 H1' A 4 H1' A 4 -7.373 -3.297 -9.977 41 H8 A 4 H8 A 4 -4.689 -1.796 -12.001 42 H61 A 4 H61 A 4 -1.593 -0.505 -6.839 43 H62 A 4 H62 A 4 -1.496 -0.608 -8.583 44 H2 A 4 H2 A 4 -5.786 -1.647 -5.699 45 H5' G 5 H5' G 5 -10.283 0.071 -9.570 46 H5'' G 5 H5'' G 5 -11.587 1.270 -9.698 47 H4' G 5 H4' G 5 -11.320 1.250 -7.409 48 H3' G 5 H3' G 5 -9.374 3.263 -8.564 49 H2' G 5 H2' G 5 -8.400 3.607 -6.460 50 HO2' G 5 HO2' G 5 -9.966 2.345 -4.717 51 H1' G 5 H1' G 5 -8.736 1.033 -5.409 52 H8 G 5 H8 G 5 -7.157 1.333 -8.869 53 H1 G 5 H1 G 5 -2.973 1.804 -4.088 54 H21 G 5 H21 G 5 -4.048 1.908 -2.149 55 H22 G 5 H22 G 5 -5.794 1.861 -2.039 56 HN1 PSU 6 HN1 PSU 6 -7.107 7.163 -10.550 57 HN3 PSU 6 HN3 PSU 6 -3.188 7.767 -9.637 58 H6 PSU 6 H6 PSU 6 -7.668 6.813 -8.206 59 H1' PSU 6 H1' PSU 6 -5.234 6.370 -5.639 60 H2' PSU 6 H2' PSU 6 -5.786 9.060 -6.078 61 HO2' PSU 6 HO2' PSU 6 -4.986 7.608 -4.116 62 H3' PSU 6 H3' PSU 6 -8.102 8.973 -6.303 63 H4' PSU 6 H4' PSU 6 -8.340 6.695 -4.329 64 H5' PSU 6 H5' PSU 6 -10.394 7.145 -5.342 65 H5'' PSU 6 H5'' PSU 6 -9.653 7.582 -6.894 66 HN1 PSU 7 HN1 PSU 7 -6.239 12.494 -7.786 67 HN3 PSU 7 HN3 PSU 7 -2.641 14.318 -8.324 68 H6 PSU 7 H6 PSU 7 -5.387 11.212 -5.900 69 H1' PSU 7 H1' PSU 7 -2.030 10.755 -5.199 70 H2' PSU 7 H2' PSU 7 -2.852 13.270 -3.976 71 HO2' PSU 7 HO2' PSU 7 -1.068 11.872 -2.532 72 H3' PSU 7 H3' PSU 7 -3.805 12.554 -1.967 73 H4' PSU 7 H4' PSU 7 -4.733 10.064 -2.545 74 H5' PSU 7 H5' PSU 7 -6.285 11.857 -2.575 75 H5'' PSU 7 H5'' PSU 7 -5.417 12.698 -3.874 76 H5' G 8 H5' G 8 0.667 11.960 -2.044 77 H5'' G 8 H5'' G 8 0.886 12.288 -0.312 78 H4' G 8 H4' G 8 1.111 14.125 -2.646 79 H3' G 8 H3' G 8 2.894 13.302 -0.769 80 H2' G 8 H2' G 8 1.986 14.112 1.226 81 HO2' G 8 HO2' G 8 3.119 15.838 1.715 82 H1' G 8 H1' G 8 0.620 16.525 0.314 83 H8 G 8 H8 G 8 -1.846 13.922 0.113 84 H1 G 8 H1 G 8 -0.466 15.037 6.238 85 H21 G 8 H21 G 8 1.412 16.210 6.393 86 H22 G 8 H22 G 8 2.321 16.714 4.986 87 H5' G 9 H5' G 9 4.746 13.146 -3.266 88 H5'' G 9 H5'' G 9 4.077 12.034 -2.057 89 H4' G 9 H4' G 9 6.858 12.238 -3.139 90 H3' G 9 H3' G 9 4.772 10.188 -2.853 91 H2' G 9 H2' G 9 5.865 8.668 -1.488 92 HO2' G 9 HO2' G 9 8.209 8.567 -1.478 93 H1' G 9 H1' G 9 7.559 10.162 -0.009 94 H8 G 9 H8 G 9 6.292 10.817 2.214 95 H1 G 9 H1 G 9 0.617 9.597 -0.415 96 H21 G 9 H21 G 9 0.844 9.290 -2.597 97 H22 G 9 H22 G 9 2.392 9.384 -3.406 98 H5' G 10 H5' G 10 6.628 7.002 -2.694 99 H5'' G 10 H5'' G 10 5.704 5.946 -3.775 100 H4' G 10 H4' G 10 5.252 6.446 -1.015 101 H3' G 10 H3' G 10 4.134 4.711 -3.141 102 H2' G 10 H2' G 10 1.887 4.848 -2.580 103 HO2' G 10 HO2' G 10 1.234 5.324 -0.404 104 H1' G 10 H1' G 10 1.629 7.317 -1.474 105 H8 G 10 H8 G 10 3.807 7.885 -4.433 106 H1 G 10 H1 G 10 -2.240 6.798 -6.126 107 H21 G 10 H21 G 10 -3.386 6.014 -4.400 108 H22 G 10 H22 G 10 -2.661 5.755 -2.829 109 H5' C 11 H5' C 11 3.848 3.056 1.255 110 H5'' C 11 H5'' C 11 3.627 1.297 1.317 111 H4' C 11 H4' C 11 1.922 2.661 2.624 112 H3' C 11 H3' C 11 1.245 0.607 0.510 113 H2' C 11 H2' C 11 -1.074 1.079 0.710 114 HO2' C 11 HO2' C 11 -1.878 2.386 2.419 115 H1' C 11 H1' C 11 -0.945 3.755 0.725 116 H41 C 11 H41 C 11 -1.276 1.824 -5.368 117 H42 C 11 H42 C 11 0.466 1.943 -5.473 118 H5 C 11 H5 C 11 1.875 2.416 -3.578 119 H6 C 11 H6 C 11 1.917 2.874 -1.171 120 HN1 PSU 12 HN1 PSU 12 -0.250 -0.307 -2.400 121 HN3 PSU 12 HN3 PSU 12 -3.419 -1.025 -4.850 122 H6 PSU 12 H6 PSU 12 -1.623 -0.625 -0.418 123 H1' PSU 12 H1' PSU 12 -5.253 -0.982 -0.577 124 H2' PSU 12 H2' PSU 12 -3.755 -3.306 -0.657 125 HO2' PSU 12 HO2' PSU 12 -5.194 -3.939 1.140 126 H3' PSU 12 H3' PSU 12 -2.055 -2.643 0.852 127 H4' PSU 12 H4' PSU 12 -4.145 -1.260 2.567 128 H5' PSU 12 H5' PSU 12 -2.154 0.463 2.518 129 H5'' PSU 12 H5'' PSU 12 -2.043 -0.986 3.536 130 H5' C 13 H5' C 13 -5.276 -5.623 1.651 131 H5'' C 13 H5'' C 13 -4.541 -7.234 1.535 132 H4' C 13 H4' C 13 -6.377 -6.668 -0.178 133 H3' C 13 H3' C 13 -3.606 -7.700 -0.871 134 H2' C 13 H2' C 13 -4.160 -7.656 -3.147 135 HO2' C 13 HO2' C 13 -6.923 -7.324 -2.625 136 H1' C 13 H1' C 13 -5.941 -5.479 -3.082 137 H41 C 13 H41 C 13 -0.670 -3.692 -6.182 138 H42 C 13 H42 C 13 0.231 -3.653 -4.684 139 H5 C 13 H5 C 13 -0.700 -4.319 -2.571 140 H6 C 13 H6 C 13 -2.698 -5.146 -1.419 141 HN1 PSU 14 HN1 PSU 14 -2.161 -8.360 -3.981 142 HN3 PSU 14 HN3 PSU 14 -1.443 -8.751 -7.967 143 H6 PSU 14 H6 PSU 14 -4.269 -9.556 -4.172 144 H1' PSU 14 H1' PSU 14 -5.720 -10.463 -7.398 145 H2' PSU 14 H2' PSU 14 -4.111 -12.349 -6.251 146 HO2' PSU 14 HO2' PSU 14 -6.499 -13.450 -6.218 147 H3' PSU 14 H3' PSU 14 -4.571 -11.972 -3.975 148 H4' PSU 14 H4' PSU 14 -7.492 -11.435 -4.457 149 H5' PSU 14 H5' PSU 14 -6.506 -9.286 -3.113 150 H5'' PSU 14 H5'' PSU 14 -7.036 -10.784 -2.321 151 H5' C 15 H5' C 15 -6.106 -15.137 -6.635 152 H5'' C 15 H5'' C 15 -5.458 -16.687 -6.062 153 H4' C 15 H4' C 15 -4.950 -16.241 -8.470 154 H3' C 15 H3' C 15 -2.722 -16.475 -6.432 155 H2' C 15 H2' C 15 -1.124 -16.242 -8.136 156 HO2' C 15 HO2' C 15 -2.381 -17.713 -9.581 157 H1' C 15 H1' C 15 -2.454 -14.304 -9.585 158 H41 C 15 H41 C 15 1.799 -11.185 -6.035 159 H42 C 15 H42 C 15 0.824 -11.418 -4.601 160 H5 C 15 H5 C 15 -1.210 -12.712 -4.586 161 H6 C 15 H6 C 15 -2.732 -14.080 -5.935 Start of MODEL 2 1 H5' G 1 H5' G 1 10.038 -6.540 -10.122 2 H5'' G 1 H5'' G 1 9.479 -4.976 -10.748 3 H4' G 1 H4' G 1 8.448 -6.687 -12.090 4 H3' G 1 H3' G 1 6.639 -5.340 -10.062 5 H2' G 1 H2' G 1 4.836 -6.692 -10.740 6 HO2' G 1 HO2' G 1 6.356 -7.500 -13.020 7 H1' G 1 H1' G 1 6.234 -9.034 -11.218 8 H8 G 1 H8 G 1 7.017 -7.116 -7.988 9 H1 G 1 H1 G 1 2.171 -11.226 -7.466 10 H21 G 1 H21 G 1 1.674 -12.067 -9.455 11 H22 G 1 H22 G 1 2.537 -11.615 -10.910 12 H5' A 2 H5' A 2 5.245 -4.806 -14.842 13 H5'' A 2 H5'' A 2 4.070 -3.485 -14.690 14 H4' A 2 H4' A 2 3.339 -5.581 -16.012 15 H3' A 2 H3' A 2 1.775 -4.239 -13.793 16 H2' A 2 H2' A 2 0.060 -5.888 -13.987 17 HO2' A 2 HO2' A 2 0.565 -7.574 -15.778 18 H1' A 2 H1' A 2 1.652 -8.050 -14.063 19 H8 A 2 H8 A 2 3.436 -5.537 -11.924 20 H61 A 2 H61 A 2 -0.246 -7.150 -7.262 21 H62 A 2 H62 A 2 1.178 -6.242 -7.719 22 H2 A 2 H2 A 2 -1.830 -9.060 -11.009 23 H5' G 3 H5' G 3 -1.489 -3.810 -16.708 24 H5'' G 3 H5'' G 3 -2.283 -2.323 -16.150 25 H4' G 3 H4' G 3 -3.504 -4.587 -15.769 26 H3' G 3 H3' G 3 -3.059 -2.440 -13.656 27 H2' G 3 H2' G 3 -4.295 -3.770 -12.121 28 HO2' G 3 HO2' G 3 -5.558 -4.561 -14.348 29 H1' G 3 H1' G 3 -3.227 -6.197 -12.827 30 H8 G 3 H8 G 3 -0.223 -4.116 -12.791 31 H1 G 3 H1 G 3 -2.629 -4.644 -6.909 32 H21 G 3 H21 G 3 -4.694 -5.453 -7.006 33 H22 G 3 H22 G 3 -5.473 -5.859 -8.520 34 H5' A 4 H5' A 4 -7.750 -1.738 -14.596 35 H5'' A 4 H5'' A 4 -7.921 -0.065 -14.027 36 H4' A 4 H4' A 4 -9.254 -1.916 -12.788 37 H3' A 4 H3' A 4 -7.538 0.224 -11.493 38 H2' A 4 H2' A 4 -8.112 -0.645 -9.349 39 HO2' A 4 HO2' A 4 -10.159 -1.977 -10.800 40 H1' A 4 H1' A 4 -7.804 -3.278 -9.938 41 H8 A 4 H8 A 4 -5.055 -1.752 -11.863 42 H61 A 4 H61 A 4 -1.950 -0.958 -6.601 43 H62 A 4 H62 A 4 -1.839 -0.942 -8.346 44 H2 A 4 H2 A 4 -6.202 -1.983 -5.573 45 H5' G 5 H5' G 5 -10.324 0.096 -9.251 46 H5'' G 5 H5'' G 5 -11.561 1.367 -9.238 47 H4' G 5 H4' G 5 -11.152 1.182 -6.970 48 H3' G 5 H3' G 5 -9.189 3.196 -8.111 49 H2' G 5 H2' G 5 -8.183 3.421 -5.991 50 HO2' G 5 HO2' G 5 -9.253 3.042 -4.115 51 H1' G 5 H1' G 5 -8.444 0.777 -5.157 52 H8 G 5 H8 G 5 -7.086 1.122 -8.684 53 H1 G 5 H1 G 5 -2.624 1.881 -4.195 54 H21 G 5 H21 G 5 -3.570 2.008 -2.195 55 H22 G 5 H22 G 5 -5.301 1.906 -1.967 56 HN1 PSU 6 HN1 PSU 6 -7.469 6.725 -10.341 57 HN3 PSU 6 HN3 PSU 6 -3.439 7.248 -10.116 58 H6 PSU 6 H6 PSU 6 -7.633 6.417 -7.931 59 H1' PSU 6 H1' PSU 6 -4.772 5.970 -5.809 60 H2' PSU 6 H2' PSU 6 -5.512 8.670 -6.206 61 HO2' PSU 6 HO2' PSU 6 -5.218 8.540 -3.724 62 H3' PSU 6 H3' PSU 6 -7.796 8.478 -5.765 63 H4' PSU 6 H4' PSU 6 -7.278 6.178 -3.849 64 H5' PSU 6 H5' PSU 6 -9.524 6.077 -4.053 65 H5'' PSU 6 H5'' PSU 6 -9.524 7.233 -5.399 66 HN1 PSU 7 HN1 PSU 7 -6.916 12.028 -6.505 67 HN3 PSU 7 HN3 PSU 7 -3.779 13.767 -8.425 68 H6 PSU 7 H6 PSU 7 -5.447 11.079 -4.812 69 H1' PSU 7 H1' PSU 7 -1.912 10.938 -5.162 70 H2' PSU 7 H2' PSU 7 -2.539 13.395 -4.079 71 HO2' PSU 7 HO2' PSU 7 -0.611 11.619 -3.885 72 H3' PSU 7 H3' PSU 7 -4.191 12.843 -2.549 73 H4' PSU 7 H4' PSU 7 -3.193 10.104 -1.904 74 H5' PSU 7 H5' PSU 7 -5.445 9.541 -1.982 75 H5'' PSU 7 H5'' PSU 7 -5.531 11.255 -1.529 76 H5' G 8 H5' G 8 0.559 12.001 -2.616 77 H5'' G 8 H5'' G 8 1.750 11.861 -1.309 78 H4' G 8 H4' G 8 1.603 13.986 -3.038 79 H3' G 8 H3' G 8 3.297 13.360 -1.038 80 H2' G 8 H2' G 8 1.917 13.854 0.832 81 HO2' G 8 HO2' G 8 2.799 15.612 1.709 82 H1' G 8 H1' G 8 0.755 16.371 -0.236 83 H8 G 8 H8 G 8 -1.825 13.962 -0.579 84 H1 G 8 H1 G 8 -0.945 15.099 5.632 85 H21 G 8 H21 G 8 1.003 16.113 5.950 86 H22 G 8 H22 G 8 2.083 16.507 4.631 87 H5' G 9 H5' G 9 4.980 12.643 -3.883 88 H5'' G 9 H5'' G 9 4.326 11.962 -2.380 89 H4' G 9 H4' G 9 7.224 12.113 -3.258 90 H3' G 9 H3' G 9 5.162 10.021 -3.171 91 H2' G 9 H2' G 9 6.081 8.613 -1.566 92 HO2' G 9 HO2' G 9 8.538 9.064 -1.150 93 H1' G 9 H1' G 9 7.454 10.275 0.064 94 H8 G 9 H8 G 9 5.830 10.937 2.027 95 H1 G 9 H1 G 9 0.698 9.364 -1.416 96 H21 G 9 H21 G 9 1.286 9.001 -3.527 97 H22 G 9 H22 G 9 2.940 9.150 -4.079 98 H5' G 10 H5' G 10 7.022 6.836 -2.465 99 H5'' G 10 H5'' G 10 6.321 5.711 -3.640 100 H4' G 10 H4' G 10 5.329 6.414 -1.065 101 H3' G 10 H3' G 10 4.692 4.475 -3.197 102 H2' G 10 H2' G 10 2.391 4.659 -3.218 103 HO2' G 10 HO2' G 10 2.785 4.456 -0.622 104 H1' G 10 H1' G 10 1.885 7.160 -2.184 105 H8 G 10 H8 G 10 4.483 7.448 -4.894 106 H1 G 10 H1 G 10 -1.437 6.876 -7.190 107 H21 G 10 H21 G 10 -2.831 6.297 -5.560 108 H22 G 10 H22 G 10 -2.298 6.053 -3.912 109 H5' C 11 H5' C 11 4.013 2.624 1.388 110 H5'' C 11 H5'' C 11 3.680 0.895 1.162 111 H4' C 11 H4' C 11 1.998 2.262 2.568 112 H3' C 11 H3' C 11 1.369 0.358 0.306 113 H2' C 11 H2' C 11 -0.947 0.869 0.444 114 HO2' C 11 HO2' C 11 -1.876 1.639 2.230 115 H1' C 11 H1' C 11 -0.764 3.530 0.604 116 H41 C 11 H41 C 11 -0.823 1.855 -5.578 117 H42 C 11 H42 C 11 0.920 2.018 -5.605 118 H5 C 11 H5 C 11 2.238 2.429 -3.629 119 H6 C 11 H6 C 11 2.171 2.779 -1.208 120 HN1 PSU 12 HN1 PSU 12 -0.181 -0.583 -2.655 121 HN3 PSU 12 HN3 PSU 12 -3.510 -1.150 -4.928 122 H6 PSU 12 H6 PSU 12 -1.450 -0.871 -0.602 123 H1' PSU 12 H1' PSU 12 -5.035 -0.899 -0.503 124 H2' PSU 12 H2' PSU 12 -3.926 -3.455 -0.907 125 HO2' PSU 12 HO2' PSU 12 -5.591 -4.064 0.591 126 H3' PSU 12 H3' PSU 12 -2.252 -3.352 0.740 127 H4' PSU 12 H4' PSU 12 -4.040 -1.611 2.469 128 H5' PSU 12 H5' PSU 12 -1.919 -0.512 3.021 129 H5'' PSU 12 H5'' PSU 12 -1.779 -2.264 3.273 130 H5' C 13 H5' C 13 -6.062 -5.957 1.325 131 H5'' C 13 H5'' C 13 -5.389 -7.596 1.212 132 H4' C 13 H4' C 13 -7.145 -6.970 -0.544 133 H3' C 13 H3' C 13 -4.387 -8.069 -1.137 134 H2' C 13 H2' C 13 -4.735 -7.875 -3.440 135 HO2' C 13 HO2' C 13 -7.210 -7.394 -3.953 136 H1' C 13 H1' C 13 -6.466 -5.670 -3.447 137 H41 C 13 H41 C 13 -0.933 -3.705 -5.885 138 H42 C 13 H42 C 13 -0.151 -3.854 -4.327 139 H5 C 13 H5 C 13 -1.258 -4.711 -2.372 140 H6 C 13 H6 C 13 -3.361 -5.596 -1.475 141 HN1 PSU 14 HN1 PSU 14 -2.710 -8.418 -4.064 142 HN3 PSU 14 HN3 PSU 14 -1.540 -8.407 -7.960 143 H6 PSU 14 H6 PSU 14 -4.708 -9.709 -4.592 144 H1' PSU 14 H1' PSU 14 -5.684 -10.469 -8.048 145 H2' PSU 14 H2' PSU 14 -4.148 -12.298 -6.724 146 HO2' PSU 14 HO2' PSU 14 -6.537 -13.450 -7.069 147 H3' PSU 14 H3' PSU 14 -4.955 -12.010 -4.534 148 H4' PSU 14 H4' PSU 14 -7.805 -11.650 -5.440 149 H5' PSU 14 H5' PSU 14 -7.256 -9.511 -3.903 150 H5'' PSU 14 H5'' PSU 14 -7.674 -11.094 -3.218 151 H5' C 15 H5' C 15 -5.764 -15.170 -7.419 152 H5'' C 15 H5'' C 15 -5.202 -16.709 -6.734 153 H4' C 15 H4' C 15 -4.227 -16.260 -8.981 154 H3' C 15 H3' C 15 -2.441 -16.360 -6.538 155 H2' C 15 H2' C 15 -0.548 -16.045 -7.884 156 HO2' C 15 HO2' C 15 -1.259 -17.602 -9.507 157 H1' C 15 H1' C 15 -1.668 -14.217 -9.636 158 H41 C 15 H41 C 15 1.633 -10.741 -5.463 159 H42 C 15 H42 C 15 0.458 -11.063 -4.207 160 H5 C 15 H5 C 15 -1.431 -12.528 -4.510 161 H6 C 15 H6 C 15 -2.599 -14.004 -6.081 Start of MODEL 3 1 H5' G 1 H5' G 1 10.071 -7.649 -10.866 2 H5'' G 1 H5'' G 1 9.721 -6.046 -11.542 3 H4' G 1 H4' G 1 8.373 -7.569 -12.785 4 H3' G 1 H3' G 1 6.847 -6.088 -10.619 5 H2' G 1 H2' G 1 4.885 -7.250 -11.185 6 HO2' G 1 HO2' G 1 4.704 -8.353 -13.229 7 H1' G 1 H1' G 1 6.045 -9.680 -11.926 8 H8 G 1 H8 G 1 7.045 -8.081 -8.590 9 H1 G 1 H1 G 1 1.882 -11.808 -8.247 10 H21 G 1 H21 G 1 1.287 -12.463 -10.283 11 H22 G 1 H22 G 1 2.164 -11.980 -11.718 12 H5' A 2 H5' A 2 5.214 -5.397 -15.298 13 H5'' A 2 H5'' A 2 4.151 -3.993 -15.072 14 H4' A 2 H4' A 2 3.181 -6.047 -16.320 15 H3' A 2 H3' A 2 1.868 -4.616 -13.987 16 H2' A 2 H2' A 2 -0.001 -6.104 -14.172 17 HO2' A 2 HO2' A 2 0.289 -7.794 -15.985 18 H1' A 2 H1' A 2 1.440 -8.380 -14.312 19 H8 A 2 H8 A 2 3.436 -5.998 -12.203 20 H61 A 2 H61 A 2 -0.194 -7.431 -7.443 21 H62 A 2 H62 A 2 1.267 -6.607 -7.936 22 H2 A 2 H2 A 2 -2.004 -9.201 -11.151 23 H5' G 3 H5' G 3 -1.290 -4.017 -16.754 24 H5'' G 3 H5'' G 3 -2.117 -2.515 -16.296 25 H4' G 3 H4' G 3 -3.359 -4.705 -15.797 26 H3' G 3 H3' G 3 -2.784 -2.564 -13.714 27 H2' G 3 H2' G 3 -4.027 -3.842 -12.142 28 HO2' G 3 HO2' G 3 -5.827 -4.555 -13.089 29 H1' G 3 H1' G 3 -3.089 -6.324 -12.898 30 H8 G 3 H8 G 3 -0.015 -4.351 -12.884 31 H1 G 3 H1 G 3 -2.295 -4.904 -6.956 32 H21 G 3 H21 G 3 -4.378 -5.664 -7.011 33 H22 G 3 H22 G 3 -5.203 -6.032 -8.510 34 H5' A 4 H5' A 4 -7.439 -1.632 -14.718 35 H5'' A 4 H5'' A 4 -7.540 0.055 -14.173 36 H4' A 4 H4' A 4 -8.974 -1.713 -12.931 37 H3' A 4 H3' A 4 -7.203 0.395 -11.682 38 H2' A 4 H2' A 4 -7.709 -0.418 -9.509 39 HO2' A 4 HO2' A 4 -9.403 -2.386 -9.769 40 H1' A 4 H1' A 4 -7.544 -3.081 -10.030 41 H8 A 4 H8 A 4 -4.771 -1.791 -12.066 42 H61 A 4 H61 A 4 -1.535 -0.779 -6.921 43 H62 A 4 H62 A 4 -1.457 -0.878 -8.666 44 H2 A 4 H2 A 4 -5.798 -1.588 -5.755 45 H5' G 5 H5' G 5 -10.103 0.215 -9.515 46 H5'' G 5 H5'' G 5 -11.363 1.462 -9.453 47 H4' G 5 H4' G 5 -10.943 1.023 -7.187 48 H3' G 5 H3' G 5 -9.374 3.404 -8.195 49 H2' G 5 H2' G 5 -8.204 3.593 -6.179 50 HO2' G 5 HO2' G 5 -9.940 1.873 -4.766 51 H1' G 5 H1' G 5 -8.201 0.890 -5.414 52 H8 G 5 H8 G 5 -6.878 1.493 -8.906 53 H1 G 5 H1 G 5 -2.519 2.473 -4.352 54 H21 G 5 H21 G 5 -3.493 2.457 -2.356 55 H22 G 5 H22 G 5 -5.212 2.204 -2.152 56 HN1 PSU 6 HN1 PSU 6 -7.068 7.083 -10.485 57 HN3 PSU 6 HN3 PSU 6 -3.132 7.550 -9.554 58 H6 PSU 6 H6 PSU 6 -7.657 6.804 -8.136 59 H1' PSU 6 H1' PSU 6 -5.233 6.395 -5.521 60 H2' PSU 6 H2' PSU 6 -5.780 9.066 -6.075 61 HO2' PSU 6 HO2' PSU 6 -6.424 8.627 -3.529 62 H3' PSU 6 H3' PSU 6 -8.105 8.898 -6.371 63 H4' PSU 6 H4' PSU 6 -8.259 6.790 -4.196 64 H5' PSU 6 H5' PSU 6 -10.366 7.257 -5.176 65 H5'' PSU 6 H5'' PSU 6 -9.676 7.385 -6.808 66 HN1 PSU 7 HN1 PSU 7 -5.783 12.426 -8.395 67 HN3 PSU 7 HN3 PSU 7 -1.739 12.632 -8.804 68 H6 PSU 7 H6 PSU 7 -5.580 11.409 -6.193 69 H1' PSU 7 H1' PSU 7 -2.543 10.057 -4.942 70 H2' PSU 7 H2' PSU 7 -3.295 12.852 -4.193 71 HO2' PSU 7 HO2' PSU 7 -1.182 12.581 -4.004 72 H3' PSU 7 H3' PSU 7 -4.105 12.279 -2.034 73 H4' PSU 7 H4' PSU 7 -5.399 9.975 -2.652 74 H5' PSU 7 H5' PSU 7 -6.771 11.846 -2.653 75 H5'' PSU 7 H5'' PSU 7 -5.702 12.764 -3.734 76 H5' G 8 H5' G 8 0.170 11.483 -2.000 77 H5'' G 8 H5'' G 8 0.350 11.680 -0.245 78 H4' G 8 H4' G 8 0.577 13.708 -2.424 79 H3' G 8 H3' G 8 2.397 12.699 -0.694 80 H2' G 8 H2' G 8 1.448 13.258 1.385 81 HO2' G 8 HO2' G 8 2.765 15.591 0.443 82 H1' G 8 H1' G 8 0.261 15.864 0.686 83 H8 G 8 H8 G 8 -2.251 13.222 0.458 84 H1 G 8 H1 G 8 -1.036 14.597 6.565 85 H21 G 8 H21 G 8 0.810 15.814 6.718 86 H22 G 8 H22 G 8 1.745 16.287 5.318 87 H5' G 9 H5' G 9 4.122 12.631 -3.940 88 H5'' G 9 H5'' G 9 3.962 12.302 -2.204 89 H4' G 9 H4' G 9 6.588 12.620 -3.699 90 H3' G 9 H3' G 9 4.841 10.291 -3.253 91 H2' G 9 H2' G 9 6.220 9.055 -1.838 92 HO2' G 9 HO2' G 9 8.066 9.899 -3.547 93 H1' G 9 H1' G 9 7.588 10.944 -0.469 94 H8 G 9 H8 G 9 6.351 11.070 1.766 95 H1 G 9 H1 G 9 0.720 9.601 -0.821 96 H21 G 9 H21 G 9 0.895 9.557 -3.031 97 H22 G 9 H22 G 9 2.400 9.888 -3.859 98 H5' G 10 H5' G 10 7.046 7.295 -2.866 99 H5'' G 10 H5'' G 10 6.240 6.114 -3.912 100 H4' G 10 H4' G 10 5.632 6.713 -1.223 101 H3' G 10 H3' G 10 4.622 4.888 -3.327 102 H2' G 10 H2' G 10 2.356 5.012 -2.852 103 HO2' G 10 HO2' G 10 2.087 6.072 -0.455 104 H1' G 10 H1' G 10 2.028 7.500 -1.799 105 H8 G 10 H8 G 10 4.234 8.001 -4.762 106 H1 G 10 H1 G 10 -1.810 6.893 -6.459 107 H21 G 10 H21 G 10 -2.963 6.146 -4.725 108 H22 G 10 H22 G 10 -2.247 5.923 -3.143 109 H5' C 11 H5' C 11 4.334 2.844 1.176 110 H5'' C 11 H5'' C 11 4.068 1.117 0.867 111 H4' C 11 H4' C 11 2.391 2.310 2.420 112 H3' C 11 H3' C 11 1.714 0.556 0.047 113 H2' C 11 H2' C 11 -0.603 0.970 0.344 114 HO2' C 11 HO2' C 11 -0.654 2.603 2.483 115 H1' C 11 H1' C 11 -0.494 3.616 0.718 116 H41 C 11 H41 C 11 -0.946 2.457 -5.559 117 H42 C 11 H42 C 11 0.794 2.586 -5.686 118 H5 C 11 H5 C 11 2.242 2.827 -3.780 119 H6 C 11 H6 C 11 2.340 3.004 -1.338 120 HN1 PSU 12 HN1 PSU 12 -0.248 -0.392 -2.722 121 HN3 PSU 12 HN3 PSU 12 -3.644 -1.190 -4.821 122 H6 PSU 12 H6 PSU 12 -1.403 -0.711 -0.605 123 H1' PSU 12 H1' PSU 12 -4.997 -1.048 -0.355 124 H2' PSU 12 H2' PSU 12 -3.671 -3.443 -0.710 125 HO2' PSU 12 HO2' PSU 12 -5.795 -2.659 0.509 126 H3' PSU 12 H3' PSU 12 -1.761 -2.980 0.597 127 H4' PSU 12 H4' PSU 12 -3.473 -1.523 2.631 128 H5' PSU 12 H5' PSU 12 -1.424 0.080 2.352 129 H5'' PSU 12 H5'' PSU 12 -1.213 -1.444 3.239 130 H5' C 13 H5' C 13 -5.153 -5.125 1.391 131 H5'' C 13 H5'' C 13 -4.914 -6.850 1.733 132 H4' C 13 H4' C 13 -6.562 -6.655 -0.028 133 H3' C 13 H3' C 13 -3.814 -7.637 -0.840 134 H2' C 13 H2' C 13 -4.464 -7.750 -3.089 135 HO2' C 13 HO2' C 13 -7.207 -7.457 -2.390 136 H1' C 13 H1' C 13 -6.220 -5.588 -3.145 137 H41 C 13 H41 C 13 -0.916 -3.699 -6.095 138 H42 C 13 H42 C 13 -0.007 -3.784 -4.603 139 H5 C 13 H5 C 13 -0.945 -4.552 -2.532 140 H6 C 13 H6 C 13 -2.962 -5.393 -1.421 141 HN1 PSU 14 HN1 PSU 14 -2.366 -8.555 -3.729 142 HN3 PSU 14 HN3 PSU 14 -1.561 -8.528 -7.721 143 H6 PSU 14 H6 PSU 14 -4.503 -9.663 -4.096 144 H1' PSU 14 H1' PSU 14 -5.868 -10.208 -7.454 145 H2' PSU 14 H2' PSU 14 -4.374 -12.213 -6.329 146 HO2' PSU 14 HO2' PSU 14 -7.083 -12.827 -6.591 147 H3' PSU 14 H3' PSU 14 -4.990 -11.946 -4.073 148 H4' PSU 14 H4' PSU 14 -7.855 -11.328 -4.796 149 H5' PSU 14 H5' PSU 14 -7.459 -9.521 -3.073 150 H5'' PSU 14 H5'' PSU 14 -7.256 -11.177 -2.467 151 H5' C 15 H5' C 15 -6.031 -14.335 -6.860 152 H5'' C 15 H5'' C 15 -6.179 -16.075 -6.537 153 H4' C 15 H4' C 15 -4.953 -16.052 -8.527 154 H3' C 15 H3' C 15 -3.080 -16.090 -6.150 155 H2' C 15 H2' C 15 -1.216 -16.061 -7.578 156 HO2' C 15 HO2' C 15 -1.286 -17.082 -9.426 157 H1' C 15 H1' C 15 -2.206 -14.268 -9.415 158 H41 C 15 H41 C 15 1.334 -10.730 -5.505 159 H42 C 15 H42 C 15 0.241 -11.024 -4.170 160 H5 C 15 H5 C 15 -1.687 -12.457 -4.332 161 H6 C 15 H6 C 15 -2.981 -13.927 -5.806 Start of MODEL 4 1 H5' G 1 H5' G 1 9.431 -8.350 -10.622 2 H5'' G 1 H5'' G 1 9.598 -6.784 -11.441 3 H4' G 1 H4' G 1 8.038 -7.665 -12.855 4 H3' G 1 H3' G 1 6.537 -6.534 -10.500 5 H2' G 1 H2' G 1 4.516 -7.544 -11.144 6 HO2' G 1 HO2' G 1 4.104 -8.199 -13.248 7 H1' G 1 H1' G 1 5.459 -9.933 -12.097 8 H8 G 1 H8 G 1 7.170 -8.741 -8.905 9 H1 G 1 H1 G 1 1.672 -11.795 -7.857 10 H21 G 1 H21 G 1 0.639 -12.178 -9.779 11 H22 G 1 H22 G 1 1.304 -11.685 -11.320 12 H5' A 2 H5' A 2 5.056 -5.736 -15.026 13 H5'' A 2 H5'' A 2 3.977 -4.326 -14.976 14 H4' A 2 H4' A 2 3.114 -6.394 -16.235 15 H3' A 2 H3' A 2 1.634 -4.892 -14.067 16 H2' A 2 H2' A 2 -0.188 -6.416 -14.201 17 HO2' A 2 HO2' A 2 0.461 -8.182 -16.043 18 H1' A 2 H1' A 2 1.253 -8.701 -14.241 19 H8 A 2 H8 A 2 3.144 -6.188 -12.171 20 H61 A 2 H61 A 2 -0.539 -7.601 -7.448 21 H62 A 2 H62 A 2 0.901 -6.737 -7.937 22 H2 A 2 H2 A 2 -2.193 -9.562 -11.138 23 H5' G 3 H5' G 3 -1.558 -4.377 -16.874 24 H5'' G 3 H5'' G 3 -2.277 -2.837 -16.364 25 H4' G 3 H4' G 3 -3.556 -5.034 -15.817 26 H3' G 3 H3' G 3 -2.944 -2.812 -13.825 27 H2' G 3 H2' G 3 -4.228 -4.000 -12.221 28 HO2' G 3 HO2' G 3 -5.972 -4.986 -12.901 29 H1' G 3 H1' G 3 -3.334 -6.530 -12.905 30 H8 G 3 H8 G 3 -0.192 -4.712 -12.836 31 H1 G 3 H1 G 3 -2.708 -4.922 -6.983 32 H21 G 3 H21 G 3 -4.837 -5.545 -7.089 33 H22 G 3 H22 G 3 -5.633 -5.909 -8.604 34 H5' A 4 H5' A 4 -7.543 -1.876 -14.678 35 H5'' A 4 H5'' A 4 -7.629 -0.168 -14.206 36 H4' A 4 H4' A 4 -8.972 -1.890 -12.802 37 H3' A 4 H3' A 4 -7.157 0.288 -11.738 38 H2' A 4 H2' A 4 -7.574 -0.431 -9.509 39 HO2' A 4 HO2' A 4 -9.317 -2.488 -9.986 40 H1' A 4 H1' A 4 -7.355 -3.103 -9.927 41 H8 A 4 H8 A 4 -4.722 -1.862 -12.171 42 H61 A 4 H61 A 4 -1.249 -0.603 -7.234 43 H62 A 4 H62 A 4 -1.250 -0.776 -8.974 44 H2 A 4 H2 A 4 -5.445 -1.382 -5.839 45 H5' G 5 H5' G 5 -10.040 0.329 -9.558 46 H5'' G 5 H5'' G 5 -11.396 1.469 -9.668 47 H4' G 5 H4' G 5 -11.118 1.463 -7.383 48 H3' G 5 H3' G 5 -9.198 3.527 -8.505 49 H2' G 5 H2' G 5 -8.310 3.898 -6.353 50 HO2' G 5 HO2' G 5 -10.818 3.475 -5.609 51 H1' G 5 H1' G 5 -8.438 1.287 -5.413 52 H8 G 5 H8 G 5 -7.036 1.589 -8.927 53 H1 G 5 H1 G 5 -2.708 2.773 -4.397 54 H21 G 5 H21 G 5 -3.698 2.878 -2.414 55 H22 G 5 H22 G 5 -5.422 2.660 -2.209 56 HN1 PSU 6 HN1 PSU 6 -6.906 7.498 -10.590 57 HN3 PSU 6 HN3 PSU 6 -2.988 8.035 -9.626 58 H6 PSU 6 H6 PSU 6 -7.484 7.054 -8.264 59 H1' PSU 6 H1' PSU 6 -5.068 6.495 -5.699 60 H2' PSU 6 H2' PSU 6 -5.612 9.222 -6.068 61 HO2' PSU 6 HO2' PSU 6 -5.702 7.605 -3.712 62 H3' PSU 6 H3' PSU 6 -7.939 9.133 -6.177 63 H4' PSU 6 H4' PSU 6 -8.027 6.773 -4.281 64 H5' PSU 6 H5' PSU 6 -10.160 7.301 -5.093 65 H5'' PSU 6 H5'' PSU 6 -9.549 7.761 -6.694 66 HN1 PSU 7 HN1 PSU 7 -5.788 12.585 -8.040 67 HN3 PSU 7 HN3 PSU 7 -1.825 12.544 -8.962 68 H6 PSU 7 H6 PSU 7 -5.360 11.651 -5.833 69 H1' PSU 7 H1' PSU 7 -2.133 10.319 -4.871 70 H2' PSU 7 H2' PSU 7 -3.269 12.993 -4.054 71 HO2' PSU 7 HO2' PSU 7 -0.930 12.253 -4.599 72 H3' PSU 7 H3' PSU 7 -3.501 12.247 -1.787 73 H4' PSU 7 H4' PSU 7 -4.501 9.768 -2.359 74 H5' PSU 7 H5' PSU 7 -6.284 11.129 -2.030 75 H5'' PSU 7 H5'' PSU 7 -5.460 12.524 -2.755 76 H5' G 8 H5' G 8 -0.873 12.268 -2.145 77 H5'' G 8 H5'' G 8 0.679 11.605 -1.603 78 H4' G 8 H4' G 8 0.545 14.149 -1.910 79 H3' G 8 H3' G 8 2.128 12.676 -0.251 80 H2' G 8 H2' G 8 0.773 12.642 1.686 81 HO2' G 8 HO2' G 8 2.520 14.783 1.663 82 H1' G 8 H1' G 8 -0.203 15.452 1.431 83 H8 G 8 H8 G 8 -2.687 12.893 0.508 84 H1 G 8 H1 G 8 -2.413 13.639 6.833 85 H21 G 8 H21 G 8 -0.613 14.805 7.384 86 H22 G 8 H22 G 8 0.520 15.403 6.194 87 H5' G 9 H5' G 9 4.234 13.661 -3.106 88 H5'' G 9 H5'' G 9 3.908 12.778 -1.599 89 H4' G 9 H4' G 9 6.615 13.448 -2.798 90 H3' G 9 H3' G 9 4.872 11.078 -2.810 91 H2' G 9 H2' G 9 6.189 9.615 -1.566 92 HO2' G 9 HO2' G 9 8.575 10.264 -1.353 93 H1' G 9 H1' G 9 7.521 11.237 0.147 94 H8 G 9 H8 G 9 6.095 11.359 2.359 95 H1 G 9 H1 G 9 0.815 9.514 -0.692 96 H21 G 9 H21 G 9 1.164 9.524 -2.883 97 H22 G 9 H22 G 9 2.697 9.985 -3.588 98 H5' G 10 H5' G 10 7.180 8.190 -2.922 99 H5'' G 10 H5'' G 10 6.439 7.155 -4.153 100 H4' G 10 H4' G 10 5.833 7.311 -1.367 101 H3' G 10 H3' G 10 5.133 5.593 -3.663 102 H2' G 10 H2' G 10 2.860 5.376 -3.318 103 HO2' G 10 HO2' G 10 3.541 5.718 -0.574 104 H1' G 10 H1' G 10 2.152 7.621 -1.916 105 H8 G 10 H8 G 10 4.319 8.721 -4.769 106 H1 G 10 H1 G 10 -1.609 7.312 -6.640 107 H21 G 10 H21 G 10 -2.697 6.276 -5.008 108 H22 G 10 H22 G 10 -1.961 5.931 -3.459 109 H5' C 11 H5' C 11 4.576 3.517 0.509 110 H5'' C 11 H5'' C 11 4.561 1.748 0.360 111 H4' C 11 H4' C 11 2.521 2.776 1.486 112 H3' C 11 H3' C 11 2.382 0.946 -0.932 113 H2' C 11 H2' C 11 0.035 1.132 -0.952 114 HO2' C 11 HO2' C 11 0.116 2.430 1.585 115 H1' C 11 H1' C 11 -0.192 3.773 -0.343 116 H41 C 11 H41 C 11 -0.630 3.026 -6.669 117 H42 C 11 H42 C 11 1.112 3.072 -6.798 118 H5 C 11 H5 C 11 2.580 3.160 -4.887 119 H6 C 11 H6 C 11 2.688 3.225 -2.442 120 HN1 PSU 12 HN1 PSU 12 0.469 -0.636 -2.916 121 HN3 PSU 12 HN3 PSU 12 -2.992 -0.995 -5.027 122 H6 PSU 12 H6 PSU 12 -0.723 -0.789 -0.798 123 H1' PSU 12 H1' PSU 12 -4.326 -0.612 -0.564 124 H2' PSU 12 H2' PSU 12 -3.454 -3.187 -0.939 125 HO2' PSU 12 HO2' PSU 12 -5.227 -1.915 0.643 126 H3' PSU 12 H3' PSU 12 -1.443 -3.078 0.289 127 H4' PSU 12 H4' PSU 12 -2.740 -1.382 2.431 128 H5' PSU 12 H5' PSU 12 -0.573 -0.224 2.370 129 H5'' PSU 12 H5'' PSU 12 -0.339 -1.973 2.557 130 H5' C 13 H5' C 13 -5.247 -5.434 1.574 131 H5'' C 13 H5'' C 13 -4.637 -7.102 1.575 132 H4' C 13 H4' C 13 -6.686 -6.691 0.126 133 H3' C 13 H3' C 13 -4.105 -7.934 -0.808 134 H2' C 13 H2' C 13 -4.760 -7.942 -3.046 135 HO2' C 13 HO2' C 13 -7.415 -7.808 -2.015 136 H1' C 13 H1' C 13 -6.350 -5.678 -3.120 137 H41 C 13 H41 C 13 -0.866 -4.263 -6.012 138 H42 C 13 H42 C 13 -0.024 -4.240 -4.478 139 H5 C 13 H5 C 13 -1.074 -4.801 -2.394 140 H6 C 13 H6 C 13 -3.164 -5.487 -1.308 141 HN1 PSU 14 HN1 PSU 14 -2.736 -8.508 -3.764 142 HN3 PSU 14 HN3 PSU 14 -1.819 -8.873 -7.715 143 H6 PSU 14 H6 PSU 14 -4.757 -9.841 -4.040 144 H1' PSU 14 H1' PSU 14 -5.957 -10.912 -7.334 145 H2' PSU 14 H2' PSU 14 -4.367 -12.610 -5.888 146 HO2' PSU 14 HO2' PSU 14 -6.908 -12.783 -7.032 147 H3' PSU 14 H3' PSU 14 -5.068 -12.090 -3.706 148 H4' PSU 14 H4' PSU 14 -7.948 -11.751 -4.514 149 H5' PSU 14 H5' PSU 14 -7.332 -9.492 -3.223 150 H5'' PSU 14 H5'' PSU 14 -7.664 -11.003 -2.352 151 H5' C 15 H5' C 15 -6.112 -14.891 -6.542 152 H5'' C 15 H5'' C 15 -5.826 -16.559 -6.006 153 H4' C 15 H4' C 15 -4.834 -16.262 -8.206 154 H3' C 15 H3' C 15 -2.914 -16.411 -5.866 155 H2' C 15 H2' C 15 -1.092 -16.293 -7.339 156 HO2' C 15 HO2' C 15 -2.685 -17.633 -8.969 157 H1' C 15 H1' C 15 -2.172 -14.419 -9.058 158 H41 C 15 H41 C 15 1.601 -11.133 -5.154 159 H42 C 15 H42 C 15 0.530 -11.418 -3.802 160 H5 C 15 H5 C 15 -1.457 -12.775 -3.954 161 H6 C 15 H6 C 15 -2.828 -14.173 -5.430 Start of MODEL 5 1 H5' G 1 H5' G 1 9.545 -7.666 -10.004 2 H5'' G 1 H5'' G 1 9.323 -6.199 -10.979 3 H4' G 1 H4' G 1 8.069 -7.803 -12.150 4 H3' G 1 H3' G 1 6.327 -6.202 -10.257 5 H2' G 1 H2' G 1 4.448 -7.483 -10.859 6 HO2' G 1 HO2' G 1 5.383 -9.000 -12.902 7 H1' G 1 H1' G 1 5.719 -9.934 -11.225 8 H8 G 1 H8 G 1 6.429 -7.855 -8.067 9 H1 G 1 H1 G 1 1.486 -11.848 -7.529 10 H21 G 1 H21 G 1 1.079 -12.813 -9.486 11 H22 G 1 H22 G 1 2.026 -12.473 -10.917 12 H5' A 2 H5' A 2 5.218 -6.004 -15.028 13 H5'' A 2 H5'' A 2 4.187 -4.566 -15.169 14 H4' A 2 H4' A 2 3.313 -6.670 -16.312 15 H3' A 2 H3' A 2 1.745 -5.094 -14.244 16 H2' A 2 H2' A 2 -0.082 -6.608 -14.497 17 HO2' A 2 HO2' A 2 0.136 -6.757 -16.835 18 H1' A 2 H1' A 2 1.362 -8.898 -14.414 19 H8 A 2 H8 A 2 3.061 -6.402 -12.164 20 H61 A 2 H61 A 2 -1.098 -7.777 -7.840 21 H62 A 2 H62 A 2 0.392 -6.925 -8.174 22 H2 A 2 H2 A 2 -2.382 -9.727 -11.670 23 H5' G 3 H5' G 3 -1.372 -4.552 -17.175 24 H5'' G 3 H5'' G 3 -2.047 -2.986 -16.685 25 H4' G 3 H4' G 3 -3.421 -5.136 -16.178 26 H3' G 3 H3' G 3 -2.797 -2.956 -14.139 27 H2' G 3 H2' G 3 -4.182 -4.139 -12.601 28 HO2' G 3 HO2' G 3 -5.001 -5.870 -14.716 29 H1' G 3 H1' G 3 -3.333 -6.675 -13.289 30 H8 G 3 H8 G 3 -0.146 -4.943 -13.093 31 H1 G 3 H1 G 3 -2.872 -5.103 -7.332 32 H21 G 3 H21 G 3 -5.008 -5.677 -7.523 33 H22 G 3 H22 G 3 -5.753 -6.020 -9.069 34 H5' A 4 H5' A 4 -7.379 -2.198 -14.754 35 H5'' A 4 H5'' A 4 -7.522 -0.474 -14.357 36 H4' A 4 H4' A 4 -8.740 -2.183 -12.829 37 H3' A 4 H3' A 4 -6.971 0.100 -11.915 38 H2' A 4 H2' A 4 -7.331 -0.538 -9.654 39 HO2' A 4 HO2' A 4 -9.039 -2.629 -9.943 40 H1' A 4 H1' A 4 -7.121 -3.236 -9.975 41 H8 A 4 H8 A 4 -4.448 -2.035 -12.181 42 H61 A 4 H61 A 4 -1.067 -0.672 -7.222 43 H62 A 4 H62 A 4 -1.045 -0.890 -8.958 44 H2 A 4 H2 A 4 -5.296 -1.411 -5.875 45 H5' G 5 H5' G 5 -9.976 -0.084 -9.429 46 H5'' G 5 H5'' G 5 -11.098 1.292 -9.467 47 H4' G 5 H4' G 5 -10.672 0.868 -7.165 48 H3' G 5 H3' G 5 -9.143 3.206 -8.319 49 H2' G 5 H2' G 5 -7.946 3.513 -6.325 50 HO2' G 5 HO2' G 5 -9.116 3.499 -4.570 51 H1' G 5 H1' G 5 -7.808 0.856 -5.475 52 H8 G 5 H8 G 5 -6.780 1.449 -9.085 53 H1 G 5 H1 G 5 -2.056 2.434 -4.921 54 H21 G 5 H21 G 5 -2.846 2.390 -2.851 55 H22 G 5 H22 G 5 -4.536 2.117 -2.494 56 HN1 PSU 6 HN1 PSU 6 -7.067 7.263 -10.357 57 HN3 PSU 6 HN3 PSU 6 -3.091 7.794 -9.661 58 H6 PSU 6 H6 PSU 6 -7.474 6.748 -8.011 59 H1' PSU 6 H1' PSU 6 -4.854 6.156 -5.635 60 H2' PSU 6 H2' PSU 6 -5.478 8.850 -5.874 61 HO2' PSU 6 HO2' PSU 6 -5.254 8.861 -3.647 62 H3' PSU 6 H3' PSU 6 -7.809 8.684 -6.032 63 H4' PSU 6 H4' PSU 6 -7.845 6.353 -4.099 64 H5' PSU 6 H5' PSU 6 -9.990 6.780 -4.919 65 H5'' PSU 6 H5'' PSU 6 -9.395 7.272 -6.516 66 HN1 PSU 7 HN1 PSU 7 -6.171 12.001 -7.509 67 HN3 PSU 7 HN3 PSU 7 -2.411 13.092 -8.620 68 H6 PSU 7 H6 PSU 7 -5.368 11.127 -5.384 69 H1' PSU 7 H1' PSU 7 -1.881 10.627 -4.669 70 H2' PSU 7 H2' PSU 7 -3.426 13.021 -3.717 71 HO2' PSU 7 HO2' PSU 7 -1.390 13.606 -3.769 72 H3' PSU 7 H3' PSU 7 -3.548 12.226 -1.471 73 H4' PSU 7 H4' PSU 7 -4.092 9.615 -2.012 74 H5' PSU 7 H5' PSU 7 -6.115 10.598 -1.793 75 H5'' PSU 7 H5'' PSU 7 -5.515 12.140 -2.433 76 H5' G 8 H5' G 8 -0.461 12.308 -1.847 77 H5'' G 8 H5'' G 8 1.044 12.054 -0.942 78 H4' G 8 H4' G 8 0.309 14.491 -1.725 79 H3' G 8 H3' G 8 2.228 13.628 0.005 80 H2' G 8 H2' G 8 0.785 13.388 1.917 81 HO2' G 8 HO2' G 8 1.048 15.521 3.093 82 H1' G 8 H1' G 8 -0.507 16.055 1.343 83 H8 G 8 H8 G 8 -2.996 13.506 1.058 84 H1 G 8 H1 G 8 -1.805 14.536 7.237 85 H21 G 8 H21 G 8 0.093 15.654 7.470 86 H22 G 8 H22 G 8 1.068 16.148 6.103 87 H5' G 9 H5' G 9 3.973 14.095 -2.739 88 H5'' G 9 H5'' G 9 3.490 12.785 -1.642 89 H4' G 9 H4' G 9 6.245 13.711 -2.424 90 H3' G 9 H3' G 9 4.640 11.252 -2.639 91 H2' G 9 H2' G 9 5.967 9.798 -1.403 92 HO2' G 9 HO2' G 9 8.319 10.835 -1.048 93 H1' G 9 H1' G 9 7.119 11.382 0.459 94 H8 G 9 H8 G 9 5.566 11.339 2.581 95 H1 G 9 H1 G 9 0.560 9.397 -0.854 96 H21 G 9 H21 G 9 1.035 9.533 -3.018 97 H22 G 9 H22 G 9 2.581 10.103 -3.607 98 H5' G 10 H5' G 10 7.162 8.423 -2.658 99 H5'' G 10 H5'' G 10 6.571 7.430 -4.001 100 H4' G 10 H4' G 10 5.738 7.388 -1.278 101 H3' G 10 H3' G 10 5.279 5.806 -3.727 102 H2' G 10 H2' G 10 2.995 5.510 -3.587 103 HO2' G 10 HO2' G 10 2.282 5.927 -1.083 104 H1' G 10 H1' G 10 2.110 7.606 -2.046 105 H8 G 10 H8 G 10 4.398 8.922 -4.742 106 H1 G 10 H1 G 10 -1.475 7.674 -6.880 107 H21 G 10 H21 G 10 -2.619 6.548 -5.350 108 H22 G 10 H22 G 10 -1.933 6.102 -3.804 109 H5' C 11 H5' C 11 5.020 3.208 0.417 110 H5'' C 11 H5'' C 11 4.942 1.485 -0.006 111 H4' C 11 H4' C 11 3.080 2.420 1.519 112 H3' C 11 H3' C 11 2.730 0.726 -0.957 113 H2' C 11 H2' C 11 0.381 0.912 -0.850 114 HO2' C 11 HO2' C 11 0.394 2.240 1.634 115 H1' C 11 H1' C 11 0.156 3.509 -0.177 116 H41 C 11 H41 C 11 -0.170 2.950 -6.535 117 H42 C 11 H42 C 11 1.569 3.105 -6.636 118 H5 C 11 H5 C 11 3.000 3.204 -4.698 119 H6 C 11 H6 C 11 3.069 3.187 -2.250 120 HN1 PSU 12 HN1 PSU 12 0.729 -0.888 -3.228 121 HN3 PSU 12 HN3 PSU 12 -2.878 -1.236 -5.080 122 H6 PSU 12 H6 PSU 12 -0.307 -1.030 -1.031 123 H1' PSU 12 H1' PSU 12 -3.814 -0.719 -0.501 124 H2' PSU 12 H2' PSU 12 -3.205 -3.372 -1.041 125 HO2' PSU 12 HO2' PSU 12 -5.017 -2.149 0.239 126 H3' PSU 12 H3' PSU 12 -1.207 -3.556 0.186 127 H4' PSU 12 H4' PSU 12 -2.251 -1.705 2.341 128 H5' PSU 12 H5' PSU 12 -0.001 -1.020 2.521 129 H5'' PSU 12 H5'' PSU 12 0.115 -2.760 2.189 130 H5' C 13 H5' C 13 -5.321 -4.746 0.848 131 H5'' C 13 H5'' C 13 -5.239 -6.457 1.312 132 H4' C 13 H4' C 13 -6.863 -6.261 -0.461 133 H3' C 13 H3' C 13 -4.198 -7.499 -1.191 134 H2' C 13 H2' C 13 -4.847 -7.709 -3.445 135 HO2' C 13 HO2' C 13 -7.409 -6.929 -3.479 136 H1' C 13 H1' C 13 -6.251 -5.363 -3.713 137 H41 C 13 H41 C 13 -0.519 -4.139 -6.144 138 H42 C 13 H42 C 13 0.244 -4.338 -4.584 139 H5 C 13 H5 C 13 -0.958 -4.980 -2.599 140 H6 C 13 H6 C 13 -3.159 -5.549 -1.674 141 HN1 PSU 14 HN1 PSU 14 -2.956 -8.515 -4.199 142 HN3 PSU 14 HN3 PSU 14 -2.399 -9.041 -8.199 143 H6 PSU 14 H6 PSU 14 -5.077 -9.710 -4.266 144 H1' PSU 14 H1' PSU 14 -6.633 -10.764 -7.409 145 H2' PSU 14 H2' PSU 14 -4.982 -12.561 -6.178 146 HO2' PSU 14 HO2' PSU 14 -7.470 -13.564 -6.027 147 H3' PSU 14 H3' PSU 14 -5.410 -12.008 -3.928 148 H4' PSU 14 H4' PSU 14 -8.355 -11.607 -4.455 149 H5' PSU 14 H5' PSU 14 -7.713 -9.456 -3.112 150 H5'' PSU 14 H5'' PSU 14 -7.764 -11.018 -2.269 151 H5' C 15 H5' C 15 -6.618 -15.149 -6.245 152 H5'' C 15 H5'' C 15 -6.131 -16.744 -5.639 153 H4' C 15 H4' C 15 -5.330 -16.472 -7.928 154 H3' C 15 H3' C 15 -3.270 -16.384 -5.712 155 H2' C 15 H2' C 15 -1.545 -16.146 -7.280 156 HO2' C 15 HO2' C 15 -3.219 -17.578 -8.841 157 H1' C 15 H1' C 15 -2.853 -14.423 -8.987 158 H41 C 15 H41 C 15 0.750 -10.731 -5.272 159 H42 C 15 H42 C 15 -0.336 -10.973 -3.920 160 H5 C 15 H5 C 15 -2.241 -12.447 -4.005 161 H6 C 15 H6 C 15 -3.510 -14.015 -5.397 Start of MODEL 6 1 H5' G 1 H5' G 1 9.794 -9.163 -12.693 2 H5'' G 1 H5'' G 1 9.518 -7.423 -12.914 3 H4' G 1 H4' G 1 7.714 -8.752 -13.959 4 H3' G 1 H3' G 1 7.088 -7.000 -11.562 5 H2' G 1 H2' G 1 4.847 -7.672 -11.621 6 HO2' G 1 HO2' G 1 4.552 -9.050 -13.877 7 H1' G 1 H1' G 1 5.219 -10.287 -12.563 8 H8 G 1 H8 G 1 7.091 -8.770 -9.540 9 H1 G 1 H1 G 1 1.795 -11.990 -8.047 10 H21 G 1 H21 G 1 0.774 -12.667 -9.894 11 H22 G 1 H22 G 1 1.400 -12.328 -11.492 12 H5' A 2 H5' A 2 4.941 -6.278 -15.929 13 H5'' A 2 H5'' A 2 3.901 -4.850 -15.766 14 H4' A 2 H4' A 2 2.860 -7.013 -16.754 15 H3' A 2 H3' A 2 1.660 -5.340 -14.514 16 H2' A 2 H2' A 2 -0.230 -6.814 -14.511 17 HO2' A 2 HO2' A 2 -0.567 -8.324 -16.133 18 H1' A 2 H1' A 2 1.184 -9.116 -14.519 19 H8 A 2 H8 A 2 3.226 -6.612 -12.601 20 H61 A 2 H61 A 2 -0.403 -7.681 -7.743 21 H62 A 2 H62 A 2 1.068 -6.909 -8.292 22 H2 A 2 H2 A 2 -2.244 -9.672 -11.325 23 H5' G 3 H5' G 3 -1.727 -4.448 -17.227 24 H5'' G 3 H5'' G 3 -2.222 -2.857 -16.613 25 H4' G 3 H4' G 3 -3.742 -4.902 -16.094 26 H3' G 3 H3' G 3 -2.758 -2.879 -14.041 27 H2' G 3 H2' G 3 -4.106 -3.989 -12.421 28 HO2' G 3 HO2' G 3 -5.810 -5.244 -12.948 29 H1' G 3 H1' G 3 -3.493 -6.555 -13.206 30 H8 G 3 H8 G 3 -0.213 -4.972 -13.385 31 H1 G 3 H1 G 3 -2.198 -5.187 -7.333 32 H21 G 3 H21 G 3 -4.366 -5.667 -7.261 33 H22 G 3 H22 G 3 -5.316 -5.936 -8.705 34 H5' A 4 H5' A 4 -7.303 -1.537 -14.818 35 H5'' A 4 H5'' A 4 -7.325 0.151 -14.267 36 H4' A 4 H4' A 4 -8.821 -1.552 -13.012 37 H3' A 4 H3' A 4 -6.954 0.485 -11.797 38 H2' A 4 H2' A 4 -7.374 -0.326 -9.612 39 HO2' A 4 HO2' A 4 -9.116 -1.757 -9.182 40 H1' A 4 H1' A 4 -7.323 -2.988 -10.129 41 H8 A 4 H8 A 4 -4.620 -1.877 -12.329 42 H61 A 4 H61 A 4 -1.074 -0.863 -7.390 43 H62 A 4 H62 A 4 -1.092 -1.022 -9.132 44 H2 A 4 H2 A 4 -5.308 -1.413 -5.988 45 H5' G 5 H5' G 5 -9.764 0.471 -9.613 46 H5'' G 5 H5'' G 5 -11.106 1.634 -9.622 47 H4' G 5 H4' G 5 -10.775 1.486 -7.349 48 H3' G 5 H3' G 5 -8.864 3.593 -8.400 49 H2' G 5 H2' G 5 -7.892 3.817 -6.265 50 HO2' G 5 HO2' G 5 -10.337 3.528 -5.434 51 H1' G 5 H1' G 5 -8.042 1.165 -5.465 52 H8 G 5 H8 G 5 -6.745 1.680 -9.003 53 H1 G 5 H1 G 5 -2.245 2.318 -4.536 54 H21 G 5 H21 G 5 -3.168 2.314 -2.522 55 H22 G 5 H22 G 5 -4.894 2.152 -2.279 56 HN1 PSU 6 HN1 PSU 6 -7.013 7.462 -10.379 57 HN3 PSU 6 HN3 PSU 6 -3.102 7.934 -9.354 58 H6 PSU 6 H6 PSU 6 -7.642 7.059 -8.061 59 H1' PSU 6 H1' PSU 6 -5.292 6.483 -5.446 60 H2' PSU 6 H2' PSU 6 -5.841 9.252 -5.906 61 HO2' PSU 6 HO2' PSU 6 -4.716 9.159 -4.128 62 H3' PSU 6 H3' PSU 6 -8.153 9.202 -5.675 63 H4' PSU 6 H4' PSU 6 -8.036 6.724 -3.942 64 H5' PSU 6 H5' PSU 6 -10.240 7.404 -4.511 65 H5'' PSU 6 H5'' PSU 6 -9.781 7.788 -6.182 66 HN1 PSU 7 HN1 PSU 7 -5.382 11.796 -7.941 67 HN3 PSU 7 HN3 PSU 7 -1.355 11.686 -8.520 68 H6 PSU 7 H6 PSU 7 -5.128 11.317 -5.567 69 H1' PSU 7 H1' PSU 7 -1.978 10.319 -4.094 70 H2' PSU 7 H2' PSU 7 -2.976 13.112 -4.104 71 HO2' PSU 7 HO2' PSU 7 -0.784 12.637 -3.858 72 H3' PSU 7 H3' PSU 7 -4.361 12.922 -2.284 73 H4' PSU 7 H4' PSU 7 -3.703 10.067 -1.710 74 H5' PSU 7 H5' PSU 7 -6.024 9.793 -1.750 75 H5'' PSU 7 H5'' PSU 7 -5.860 11.479 -1.219 76 H5' G 8 H5' G 8 0.014 12.527 -2.292 77 H5'' G 8 H5'' G 8 1.425 12.241 -1.260 78 H4' G 8 H4' G 8 0.653 14.707 -2.004 79 H3' G 8 H3' G 8 2.479 13.726 -0.132 80 H2' G 8 H2' G 8 1.026 13.800 1.748 81 HO2' G 8 HO2' G 8 1.273 16.069 2.642 82 H1' G 8 H1' G 8 -0.213 16.368 0.749 83 H8 G 8 H8 G 8 -2.014 13.056 1.306 84 H1 G 8 H1 G 8 -2.842 17.235 6.052 85 H21 G 8 H21 G 8 -1.500 18.978 5.770 86 H22 G 8 H22 G 8 -0.403 19.110 4.413 87 H5' G 9 H5' G 9 4.045 13.583 -3.030 88 H5'' G 9 H5'' G 9 3.570 12.582 -1.644 89 H4' G 9 H4' G 9 6.324 13.098 -2.760 90 H3' G 9 H3' G 9 4.487 10.803 -2.527 91 H2' G 9 H2' G 9 5.791 9.407 -1.204 92 HO2' G 9 HO2' G 9 7.880 9.176 -1.588 93 H1' G 9 H1' G 9 7.238 11.110 0.321 94 H8 G 9 H8 G 9 5.896 11.431 2.561 95 H1 G 9 H1 G 9 0.482 9.459 -0.161 96 H21 G 9 H21 G 9 0.758 9.307 -2.362 97 H22 G 9 H22 G 9 2.274 9.690 -3.146 98 H5' G 10 H5' G 10 6.804 7.881 -2.414 99 H5'' G 10 H5'' G 10 6.081 6.744 -3.561 100 H4' G 10 H4' G 10 5.529 7.016 -0.788 101 H3' G 10 H3' G 10 4.758 5.223 -3.007 102 H2' G 10 H2' G 10 2.498 5.028 -2.592 103 HO2' G 10 HO2' G 10 3.051 4.161 -0.456 104 H1' G 10 H1' G 10 1.863 7.273 -1.119 105 H8 G 10 H8 G 10 3.758 8.249 -4.232 106 H1 G 10 H1 G 10 -2.401 7.049 -5.353 107 H21 G 10 H21 G 10 -3.331 6.109 -3.577 108 H22 G 10 H22 G 10 -2.434 5.775 -2.111 109 H5' C 11 H5' C 11 4.453 2.958 1.232 110 H5'' C 11 H5'' C 11 4.334 1.221 0.886 111 H4' C 11 H4' C 11 2.416 2.329 2.232 112 H3' C 11 H3' C 11 2.130 0.491 -0.161 113 H2' C 11 H2' C 11 -0.231 0.706 -0.054 114 HO2' C 11 HO2' C 11 0.305 1.216 2.576 115 H1' C 11 H1' C 11 -0.372 3.364 0.346 116 H41 C 11 H41 C 11 -0.534 2.349 -5.958 117 H42 C 11 H42 C 11 1.209 2.484 -6.016 118 H5 C 11 H5 C 11 2.585 2.696 -4.051 119 H6 C 11 H6 C 11 2.587 2.832 -1.605 120 HN1 PSU 12 HN1 PSU 12 0.477 -0.897 -2.950 121 HN3 PSU 12 HN3 PSU 12 -2.779 -1.216 -5.372 122 H6 PSU 12 H6 PSU 12 -0.910 -1.045 -0.956 123 H1' PSU 12 H1' PSU 12 -4.559 -0.947 -1.096 124 H2' PSU 12 H2' PSU 12 -3.306 -3.424 -1.121 125 HO2' PSU 12 HO2' PSU 12 -5.502 -3.124 -0.624 126 H3' PSU 12 H3' PSU 12 -1.598 -2.975 0.437 127 H4' PSU 12 H4' PSU 12 -3.473 -1.233 2.061 128 H5' PSU 12 H5' PSU 12 -1.371 0.196 2.134 129 H5'' PSU 12 H5'' PSU 12 -1.233 -1.397 2.907 130 H5' C 13 H5' C 13 -5.088 -4.498 0.802 131 H5'' C 13 H5'' C 13 -5.378 -6.117 1.467 132 H4' C 13 H4' C 13 -6.607 -6.123 -0.544 133 H3' C 13 H3' C 13 -3.859 -7.358 -0.915 134 H2' C 13 H2' C 13 -4.316 -7.703 -3.189 135 HO2' C 13 HO2' C 13 -6.407 -7.877 -3.993 136 H1' C 13 H1' C 13 -5.971 -5.466 -3.605 137 H41 C 13 H41 C 13 -0.528 -4.158 -6.599 138 H42 C 13 H42 C 13 0.376 -4.241 -5.102 139 H5 C 13 H5 C 13 -0.620 -4.811 -2.994 140 H6 C 13 H6 C 13 -2.703 -5.405 -1.842 141 HN1 PSU 14 HN1 PSU 14 -2.408 -8.478 -3.906 142 HN3 PSU 14 HN3 PSU 14 -1.865 -8.849 -7.923 143 H6 PSU 14 H6 PSU 14 -4.505 -9.716 -4.005 144 H1' PSU 14 H1' PSU 14 -6.034 -10.717 -7.193 145 H2' PSU 14 H2' PSU 14 -4.372 -12.476 -5.906 146 HO2' PSU 14 HO2' PSU 14 -5.760 -13.469 -7.208 147 H3' PSU 14 H3' PSU 14 -4.900 -11.934 -3.671 148 H4' PSU 14 H4' PSU 14 -7.827 -11.599 -4.342 149 H5' PSU 14 H5' PSU 14 -7.375 -9.489 -2.918 150 H5'' PSU 14 H5'' PSU 14 -7.311 -11.065 -2.102 151 H5' C 15 H5' C 15 -6.180 -14.781 -6.079 152 H5'' C 15 H5'' C 15 -5.971 -16.486 -5.634 153 H4' C 15 H4' C 15 -5.144 -16.269 -7.871 154 H3' C 15 H3' C 15 -2.967 -16.332 -5.761 155 H2' C 15 H2' C 15 -1.332 -16.244 -7.445 156 HO2' C 15 HO2' C 15 -3.043 -16.359 -9.629 157 H1' C 15 H1' C 15 -2.635 -14.439 -9.082 158 H41 C 15 H41 C 15 1.530 -10.951 -5.796 159 H42 C 15 H42 C 15 0.595 -11.141 -4.329 160 H5 C 15 H5 C 15 -1.385 -12.506 -4.195 161 H6 C 15 H6 C 15 -2.884 -14.004 -5.430 Start of MODEL 7 1 H5' G 1 H5' G 1 9.665 -8.439 -9.703 2 H5'' G 1 H5'' G 1 9.691 -6.930 -10.639 3 H4' G 1 H4' G 1 8.323 -8.188 -12.003 4 H3' G 1 H3' G 1 6.594 -6.828 -9.923 5 H2' G 1 H2' G 1 4.687 -7.976 -10.678 6 HO2' G 1 HO2' G 1 4.799 -7.641 -12.866 7 H1' G 1 H1' G 1 5.853 -10.403 -11.290 8 H8 G 1 H8 G 1 6.963 -8.911 -7.968 9 H1 G 1 H1 G 1 1.431 -12.061 -7.601 10 H21 G 1 H21 G 1 0.745 -12.629 -9.626 11 H22 G 1 H22 G 1 1.646 -12.234 -11.073 12 H5' A 2 H5' A 2 5.523 -5.876 -14.618 13 H5'' A 2 H5'' A 2 4.484 -4.437 -14.564 14 H4' A 2 H4' A 2 3.641 -6.403 -15.981 15 H3' A 2 H3' A 2 2.079 -4.967 -13.834 16 H2' A 2 H2' A 2 0.233 -6.446 -14.104 17 HO2' A 2 HO2' A 2 1.446 -7.805 -16.266 18 H1' A 2 H1' A 2 1.615 -8.761 -14.206 19 H8 A 2 H8 A 2 3.556 -6.557 -11.898 20 H61 A 2 H61 A 2 -0.507 -7.874 -7.466 21 H62 A 2 H62 A 2 1.037 -7.134 -7.822 22 H2 A 2 H2 A 2 -2.137 -9.428 -11.348 23 H5' G 3 H5' G 3 -0.781 -4.613 -16.810 24 H5'' G 3 H5'' G 3 -1.667 -3.088 -16.614 25 H4' G 3 H4' G 3 -2.969 -5.173 -15.982 26 H3' G 3 H3' G 3 -2.469 -2.921 -13.993 27 H2' G 3 H2' G 3 -3.812 -4.090 -12.425 28 HO2' G 3 HO2' G 3 -4.863 -6.156 -13.407 29 H1' G 3 H1' G 3 -2.928 -6.640 -13.039 30 H8 G 3 H8 G 3 0.168 -4.680 -12.852 31 H1 G 3 H1 G 3 -2.473 -5.257 -7.082 32 H21 G 3 H21 G 3 -4.555 -5.999 -7.269 33 H22 G 3 H22 G 3 -5.292 -6.353 -8.816 34 H5' A 4 H5' A 4 -7.046 -1.916 -15.105 35 H5'' A 4 H5'' A 4 -7.085 -0.201 -14.645 36 H4' A 4 H4' A 4 -8.556 -1.857 -13.295 37 H3' A 4 H3' A 4 -6.712 0.261 -12.176 38 H2' A 4 H2' A 4 -7.200 -0.439 -9.958 39 HO2' A 4 HO2' A 4 -9.447 -1.598 -11.207 40 H1' A 4 H1' A 4 -7.079 -3.115 -10.344 41 H8 A 4 H8 A 4 -4.356 -1.980 -12.536 42 H61 A 4 H61 A 4 -0.931 -0.840 -7.542 43 H62 A 4 H62 A 4 -0.909 -1.022 -9.282 44 H2 A 4 H2 A 4 -5.181 -1.452 -6.222 45 H5' G 5 H5' G 5 -9.870 -0.004 -9.778 46 H5'' G 5 H5'' G 5 -10.937 1.415 -9.824 47 H4' G 5 H4' G 5 -10.673 0.767 -7.520 48 H3' G 5 H3' G 5 -9.226 3.257 -8.417 49 H2' G 5 H2' G 5 -8.083 3.475 -6.385 50 HO2' G 5 HO2' G 5 -9.058 3.074 -4.537 51 H1' G 5 H1' G 5 -7.808 0.791 -5.704 52 H8 G 5 H8 G 5 -6.795 1.555 -9.270 53 H1 G 5 H1 G 5 -2.212 2.846 -5.033 54 H21 G 5 H21 G 5 -3.022 2.695 -2.974 55 H22 G 5 H22 G 5 -4.688 2.276 -2.647 56 HN1 PSU 6 HN1 PSU 6 -7.328 7.277 -10.082 57 HN3 PSU 6 HN3 PSU 6 -3.405 7.924 -9.215 58 H6 PSU 6 H6 PSU 6 -7.819 6.719 -7.764 59 H1' PSU 6 H1' PSU 6 -5.263 6.140 -5.305 60 H2' PSU 6 H2' PSU 6 -6.065 8.828 -5.508 61 HO2' PSU 6 HO2' PSU 6 -4.932 7.340 -3.764 62 H3' PSU 6 H3' PSU 6 -8.380 8.515 -5.533 63 H4' PSU 6 H4' PSU 6 -8.130 6.057 -3.776 64 H5' PSU 6 H5' PSU 6 -10.349 6.334 -4.419 65 H5'' PSU 6 H5'' PSU 6 -9.919 7.045 -5.987 66 HN1 PSU 7 HN1 PSU 7 -7.214 13.232 -5.795 67 HN3 PSU 7 HN3 PSU 7 -3.723 15.324 -5.791 68 H6 PSU 7 H6 PSU 7 -6.107 11.244 -4.928 69 H1' PSU 7 H1' PSU 7 -2.861 10.582 -5.123 70 H2' PSU 7 H2' PSU 7 -2.498 12.369 -3.057 71 HO2' PSU 7 HO2' PSU 7 -1.713 9.652 -2.797 72 H3' PSU 7 H3' PSU 7 -3.966 11.772 -1.383 73 H4' PSU 7 H4' PSU 7 -4.928 9.191 -2.128 74 H5' PSU 7 H5' PSU 7 -6.573 10.708 -1.510 75 H5'' PSU 7 H5'' PSU 7 -5.861 12.029 -2.460 76 H5' G 8 H5' G 8 -0.156 11.352 -1.555 77 H5'' G 8 H5'' G 8 0.415 11.442 0.122 78 H4' G 8 H4' G 8 0.317 13.532 -1.923 79 H3' G 8 H3' G 8 2.200 12.749 -0.162 80 H2' G 8 H2' G 8 1.093 13.154 1.888 81 HO2' G 8 HO2' G 8 2.826 14.996 1.250 82 H1' G 8 H1' G 8 -0.241 15.690 1.158 83 H8 G 8 H8 G 8 -2.660 13.039 0.840 84 H1 G 8 H1 G 8 -1.500 14.120 7.016 85 H21 G 8 H21 G 8 0.348 15.329 7.242 86 H22 G 8 H22 G 8 1.293 15.865 5.871 87 H5' G 9 H5' G 9 3.766 13.277 -3.961 88 H5'' G 9 H5'' G 9 3.558 12.630 -2.321 89 H4' G 9 H4' G 9 6.186 13.402 -3.637 90 H3' G 9 H3' G 9 4.675 10.884 -3.481 91 H2' G 9 H2' G 9 6.091 9.664 -2.112 92 HO2' G 9 HO2' G 9 8.119 11.289 -3.266 93 H1' G 9 H1' G 9 7.412 11.557 -0.651 94 H8 G 9 H8 G 9 6.325 11.434 1.663 95 H1 G 9 H1 G 9 0.776 9.315 -0.635 96 H21 G 9 H21 G 9 0.796 9.387 -2.848 97 H22 G 9 H22 G 9 2.175 9.958 -3.759 98 H5' G 10 H5' G 10 7.173 8.158 -3.261 99 H5'' G 10 H5'' G 10 6.611 7.000 -4.478 100 H4' G 10 H4' G 10 5.801 7.147 -1.799 101 H3' G 10 H3' G 10 5.126 5.540 -4.184 102 H2' G 10 H2' G 10 2.839 5.394 -3.926 103 HO2' G 10 HO2' G 10 1.895 5.152 -1.915 104 H1' G 10 H1' G 10 2.174 7.557 -2.353 105 H8 G 10 H8 G 10 4.309 8.693 -5.246 106 H1 G 10 H1 G 10 -1.775 7.731 -6.887 107 H21 G 10 H21 G 10 -2.850 6.694 -5.248 108 H22 G 10 H22 G 10 -2.068 6.240 -3.749 109 H5' C 11 H5' C 11 4.771 3.396 -0.017 110 H5'' C 11 H5'' C 11 4.778 1.622 -0.114 111 H4' C 11 H4' C 11 2.823 2.567 1.155 112 H3' C 11 H3' C 11 2.541 0.806 -1.280 113 H2' C 11 H2' C 11 0.203 1.058 -1.310 114 HO2' C 11 HO2' C 11 -0.566 2.386 0.764 115 H1' C 11 H1' C 11 -0.002 3.674 -0.632 116 H41 C 11 H41 C 11 -0.255 3.215 -6.989 117 H42 C 11 H42 C 11 1.492 3.189 -7.070 118 H5 C 11 H5 C 11 2.902 3.141 -5.116 119 H6 C 11 H6 C 11 2.938 3.110 -2.664 120 HN1 PSU 12 HN1 PSU 12 0.662 -0.930 -3.146 121 HN3 PSU 12 HN3 PSU 12 -2.800 -1.188 -5.270 122 H6 PSU 12 H6 PSU 12 -0.551 -0.880 -1.037 123 H1' PSU 12 H1' PSU 12 -4.114 -0.409 -0.848 124 H2' PSU 12 H2' PSU 12 -3.538 -3.072 -1.100 125 HO2' PSU 12 HO2' PSU 12 -4.843 -1.607 0.954 126 H3' PSU 12 H3' PSU 12 -1.514 -3.137 0.111 127 H4' PSU 12 H4' PSU 12 -2.582 -1.226 2.195 128 H5' PSU 12 H5' PSU 12 -0.323 -0.344 2.124 129 H5'' PSU 12 H5'' PSU 12 -0.235 -2.114 2.224 130 H5' C 13 H5' C 13 -5.272 -4.444 0.878 131 H5'' C 13 H5'' C 13 -5.315 -6.113 1.483 132 H4' C 13 H4' C 13 -6.862 -6.050 -0.327 133 H3' C 13 H3' C 13 -4.186 -7.290 -0.995 134 H2' C 13 H2' C 13 -4.813 -7.585 -3.244 135 HO2' C 13 HO2' C 13 -7.481 -7.214 -2.293 136 H1' C 13 H1' C 13 -6.244 -5.264 -3.607 137 H41 C 13 H41 C 13 -0.481 -4.150 -6.050 138 H42 C 13 H42 C 13 0.245 -4.179 -4.459 139 H5 C 13 H5 C 13 -0.982 -4.666 -2.460 140 H6 C 13 H6 C 13 -3.187 -5.211 -1.528 141 HN1 PSU 14 HN1 PSU 14 -2.742 -8.499 -3.886 142 HN3 PSU 14 HN3 PSU 14 -2.118 -8.701 -7.904 143 H6 PSU 14 H6 PSU 14 -4.916 -9.574 -4.099 144 H1' PSU 14 H1' PSU 14 -6.408 -10.333 -7.376 145 H2' PSU 14 H2' PSU 14 -4.942 -12.231 -6.058 146 HO2' PSU 14 HO2' PSU 14 -6.340 -13.235 -7.298 147 H3' PSU 14 H3' PSU 14 -5.494 -11.681 -3.837 148 H4' PSU 14 H4' PSU 14 -8.366 -11.098 -4.557 149 H5' PSU 14 H5' PSU 14 -7.742 -9.028 -3.126 150 H5'' PSU 14 H5'' PSU 14 -7.840 -10.603 -2.313 151 H5' C 15 H5' C 15 -6.815 -14.653 -6.347 152 H5'' C 15 H5'' C 15 -6.430 -16.298 -5.801 153 H4' C 15 H4' C 15 -5.562 -15.954 -8.061 154 H3' C 15 H3' C 15 -3.557 -16.118 -5.798 155 H2' C 15 H2' C 15 -1.790 -15.951 -7.330 156 HO2' C 15 HO2' C 15 -3.736 -16.480 -9.360 157 H1' C 15 H1' C 15 -2.954 -14.076 -8.993 158 H41 C 15 H41 C 15 0.938 -10.812 -5.174 159 H42 C 15 H42 C 15 -0.136 -11.048 -3.814 160 H5 C 15 H5 C 15 -2.145 -12.374 -3.932 161 H6 C 15 H6 C 15 -3.542 -13.779 -5.374 Start of MODEL 8 1 H5' G 1 H5' G 1 9.469 -5.671 -9.835 2 H5'' G 1 H5'' G 1 8.768 -4.188 -10.514 3 H4' G 1 H4' G 1 7.953 -6.103 -11.781 4 H3' G 1 H3' G 1 6.005 -4.642 -9.984 5 H2' G 1 H2' G 1 4.295 -6.162 -10.480 6 HO2' G 1 HO2' G 1 4.690 -5.983 -12.797 7 H1' G 1 H1' G 1 5.809 -8.476 -10.765 8 H8 G 1 H8 G 1 6.345 -6.182 -7.727 9 H1 G 1 H1 G 1 1.864 -10.636 -6.875 10 H21 G 1 H21 G 1 1.528 -11.746 -8.766 11 H22 G 1 H22 G 1 2.408 -11.387 -10.234 12 H5' A 2 H5' A 2 5.049 -4.921 -14.755 13 H5'' A 2 H5'' A 2 3.928 -3.585 -15.084 14 H4' A 2 H4' A 2 3.235 -5.732 -16.168 15 H3' A 2 H3' A 2 1.489 -4.373 -14.099 16 H2' A 2 H2' A 2 -0.134 -6.107 -14.309 17 HO2' A 2 HO2' A 2 1.338 -7.398 -16.356 18 H1' A 2 H1' A 2 1.576 -8.196 -14.213 19 H8 A 2 H8 A 2 3.009 -5.433 -12.095 20 H61 A 2 H61 A 2 -0.739 -7.236 -7.560 21 H62 A 2 H62 A 2 0.608 -6.204 -7.986 22 H2 A 2 H2 A 2 -1.911 -9.445 -11.299 23 H5' G 3 H5' G 3 -1.789 -4.285 -16.956 24 H5'' G 3 H5'' G 3 -2.544 -2.741 -16.511 25 H4' G 3 H4' G 3 -3.828 -4.895 -15.909 26 H3' G 3 H3' G 3 -3.172 -2.700 -13.901 27 H2' G 3 H2' G 3 -4.448 -3.900 -12.294 28 HO2' G 3 HO2' G 3 -6.178 -4.944 -12.921 29 H1' G 3 H1' G 3 -3.572 -6.423 -13.000 30 H8 G 3 H8 G 3 -0.513 -4.381 -13.016 31 H1 G 3 H1 G 3 -2.691 -5.147 -7.077 32 H21 G 3 H21 G 3 -4.750 -5.962 -7.121 33 H22 G 3 H22 G 3 -5.588 -6.319 -8.614 34 H5' A 4 H5' A 4 -7.944 -2.110 -14.633 35 H5'' A 4 H5'' A 4 -8.092 -0.394 -14.210 36 H4' A 4 H4' A 4 -9.533 -2.072 -12.884 37 H3' A 4 H3' A 4 -7.809 0.132 -11.758 38 H2' A 4 H2' A 4 -8.255 -0.555 -9.534 39 HO2' A 4 HO2' A 4 -10.410 -1.952 -10.746 40 H1' A 4 H1' A 4 -8.032 -3.226 -9.852 41 H8 A 4 H8 A 4 -5.402 -1.949 -12.128 42 H61 A 4 H61 A 4 -1.908 -0.716 -7.211 43 H62 A 4 H62 A 4 -1.931 -0.857 -8.954 44 H2 A 4 H2 A 4 -6.070 -1.615 -5.777 45 H5' G 5 H5' G 5 -10.515 0.046 -9.276 46 H5'' G 5 H5'' G 5 -11.691 1.371 -9.285 47 H4' G 5 H4' G 5 -11.080 1.171 -7.018 48 H3' G 5 H3' G 5 -9.665 3.383 -8.483 49 H2' G 5 H2' G 5 -8.106 3.729 -6.804 50 HO2' G 5 HO2' G 5 -10.207 3.787 -5.338 51 H1' G 5 H1' G 5 -8.221 1.208 -5.497 52 H8 G 5 H8 G 5 -7.143 1.253 -9.132 53 H1 G 5 H1 G 5 -2.370 2.346 -5.046 54 H21 G 5 H21 G 5 -3.177 2.617 -2.995 55 H22 G 5 H22 G 5 -4.888 2.531 -2.641 56 HN1 PSU 6 HN1 PSU 6 -6.282 7.113 -11.099 57 HN3 PSU 6 HN3 PSU 6 -2.547 7.967 -9.724 58 H6 PSU 6 H6 PSU 6 -7.092 6.718 -8.837 59 H1' PSU 6 H1' PSU 6 -5.005 6.394 -6.006 60 H2' PSU 6 H2' PSU 6 -5.575 9.112 -6.562 61 HO2' PSU 6 HO2' PSU 6 -6.107 8.519 -3.997 62 H3' PSU 6 H3' PSU 6 -7.887 8.999 -6.709 63 H4' PSU 6 H4' PSU 6 -8.014 6.614 -4.856 64 H5' PSU 6 H5' PSU 6 -9.950 7.732 -6.207 65 H5'' PSU 6 H5'' PSU 6 -9.226 6.928 -7.613 66 HN1 PSU 7 HN1 PSU 7 -4.200 12.068 -8.846 67 HN3 PSU 7 HN3 PSU 7 -0.133 12.061 -8.677 68 H6 PSU 7 H6 PSU 7 -4.368 11.124 -6.607 69 H1' PSU 7 H1' PSU 7 -1.599 9.716 -4.866 70 H2' PSU 7 H2' PSU 7 -2.412 12.559 -4.367 71 HO2' PSU 7 HO2' PSU 7 -0.726 12.280 -2.799 72 H3' PSU 7 H3' PSU 7 -3.454 12.070 -2.287 73 H4' PSU 7 H4' PSU 7 -4.661 9.725 -2.973 74 H5' PSU 7 H5' PSU 7 -5.866 11.810 -3.044 75 H5'' PSU 7 H5'' PSU 7 -4.881 12.400 -4.398 76 H5' G 8 H5' G 8 0.505 11.468 -1.715 77 H5'' G 8 H5'' G 8 0.618 11.580 0.053 78 H4' G 8 H4' G 8 0.912 13.703 -2.007 79 H3' G 8 H3' G 8 2.605 12.749 -0.135 80 H2' G 8 H2' G 8 1.436 13.134 1.865 81 HO2' G 8 HO2' G 8 2.419 14.788 2.765 82 H1' G 8 H1' G 8 0.032 15.621 1.234 83 H8 G 8 H8 G 8 -2.324 13.113 0.342 84 H1 G 8 H1 G 8 -1.427 12.882 6.651 85 H21 G 8 H21 G 8 0.411 14.000 7.196 86 H22 G 8 H22 G 8 1.414 14.797 6.004 87 H5' G 9 H5' G 9 4.162 12.875 -3.491 88 H5'' G 9 H5'' G 9 4.085 12.422 -1.777 89 H4' G 9 H4' G 9 6.638 12.942 -3.339 90 H3' G 9 H3' G 9 4.981 10.534 -3.058 91 H2' G 9 H2' G 9 6.387 9.232 -1.742 92 HO2' G 9 HO2' G 9 8.138 9.862 -3.441 93 H1' G 9 H1' G 9 7.772 11.031 -0.269 94 H8 G 9 H8 G 9 6.561 11.085 2.002 95 H1 G 9 H1 G 9 0.953 9.493 -0.561 96 H21 G 9 H21 G 9 1.113 9.496 -2.778 97 H22 G 9 H22 G 9 2.601 9.890 -3.611 98 H5' G 10 H5' G 10 7.209 7.626 -2.966 99 H5'' G 10 H5'' G 10 6.460 6.505 -4.117 100 H4' G 10 H4' G 10 5.830 6.788 -1.398 101 H3' G 10 H3' G 10 4.753 5.277 -3.744 102 H2' G 10 H2' G 10 2.550 5.172 -3.008 103 HO2' G 10 HO2' G 10 3.066 4.260 -0.978 104 H1' G 10 H1' G 10 2.272 7.503 -1.601 105 H8 G 10 H8 G 10 4.013 8.504 -4.725 106 H1 G 10 H1 G 10 -2.101 7.052 -5.806 107 H21 G 10 H21 G 10 -2.964 6.034 -4.030 108 H22 G 10 H22 G 10 -2.031 5.717 -2.584 109 H5' C 11 H5' C 11 4.661 2.594 0.344 110 H5'' C 11 H5'' C 11 4.388 0.928 -0.201 111 H4' C 11 H4' C 11 2.727 1.932 1.521 112 H3' C 11 H3' C 11 2.031 0.448 -1.028 113 H2' C 11 H2' C 11 -0.283 0.765 -0.600 114 HO2' C 11 HO2' C 11 -0.862 1.837 1.497 115 H1' C 11 H1' C 11 -0.208 3.346 0.106 116 H41 C 11 H41 C 11 -1.048 2.909 -6.230 117 H42 C 11 H42 C 11 0.680 3.073 -6.450 118 H5 C 11 H5 C 11 2.246 3.125 -4.621 119 H6 C 11 H6 C 11 2.492 3.026 -2.182 120 HN1 PSU 12 HN1 PSU 12 -0.153 -0.825 -3.318 121 HN3 PSU 12 HN3 PSU 12 -3.784 -1.389 -5.066 122 H6 PSU 12 H6 PSU 12 -1.112 -1.048 -1.095 123 H1' PSU 12 H1' PSU 12 -4.619 -0.963 -0.459 124 H2' PSU 12 H2' PSU 12 -3.856 -3.568 -1.041 125 HO2' PSU 12 HO2' PSU 12 -4.923 -2.985 1.506 126 H3' PSU 12 H3' PSU 12 -1.835 -3.659 0.149 127 H4' PSU 12 H4' PSU 12 -2.906 -1.867 2.333 128 H5' PSU 12 H5' PSU 12 -0.677 -0.949 2.307 129 H5'' PSU 12 H5'' PSU 12 -0.528 -2.717 2.247 130 H5' C 13 H5' C 13 -5.462 -4.959 0.855 131 H5'' C 13 H5'' C 13 -5.577 -6.584 1.562 132 H4' C 13 H4' C 13 -7.111 -6.703 -0.201 133 H3' C 13 H3' C 13 -4.398 -7.765 -0.991 134 H2' C 13 H2' C 13 -5.036 -8.017 -3.227 135 HO2' C 13 HO2' C 13 -7.436 -7.798 -3.700 136 H1' C 13 H1' C 13 -6.724 -5.857 -3.492 137 H41 C 13 H41 C 13 -1.284 -4.089 -6.235 138 H42 C 13 H42 C 13 -0.416 -4.232 -4.723 139 H5 C 13 H5 C 13 -1.434 -4.986 -2.684 140 H6 C 13 H6 C 13 -3.516 -5.746 -1.633 141 HN1 PSU 14 HN1 PSU 14 -2.766 -8.298 -4.015 142 HN3 PSU 14 HN3 PSU 14 -2.159 -8.413 -8.038 143 H6 PSU 14 H6 PSU 14 -4.619 -9.871 -4.181 144 H1' PSU 14 H1' PSU 14 -5.896 -11.053 -7.429 145 H2' PSU 14 H2' PSU 14 -4.052 -12.468 -5.945 146 HO2' PSU 14 HO2' PSU 14 -5.246 -13.524 -7.481 147 H3' PSU 14 H3' PSU 14 -4.858 -12.021 -3.783 148 H4' PSU 14 H4' PSU 14 -7.735 -12.111 -4.695 149 H5' PSU 14 H5' PSU 14 -7.611 -9.874 -3.318 150 H5'' PSU 14 H5'' PSU 14 -7.574 -11.432 -2.468 151 H5' C 15 H5' C 15 -5.318 -15.930 -5.999 152 H5'' C 15 H5'' C 15 -4.268 -17.078 -5.144 153 H4' C 15 H4' C 15 -3.734 -16.707 -7.611 154 H3' C 15 H3' C 15 -1.740 -16.289 -5.372 155 H2' C 15 H2' C 15 -0.066 -15.762 -6.927 156 HO2' C 15 HO2' C 15 -0.800 -16.024 -9.307 157 H1' C 15 H1' C 15 -1.640 -14.284 -8.649 158 H41 C 15 H41 C 15 1.332 -10.045 -4.970 159 H42 C 15 H42 C 15 0.283 -10.425 -3.622 160 H5 C 15 H5 C 15 -1.379 -12.175 -3.695 161 H6 C 15 H6 C 15 -2.379 -13.939 -5.075 Start of MODEL 9 1 H5' G 1 H5' G 1 10.011 -8.324 -11.563 2 H5'' G 1 H5'' G 1 9.271 -6.719 -11.384 3 H4' G 1 H4' G 1 8.138 -8.226 -13.073 4 H3' G 1 H3' G 1 6.709 -7.007 -10.695 5 H2' G 1 H2' G 1 4.703 -8.084 -11.295 6 HO2' G 1 HO2' G 1 5.409 -9.165 -13.712 7 H1' G 1 H1' G 1 5.763 -10.459 -12.251 8 H8 G 1 H8 G 1 7.212 -9.234 -8.941 9 H1 G 1 H1 G 1 1.733 -12.433 -8.301 10 H21 G 1 H21 G 1 0.859 -12.846 -10.299 11 H22 G 1 H22 G 1 1.628 -12.331 -11.784 12 H5' A 2 H5' A 2 5.066 -5.941 -15.186 13 H5'' A 2 H5'' A 2 3.927 -4.596 -14.971 14 H4' A 2 H4' A 2 3.103 -6.654 -16.307 15 H3' A 2 H3' A 2 1.652 -5.318 -14.007 16 H2' A 2 H2' A 2 -0.128 -6.903 -14.211 17 HO2' A 2 HO2' A 2 1.186 -7.666 -16.637 18 H1' A 2 H1' A 2 1.408 -9.097 -14.316 19 H8 A 2 H8 A 2 3.340 -6.659 -12.227 20 H61 A 2 H61 A 2 -0.341 -8.035 -7.488 21 H62 A 2 H62 A 2 1.119 -7.205 -7.977 22 H2 A 2 H2 A 2 -2.080 -9.903 -11.188 23 H5' G 3 H5' G 3 -1.403 -4.875 -16.837 24 H5'' G 3 H5'' G 3 -2.213 -3.312 -16.619 25 H4' G 3 H4' G 3 -3.632 -5.290 -15.982 26 H3' G 3 H3' G 3 -2.892 -3.182 -13.913 27 H2' G 3 H2' G 3 -4.280 -4.330 -12.353 28 HO2' G 3 HO2' G 3 -6.011 -4.696 -13.901 29 H1' G 3 H1' G 3 -3.500 -6.874 -13.023 30 H8 G 3 H8 G 3 -0.309 -5.084 -13.071 31 H1 G 3 H1 G 3 -2.599 -5.332 -7.130 32 H21 G 3 H21 G 3 -4.723 -5.956 -7.160 33 H22 G 3 H22 G 3 -5.578 -6.315 -8.643 34 H5' A 4 H5' A 4 -7.466 -1.903 -14.872 35 H5'' A 4 H5'' A 4 -7.388 -0.182 -14.447 36 H4' A 4 H4' A 4 -9.010 -1.655 -13.092 37 H3' A 4 H3' A 4 -6.972 0.276 -11.985 38 H2' A 4 H2' A 4 -7.463 -0.367 -9.756 39 HO2' A 4 HO2' A 4 -9.796 -1.507 -10.923 40 H1' A 4 H1' A 4 -7.584 -3.043 -10.109 41 H8 A 4 H8 A 4 -4.889 -2.259 -12.451 42 H61 A 4 H61 A 4 -1.107 -1.232 -7.707 43 H62 A 4 H62 A 4 -1.204 -1.497 -9.433 44 H2 A 4 H2 A 4 -5.316 -1.366 -6.133 45 H5' G 5 H5' G 5 -10.017 0.578 -9.967 46 H5'' G 5 H5'' G 5 -11.230 1.874 -9.985 47 H4' G 5 H4' G 5 -10.951 1.493 -7.697 48 H3' G 5 H3' G 5 -9.123 3.718 -8.636 49 H2' G 5 H2' G 5 -8.109 3.853 -6.525 50 HO2' G 5 HO2' G 5 -10.065 4.036 -5.353 51 H1' G 5 H1' G 5 -8.319 1.165 -5.772 52 H8 G 5 H8 G 5 -6.795 1.628 -9.193 53 H1 G 5 H1 G 5 -2.620 2.543 -4.462 54 H21 G 5 H21 G 5 -3.682 2.618 -2.519 55 H22 G 5 H22 G 5 -5.418 2.444 -2.388 56 HN1 PSU 6 HN1 PSU 6 -7.308 7.543 -10.539 57 HN3 PSU 6 HN3 PSU 6 -3.341 8.257 -9.988 58 H6 PSU 6 H6 PSU 6 -7.606 6.996 -8.186 59 H1' PSU 6 H1' PSU 6 -4.881 6.445 -5.935 60 H2' PSU 6 H2' PSU 6 -5.672 9.153 -6.097 61 HO2' PSU 6 HO2' PSU 6 -5.679 8.396 -3.547 62 H3' PSU 6 H3' PSU 6 -7.975 8.862 -5.854 63 H4' PSU 6 H4' PSU 6 -7.524 6.396 -4.141 64 H5' PSU 6 H5' PSU 6 -9.742 6.268 -4.513 65 H5'' PSU 6 H5'' PSU 6 -9.686 7.557 -5.730 66 HN1 PSU 7 HN1 PSU 7 -7.135 12.500 -6.479 67 HN3 PSU 7 HN3 PSU 7 -4.487 15.556 -6.939 68 H6 PSU 7 H6 PSU 7 -5.570 11.252 -5.096 69 H1' PSU 7 H1' PSU 7 -2.241 11.726 -5.012 70 H2' PSU 7 H2' PSU 7 -2.747 13.904 -3.447 71 HO2' PSU 7 HO2' PSU 7 -0.882 12.096 -3.609 72 H3' PSU 7 H3' PSU 7 -4.475 13.118 -2.104 73 H4' PSU 7 H4' PSU 7 -3.479 10.304 -1.878 74 H5' PSU 7 H5' PSU 7 -5.695 9.816 -1.840 75 H5'' PSU 7 H5'' PSU 7 -5.883 11.551 -1.522 76 H5' G 8 H5' G 8 -0.017 12.672 -2.066 77 H5'' G 8 H5'' G 8 1.327 12.207 -1.006 78 H4' G 8 H4' G 8 0.954 14.742 -1.823 79 H3' G 8 H3' G 8 2.653 13.614 -0.016 80 H2' G 8 H2' G 8 1.203 13.548 1.860 81 HO2' G 8 HO2' G 8 1.572 16.106 2.575 82 H1' G 8 H1' G 8 0.023 16.249 1.355 83 H8 G 8 H8 G 8 -2.497 13.800 0.657 84 H1 G 8 H1 G 8 -1.581 14.075 6.961 85 H21 G 8 H21 G 8 0.306 15.157 7.405 86 H22 G 8 H22 G 8 1.335 15.807 6.147 87 H5' G 9 H5' G 9 4.489 13.687 -2.763 88 H5'' G 9 H5'' G 9 3.924 12.621 -1.463 89 H4' G 9 H4' G 9 6.762 13.199 -2.327 90 H3' G 9 H3' G 9 4.873 10.958 -2.539 91 H2' G 9 H2' G 9 5.975 9.372 -1.254 92 HO2' G 9 HO2' G 9 8.304 9.498 -0.970 93 H1' G 9 H1' G 9 7.349 10.839 0.575 94 H8 G 9 H8 G 9 5.837 11.007 2.719 95 H1 G 9 H1 G 9 0.587 9.597 -0.607 96 H21 G 9 H21 G 9 1.040 9.623 -2.782 97 H22 G 9 H22 G 9 2.635 9.984 -3.403 98 H5' G 10 H5' G 10 7.028 7.909 -2.520 99 H5'' G 10 H5'' G 10 6.366 6.948 -3.852 100 H4' G 10 H4' G 10 5.484 7.061 -1.141 101 H3' G 10 H3' G 10 4.923 5.462 -3.558 102 H2' G 10 H2' G 10 2.620 5.386 -3.464 103 HO2' G 10 HO2' G 10 1.985 5.987 -0.936 104 H1' G 10 H1' G 10 1.907 7.609 -2.019 105 H8 G 10 H8 G 10 4.371 8.688 -4.630 106 H1 G 10 H1 G 10 -1.450 7.707 -7.037 107 H21 G 10 H21 G 10 -2.722 6.671 -5.548 108 H22 G 10 H22 G 10 -2.140 6.224 -3.960 109 H5' C 11 H5' C 11 4.225 3.420 0.633 110 H5'' C 11 H5'' C 11 4.132 1.649 0.580 111 H4' C 11 H4' C 11 2.194 2.791 1.754 112 H3' C 11 H3' C 11 1.878 0.884 -0.577 113 H2' C 11 H2' C 11 -0.479 1.197 -0.553 114 HO2' C 11 HO2' C 11 0.038 2.043 2.061 115 H1' C 11 H1' C 11 -0.527 3.855 -0.294 116 H41 C 11 H41 C 11 -0.371 2.536 -6.541 117 H42 C 11 H42 C 11 1.374 2.649 -6.515 118 H5 C 11 H5 C 11 2.647 2.938 -4.487 119 H6 C 11 H6 C 11 2.519 3.180 -2.050 120 HN1 PSU 12 HN1 PSU 12 0.394 -0.738 -3.318 121 HN3 PSU 12 HN3 PSU 12 -3.001 -1.399 -5.463 122 H6 PSU 12 H6 PSU 12 -0.848 -0.721 -1.228 123 H1' PSU 12 H1' PSU 12 -4.438 -0.582 -1.083 124 H2' PSU 12 H2' PSU 12 -3.456 -3.192 -1.186 125 HO2' PSU 12 HO2' PSU 12 -5.410 -1.795 0.137 126 H3' PSU 12 H3' PSU 12 -1.658 -2.959 0.311 127 H4' PSU 12 H4' PSU 12 -3.232 -0.981 1.982 128 H5' PSU 12 H5' PSU 12 -0.949 0.173 1.909 129 H5'' PSU 12 H5'' PSU 12 -1.013 -1.383 2.761 130 H5' C 13 H5' C 13 -5.442 -5.073 1.333 131 H5'' C 13 H5'' C 13 -5.021 -6.779 1.583 132 H4' C 13 H4' C 13 -6.695 -6.469 -0.235 133 H3' C 13 H3' C 13 -3.942 -7.598 -0.841 134 H2' C 13 H2' C 13 -4.516 -7.812 -3.106 135 HO2' C 13 HO2' C 13 -7.109 -7.264 -3.265 136 H1' C 13 H1' C 13 -6.175 -5.574 -3.321 137 H41 C 13 H41 C 13 -0.720 -4.158 -6.271 138 H42 C 13 H42 C 13 0.132 -4.098 -4.745 139 H5 C 13 H5 C 13 -0.896 -4.630 -2.641 140 H6 C 13 H6 C 13 -2.974 -5.308 -1.528 141 HN1 PSU 14 HN1 PSU 14 -2.591 -8.465 -3.892 142 HN3 PSU 14 HN3 PSU 14 -1.871 -8.895 -7.872 143 H6 PSU 14 H6 PSU 14 -4.643 -9.765 -4.050 144 H1' PSU 14 H1' PSU 14 -6.014 -10.878 -7.266 145 H2' PSU 14 H2' PSU 14 -4.334 -12.572 -5.937 146 HO2' PSU 14 HO2' PSU 14 -7.128 -12.932 -6.446 147 H3' PSU 14 H3' PSU 14 -4.875 -12.010 -3.717 148 H4' PSU 14 H4' PSU 14 -7.816 -11.756 -4.341 149 H5' PSU 14 H5' PSU 14 -7.249 -9.507 -3.069 150 H5'' PSU 14 H5'' PSU 14 -7.381 -11.037 -2.178 151 H5' C 15 H5' C 15 -5.951 -14.702 -6.291 152 H5'' C 15 H5'' C 15 -5.950 -16.390 -5.740 153 H4' C 15 H4' C 15 -4.995 -16.468 -7.908 154 H3' C 15 H3' C 15 -2.916 -16.450 -5.712 155 H2' C 15 H2' C 15 -1.188 -16.555 -7.293 156 HO2' C 15 HO2' C 15 -1.620 -17.948 -8.850 157 H1' C 15 H1' C 15 -2.276 -14.814 -9.124 158 H41 C 15 H41 C 15 1.715 -11.300 -5.656 159 H42 C 15 H42 C 15 0.700 -11.458 -4.241 160 H5 C 15 H5 C 15 -1.318 -12.772 -4.200 161 H6 C 15 H6 C 15 -2.784 -14.244 -5.501 Start of MODEL 10 1 H5' G 1 H5' G 1 9.935 -6.343 -10.616 2 H5'' G 1 H5'' G 1 8.927 -4.892 -10.445 3 H4' G 1 H4' G 1 8.197 -6.689 -12.173 4 H3' G 1 H3' G 1 6.440 -5.373 -10.084 5 H2' G 1 H2' G 1 4.610 -6.682 -10.746 6 HO2' G 1 HO2' G 1 4.279 -7.211 -12.792 7 H1' G 1 H1' G 1 5.993 -9.000 -11.495 8 H8 G 1 H8 G 1 6.588 -7.308 -8.090 9 H1 G 1 H1 G 1 2.000 -11.734 -8.030 10 H21 G 1 H21 G 1 1.638 -12.485 -10.084 11 H22 G 1 H22 G 1 2.527 -11.899 -11.471 12 H5' A 2 H5' A 2 5.139 -5.066 -14.936 13 H5'' A 2 H5'' A 2 3.982 -3.722 -14.860 14 H4' A 2 H4' A 2 3.241 -5.807 -16.166 15 H3' A 2 H3' A 2 1.655 -4.454 -13.971 16 H2' A 2 H2' A 2 -0.074 -6.084 -14.195 17 HO2' A 2 HO2' A 2 0.320 -6.079 -16.639 18 H1' A 2 H1' A 2 1.501 -8.263 -14.233 19 H8 A 2 H8 A 2 3.231 -5.678 -12.111 20 H61 A 2 H61 A 2 -0.433 -7.324 -7.454 21 H62 A 2 H62 A 2 0.966 -6.382 -7.918 22 H2 A 2 H2 A 2 -1.940 -9.332 -11.183 23 H5' G 3 H5' G 3 -1.573 -3.796 -16.867 24 H5'' G 3 H5'' G 3 -2.256 -2.280 -16.248 25 H4' G 3 H4' G 3 -3.613 -4.468 -15.902 26 H3' G 3 H3' G 3 -2.971 -2.445 -13.718 27 H2' G 3 H2' G 3 -4.305 -3.737 -12.232 28 HO2' G 3 HO2' G 3 -5.145 -5.564 -14.193 29 H1' G 3 H1' G 3 -3.440 -6.212 -13.077 30 H8 G 3 H8 G 3 -0.298 -4.356 -12.922 31 H1 G 3 H1 G 3 -2.717 -5.043 -7.069 32 H21 G 3 H21 G 3 -4.830 -5.709 -7.190 33 H22 G 3 H22 G 3 -5.641 -5.988 -8.716 34 H5' A 4 H5' A 4 -7.624 -1.460 -14.549 35 H5'' A 4 H5'' A 4 -7.672 0.245 -14.056 36 H4' A 4 H4' A 4 -9.178 -1.381 -12.751 37 H3' A 4 H3' A 4 -7.205 0.545 -11.492 38 H2' A 4 H2' A 4 -7.878 -0.214 -9.335 39 HO2' A 4 HO2' A 4 -10.180 -0.805 -10.669 40 H1' A 4 H1' A 4 -7.875 -2.870 -9.876 41 H8 A 4 H8 A 4 -4.998 -1.708 -11.865 42 H61 A 4 H61 A 4 -1.758 -1.025 -6.674 43 H62 A 4 H62 A 4 -1.676 -1.079 -8.421 44 H2 A 4 H2 A 4 -6.074 -1.622 -5.560 45 H5' G 5 H5' G 5 -10.278 0.592 -9.560 46 H5'' G 5 H5'' G 5 -11.496 1.882 -9.517 47 H4' G 5 H4' G 5 -11.304 1.245 -7.265 48 H3' G 5 H3' G 5 -9.597 3.655 -7.919 49 H2' G 5 H2' G 5 -8.620 3.642 -5.791 50 HO2' G 5 HO2' G 5 -10.754 3.571 -4.774 51 H1' G 5 H1' G 5 -8.735 0.885 -5.262 52 H8 G 5 H8 G 5 -7.087 1.630 -8.561 53 H1 G 5 H1 G 5 -3.143 2.428 -3.616 54 H21 G 5 H21 G 5 -4.281 2.360 -1.714 55 H22 G 5 H22 G 5 -6.013 2.118 -1.663 56 HN1 PSU 6 HN1 PSU 6 -6.712 6.486 -10.619 57 HN3 PSU 6 HN3 PSU 6 -2.882 7.258 -9.479 58 H6 PSU 6 H6 PSU 6 -7.471 6.493 -8.303 59 H1' PSU 6 H1' PSU 6 -5.263 6.490 -5.499 60 H2' PSU 6 H2' PSU 6 -5.784 9.083 -6.450 61 HO2' PSU 6 HO2' PSU 6 -6.350 8.463 -3.768 62 H3' PSU 6 H3' PSU 6 -8.100 8.976 -6.645 63 H4' PSU 6 H4' PSU 6 -8.336 6.979 -4.390 64 H5' PSU 6 H5' PSU 6 -10.351 7.548 -5.607 65 H5'' PSU 6 H5'' PSU 6 -9.542 7.291 -7.166 66 HN1 PSU 7 HN1 PSU 7 -5.997 12.520 -8.426 67 HN3 PSU 7 HN3 PSU 7 -2.452 14.442 -8.968 68 H6 PSU 7 H6 PSU 7 -5.070 11.160 -6.635 69 H1' PSU 7 H1' PSU 7 -1.709 10.703 -6.068 70 H2' PSU 7 H2' PSU 7 -2.451 13.166 -4.693 71 HO2' PSU 7 HO2' PSU 7 -0.313 12.575 -4.966 72 H3' PSU 7 H3' PSU 7 -3.303 12.359 -2.673 73 H4' PSU 7 H4' PSU 7 -4.326 9.937 -3.332 74 H5' PSU 7 H5' PSU 7 -5.751 11.880 -3.213 75 H5'' PSU 7 H5'' PSU 7 -4.976 12.607 -4.635 76 H5' G 8 H5' G 8 0.844 11.787 -2.360 77 H5'' G 8 H5'' G 8 1.086 11.994 -0.614 78 H4' G 8 H4' G 8 1.253 13.987 -2.793 79 H3' G 8 H3' G 8 3.000 13.235 -0.889 80 H2' G 8 H2' G 8 1.724 13.657 1.057 81 HO2' G 8 HO2' G 8 2.164 16.024 1.619 82 H1' G 8 H1' G 8 0.510 16.216 0.190 83 H8 G 8 H8 G 8 -1.749 13.322 -0.171 84 H1 G 8 H1 G 8 -1.511 15.301 5.884 85 H21 G 8 H21 G 8 0.182 16.708 6.155 86 H22 G 8 H22 G 8 1.250 17.159 4.845 87 H5' G 9 H5' G 9 4.548 12.930 -3.486 88 H5'' G 9 H5'' G 9 4.088 11.843 -2.161 89 H4' G 9 H4' G 9 6.764 12.273 -3.440 90 H3' G 9 H3' G 9 4.914 10.057 -3.013 91 H2' G 9 H2' G 9 6.108 8.729 -1.536 92 HO2' G 9 HO2' G 9 8.469 8.818 -1.540 93 H1' G 9 H1' G 9 7.722 10.423 -0.195 94 H8 G 9 H8 G 9 6.462 11.044 2.014 95 H1 G 9 H1 G 9 0.798 9.581 -0.506 96 H21 G 9 H21 G 9 1.010 9.232 -2.684 97 H22 G 9 H22 G 9 2.545 9.361 -3.512 98 H5' G 10 H5' G 10 6.927 6.998 -2.569 99 H5'' G 10 H5'' G 10 6.100 5.834 -3.616 100 H4' G 10 H4' G 10 5.484 6.443 -0.935 101 H3' G 10 H3' G 10 4.419 4.683 -3.075 102 H2' G 10 H2' G 10 2.160 4.864 -2.598 103 HO2' G 10 HO2' G 10 2.935 5.609 0.053 104 H1' G 10 H1' G 10 1.906 7.352 -1.526 105 H8 G 10 H8 G 10 4.149 7.816 -4.470 106 H1 G 10 H1 G 10 -1.897 6.785 -6.208 107 H21 G 10 H21 G 10 -3.077 6.086 -4.464 108 H22 G 10 H22 G 10 -2.373 5.873 -2.878 109 H5' C 11 H5' C 11 3.813 2.954 1.344 110 H5'' C 11 H5'' C 11 3.651 1.189 1.233 111 H4' C 11 H4' C 11 1.822 2.393 2.541 112 H3' C 11 H3' C 11 1.354 0.494 0.231 113 H2' C 11 H2' C 11 -1.001 0.845 0.376 114 HO2' C 11 HO2' C 11 -1.418 0.837 2.542 115 H1' C 11 H1' C 11 -0.975 3.504 0.563 116 H41 C 11 H41 C 11 -0.908 2.073 -5.669 117 H42 C 11 H42 C 11 0.831 2.261 -5.668 118 H5 C 11 H5 C 11 2.119 2.620 -3.665 119 H6 C 11 H6 C 11 2.022 2.871 -1.230 120 HN1 PSU 12 HN1 PSU 12 0.253 -0.632 -2.586 121 HN3 PSU 12 HN3 PSU 12 -3.148 -1.284 -4.725 122 H6 PSU 12 H6 PSU 12 -0.905 -1.027 -0.490 123 H1' PSU 12 H1' PSU 12 -4.458 -1.170 -0.205 124 H2' PSU 12 H2' PSU 12 -3.418 -3.694 -0.861 125 HO2' PSU 12 HO2' PSU 12 -5.341 -4.083 -0.084 126 H3' PSU 12 H3' PSU 12 -1.619 -3.706 0.653 127 H4' PSU 12 H4' PSU 12 -3.302 -2.140 2.639 128 H5' PSU 12 H5' PSU 12 -1.131 -1.045 3.111 129 H5'' PSU 12 H5'' PSU 12 -1.035 -2.806 3.317 130 H5' C 13 H5' C 13 -5.355 -5.481 1.092 131 H5'' C 13 H5'' C 13 -5.309 -7.212 1.480 132 H4' C 13 H4' C 13 -6.834 -7.039 -0.330 133 H3' C 13 H3' C 13 -4.064 -7.939 -1.162 134 H2' C 13 H2' C 13 -4.700 -7.960 -3.421 135 HO2' C 13 HO2' C 13 -7.407 -7.928 -2.505 136 H1' C 13 H1' C 13 -6.457 -5.822 -3.409 137 H41 C 13 H41 C 13 -1.139 -3.684 -6.138 138 H42 C 13 H42 C 13 -0.237 -3.882 -4.651 139 H5 C 13 H5 C 13 -1.190 -4.809 -2.647 140 H6 C 13 H6 C 13 -3.215 -5.738 -1.624 141 HN1 PSU 14 HN1 PSU 14 -2.653 -8.531 -3.891 142 HN3 PSU 14 HN3 PSU 14 -1.623 -8.613 -7.826 143 H6 PSU 14 H6 PSU 14 -4.617 -9.913 -4.305 144 H1' PSU 14 H1' PSU 14 -5.714 -10.792 -7.683 145 H2' PSU 14 H2' PSU 14 -4.022 -12.559 -6.483 146 HO2' PSU 14 HO2' PSU 14 -5.876 -12.848 -8.084 147 H3' PSU 14 H3' PSU 14 -4.669 -12.280 -4.235 148 H4' PSU 14 H4' PSU 14 -7.595 -12.075 -4.933 149 H5' PSU 14 H5' PSU 14 -7.201 -9.967 -3.413 150 H5'' PSU 14 H5'' PSU 14 -7.212 -11.586 -2.685 151 H5' C 15 H5' C 15 -5.581 -15.253 -7.383 152 H5'' C 15 H5'' C 15 -5.143 -16.809 -6.647 153 H4' C 15 H4' C 15 -4.194 -16.614 -8.911 154 H3' C 15 H3' C 15 -2.369 -16.640 -6.510 155 H2' C 15 H2' C 15 -0.458 -16.416 -7.848 156 HO2' C 15 HO2' C 15 -0.444 -17.495 -9.664 157 H1' C 15 H1' C 15 -1.433 -14.568 -9.603 158 H41 C 15 H41 C 15 1.431 -11.104 -5.111 159 H42 C 15 H42 C 15 0.184 -11.502 -3.949 160 H5 C 15 H5 C 15 -1.632 -13.006 -4.426 161 H6 C 15 H6 C 15 -2.648 -14.461 -6.116 Start of MODEL 11 1 H5' G 1 H5' G 1 9.968 -8.200 -11.706 2 H5'' G 1 H5'' G 1 9.292 -6.559 -11.660 3 H4' G 1 H4' G 1 8.207 -7.972 -13.391 4 H3' G 1 H3' G 1 6.686 -6.804 -11.071 5 H2' G 1 H2' G 1 4.728 -7.970 -11.582 6 HO2' G 1 HO2' G 1 5.671 -8.717 -14.150 7 H1' G 1 H1' G 1 5.780 -10.307 -12.604 8 H8 G 1 H8 G 1 7.304 -9.000 -9.348 9 H1 G 1 H1 G 1 2.099 -12.586 -8.502 10 H21 G 1 H21 G 1 1.178 -13.061 -10.460 11 H22 G 1 H22 G 1 1.844 -12.496 -11.975 12 H5' A 2 H5' A 2 5.037 -5.846 -15.448 13 H5'' A 2 H5'' A 2 3.948 -4.446 -15.355 14 H4' A 2 H4' A 2 3.016 -6.526 -16.519 15 H3' A 2 H3' A 2 1.677 -5.048 -14.245 16 H2' A 2 H2' A 2 -0.118 -6.608 -14.237 17 HO2' A 2 HO2' A 2 0.825 -7.131 -16.825 18 H1' A 2 H1' A 2 1.354 -8.864 -14.398 19 H8 A 2 H8 A 2 3.420 -6.436 -12.437 20 H61 A 2 H61 A 2 -0.008 -7.735 -7.496 21 H62 A 2 H62 A 2 1.432 -6.930 -8.073 22 H2 A 2 H2 A 2 -1.973 -9.607 -11.081 23 H5' G 3 H5' G 3 -1.732 -4.459 -16.859 24 H5'' G 3 H5'' G 3 -2.378 -2.910 -16.285 25 H4' G 3 H4' G 3 -3.690 -5.063 -15.687 26 H3' G 3 H3' G 3 -2.851 -2.938 -13.672 27 H2' G 3 H2' G 3 -4.069 -4.145 -12.019 28 HO2' G 3 HO2' G 3 -5.136 -6.203 -13.298 29 H1' G 3 H1' G 3 -3.286 -6.662 -12.819 30 H8 G 3 H8 G 3 -0.142 -4.821 -13.002 31 H1 G 3 H1 G 3 -2.078 -5.225 -6.945 32 H21 G 3 H21 G 3 -4.190 -5.897 -6.869 33 H22 G 3 H22 G 3 -5.120 -6.245 -8.307 34 H5' A 4 H5' A 4 -7.555 -1.802 -14.397 35 H5'' A 4 H5'' A 4 -7.531 -0.094 -13.916 36 H4' A 4 H4' A 4 -9.062 -1.699 -12.580 37 H3' A 4 H3' A 4 -7.095 0.296 -11.427 38 H2' A 4 H2' A 4 -7.626 -0.405 -9.221 39 HO2' A 4 HO2' A 4 -9.430 -1.744 -8.795 40 H1' A 4 H1' A 4 -7.622 -3.079 -9.656 41 H8 A 4 H8 A 4 -4.849 -2.128 -11.845 42 H61 A 4 H61 A 4 -1.373 -0.939 -6.904 43 H62 A 4 H62 A 4 -1.369 -1.185 -8.636 44 H2 A 4 H2 A 4 -5.644 -1.336 -5.548 45 H5' G 5 H5' G 5 -10.357 0.622 -9.410 46 H5'' G 5 H5'' G 5 -11.413 2.043 -9.520 47 H4' G 5 H4' G 5 -11.265 1.559 -7.204 48 H3' G 5 H3' G 5 -9.515 3.837 -8.119 49 H2' G 5 H2' G 5 -8.413 3.983 -6.065 50 HO2' G 5 HO2' G 5 -10.548 2.531 -4.843 51 H1' G 5 H1' G 5 -8.619 1.316 -5.214 52 H8 G 5 H8 G 5 -7.119 1.649 -8.654 53 H1 G 5 H1 G 5 -2.886 2.670 -4.001 54 H21 G 5 H21 G 5 -3.929 2.832 -2.048 55 H22 G 5 H22 G 5 -5.666 2.689 -1.896 56 HN1 PSU 6 HN1 PSU 6 -7.192 7.051 -10.714 57 HN3 PSU 6 HN3 PSU 6 -3.200 7.472 -10.038 58 H6 PSU 6 H6 PSU 6 -7.649 6.910 -8.326 59 H1' PSU 6 H1' PSU 6 -5.107 6.516 -5.849 60 H2' PSU 6 H2' PSU 6 -5.578 9.199 -6.491 61 HO2' PSU 6 HO2' PSU 6 -5.987 8.543 -3.831 62 H3' PSU 6 H3' PSU 6 -7.913 9.174 -6.514 63 H4' PSU 6 H4' PSU 6 -7.996 7.070 -4.338 64 H5' PSU 6 H5' PSU 6 -10.137 7.654 -5.159 65 H5'' PSU 6 H5'' PSU 6 -9.562 7.763 -6.834 66 HN1 PSU 7 HN1 PSU 7 -5.838 13.996 -6.377 67 HN3 PSU 7 HN3 PSU 7 -1.914 15.036 -6.660 68 H6 PSU 7 H6 PSU 7 -5.285 11.961 -5.162 69 H1' PSU 7 H1' PSU 7 -2.164 10.517 -5.086 70 H2' PSU 7 H2' PSU 7 -1.717 12.404 -3.189 71 HO2' PSU 7 HO2' PSU 7 -0.523 10.488 -3.277 72 H3' PSU 7 H3' PSU 7 -3.835 12.524 -2.182 73 H4' PSU 7 H4' PSU 7 -4.327 9.565 -2.319 74 H5' PSU 7 H5' PSU 7 -6.491 10.212 -2.390 75 H5'' PSU 7 H5'' PSU 7 -5.888 11.829 -1.978 76 H5' G 8 H5' G 8 0.709 12.142 -2.258 77 H5'' G 8 H5'' G 8 0.874 12.311 -0.497 78 H4' G 8 H4' G 8 0.935 14.373 -2.600 79 H3' G 8 H3' G 8 2.605 13.742 -0.564 80 H2' G 8 H2' G 8 1.060 14.044 1.236 81 HO2' G 8 HO2' G 8 1.424 16.619 1.590 82 H1' G 8 H1' G 8 -0.021 16.612 0.118 83 H8 G 8 H8 G 8 -2.592 14.112 -0.066 84 H1 G 8 H1 G 8 -1.903 15.997 5.989 85 H21 G 8 H21 G 8 0.017 17.090 6.224 86 H22 G 8 H22 G 8 1.118 17.352 4.891 87 H5' G 9 H5' G 9 4.351 13.324 -3.394 88 H5'' G 9 H5'' G 9 3.916 12.424 -1.928 89 H4' G 9 H4' G 9 6.656 13.024 -3.045 90 H3' G 9 H3' G 9 4.952 10.675 -2.776 91 H2' G 9 H2' G 9 6.074 9.464 -1.152 92 HO2' G 9 HO2' G 9 8.538 10.267 -0.993 93 H1' G 9 H1' G 9 7.427 11.300 0.303 94 H8 G 9 H8 G 9 5.925 11.835 2.382 95 H1 G 9 H1 G 9 0.653 9.872 -0.614 96 H21 G 9 H21 G 9 1.090 9.517 -2.761 97 H22 G 9 H22 G 9 2.681 9.761 -3.448 98 H5' G 10 H5' G 10 7.132 7.783 -2.074 99 H5'' G 10 H5'' G 10 6.524 6.539 -3.177 100 H4' G 10 H4' G 10 5.529 7.213 -0.614 101 H3' G 10 H3' G 10 4.959 5.215 -2.713 102 H2' G 10 H2' G 10 2.651 5.259 -2.685 103 HO2' G 10 HO2' G 10 1.500 5.540 -0.770 104 H1' G 10 H1' G 10 2.008 7.727 -1.654 105 H8 G 10 H8 G 10 4.539 8.119 -4.435 106 H1 G 10 H1 G 10 -1.398 7.244 -6.584 107 H21 G 10 H21 G 10 -2.730 6.647 -4.919 108 H22 G 10 H22 G 10 -2.157 6.460 -3.276 109 H5' C 11 H5' C 11 3.735 3.672 1.711 110 H5'' C 11 H5'' C 11 3.775 1.900 1.643 111 H4' C 11 H4' C 11 1.636 2.892 2.581 112 H3' C 11 H3' C 11 1.714 1.011 0.205 113 H2' C 11 H2' C 11 -0.649 1.134 0.029 114 HO2' C 11 HO2' C 11 -1.323 2.743 2.078 115 H1' C 11 H1' C 11 -0.941 3.784 0.417 116 H41 C 11 H41 C 11 -0.570 2.794 -5.869 117 H42 C 11 H42 C 11 1.174 2.910 -5.790 118 H5 C 11 H5 C 11 2.393 3.109 -3.720 119 H6 C 11 H6 C 11 2.199 3.251 -1.279 120 HN1 PSU 12 HN1 PSU 12 0.399 -0.517 -2.626 121 HN3 PSU 12 HN3 PSU 12 -2.722 -1.119 -5.170 122 H6 PSU 12 H6 PSU 12 -1.048 -0.764 -0.684 123 H1' PSU 12 H1' PSU 12 -4.638 -0.832 -0.906 124 H2' PSU 12 H2' PSU 12 -3.485 -3.359 -1.165 125 HO2' PSU 12 HO2' PSU 12 -5.735 -2.656 -0.613 126 H3' PSU 12 H3' PSU 12 -1.855 -3.183 0.524 127 H4' PSU 12 H4' PSU 12 -3.727 -1.492 2.207 128 H5' PSU 12 H5' PSU 12 -1.691 -0.330 2.819 129 H5'' PSU 12 H5'' PSU 12 -1.407 -2.076 2.973 130 H5' C 13 H5' C 13 -5.664 -5.729 1.319 131 H5'' C 13 H5'' C 13 -5.080 -7.403 1.417 132 H4' C 13 H4' C 13 -6.870 -7.051 -0.318 133 H3' C 13 H3' C 13 -4.107 -8.088 -0.987 134 H2' C 13 H2' C 13 -4.592 -8.123 -3.275 135 HO2' C 13 HO2' C 13 -7.005 -8.865 -2.370 136 H1' C 13 H1' C 13 -6.341 -5.952 -3.401 137 H41 C 13 H41 C 13 -0.876 -4.111 -6.072 138 H42 C 13 H42 C 13 -0.057 -4.148 -4.527 139 H5 C 13 H5 C 13 -1.118 -4.875 -2.491 140 H6 C 13 H6 C 13 -3.198 -5.705 -1.490 141 HN1 PSU 14 HN1 PSU 14 -2.585 -8.644 -4.047 142 HN3 PSU 14 HN3 PSU 14 -1.591 -9.028 -7.977 143 H6 PSU 14 H6 PSU 14 -4.581 -10.006 -4.347 144 H1' PSU 14 H1' PSU 14 -5.758 -11.055 -7.631 145 H2' PSU 14 H2' PSU 14 -4.027 -12.786 -6.375 146 HO2' PSU 14 HO2' PSU 14 -6.669 -13.060 -7.354 147 H3' PSU 14 H3' PSU 14 -4.742 -12.482 -4.150 148 H4' PSU 14 H4' PSU 14 -7.634 -12.291 -5.016 149 H5' PSU 14 H5' PSU 14 -7.573 -10.396 -3.342 150 H5'' PSU 14 H5'' PSU 14 -7.205 -11.994 -2.666 151 H5' C 15 H5' C 15 -5.989 -15.316 -6.672 152 H5'' C 15 H5'' C 15 -5.837 -17.054 -6.344 153 H4' C 15 H4' C 15 -5.110 -16.723 -8.604 154 H3' C 15 H3' C 15 -2.876 -17.073 -6.592 155 H2' C 15 H2' C 15 -1.267 -16.888 -8.280 156 HO2' C 15 HO2' C 15 -2.116 -16.807 -10.575 157 H1' C 15 H1' C 15 -2.520 -14.920 -9.763 158 H41 C 15 H41 C 15 1.868 -11.903 -6.295 159 H42 C 15 H42 C 15 0.887 -12.066 -4.855 160 H5 C 15 H5 C 15 -1.196 -13.276 -4.806 161 H6 C 15 H6 C 15 -2.774 -14.616 -6.118 Start of MODEL 12 1 H5' G 1 H5' G 1 9.536 -9.909 -12.093 2 H5'' G 1 H5'' G 1 9.829 -8.252 -12.660 3 H4' G 1 H4' G 1 7.905 -8.855 -13.852 4 H3' G 1 H3' G 1 7.193 -7.385 -11.300 5 H2' G 1 H2' G 1 4.890 -7.682 -11.722 6 HO2' G 1 HO2' G 1 4.953 -8.877 -14.174 7 H1' G 1 H1' G 1 4.973 -10.243 -12.705 8 H8 G 1 H8 G 1 7.030 -8.997 -9.664 9 H1 G 1 H1 G 1 1.569 -11.937 -8.189 10 H21 G 1 H21 G 1 0.485 -12.498 -10.042 11 H22 G 1 H22 G 1 1.110 -12.147 -11.638 12 H5' A 2 H5' A 2 5.430 -6.115 -15.681 13 H5'' A 2 H5'' A 2 4.522 -4.607 -15.454 14 H4' A 2 H4' A 2 3.320 -6.608 -16.604 15 H3' A 2 H3' A 2 2.215 -4.938 -14.314 16 H2' A 2 H2' A 2 0.196 -6.213 -14.417 17 HO2' A 2 HO2' A 2 0.580 -6.327 -16.926 18 H1' A 2 H1' A 2 1.380 -8.657 -14.561 19 H8 A 2 H8 A 2 3.416 -6.238 -12.447 20 H61 A 2 H61 A 2 -0.214 -7.752 -7.708 21 H62 A 2 H62 A 2 1.224 -6.879 -8.192 22 H2 A 2 H2 A 2 -1.914 -9.625 -11.418 23 H5' G 3 H5' G 3 -1.221 -4.638 -16.895 24 H5'' G 3 H5'' G 3 -1.913 -3.060 -16.475 25 H4' G 3 H4' G 3 -3.227 -5.194 -15.794 26 H3' G 3 H3' G 3 -2.562 -2.887 -13.917 27 H2' G 3 H2' G 3 -3.863 -3.980 -12.255 28 HO2' G 3 HO2' G 3 -4.791 -5.783 -14.271 29 H1' G 3 H1' G 3 -3.045 -6.561 -12.841 30 H8 G 3 H8 G 3 0.118 -4.728 -12.814 31 H1 G 3 H1 G 3 -2.392 -4.865 -6.955 32 H21 G 3 H21 G 3 -4.509 -5.525 -7.048 33 H22 G 3 H22 G 3 -5.301 -5.931 -8.555 34 H5' A 4 H5' A 4 -7.159 -2.070 -14.742 35 H5'' A 4 H5'' A 4 -7.318 -0.344 -14.357 36 H4' A 4 H4' A 4 -8.569 -2.053 -12.851 37 H3' A 4 H3' A 4 -6.822 0.224 -11.875 38 H2' A 4 H2' A 4 -7.312 -0.410 -9.636 39 HO2' A 4 HO2' A 4 -8.962 -2.463 -9.801 40 H1' A 4 H1' A 4 -7.099 -3.112 -9.966 41 H8 A 4 H8 A 4 -4.285 -1.868 -11.981 42 H61 A 4 H61 A 4 -1.241 -0.573 -6.785 43 H62 A 4 H62 A 4 -1.104 -0.755 -8.519 44 H2 A 4 H2 A 4 -5.536 -1.375 -5.729 45 H5' G 5 H5' G 5 -9.778 0.051 -9.653 46 H5'' G 5 H5'' G 5 -11.078 1.256 -9.746 47 H4' G 5 H4' G 5 -10.814 1.002 -7.440 48 H3' G 5 H3' G 5 -9.137 3.301 -8.467 49 H2' G 5 H2' G 5 -8.155 3.618 -6.361 50 HO2' G 5 HO2' G 5 -9.191 2.517 -4.472 51 H1' G 5 H1' G 5 -8.125 0.968 -5.489 52 H8 G 5 H8 G 5 -6.748 1.557 -8.987 53 H1 G 5 H1 G 5 -2.464 2.564 -4.376 54 H21 G 5 H21 G 5 -3.453 2.507 -2.394 55 H22 G 5 H22 G 5 -5.168 2.219 -2.208 56 HN1 PSU 6 HN1 PSU 6 -7.223 7.515 -10.159 57 HN3 PSU 6 HN3 PSU 6 -3.326 8.022 -9.097 58 H6 PSU 6 H6 PSU 6 -7.827 6.871 -7.890 59 H1' PSU 6 H1' PSU 6 -5.432 6.087 -5.366 60 H2' PSU 6 H2' PSU 6 -6.057 8.843 -5.483 61 HO2' PSU 6 HO2' PSU 6 -5.964 7.016 -3.287 62 H3' PSU 6 H3' PSU 6 -8.378 8.723 -5.427 63 H4' PSU 6 H4' PSU 6 -8.346 6.105 -3.920 64 H5' PSU 6 H5' PSU 6 -10.493 6.926 -4.668 65 H5'' PSU 6 H5'' PSU 6 -9.865 7.240 -6.299 66 HN1 PSU 7 HN1 PSU 7 -6.237 11.855 -7.581 67 HN3 PSU 7 HN3 PSU 7 -2.498 13.116 -8.571 68 H6 PSU 7 H6 PSU 7 -5.449 10.943 -5.466 69 H1' PSU 7 H1' PSU 7 -2.018 10.438 -4.717 70 H2' PSU 7 H2' PSU 7 -3.316 12.968 -3.795 71 HO2' PSU 7 HO2' PSU 7 -0.846 11.814 -3.994 72 H3' PSU 7 H3' PSU 7 -3.617 12.255 -1.558 73 H4' PSU 7 H4' PSU 7 -4.273 9.640 -1.996 74 H5' PSU 7 H5' PSU 7 -6.044 11.158 -1.628 75 H5'' PSU 7 H5'' PSU 7 -5.587 12.169 -3.015 76 H5' G 8 H5' G 8 -0.682 12.525 -2.165 77 H5'' G 8 H5'' G 8 0.751 11.921 -1.313 78 H4' G 8 H4' G 8 0.671 14.405 -2.217 79 H3' G 8 H3' G 8 2.316 13.153 -0.436 80 H2' G 8 H2' G 8 1.097 13.507 1.556 81 HO2' G 8 HO2' G 8 2.523 14.735 2.501 82 H1' G 8 H1' G 8 0.217 16.279 0.880 83 H8 G 8 H8 G 8 -2.337 13.578 0.662 84 H1 G 8 H1 G 8 -1.732 15.796 6.610 85 H21 G 8 H21 G 8 0.074 17.072 6.765 86 H22 G 8 H22 G 8 1.130 17.379 5.404 87 H5' G 9 H5' G 9 3.993 13.106 -3.696 88 H5'' G 9 H5'' G 9 3.802 12.699 -1.979 89 H4' G 9 H4' G 9 6.448 13.054 -3.434 90 H3' G 9 H3' G 9 4.686 10.724 -3.045 91 H2' G 9 H2' G 9 6.042 9.457 -1.639 92 HO2' G 9 HO2' G 9 7.827 9.499 -3.101 93 H1' G 9 H1' G 9 7.422 11.304 -0.233 94 H8 G 9 H8 G 9 6.129 11.592 1.992 95 H1 G 9 H1 G 9 0.632 9.671 -0.585 96 H21 G 9 H21 G 9 0.852 9.489 -2.781 97 H22 G 9 H22 G 9 2.353 9.838 -3.609 98 H5' G 10 H5' G 10 7.040 7.791 -2.617 99 H5'' G 10 H5'' G 10 6.365 6.601 -3.740 100 H4' G 10 H4' G 10 5.672 6.955 -1.041 101 H3' G 10 H3' G 10 4.839 5.227 -3.286 102 H2' G 10 H2' G 10 2.559 5.224 -2.967 103 HO2' G 10 HO2' G 10 3.387 4.897 -0.415 104 H1' G 10 H1' G 10 2.042 7.512 -1.533 105 H8 G 10 H8 G 10 4.163 8.360 -4.527 106 H1 G 10 H1 G 10 -1.985 7.539 -6.003 107 H21 G 10 H21 G 10 -3.068 6.650 -4.280 108 H22 G 10 H22 G 10 -2.271 6.259 -2.772 109 H5' C 11 H5' C 11 4.193 3.281 0.962 110 H5'' C 11 H5'' C 11 4.045 1.515 0.849 111 H4' C 11 H4' C 11 2.103 2.713 1.981 112 H3' C 11 H3' C 11 1.867 0.794 -0.339 113 H2' C 11 H2' C 11 -0.445 1.173 -0.540 114 HO2' C 11 HO2' C 11 -1.058 2.785 1.501 115 H1' C 11 H1' C 11 -0.528 3.837 -0.098 116 H41 C 11 H41 C 11 -0.301 2.868 -6.398 117 H42 C 11 H42 C 11 1.447 2.801 -6.329 118 H5 C 11 H5 C 11 2.689 2.865 -4.264 119 H6 C 11 H6 C 11 2.524 3.010 -1.825 120 HN1 PSU 12 HN1 PSU 12 0.051 -0.440 -2.355 121 HN3 PSU 12 HN3 PSU 12 -3.148 -1.020 -4.806 122 H6 PSU 12 H6 PSU 12 -1.336 -0.691 -0.369 123 H1' PSU 12 H1' PSU 12 -4.940 -0.735 -0.498 124 H2' PSU 12 H2' PSU 12 -3.900 -3.259 -0.805 125 HO2' PSU 12 HO2' PSU 12 -5.263 -3.183 1.527 126 H3' PSU 12 H3' PSU 12 -2.050 -3.087 0.646 127 H4' PSU 12 H4' PSU 12 -3.631 -1.454 2.638 128 H5' PSU 12 H5' PSU 12 -1.532 -0.213 2.825 129 H5'' PSU 12 H5'' PSU 12 -1.214 -1.954 2.977 130 H5' C 13 H5' C 13 -5.873 -4.795 0.911 131 H5'' C 13 H5'' C 13 -5.735 -6.525 1.287 132 H4' C 13 H4' C 13 -7.150 -6.294 -0.662 133 H3' C 13 H3' C 13 -4.353 -7.363 -1.118 134 H2' C 13 H2' C 13 -4.714 -7.472 -3.427 135 HO2' C 13 HO2' C 13 -7.411 -6.973 -3.546 136 H1' C 13 H1' C 13 -6.422 -5.285 -3.711 137 H41 C 13 H41 C 13 -0.825 -3.447 -6.088 138 H42 C 13 H42 C 13 -0.046 -3.649 -4.534 139 H5 C 13 H5 C 13 -1.179 -4.475 -2.588 140 H6 C 13 H6 C 13 -3.316 -5.265 -1.686 141 HN1 PSU 14 HN1 PSU 14 -2.679 -8.071 -4.112 142 HN3 PSU 14 HN3 PSU 14 -1.840 -8.647 -8.054 143 H6 PSU 14 H6 PSU 14 -4.677 -9.456 -4.264 144 H1' PSU 14 H1' PSU 14 -5.947 -10.720 -7.448 145 H2' PSU 14 H2' PSU 14 -4.190 -12.333 -6.097 146 HO2' PSU 14 HO2' PSU 14 -5.876 -12.939 -7.649 147 H3' PSU 14 H3' PSU 14 -4.801 -11.818 -3.881 148 H4' PSU 14 H4' PSU 14 -7.734 -11.683 -4.582 149 H5' PSU 14 H5' PSU 14 -7.073 -9.358 -3.295 150 H5'' PSU 14 H5'' PSU 14 -7.581 -10.847 -2.476 151 H5' C 15 H5' C 15 -6.073 -14.904 -6.086 152 H5'' C 15 H5'' C 15 -5.831 -16.593 -5.596 153 H4' C 15 H4' C 15 -5.128 -16.440 -7.883 154 H3' C 15 H3' C 15 -2.882 -16.487 -5.859 155 H2' C 15 H2' C 15 -1.276 -16.386 -7.570 156 HO2' C 15 HO2' C 15 -2.275 -16.445 -9.867 157 H1' C 15 H1' C 15 -2.564 -14.555 -9.159 158 H41 C 15 H41 C 15 1.521 -11.197 -5.620 159 H42 C 15 H42 C 15 0.493 -11.371 -4.213 160 H5 C 15 H5 C 15 -1.523 -12.683 -4.206 161 H6 C 15 H6 C 15 -2.988 -14.129 -5.537 Start of MODEL 13 1 H5' G 1 H5' G 1 9.560 -7.391 -12.412 2 H5'' G 1 H5'' G 1 8.717 -5.847 -12.654 3 H4' G 1 H4' G 1 7.548 -7.900 -13.613 4 H3' G 1 H3' G 1 6.254 -6.002 -11.627 5 H2' G 1 H2' G 1 4.285 -7.278 -11.674 6 HO2' G 1 HO2' G 1 3.641 -8.400 -13.423 7 H1' G 1 H1' G 1 5.446 -9.800 -12.018 8 H8 G 1 H8 G 1 6.668 -7.366 -9.296 9 H1 G 1 H1 G 1 2.015 -11.295 -7.408 10 H21 G 1 H21 G 1 1.293 -12.499 -9.127 11 H22 G 1 H22 G 1 1.959 -12.331 -10.736 12 H5' A 2 H5' A 2 4.319 -6.757 -16.153 13 H5'' A 2 H5'' A 2 3.178 -5.407 -16.306 14 H4' A 2 H4' A 2 2.285 -7.687 -17.006 15 H3' A 2 H3' A 2 0.952 -5.943 -14.906 16 H2' A 2 H2' A 2 -0.796 -7.572 -14.730 17 HO2' A 2 HO2' A 2 0.405 -8.682 -17.073 18 H1' A 2 H1' A 2 0.811 -9.727 -14.537 19 H8 A 2 H8 A 2 2.623 -6.808 -12.985 20 H61 A 2 H61 A 2 -0.660 -7.778 -7.863 21 H62 A 2 H62 A 2 0.681 -6.897 -8.561 22 H2 A 2 H2 A 2 -2.361 -10.359 -11.122 23 H5' G 3 H5' G 3 -2.519 -5.523 -17.639 24 H5'' G 3 H5'' G 3 -3.063 -3.889 -17.214 25 H4' G 3 H4' G 3 -4.518 -5.908 -16.455 26 H3' G 3 H3' G 3 -3.614 -3.621 -14.656 27 H2' G 3 H2' G 3 -4.899 -4.589 -12.904 28 HO2' G 3 HO2' G 3 -6.808 -5.140 -13.794 29 H1' G 3 H1' G 3 -4.254 -7.225 -13.435 30 H8 G 3 H8 G 3 -0.984 -5.669 -13.714 31 H1 G 3 H1 G 3 -3.057 -5.257 -7.703 32 H21 G 3 H21 G 3 -5.227 -5.711 -7.612 33 H22 G 3 H22 G 3 -6.163 -6.116 -9.033 34 H5' A 4 H5' A 4 -8.048 -2.429 -14.903 35 H5'' A 4 H5'' A 4 -7.982 -0.667 -14.704 36 H4' A 4 H4' A 4 -9.039 -2.077 -12.794 37 H3' A 4 H3' A 4 -6.931 0.074 -12.425 38 H2' A 4 H2' A 4 -7.092 -0.269 -10.082 39 HO2' A 4 HO2' A 4 -8.879 -1.783 -9.356 40 H1' A 4 H1' A 4 -7.385 -3.022 -10.146 41 H8 A 4 H8 A 4 -4.573 -2.493 -12.414 42 H61 A 4 H61 A 4 -0.989 -1.177 -7.578 43 H62 A 4 H62 A 4 -1.006 -1.573 -9.283 44 H2 A 4 H2 A 4 -5.269 -1.084 -6.218 45 H5' G 5 H5' G 5 -9.778 0.384 -10.068 46 H5'' G 5 H5'' G 5 -11.064 1.609 -10.100 47 H4' G 5 H4' G 5 -10.676 1.444 -7.818 48 H3' G 5 H3' G 5 -8.874 3.586 -8.984 49 H2' G 5 H2' G 5 -7.835 3.895 -6.902 50 HO2' G 5 HO2' G 5 -10.318 3.035 -5.976 51 H1' G 5 H1' G 5 -7.970 1.261 -5.979 52 H8 G 5 H8 G 5 -6.594 1.745 -9.506 53 H1 G 5 H1 G 5 -2.232 2.516 -4.917 54 H21 G 5 H21 G 5 -3.213 2.498 -2.928 55 H22 G 5 H22 G 5 -4.941 2.298 -2.735 56 HN1 PSU 6 HN1 PSU 6 -5.934 7.731 -10.620 57 HN3 PSU 6 HN3 PSU 6 -2.151 8.108 -9.167 58 H6 PSU 6 H6 PSU 6 -6.797 7.168 -8.414 59 H1' PSU 6 H1' PSU 6 -4.715 6.425 -5.607 60 H2' PSU 6 H2' PSU 6 -5.221 9.182 -5.910 61 HO2' PSU 6 HO2' PSU 6 -5.842 8.571 -3.449 62 H3' PSU 6 H3' PSU 6 -7.533 9.136 -6.178 63 H4' PSU 6 H4' PSU 6 -7.825 6.615 -4.543 64 H5' PSU 6 H5' PSU 6 -9.809 7.424 -5.624 65 H5'' PSU 6 H5'' PSU 6 -8.946 7.694 -7.152 66 HN1 PSU 7 HN1 PSU 7 -6.620 13.339 -6.566 67 HN3 PSU 7 HN3 PSU 7 -3.519 15.973 -6.663 68 H6 PSU 7 H6 PSU 7 -5.391 11.836 -5.101 69 H1' PSU 7 H1' PSU 7 -1.943 11.995 -4.593 70 H2' PSU 7 H2' PSU 7 -3.421 13.656 -2.654 71 HO2' PSU 7 HO2' PSU 7 -1.402 14.077 -2.218 72 H3' PSU 7 H3' PSU 7 -3.714 12.067 -0.942 73 H4' PSU 7 H4' PSU 7 -4.081 9.793 -2.360 74 H5' PSU 7 H5' PSU 7 -6.087 10.794 -1.797 75 H5'' PSU 7 H5'' PSU 7 -5.572 12.393 -2.374 76 H5' G 8 H5' G 8 0.031 12.185 -1.513 77 H5'' G 8 H5'' G 8 1.165 11.831 -0.199 78 H4' G 8 H4' G 8 0.786 14.316 -1.330 79 H3' G 8 H3' G 8 2.530 13.338 0.501 80 H2' G 8 H2' G 8 1.006 13.248 2.352 81 HO2' G 8 HO2' G 8 1.551 15.012 3.684 82 H1' G 8 H1' G 8 -0.076 15.991 1.738 83 H8 G 8 H8 G 8 -1.670 12.466 1.825 84 H1 G 8 H1 G 8 -3.572 16.360 6.501 85 H21 G 8 H21 G 8 -2.453 18.270 6.403 86 H22 G 8 H22 G 8 -1.236 18.586 5.185 87 H5' G 9 H5' G 9 4.311 13.580 -1.981 88 H5'' G 9 H5'' G 9 3.904 12.271 -0.854 89 H4' G 9 H4' G 9 6.608 13.260 -1.733 90 H3' G 9 H3' G 9 5.035 10.841 -2.055 91 H2' G 9 H2' G 9 6.141 9.341 -0.678 92 HO2' G 9 HO2' G 9 8.398 10.787 -1.569 93 H1' G 9 H1' G 9 7.447 10.854 1.160 94 H8 G 9 H8 G 9 5.918 10.908 3.287 95 H1 G 9 H1 G 9 0.742 9.362 -0.090 96 H21 G 9 H21 G 9 1.195 9.472 -2.259 97 H22 G 9 H22 G 9 2.772 9.923 -2.868 98 H5' G 10 H5' G 10 7.367 7.985 -1.876 99 H5'' G 10 H5'' G 10 6.898 6.977 -3.254 100 H4' G 10 H4' G 10 5.755 7.013 -0.660 101 H3' G 10 H3' G 10 5.443 5.475 -3.163 102 H2' G 10 H2' G 10 3.141 5.328 -3.251 103 HO2' G 10 HO2' G 10 3.394 5.323 -0.430 104 H1' G 10 H1' G 10 2.248 7.472 -1.780 105 H8 G 10 H8 G 10 4.852 8.658 -4.236 106 H1 G 10 H1 G 10 -0.850 7.745 -6.938 107 H21 G 10 H21 G 10 -2.196 6.683 -5.537 108 H22 G 10 H22 G 10 -1.692 6.195 -3.934 109 H5' C 11 H5' C 11 4.586 2.839 0.875 110 H5'' C 11 H5'' C 11 4.416 1.138 0.396 111 H4' C 11 H4' C 11 2.474 2.220 1.723 112 H3' C 11 H3' C 11 2.247 0.590 -0.823 113 H2' C 11 H2' C 11 -0.098 0.910 -0.845 114 HO2' C 11 HO2' C 11 -1.223 1.712 0.956 115 H1' C 11 H1' C 11 -0.159 3.525 -0.228 116 H41 C 11 H41 C 11 0.006 2.955 -6.593 117 H42 C 11 H42 C 11 1.754 3.023 -6.548 118 H5 C 11 H5 C 11 3.024 3.042 -4.496 119 H6 C 11 H6 C 11 2.886 3.012 -2.049 120 HN1 PSU 12 HN1 PSU 12 0.626 -1.162 -3.212 121 HN3 PSU 12 HN3 PSU 12 -2.456 -1.472 -5.846 122 H6 PSU 12 H6 PSU 12 -0.909 -0.924 -1.338 123 H1' PSU 12 H1' PSU 12 -4.459 -0.391 -1.767 124 H2' PSU 12 H2' PSU 12 -3.831 -3.063 -1.689 125 HO2' PSU 12 HO2' PSU 12 -5.534 -1.412 -0.167 126 H3' PSU 12 H3' PSU 12 -2.047 -2.953 -0.142 127 H4' PSU 12 H4' PSU 12 -3.551 -0.908 1.512 128 H5' PSU 12 H5' PSU 12 -1.337 0.007 1.879 129 H5'' PSU 12 H5'' PSU 12 -1.266 -1.748 2.142 130 H5' C 13 H5' C 13 -5.583 -4.328 0.399 131 H5'' C 13 H5'' C 13 -5.939 -5.812 1.307 132 H4' C 13 H4' C 13 -7.113 -6.253 -0.634 133 H3' C 13 H3' C 13 -4.261 -7.216 -1.066 134 H2' C 13 H2' C 13 -4.840 -7.863 -3.252 135 HO2' C 13 HO2' C 13 -7.537 -7.728 -2.323 136 H1' C 13 H1' C 13 -6.627 -5.798 -3.803 137 H41 C 13 H41 C 13 -1.326 -4.317 -6.963 138 H42 C 13 H42 C 13 -0.374 -4.345 -5.495 139 H5 C 13 H5 C 13 -1.292 -4.882 -3.337 140 H6 C 13 H6 C 13 -3.323 -5.505 -2.113 141 HN1 PSU 14 HN1 PSU 14 -2.893 -8.335 -4.117 142 HN3 PSU 14 HN3 PSU 14 -2.288 -9.382 -8.003 143 H6 PSU 14 H6 PSU 14 -4.723 -9.929 -3.899 144 H1' PSU 14 H1' PSU 14 -6.027 -11.825 -6.762 145 H2' PSU 14 H2' PSU 14 -4.047 -12.968 -5.274 146 HO2' PSU 14 HO2' PSU 14 -6.603 -14.118 -4.999 147 H3' PSU 14 H3' PSU 14 -4.579 -12.031 -3.169 148 H4' PSU 14 H4' PSU 14 -7.538 -12.442 -3.647 149 H5' PSU 14 H5' PSU 14 -7.355 -9.929 -2.809 150 H5'' PSU 14 H5'' PSU 14 -7.243 -11.283 -1.668 151 H5' C 15 H5' C 15 -5.210 -15.572 -5.051 152 H5'' C 15 H5'' C 15 -4.518 -16.974 -4.210 153 H4' C 15 H4' C 15 -3.820 -17.036 -6.537 154 H3' C 15 H3' C 15 -1.720 -16.263 -4.499 155 H2' C 15 H2' C 15 -0.093 -16.133 -6.190 156 HO2' C 15 HO2' C 15 -0.289 -17.797 -7.530 157 H1' C 15 H1' C 15 -1.665 -14.900 -8.079 158 H41 C 15 H41 C 15 1.487 -10.192 -5.200 159 H42 C 15 H42 C 15 0.498 -10.356 -3.767 160 H5 C 15 H5 C 15 -1.177 -12.065 -3.509 161 H6 C 15 H6 C 15 -2.259 -13.996 -4.562 Start of MODEL 14 1 H5' G 1 H5' G 1 9.878 -7.284 -10.477 2 H5'' G 1 H5'' G 1 9.616 -5.742 -11.317 3 H4' G 1 H4' G 1 8.274 -7.175 -12.569 4 H3' G 1 H3' G 1 6.662 -5.876 -10.364 5 H2' G 1 H2' G 1 4.765 -7.166 -10.891 6 HO2' G 1 HO2' G 1 4.962 -8.513 -12.960 7 H1' G 1 H1' G 1 6.004 -9.543 -11.489 8 H8 G 1 H8 G 1 7.299 -7.591 -8.443 9 H1 G 1 H1 G 1 2.487 -11.568 -7.146 10 H21 G 1 H21 G 1 1.688 -12.431 -9.027 11 H22 G 1 H22 G 1 2.341 -12.024 -10.599 12 H5' A 2 H5' A 2 5.147 -5.604 -15.084 13 H5'' A 2 H5'' A 2 4.050 -4.207 -15.038 14 H4' A 2 H4' A 2 3.180 -6.216 -16.326 15 H3' A 2 H3' A 2 1.714 -4.922 -14.015 16 H2' A 2 H2' A 2 -0.051 -6.507 -14.221 17 HO2' A 2 HO2' A 2 -0.044 -8.013 -16.012 18 H1' A 2 H1' A 2 1.471 -8.711 -14.441 19 H8 A 2 H8 A 2 3.316 -6.277 -12.243 20 H61 A 2 H61 A 2 -0.257 -8.112 -7.570 21 H62 A 2 H62 A 2 1.147 -7.167 -8.013 22 H2 A 2 H2 A 2 -1.879 -9.904 -11.352 23 H5' G 3 H5' G 3 -1.524 -4.507 -16.838 24 H5'' G 3 H5'' G 3 -2.237 -2.915 -16.502 25 H4' G 3 H4' G 3 -3.713 -4.929 -15.964 26 H3' G 3 H3' G 3 -2.974 -2.842 -13.869 27 H2' G 3 H2' G 3 -4.464 -3.949 -12.381 28 HO2' G 3 HO2' G 3 -6.075 -5.283 -13.068 29 H1' G 3 H1' G 3 -3.783 -6.532 -13.122 30 H8 G 3 H8 G 3 -0.508 -4.949 -12.808 31 H1 G 3 H1 G 3 -3.323 -5.304 -7.102 32 H21 G 3 H21 G 3 -5.468 -5.779 -7.335 33 H22 G 3 H22 G 3 -6.218 -6.013 -8.899 34 H5' A 4 H5' A 4 -7.417 -1.356 -14.979 35 H5'' A 4 H5'' A 4 -7.314 0.340 -14.464 36 H4' A 4 H4' A 4 -8.983 -1.203 -13.219 37 H3' A 4 H3' A 4 -6.986 0.699 -11.990 38 H2' A 4 H2' A 4 -7.566 -0.011 -9.802 39 HO2' A 4 HO2' A 4 -9.909 -0.857 -11.101 40 H1' A 4 H1' A 4 -7.701 -2.677 -10.249 41 H8 A 4 H8 A 4 -4.850 -1.810 -12.378 42 H61 A 4 H61 A 4 -1.395 -0.950 -7.354 43 H62 A 4 H62 A 4 -1.376 -1.146 -9.093 44 H2 A 4 H2 A 4 -5.696 -1.174 -6.070 45 H5' G 5 H5' G 5 -10.107 0.725 -9.963 46 H5'' G 5 H5'' G 5 -11.301 2.040 -10.033 47 H4' G 5 H4' G 5 -11.250 1.508 -7.755 48 H3' G 5 H3' G 5 -9.442 3.830 -8.429 49 H2' G 5 H2' G 5 -8.524 3.882 -6.273 50 HO2' G 5 HO2' G 5 -10.662 3.874 -5.287 51 H1' G 5 H1' G 5 -8.631 1.172 -5.653 52 H8 G 5 H8 G 5 -7.130 1.952 -9.054 53 H1 G 5 H1 G 5 -2.951 2.444 -4.271 54 H21 G 5 H21 G 5 -4.002 2.290 -2.323 55 H22 G 5 H22 G 5 -5.733 2.068 -2.205 56 HN1 PSU 6 HN1 PSU 6 -7.297 7.911 -10.129 57 HN3 PSU 6 HN3 PSU 6 -3.324 8.140 -9.270 58 H6 PSU 6 H6 PSU 6 -7.821 7.262 -7.838 59 H1' PSU 6 H1' PSU 6 -5.314 6.353 -5.429 60 H2' PSU 6 H2' PSU 6 -5.851 9.089 -5.495 61 HO2' PSU 6 HO2' PSU 6 -6.368 7.925 -3.052 62 H3' PSU 6 H3' PSU 6 -8.181 9.025 -5.644 63 H4' PSU 6 H4' PSU 6 -8.332 6.512 -3.968 64 H5' PSU 6 H5' PSU 6 -10.436 7.138 -4.801 65 H5'' PSU 6 H5'' PSU 6 -9.767 7.701 -6.345 66 HN1 PSU 7 HN1 PSU 7 -7.241 13.062 -6.755 67 HN3 PSU 7 HN3 PSU 7 -4.145 15.581 -7.547 68 H6 PSU 7 H6 PSU 7 -5.836 11.663 -5.345 69 H1' PSU 7 H1' PSU 7 -2.443 11.619 -5.395 70 H2' PSU 7 H2' PSU 7 -2.718 13.901 -3.873 71 HO2' PSU 7 HO2' PSU 7 -1.023 11.930 -4.084 72 H3' PSU 7 H3' PSU 7 -4.464 13.244 -2.470 73 H4' PSU 7 H4' PSU 7 -3.511 10.377 -2.316 74 H5' PSU 7 H5' PSU 7 -5.655 10.007 -1.772 75 H5'' PSU 7 H5'' PSU 7 -5.887 11.765 -1.743 76 H5' G 8 H5' G 8 0.014 12.354 -2.724 77 H5'' G 8 H5'' G 8 1.270 11.685 -1.668 78 H4' G 8 H4' G 8 1.491 14.129 -2.704 79 H3' G 8 H3' G 8 2.860 12.837 -0.726 80 H2' G 8 H2' G 8 1.622 13.381 1.179 81 HO2' G 8 HO2' G 8 2.292 15.900 1.520 82 H1' G 8 H1' G 8 0.690 16.071 0.411 83 H8 G 8 H8 G 8 -2.010 13.875 -0.392 84 H1 G 8 H1 G 8 -1.380 14.180 5.947 85 H21 G 8 H21 G 8 0.597 15.048 6.469 86 H22 G 8 H22 G 8 1.752 15.548 5.253 87 H5' G 9 H5' G 9 4.978 12.940 -3.564 88 H5'' G 9 H5'' G 9 4.643 12.418 -1.902 89 H4' G 9 H4' G 9 7.364 12.514 -3.245 90 H3' G 9 H3' G 9 5.314 10.421 -3.007 91 H2' G 9 H2' G 9 6.421 8.937 -1.595 92 HO2' G 9 HO2' G 9 8.615 8.653 -1.654 93 H1' G 9 H1' G 9 7.976 10.533 -0.060 94 H8 G 9 H8 G 9 6.593 11.103 2.103 95 H1 G 9 H1 G 9 1.100 9.621 -0.748 96 H21 G 9 H21 G 9 1.424 9.362 -2.925 97 H22 G 9 H22 G 9 2.996 9.555 -3.671 98 H5' G 10 H5' G 10 7.266 7.226 -2.673 99 H5'' G 10 H5'' G 10 6.452 6.146 -3.817 100 H4' G 10 H4' G 10 5.747 6.686 -1.113 101 H3' G 10 H3' G 10 4.885 4.870 -3.276 102 H2' G 10 H2' G 10 2.596 5.037 -3.047 103 HO2' G 10 HO2' G 10 1.734 5.611 -0.856 104 H1' G 10 H1' G 10 2.200 7.448 -1.766 105 H8 G 10 H8 G 10 4.430 7.981 -4.738 106 H1 G 10 H1 G 10 -1.715 7.439 -6.350 107 H21 G 10 H21 G 10 -2.895 6.718 -4.619 108 H22 G 10 H22 G 10 -2.169 6.365 -3.067 109 H5' C 11 H5' C 11 3.808 3.121 1.064 110 H5'' C 11 H5'' C 11 3.874 1.353 0.908 111 H4' C 11 H4' C 11 1.754 2.210 1.961 112 H3' C 11 H3' C 11 1.780 0.558 -0.579 113 H2' C 11 H2' C 11 -0.564 0.711 -0.752 114 HO2' C 11 HO2' C 11 -1.840 0.879 0.962 115 H1' C 11 H1' C 11 -0.890 3.297 -0.002 116 H41 C 11 H41 C 11 -0.772 2.962 -6.370 117 H42 C 11 H42 C 11 0.975 3.034 -6.352 118 H5 C 11 H5 C 11 2.275 3.012 -4.322 119 H6 C 11 H6 C 11 2.180 2.931 -1.875 120 HN1 PSU 12 HN1 PSU 12 0.078 -1.242 -3.012 121 HN3 PSU 12 HN3 PSU 12 -3.272 -1.180 -5.325 122 H6 PSU 12 H6 PSU 12 -1.247 -1.229 -0.969 123 H1' PSU 12 H1' PSU 12 -4.799 -0.596 -0.943 124 H2' PSU 12 H2' PSU 12 -4.229 -3.270 -1.272 125 HO2' PSU 12 HO2' PSU 12 -5.602 -3.431 0.778 126 H3' PSU 12 H3' PSU 12 -2.314 -3.397 0.102 127 H4' PSU 12 H4' PSU 12 -3.581 -1.529 2.125 128 H5' PSU 12 H5' PSU 12 -1.300 -0.681 2.322 129 H5'' PSU 12 H5'' PSU 12 -1.293 -2.451 2.469 130 H5' C 13 H5' C 13 -5.899 -5.225 0.937 131 H5'' C 13 H5'' C 13 -5.787 -6.925 1.438 132 H4' C 13 H4' C 13 -7.224 -6.910 -0.463 133 H3' C 13 H3' C 13 -4.389 -7.806 -1.045 134 H2' C 13 H2' C 13 -4.855 -7.996 -3.332 135 HO2' C 13 HO2' C 13 -7.251 -7.849 -3.937 136 H1' C 13 H1' C 13 -6.655 -5.898 -3.599 137 H41 C 13 H41 C 13 -1.154 -3.897 -6.072 138 H42 C 13 H42 C 13 -0.390 -3.915 -4.498 139 H5 C 13 H5 C 13 -1.497 -4.661 -2.504 140 H6 C 13 H6 C 13 -3.589 -5.538 -1.569 141 HN1 PSU 14 HN1 PSU 14 -2.813 -8.373 -4.139 142 HN3 PSU 14 HN3 PSU 14 -1.624 -9.211 -7.941 143 H6 PSU 14 H6 PSU 14 -4.683 -9.923 -4.308 144 H1' PSU 14 H1' PSU 14 -5.642 -11.487 -7.454 145 H2' PSU 14 H2' PSU 14 -3.847 -12.888 -5.877 146 HO2' PSU 14 HO2' PSU 14 -4.842 -14.176 -7.264 147 H3' PSU 14 H3' PSU 14 -4.737 -12.458 -3.753 148 H4' PSU 14 H4' PSU 14 -7.580 -12.448 -4.747 149 H5' PSU 14 H5' PSU 14 -7.516 -10.266 -3.376 150 H5'' PSU 14 H5'' PSU 14 -7.320 -11.791 -2.487 151 H5' C 15 H5' C 15 -5.422 -15.615 -6.338 152 H5'' C 15 H5'' C 15 -4.897 -17.201 -5.738 153 H4' C 15 H4' C 15 -3.986 -16.780 -7.985 154 H3' C 15 H3' C 15 -2.074 -16.808 -5.636 155 H2' C 15 H2' C 15 -0.263 -16.506 -7.087 156 HO2' C 15 HO2' C 15 -2.033 -17.608 -8.965 157 H1' C 15 H1' C 15 -1.516 -14.762 -8.848 158 H41 C 15 H41 C 15 2.083 -11.149 -5.046 159 H42 C 15 H42 C 15 0.976 -11.394 -3.714 160 H5 C 15 H5 C 15 -0.951 -12.837 -3.845 161 H6 C 15 H6 C 15 -2.219 -14.369 -5.271 Start of MODEL 15 1 H5' G 1 H5' G 1 9.943 -6.266 -10.799 2 H5'' G 1 H5'' G 1 8.899 -4.832 -10.875 3 H4' G 1 H4' G 1 8.242 -6.888 -12.311 4 H3' G 1 H3' G 1 6.419 -5.326 -10.462 5 H2' G 1 H2' G 1 4.640 -6.782 -10.912 6 HO2' G 1 HO2' G 1 5.869 -8.073 -13.079 7 H1' G 1 H1' G 1 6.105 -9.134 -11.328 8 H8 G 1 H8 G 1 6.923 -7.353 -8.091 9 H1 G 1 H1 G 1 1.626 -10.883 -7.729 10 H21 G 1 H21 G 1 1.053 -11.599 -9.747 11 H22 G 1 H22 G 1 1.977 -11.207 -11.181 12 H5' A 2 H5' A 2 5.059 -5.454 -15.208 13 H5'' A 2 H5'' A 2 3.864 -4.145 -15.307 14 H4' A 2 H4' A 2 3.170 -6.436 -16.256 15 H3' A 2 H3' A 2 1.578 -4.790 -14.271 16 H2' A 2 H2' A 2 -0.110 -6.467 -14.215 17 HO2' A 2 HO2' A 2 0.639 -6.878 -16.714 18 H1' A 2 H1' A 2 1.521 -8.620 -14.023 19 H8 A 2 H8 A 2 3.161 -5.799 -12.157 20 H61 A 2 H61 A 2 -0.510 -7.101 -7.387 21 H62 A 2 H62 A 2 0.878 -6.180 -7.918 22 H2 A 2 H2 A 2 -1.948 -9.452 -10.940 23 H5' G 3 H5' G 3 -1.801 -4.914 -17.054 24 H5'' G 3 H5'' G 3 -2.534 -3.335 -16.705 25 H4' G 3 H4' G 3 -3.785 -5.454 -15.893 26 H3' G 3 H3' G 3 -3.107 -3.080 -14.101 27 H2' G 3 H2' G 3 -4.404 -4.135 -12.407 28 HO2' G 3 HO2' G 3 -5.688 -6.024 -12.951 29 H1' G 3 H1' G 3 -3.519 -6.711 -12.916 30 H8 G 3 H8 G 3 -0.441 -4.696 -13.000 31 H1 G 3 H1 G 3 -2.786 -4.986 -7.079 32 H21 G 3 H21 G 3 -4.856 -5.778 -7.120 33 H22 G 3 H22 G 3 -5.659 -6.236 -8.606 34 H5' A 4 H5' A 4 -7.667 -2.271 -14.695 35 H5'' A 4 H5'' A 4 -7.797 -0.539 -14.334 36 H4' A 4 H4' A 4 -8.917 -2.216 -12.696 37 H3' A 4 H3' A 4 -7.086 0.067 -11.895 38 H2' A 4 H2' A 4 -7.459 -0.520 -9.617 39 HO2' A 4 HO2' A 4 -9.076 -2.205 -9.142 40 H1' A 4 H1' A 4 -7.286 -3.233 -9.921 41 H8 A 4 H8 A 4 -4.580 -1.995 -12.093 42 H61 A 4 H61 A 4 -1.248 -0.687 -7.080 43 H62 A 4 H62 A 4 -1.211 -0.864 -8.819 44 H2 A 4 H2 A 4 -5.465 -1.529 -5.774 45 H5' G 5 H5' G 5 -9.859 0.048 -9.526 46 H5'' G 5 H5'' G 5 -11.167 1.248 -9.565 47 H4' G 5 H4' G 5 -10.743 1.173 -7.291 48 H3' G 5 H3' G 5 -8.939 3.258 -8.554 49 H2' G 5 H2' G 5 -7.897 3.646 -6.480 50 HO2' G 5 HO2' G 5 -10.006 2.218 -5.186 51 H1' G 5 H1' G 5 -8.018 1.040 -5.476 52 H8 G 5 H8 G 5 -6.698 1.399 -9.031 53 H1 G 5 H1 G 5 -2.216 2.200 -4.569 54 H21 G 5 H21 G 5 -3.147 2.287 -2.561 55 H22 G 5 H22 G 5 -4.874 2.144 -2.318 56 HN1 PSU 6 HN1 PSU 6 -6.783 7.377 -10.620 57 HN3 PSU 6 HN3 PSU 6 -2.921 8.101 -9.557 58 H6 PSU 6 H6 PSU 6 -7.381 6.838 -8.319 59 H1' PSU 6 H1' PSU 6 -5.023 6.294 -5.732 60 H2' PSU 6 H2' PSU 6 -5.643 9.050 -6.038 61 HO2' PSU 6 HO2' PSU 6 -5.870 8.308 -3.477 62 H3' PSU 6 H3' PSU 6 -7.957 8.927 -5.918 63 H4' PSU 6 H4' PSU 6 -7.852 6.408 -4.249 64 H5' PSU 6 H5' PSU 6 -10.040 7.133 -4.916 65 H5'' PSU 6 H5'' PSU 6 -9.501 7.450 -6.578 66 HN1 PSU 7 HN1 PSU 7 -7.334 13.117 -6.136 67 HN3 PSU 7 HN3 PSU 7 -4.711 16.181 -6.664 68 H6 PSU 7 H6 PSU 7 -5.552 11.614 -5.447 69 H1' PSU 7 H1' PSU 7 -2.312 11.980 -6.101 70 H2' PSU 7 H2' PSU 7 -2.226 13.897 -4.159 71 HO2' PSU 7 HO2' PSU 7 -0.752 11.491 -4.479 72 H3' PSU 7 H3' PSU 7 -3.390 13.048 -2.356 73 H4' PSU 7 H4' PSU 7 -3.385 10.196 -2.823 74 H5' PSU 7 H5' PSU 7 -5.384 11.040 -1.999 75 H5'' PSU 7 H5'' PSU 7 -5.359 12.450 -3.077 76 H5' G 8 H5' G 8 0.672 12.196 -3.698 77 H5'' G 8 H5'' G 8 2.227 11.835 -2.919 78 H4' G 8 H4' G 8 1.226 14.162 -2.495 79 H3' G 8 H3' G 8 2.611 12.336 -0.709 80 H2' G 8 H2' G 8 1.037 12.367 1.003 81 HO2' G 8 HO2' G 8 1.282 14.133 2.326 82 H1' G 8 H1' G 8 -0.206 14.934 0.020 83 H8 G 8 H8 G 8 -1.742 11.441 -0.068 84 H1 G 8 H1 G 8 -3.861 15.046 4.741 85 H21 G 8 H21 G 8 -2.688 16.924 4.858 86 H22 G 8 H22 G 8 -1.381 17.287 3.752 87 H5' G 9 H5' G 9 4.812 13.099 -3.590 88 H5'' G 9 H5'' G 9 4.298 12.296 -2.093 89 H4' G 9 H4' G 9 7.107 12.689 -3.142 90 H3' G 9 H3' G 9 5.218 10.440 -2.914 91 H2' G 9 H2' G 9 6.410 9.089 -1.437 92 HO2' G 9 HO2' G 9 8.814 9.618 -1.217 93 H1' G 9 H1' G 9 7.779 10.851 0.094 94 H8 G 9 H8 G 9 6.334 11.238 2.226 95 H1 G 9 H1 G 9 0.981 9.483 -0.740 96 H21 G 9 H21 G 9 1.361 9.267 -2.913 97 H22 G 9 H22 G 9 2.932 9.561 -3.625 98 H5' G 10 H5' G 10 7.315 7.470 -2.600 99 H5'' G 10 H5'' G 10 6.579 6.319 -3.727 100 H4' G 10 H4' G 10 5.884 6.772 -1.019 101 H3' G 10 H3' G 10 5.011 4.995 -3.242 102 H2' G 10 H2' G 10 2.755 4.926 -2.732 103 HO2' G 10 HO2' G 10 2.288 4.408 -0.746 104 H1' G 10 H1' G 10 2.301 7.323 -1.469 105 H8 G 10 H8 G 10 4.245 8.075 -4.574 106 H1 G 10 H1 G 10 -1.884 6.811 -5.798 107 H21 G 10 H21 G 10 -2.855 5.947 -4.001 108 H22 G 10 H22 G 10 -1.993 5.682 -2.502 109 H5' C 11 H5' C 11 4.796 2.829 1.082 110 H5'' C 11 H5'' C 11 4.524 1.094 0.824 111 H4' C 11 H4' C 11 2.787 2.374 2.246 112 H3' C 11 H3' C 11 2.182 0.547 -0.098 113 H2' C 11 H2' C 11 -0.146 0.940 0.214 114 HO2' C 11 HO2' C 11 -0.970 1.920 2.054 115 H1' C 11 H1' C 11 -0.029 3.601 0.500 116 H41 C 11 H41 C 11 -0.662 2.303 -5.731 117 H42 C 11 H42 C 11 1.077 2.376 -5.907 118 H5 C 11 H5 C 11 2.583 2.623 -4.042 119 H6 C 11 H6 C 11 2.748 2.849 -1.607 120 HN1 PSU 12 HN1 PSU 12 0.358 -0.773 -2.773 121 HN3 PSU 12 HN3 PSU 12 -3.159 -1.117 -4.788 122 H6 PSU 12 H6 PSU 12 -0.784 -0.833 -0.629 123 H1' PSU 12 H1' PSU 12 -4.323 -0.467 -0.281 124 H2' PSU 12 H2' PSU 12 -3.643 -3.140 -0.690 125 HO2' PSU 12 HO2' PSU 12 -4.990 -3.305 1.412 126 H3' PSU 12 H3' PSU 12 -1.739 -3.214 0.697 127 H4' PSU 12 H4' PSU 12 -3.083 -1.315 2.647 128 H5' PSU 12 H5' PSU 12 -0.848 -0.519 3.026 129 H5'' PSU 12 H5'' PSU 12 -0.771 -2.292 3.030 130 H5' C 13 H5' C 13 -5.630 -5.421 1.524 131 H5'' C 13 H5'' C 13 -5.063 -7.099 1.653 132 H4' C 13 H4' C 13 -6.796 -6.727 -0.142 133 H3' C 13 H3' C 13 -4.022 -7.797 -0.768 134 H2' C 13 H2' C 13 -4.609 -7.969 -3.042 135 HO2' C 13 HO2' C 13 -7.185 -8.188 -1.968 136 H1' C 13 H1' C 13 -6.266 -5.726 -3.187 137 H41 C 13 H41 C 13 -0.866 -4.051 -6.077 138 H42 C 13 H42 C 13 0.032 -4.182 -4.582 139 H5 C 13 H5 C 13 -0.948 -4.924 -2.516 140 H6 C 13 H6 C 13 -3.009 -5.679 -1.419 141 HN1 PSU 14 HN1 PSU 14 -2.716 -8.746 -3.805 142 HN3 PSU 14 HN3 PSU 14 -2.144 -8.850 -7.831 143 H6 PSU 14 H6 PSU 14 -4.834 -9.932 -4.000 144 H1' PSU 14 H1' PSU 14 -6.373 -10.640 -7.259 145 H2' PSU 14 H2' PSU 14 -4.761 -12.569 -6.172 146 HO2' PSU 14 HO2' PSU 14 -7.310 -12.454 -7.216 147 H3' PSU 14 H3' PSU 14 -5.262 -12.258 -3.890 148 H4' PSU 14 H4' PSU 14 -8.179 -11.749 -4.482 149 H5' PSU 14 H5' PSU 14 -7.760 -9.892 -2.823 150 H5'' PSU 14 H5'' PSU 14 -7.463 -11.523 -2.190 151 H5' C 15 H5' C 15 -6.128 -14.574 -7.398 152 H5'' C 15 H5'' C 15 -5.971 -16.245 -6.817 153 H4' C 15 H4' C 15 -4.642 -16.103 -8.801 154 H3' C 15 H3' C 15 -3.051 -15.983 -6.231 155 H2' C 15 H2' C 15 -1.049 -15.813 -7.427 156 HO2' C 15 HO2' C 15 -0.803 -16.526 -9.485 157 H1' C 15 H1' C 15 -1.976 -14.195 -9.478 158 H41 C 15 H41 C 15 0.874 -10.096 -5.561 159 H42 C 15 H42 C 15 -0.238 -10.480 -4.267 160 H5 C 15 H5 C 15 -1.961 -12.147 -4.459 161 H6 C 15 H6 C 15 -2.987 -13.818 -5.926 Start of MODEL 16 1 H5' G 1 H5' G 1 9.659 -7.257 -10.490 2 H5'' G 1 H5'' G 1 8.975 -5.676 -10.921 3 H4' G 1 H4' G 1 8.079 -7.442 -12.384 4 H3' G 1 H3' G 1 6.254 -6.001 -10.454 5 H2' G 1 H2' G 1 4.424 -7.344 -11.052 6 HO2' G 1 HO2' G 1 4.147 -8.024 -13.056 7 H1' G 1 H1' G 1 5.741 -9.741 -11.477 8 H8 G 1 H8 G 1 6.527 -7.627 -8.356 9 H1 G 1 H1 G 1 1.789 -11.822 -7.564 10 H21 G 1 H21 G 1 1.334 -12.820 -9.495 11 H22 G 1 H22 G 1 2.198 -12.450 -10.970 12 H5' A 2 H5' A 2 5.057 -6.181 -15.195 13 H5'' A 2 H5'' A 2 4.095 -4.703 -15.402 14 H4' A 2 H4' A 2 3.063 -6.718 -16.484 15 H3' A 2 H3' A 2 1.653 -5.204 -14.267 16 H2' A 2 H2' A 2 -0.204 -6.686 -14.430 17 HO2' A 2 HO2' A 2 0.254 -8.449 -16.239 18 H1' A 2 H1' A 2 1.208 -8.993 -14.512 19 H8 A 2 H8 A 2 2.982 -6.391 -12.383 20 H61 A 2 H61 A 2 -0.603 -8.179 -7.702 21 H62 A 2 H62 A 2 0.765 -7.191 -8.163 22 H2 A 2 H2 A 2 -2.065 -10.211 -11.430 23 H5' G 3 H5' G 3 -1.531 -5.688 -16.779 24 H5'' G 3 H5'' G 3 -2.383 -4.138 -16.915 25 H4' G 3 H4' G 3 -3.809 -5.931 -15.932 26 H3' G 3 H3' G 3 -3.058 -3.532 -14.207 27 H2' G 3 H2' G 3 -4.526 -4.398 -12.544 28 HO2' G 3 HO2' G 3 -6.238 -4.888 -14.075 29 H1' G 3 H1' G 3 -3.877 -7.082 -12.921 30 H8 G 3 H8 G 3 -0.669 -5.230 -12.843 31 H1 G 3 H1 G 3 -3.310 -5.506 -7.045 32 H21 G 3 H21 G 3 -5.398 -6.231 -7.194 33 H22 G 3 H22 G 3 -6.142 -6.647 -8.722 34 H5' A 4 H5' A 4 -7.437 -2.067 -15.214 35 H5'' A 4 H5'' A 4 -7.210 -0.327 -14.948 36 H4' A 4 H4' A 4 -8.723 -1.632 -13.286 37 H3' A 4 H3' A 4 -6.509 0.296 -12.537 38 H2' A 4 H2' A 4 -6.993 -0.093 -10.242 39 HO2' A 4 HO2' A 4 -9.279 -1.634 -10.944 40 H1' A 4 H1' A 4 -7.339 -2.796 -10.380 41 H8 A 4 H8 A 4 -4.462 -2.226 -12.617 42 H61 A 4 H61 A 4 -0.925 -1.218 -7.681 43 H62 A 4 H62 A 4 -0.930 -1.509 -9.407 44 H2 A 4 H2 A 4 -5.216 -1.203 -6.350 45 H5' G 5 H5' G 5 -9.549 0.561 -10.225 46 H5'' G 5 H5'' G 5 -10.613 1.976 -10.347 47 H4' G 5 H4' G 5 -10.498 1.491 -8.030 48 H3' G 5 H3' G 5 -8.671 3.746 -8.889 49 H2' G 5 H2' G 5 -7.771 3.926 -6.722 50 HO2' G 5 HO2' G 5 -8.897 3.429 -4.932 51 H1' G 5 H1' G 5 -7.799 1.245 -6.023 52 H8 G 5 H8 G 5 -6.427 1.826 -9.506 53 H1 G 5 H1 G 5 -2.142 2.897 -4.906 54 H21 G 5 H21 G 5 -3.137 2.864 -2.922 55 H22 G 5 H22 G 5 -4.855 2.582 -2.738 56 HN1 PSU 6 HN1 PSU 6 -6.840 7.610 -10.596 57 HN3 PSU 6 HN3 PSU 6 -3.026 8.192 -9.297 58 H6 PSU 6 H6 PSU 6 -7.598 7.085 -8.343 59 H1' PSU 6 H1' PSU 6 -5.405 6.392 -5.647 60 H2' PSU 6 H2' PSU 6 -6.057 9.200 -5.944 61 HO2' PSU 6 HO2' PSU 6 -5.473 7.424 -3.804 62 H3' PSU 6 H3' PSU 6 -8.336 9.047 -5.559 63 H4' PSU 6 H4' PSU 6 -8.044 6.354 -4.212 64 H5' PSU 6 H5' PSU 6 -10.297 7.027 -4.592 65 H5'' PSU 6 H5'' PSU 6 -9.920 7.648 -6.212 66 HN1 PSU 7 HN1 PSU 7 -7.567 12.456 -5.982 67 HN3 PSU 7 HN3 PSU 7 -5.205 15.770 -5.940 68 H6 PSU 7 H6 PSU 7 -5.860 11.139 -4.849 69 H1' PSU 7 H1' PSU 7 -2.604 11.850 -4.724 70 H2' PSU 7 H2' PSU 7 -3.201 13.745 -2.846 71 HO2' PSU 7 HO2' PSU 7 -1.437 11.518 -2.751 72 H3' PSU 7 H3' PSU 7 -4.824 12.633 -1.594 73 H4' PSU 7 H4' PSU 7 -3.553 9.925 -1.804 74 H5' PSU 7 H5' PSU 7 -5.736 9.189 -1.903 75 H5'' PSU 7 H5'' PSU 7 -5.963 10.714 -1.025 76 H5' G 8 H5' G 8 0.163 11.849 -1.818 77 H5'' G 8 H5'' G 8 1.269 11.821 -0.430 78 H4' G 8 H4' G 8 0.686 14.030 -2.075 79 H3' G 8 H3' G 8 2.680 13.455 -0.342 80 H2' G 8 H2' G 8 1.404 13.579 1.676 81 HO2' G 8 HO2' G 8 2.581 15.090 2.557 82 H1' G 8 H1' G 8 0.027 16.119 0.873 83 H8 G 8 H8 G 8 -2.526 13.688 0.897 84 H1 G 8 H1 G 8 -0.698 14.654 6.932 85 H21 G 8 H21 G 8 1.265 15.694 6.972 86 H22 G 8 H22 G 8 2.117 16.147 5.514 87 H5' G 9 H5' G 9 4.371 13.285 -3.198 88 H5'' G 9 H5'' G 9 3.921 12.353 -1.757 89 H4' G 9 H4' G 9 6.690 13.101 -2.712 90 H3' G 9 H3' G 9 5.032 10.680 -2.712 91 H2' G 9 H2' G 9 6.268 9.348 -1.271 92 HO2' G 9 HO2' G 9 8.450 9.320 -1.300 93 H1' G 9 H1' G 9 7.534 11.118 0.364 94 H8 G 9 H8 G 9 6.152 11.098 2.538 95 H1 G 9 H1 G 9 0.842 9.283 -0.480 96 H21 G 9 H21 G 9 1.160 9.357 -2.670 97 H22 G 9 H22 G 9 2.677 9.852 -3.385 98 H5' G 10 H5' G 10 7.305 7.836 -2.438 99 H5'' G 10 H5'' G 10 6.740 6.721 -3.693 100 H4' G 10 H4' G 10 5.778 6.939 -1.057 101 H3' G 10 H3' G 10 5.177 5.333 -3.469 102 H2' G 10 H2' G 10 2.878 5.267 -3.304 103 HO2' G 10 HO2' G 10 1.836 5.150 -1.300 104 H1' G 10 H1' G 10 2.237 7.466 -1.761 105 H8 G 10 H8 G 10 4.443 8.472 -4.647 106 H1 G 10 H1 G 10 -1.633 7.604 -6.370 107 H21 G 10 H21 G 10 -2.765 6.653 -4.718 108 H22 G 10 H22 G 10 -2.023 6.231 -3.190 109 H5' C 11 H5' C 11 4.502 3.158 0.701 110 H5'' C 11 H5'' C 11 4.327 1.401 0.522 111 H4' C 11 H4' C 11 2.423 2.582 1.736 112 H3' C 11 H3' C 11 2.117 0.761 -0.654 113 H2' C 11 H2' C 11 -0.209 1.168 -0.762 114 HO2' C 11 HO2' C 11 -0.978 2.684 1.123 115 H1' C 11 H1' C 11 -0.210 3.814 -0.372 116 H41 C 11 H41 C 11 0.214 2.727 -6.648 117 H42 C 11 H42 C 11 1.960 2.790 -6.533 118 H5 C 11 H5 C 11 3.139 2.970 -4.434 119 H6 C 11 H6 C 11 2.892 3.127 -2.001 120 HN1 PSU 12 HN1 PSU 12 0.516 -0.732 -3.254 121 HN3 PSU 12 HN3 PSU 12 -2.636 -1.241 -5.774 122 H6 PSU 12 H6 PSU 12 -0.956 -0.673 -1.318 123 H1' PSU 12 H1' PSU 12 -4.522 -0.373 -1.576 124 H2' PSU 12 H2' PSU 12 -3.742 -3.023 -1.650 125 HO2' PSU 12 HO2' PSU 12 -5.449 -3.334 -0.203 126 H3' PSU 12 H3' PSU 12 -1.973 -2.902 -0.089 127 H4' PSU 12 H4' PSU 12 -3.579 -0.967 1.609 128 H5' PSU 12 H5' PSU 12 -1.398 0.036 2.025 129 H5'' PSU 12 H5'' PSU 12 -1.300 -1.714 2.308 130 H5' C 13 H5' C 13 -5.678 -5.249 1.231 131 H5'' C 13 H5'' C 13 -5.159 -6.927 1.495 132 H4' C 13 H4' C 13 -6.978 -6.789 -0.179 133 H3' C 13 H3' C 13 -4.221 -7.744 -0.983 134 H2' C 13 H2' C 13 -4.896 -7.990 -3.221 135 HO2' C 13 HO2' C 13 -7.438 -7.571 -3.424 136 H1' C 13 H1' C 13 -6.559 -5.803 -3.419 137 H41 C 13 H41 C 13 -1.013 -4.091 -6.018 138 H42 C 13 H42 C 13 -0.240 -4.078 -4.448 139 H5 C 13 H5 C 13 -1.354 -4.727 -2.426 140 H6 C 13 H6 C 13 -3.462 -5.510 -1.449 141 HN1 PSU 14 HN1 PSU 14 -2.857 -8.523 -4.127 142 HN3 PSU 14 HN3 PSU 14 -2.101 -9.273 -8.056 143 H6 PSU 14 H6 PSU 14 -4.842 -9.933 -4.169 144 H1' PSU 14 H1' PSU 14 -6.173 -11.353 -7.259 145 H2' PSU 14 H2' PSU 14 -4.377 -12.900 -5.917 146 HO2' PSU 14 HO2' PSU 14 -7.168 -13.385 -6.315 147 H3' PSU 14 H3' PSU 14 -4.859 -12.221 -3.705 148 H4' PSU 14 H4' PSU 14 -7.832 -12.186 -4.234 149 H5' PSU 14 H5' PSU 14 -7.289 -9.812 -3.116 150 H5'' PSU 14 H5'' PSU 14 -7.453 -11.291 -2.148 151 H5' C 15 H5' C 15 -5.733 -15.110 -6.260 152 H5'' C 15 H5'' C 15 -5.505 -16.737 -5.589 153 H4' C 15 H4' C 15 -4.541 -16.770 -7.780 154 H3' C 15 H3' C 15 -2.568 -16.571 -5.504 155 H2' C 15 H2' C 15 -0.750 -16.499 -6.985 156 HO2' C 15 HO2' C 15 -1.000 -17.931 -8.559 157 H1' C 15 H1' C 15 -1.845 -14.819 -8.840 158 H41 C 15 H41 C 15 1.345 -10.966 -4.925 159 H42 C 15 H42 C 15 0.167 -11.209 -3.655 160 H5 C 15 H5 C 15 -1.699 -12.720 -3.860 161 H6 C 15 H6 C 15 -2.828 -14.338 -5.317 Start of MODEL 17 1 H5' G 1 H5' G 1 10.166 -6.349 -11.010 2 H5'' G 1 H5'' G 1 9.066 -5.038 -10.536 3 H4' G 1 H4' G 1 8.396 -6.504 -12.566 4 H3' G 1 H3' G 1 6.651 -5.742 -10.213 5 H2' G 1 H2' G 1 4.868 -7.040 -11.043 6 HO2' G 1 HO2' G 1 5.668 -7.929 -13.418 7 H1' G 1 H1' G 1 6.304 -9.164 -12.038 8 H8 G 1 H8 G 1 7.634 -8.150 -8.663 9 H1 G 1 H1 G 1 2.229 -11.505 -8.250 10 H21 G 1 H21 G 1 1.338 -11.760 -10.262 11 H22 G 1 H22 G 1 2.074 -11.100 -11.706 12 H5' A 2 H5' A 2 5.074 -4.605 -14.709 13 H5'' A 2 H5'' A 2 3.796 -3.402 -14.434 14 H4' A 2 H4' A 2 3.250 -5.433 -15.959 15 H3' A 2 H3' A 2 1.569 -4.354 -13.686 16 H2' A 2 H2' A 2 -0.032 -6.098 -14.012 17 HO2' A 2 HO2' A 2 1.437 -6.896 -16.331 18 H1' A 2 H1' A 2 1.691 -8.134 -14.172 19 H8 A 2 H8 A 2 3.384 -5.706 -11.899 20 H61 A 2 H61 A 2 -0.305 -7.595 -7.351 21 H62 A 2 H62 A 2 1.111 -6.651 -7.754 22 H2 A 2 H2 A 2 -1.839 -9.332 -11.207 23 H5' G 3 H5' G 3 -1.568 -3.864 -16.746 24 H5'' G 3 H5'' G 3 -2.398 -2.374 -16.250 25 H4' G 3 H4' G 3 -3.716 -4.566 -16.007 26 H3' G 3 H3' G 3 -3.298 -2.534 -13.789 27 H2' G 3 H2' G 3 -4.607 -3.876 -12.326 28 HO2' G 3 HO2' G 3 -6.318 -4.714 -13.273 29 H1' G 3 H1' G 3 -3.576 -6.304 -13.035 30 H8 G 3 H8 G 3 -0.531 -4.286 -13.016 31 H1 G 3 H1 G 3 -2.880 -4.760 -7.109 32 H21 G 3 H21 G 3 -4.956 -5.543 -7.174 33 H22 G 3 H22 G 3 -5.761 -5.945 -8.674 34 H5' A 4 H5' A 4 -7.901 -1.790 -14.682 35 H5'' A 4 H5'' A 4 -8.068 -0.101 -14.162 36 H4' A 4 H4' A 4 -9.361 -1.916 -12.836 37 H3' A 4 H3' A 4 -7.647 0.293 -11.675 38 H2' A 4 H2' A 4 -8.078 -0.506 -9.478 39 HO2' A 4 HO2' A 4 -9.965 -2.365 -10.537 40 H1' A 4 H1' A 4 -7.782 -3.161 -9.967 41 H8 A 4 H8 A 4 -5.136 -1.776 -12.097 42 H61 A 4 H61 A 4 -1.804 -0.547 -7.064 43 H62 A 4 H62 A 4 -1.771 -0.675 -8.807 44 H2 A 4 H2 A 4 -5.999 -1.508 -5.765 45 H5' G 5 H5' G 5 -10.447 0.136 -9.457 46 H5'' G 5 H5'' G 5 -11.778 1.308 -9.428 47 H4' G 5 H4' G 5 -11.331 1.132 -7.164 48 H3' G 5 H3' G 5 -9.687 3.357 -8.372 49 H2' G 5 H2' G 5 -8.416 3.621 -6.436 50 HO2' G 5 HO2' G 5 -9.846 3.983 -4.867 51 H1' G 5 H1' G 5 -8.591 1.007 -5.397 52 H8 G 5 H8 G 5 -7.265 1.431 -8.946 53 H1 G 5 H1 G 5 -2.786 2.004 -4.438 54 H21 G 5 H21 G 5 -3.729 2.044 -2.432 55 H22 G 5 H22 G 5 -5.459 1.926 -2.204 56 HN1 PSU 6 HN1 PSU 6 -6.116 6.795 -10.802 57 HN3 PSU 6 HN3 PSU 6 -2.443 7.779 -9.353 58 H6 PSU 6 H6 PSU 6 -6.998 6.513 -8.551 59 H1' PSU 6 H1' PSU 6 -4.998 6.389 -5.633 60 H2' PSU 6 H2' PSU 6 -5.607 9.048 -6.355 61 HO2' PSU 6 HO2' PSU 6 -5.309 7.541 -4.052 62 H3' PSU 6 H3' PSU 6 -7.906 8.882 -6.624 63 H4' PSU 6 H4' PSU 6 -8.141 6.600 -4.670 64 H5' PSU 6 H5' PSU 6 -10.052 7.437 -6.055 65 H5'' PSU 6 H5'' PSU 6 -9.148 7.007 -7.516 66 HN1 PSU 7 HN1 PSU 7 -4.745 11.770 -8.545 67 HN3 PSU 7 HN3 PSU 7 -0.694 11.471 -8.806 68 H6 PSU 7 H6 PSU 7 -4.713 11.116 -6.201 69 H1' PSU 7 H1' PSU 7 -1.758 9.804 -4.575 70 H2' PSU 7 H2' PSU 7 -2.825 12.610 -4.306 71 HO2' PSU 7 HO2' PSU 7 -0.647 11.127 -3.190 72 H3' PSU 7 H3' PSU 7 -3.529 12.216 -2.060 73 H4' PSU 7 H4' PSU 7 -4.539 9.699 -2.437 74 H5' PSU 7 H5' PSU 7 -6.171 11.325 -2.504 75 H5'' PSU 7 H5'' PSU 7 -5.236 12.369 -3.595 76 H5' G 8 H5' G 8 0.788 11.919 -2.132 77 H5'' G 8 H5'' G 8 1.009 12.146 -0.384 78 H4' G 8 H4' G 8 0.965 14.178 -2.584 79 H3' G 8 H3' G 8 2.980 13.379 -0.998 80 H2' G 8 H2' G 8 2.061 13.682 1.150 81 HO2' G 8 HO2' G 8 2.845 15.557 1.994 82 H1' G 8 H1' G 8 0.529 16.145 0.723 83 H8 G 8 H8 G 8 -1.855 13.545 0.242 84 H1 G 8 H1 G 8 -0.054 13.529 6.360 85 H21 G 8 H21 G 8 1.810 14.706 6.601 86 H22 G 8 H22 G 8 2.604 15.496 5.258 87 H5' G 9 H5' G 9 4.427 12.987 -3.891 88 H5'' G 9 H5'' G 9 3.991 12.095 -2.421 89 H4' G 9 H4' G 9 6.689 12.439 -3.709 90 H3' G 9 H3' G 9 4.826 10.237 -3.137 91 H2' G 9 H2' G 9 6.147 8.960 -1.713 92 HO2' G 9 HO2' G 9 7.890 8.657 -3.072 93 H1' G 9 H1' G 9 7.709 10.775 -0.455 94 H8 G 9 H8 G 9 6.523 11.288 1.797 95 H1 G 9 H1 G 9 0.803 9.690 -0.512 96 H21 G 9 H21 G 9 0.944 9.358 -2.703 97 H22 G 9 H22 G 9 2.446 9.533 -3.584 98 H5' G 10 H5' G 10 6.823 7.144 -2.698 99 H5'' G 10 H5'' G 10 5.957 5.985 -3.721 100 H4' G 10 H4' G 10 5.377 6.689 -1.041 101 H3' G 10 H3' G 10 4.269 4.862 -3.123 102 H2' G 10 H2' G 10 2.047 4.991 -2.476 103 HO2' G 10 HO2' G 10 1.559 5.773 -0.247 104 H1' G 10 H1' G 10 1.839 7.519 -1.454 105 H8 G 10 H8 G 10 3.733 7.947 -4.612 106 H1 G 10 H1 G 10 -2.391 6.587 -5.737 107 H21 G 10 H21 G 10 -3.376 5.906 -3.879 108 H22 G 10 H22 G 10 -2.528 5.780 -2.354 109 H5' C 11 H5' C 11 3.684 3.169 1.331 110 H5'' C 11 H5'' C 11 3.668 1.401 1.167 111 H4' C 11 H4' C 11 1.727 2.378 2.480 112 H3' C 11 H3' C 11 1.405 0.610 0.041 113 H2' C 11 H2' C 11 -0.954 0.796 0.181 114 HO2' C 11 HO2' C 11 -0.450 1.837 2.786 115 H1' C 11 H1' C 11 -1.126 3.433 0.681 116 H41 C 11 H41 C 11 -1.379 2.620 -5.648 117 H42 C 11 H42 C 11 0.361 2.783 -5.732 118 H5 C 11 H5 C 11 1.765 2.954 -3.782 119 H6 C 11 H6 C 11 1.807 3.007 -1.333 120 HN1 PSU 12 HN1 PSU 12 -0.126 -0.828 -2.748 121 HN3 PSU 12 HN3 PSU 12 -3.332 -0.771 -5.254 122 H6 PSU 12 H6 PSU 12 -1.570 -0.940 -0.794 123 H1' PSU 12 H1' PSU 12 -5.190 -0.540 -1.004 124 H2' PSU 12 H2' PSU 12 -4.114 -3.110 -1.119 125 HO2' PSU 12 HO2' PSU 12 -6.299 -2.703 -0.712 126 H3' PSU 12 H3' PSU 12 -2.461 -2.882 0.540 127 H4' PSU 12 H4' PSU 12 -4.253 -1.040 2.146 128 H5' PSU 12 H5' PSU 12 -2.104 0.166 2.495 129 H5'' PSU 12 H5'' PSU 12 -2.020 -1.528 3.017 130 H5' C 13 H5' C 13 -5.859 -5.740 1.667 131 H5'' C 13 H5'' C 13 -5.110 -7.348 1.654 132 H4' C 13 H4' C 13 -6.886 -6.903 -0.143 133 H3' C 13 H3' C 13 -4.072 -7.895 -0.705 134 H2' C 13 H2' C 13 -4.482 -7.858 -3.000 135 HO2' C 13 HO2' C 13 -7.264 -7.981 -2.355 136 H1' C 13 H1' C 13 -6.448 -5.815 -3.038 137 H41 C 13 H41 C 13 -1.358 -3.684 -6.197 138 H42 C 13 H42 C 13 -0.412 -3.650 -4.726 139 H5 C 13 H5 C 13 -1.243 -4.416 -2.609 140 H6 C 13 H6 C 13 -3.175 -5.354 -1.422 141 HN1 PSU 14 HN1 PSU 14 -2.484 -8.305 -3.822 142 HN3 PSU 14 HN3 PSU 14 -1.781 -8.436 -7.832 143 H6 PSU 14 H6 PSU 14 -4.421 -9.762 -4.045 144 H1' PSU 14 H1' PSU 14 -5.755 -10.765 -7.303 145 H2' PSU 14 H2' PSU 14 -3.892 -12.409 -6.133 146 HO2' PSU 14 HO2' PSU 14 -5.203 -13.334 -7.611 147 H3' PSU 14 H3' PSU 14 -4.498 -12.130 -3.872 148 H4' PSU 14 H4' PSU 14 -7.442 -12.076 -4.563 149 H5' PSU 14 H5' PSU 14 -7.103 -9.962 -2.992 150 H5'' PSU 14 H5'' PSU 14 -7.168 -11.601 -2.313 151 H5' C 15 H5' C 15 -5.419 -15.284 -6.881 152 H5'' C 15 H5'' C 15 -4.623 -16.754 -6.287 153 H4' C 15 H4' C 15 -4.041 -16.188 -8.663 154 H3' C 15 H3' C 15 -1.937 -16.269 -6.488 155 H2' C 15 H2' C 15 -0.258 -15.779 -8.046 156 HO2' C 15 HO2' C 15 -2.163 -16.285 -10.119 157 H1' C 15 H1' C 15 -1.690 -13.959 -9.556 158 H41 C 15 H41 C 15 1.904 -10.478 -5.637 159 H42 C 15 H42 C 15 0.854 -10.855 -4.289 160 H5 C 15 H5 C 15 -1.010 -12.369 -4.451 161 H6 C 15 H6 C 15 -2.259 -13.869 -5.935 Start of MODEL 18 1 H5' G 1 H5' G 1 9.745 -7.242 -12.350 2 H5'' G 1 H5'' G 1 8.921 -5.726 -12.770 3 H4' G 1 H4' G 1 7.734 -7.777 -13.602 4 H3' G 1 H3' G 1 6.413 -5.879 -11.631 5 H2' G 1 H2' G 1 4.472 -7.208 -11.656 6 HO2' G 1 HO2' G 1 5.099 -8.938 -13.699 7 H1' G 1 H1' G 1 5.712 -9.701 -11.999 8 H8 G 1 H8 G 1 6.922 -7.322 -9.241 9 H1 G 1 H1 G 1 2.259 -11.275 -7.417 10 H21 G 1 H21 G 1 1.503 -12.411 -9.166 11 H22 G 1 H22 G 1 2.148 -12.195 -10.778 12 H5' A 2 H5' A 2 4.425 -6.300 -16.087 13 H5'' A 2 H5'' A 2 3.281 -4.949 -16.214 14 H4' A 2 H4' A 2 2.380 -7.241 -16.885 15 H3' A 2 H3' A 2 1.094 -5.424 -14.832 16 H2' A 2 H2' A 2 -0.618 -7.036 -14.448 17 HO2' A 2 HO2' A 2 -1.283 -8.029 -16.202 18 H1' A 2 H1' A 2 0.956 -9.230 -14.333 19 H8 A 2 H8 A 2 2.875 -6.328 -12.873 20 H61 A 2 H61 A 2 -0.143 -7.297 -7.596 21 H62 A 2 H62 A 2 1.163 -6.420 -8.362 22 H2 A 2 H2 A 2 -2.029 -9.857 -10.769 23 H5' G 3 H5' G 3 -2.459 -5.286 -17.466 24 H5'' G 3 H5'' G 3 -3.060 -3.646 -17.155 25 H4' G 3 H4' G 3 -4.403 -5.652 -16.190 26 H3' G 3 H3' G 3 -3.527 -3.222 -14.575 27 H2' G 3 H2' G 3 -4.756 -4.113 -12.748 28 HO2' G 3 HO2' G 3 -6.039 -5.645 -14.771 29 H1' G 3 H1' G 3 -4.111 -6.790 -13.208 30 H8 G 3 H8 G 3 -0.858 -5.155 -13.411 31 H1 G 3 H1 G 3 -3.095 -4.831 -7.453 32 H21 G 3 H21 G 3 -5.245 -5.350 -7.420 33 H22 G 3 H22 G 3 -6.134 -5.775 -8.864 34 H5' A 4 H5' A 4 -7.988 -2.243 -14.783 35 H5'' A 4 H5'' A 4 -8.012 -0.481 -14.571 36 H4' A 4 H4' A 4 -8.949 -1.958 -12.649 37 H3' A 4 H3' A 4 -6.915 0.268 -12.266 38 H2' A 4 H2' A 4 -7.119 -0.116 -9.929 39 HO2' A 4 HO2' A 4 -8.842 -1.714 -9.262 40 H1' A 4 H1' A 4 -7.268 -2.876 -10.061 41 H8 A 4 H8 A 4 -4.462 -2.014 -12.290 42 H61 A 4 H61 A 4 -0.995 -0.860 -7.332 43 H62 A 4 H62 A 4 -0.981 -1.110 -9.064 44 H2 A 4 H2 A 4 -5.273 -1.189 -5.999 45 H5' G 5 H5' G 5 -9.749 0.311 -9.787 46 H5'' G 5 H5'' G 5 -10.979 1.589 -9.737 47 H4' G 5 H4' G 5 -10.559 1.176 -7.467 48 H3' G 5 H3' G 5 -8.882 3.483 -8.494 49 H2' G 5 H2' G 5 -7.810 3.679 -6.412 50 HO2' G 5 HO2' G 5 -10.131 3.353 -5.436 51 H1' G 5 H1' G 5 -7.821 0.976 -5.692 52 H8 G 5 H8 G 5 -6.519 1.767 -9.189 53 H1 G 5 H1 G 5 -2.088 2.278 -4.625 54 H21 G 5 H21 G 5 -3.041 2.107 -2.625 55 H22 G 5 H22 G 5 -4.762 1.865 -2.420 56 HN1 PSU 6 HN1 PSU 6 -6.942 7.188 -10.853 57 HN3 PSU 6 HN3 PSU 6 -2.977 7.776 -10.146 58 H6 PSU 6 H6 PSU 6 -7.382 6.840 -8.481 59 H1' PSU 6 H1' PSU 6 -4.806 6.364 -6.053 60 H2' PSU 6 H2' PSU 6 -5.498 9.092 -6.478 61 HO2' PSU 6 HO2' PSU 6 -4.143 7.818 -4.792 62 H3' PSU 6 H3' PSU 6 -7.796 8.934 -6.163 63 H4' PSU 6 H4' PSU 6 -7.492 6.518 -4.370 64 H5' PSU 6 H5' PSU 6 -9.746 7.084 -4.840 65 H5'' PSU 6 H5'' PSU 6 -9.385 7.464 -6.536 66 HN1 PSU 7 HN1 PSU 7 -6.893 12.998 -6.827 67 HN3 PSU 7 HN3 PSU 7 -3.705 15.395 -7.636 68 H6 PSU 7 H6 PSU 7 -5.562 11.612 -5.334 69 H1' PSU 7 H1' PSU 7 -2.140 11.510 -5.283 70 H2' PSU 7 H2' PSU 7 -2.401 13.801 -3.847 71 HO2' PSU 7 HO2' PSU 7 -0.838 11.729 -3.785 72 H3' PSU 7 H3' PSU 7 -4.390 13.295 -2.698 73 H4' PSU 7 H4' PSU 7 -3.553 10.441 -2.170 74 H5' PSU 7 H5' PSU 7 -5.797 10.054 -2.116 75 H5'' PSU 7 H5'' PSU 7 -5.877 11.805 -1.833 76 H5' G 8 H5' G 8 -0.113 12.541 -2.258 77 H5'' G 8 H5'' G 8 1.081 11.876 -1.129 78 H4' G 8 H4' G 8 1.413 14.293 -2.090 79 H3' G 8 H3' G 8 2.478 13.038 0.087 80 H2' G 8 H2' G 8 0.953 13.610 1.774 81 HO2' G 8 HO2' G 8 2.992 14.980 1.983 82 H1' G 8 H1' G 8 0.188 16.298 0.835 83 H8 G 8 H8 G 8 -2.494 14.343 -0.306 84 H1 G 8 H1 G 8 -2.539 14.165 6.067 85 H21 G 8 H21 G 8 -0.579 14.839 6.857 86 H22 G 8 H22 G 8 0.736 15.331 5.813 87 H5' G 9 H5' G 9 4.902 13.112 -2.702 88 H5'' G 9 H5'' G 9 4.351 12.578 -1.101 89 H4' G 9 H4' G 9 7.254 12.744 -1.996 90 H3' G 9 H3' G 9 5.219 10.629 -2.291 91 H2' G 9 H2' G 9 6.129 9.024 -0.864 92 HO2' G 9 HO2' G 9 8.213 8.627 -0.941 93 H1' G 9 H1' G 9 7.312 10.491 1.063 94 H8 G 9 H8 G 9 5.527 10.885 2.973 95 H1 G 9 H1 G 9 0.731 9.517 -1.001 96 H21 G 9 H21 G 9 1.488 9.427 -3.085 97 H22 G 9 H22 G 9 3.168 9.704 -3.486 98 H5' G 10 H5' G 10 7.191 7.336 -1.967 99 H5'' G 10 H5'' G 10 6.478 6.423 -3.308 100 H4' G 10 H4' G 10 5.497 6.763 -0.622 101 H3' G 10 H3' G 10 4.959 5.021 -2.959 102 H2' G 10 H2' G 10 2.647 5.032 -2.884 103 HO2' G 10 HO2' G 10 1.841 5.782 -0.534 104 H1' G 10 H1' G 10 2.019 7.392 -1.617 105 H8 G 10 H8 G 10 4.498 8.111 -4.346 106 H1 G 10 H1 G 10 -1.397 7.160 -6.599 107 H21 G 10 H21 G 10 -2.706 6.365 -4.992 108 H22 G 10 H22 G 10 -2.126 6.066 -3.370 109 H5' C 11 H5' C 11 4.322 2.832 1.369 110 H5'' C 11 H5'' C 11 4.141 1.086 1.102 111 H4' C 11 H4' C 11 2.284 2.235 2.445 112 H3' C 11 H3' C 11 1.891 0.450 0.036 113 H2' C 11 H2' C 11 -0.446 0.832 0.051 114 HO2' C 11 HO2' C 11 -0.428 2.396 2.378 115 H1' C 11 H1' C 11 -0.444 3.478 0.442 116 H41 C 11 H41 C 11 -0.160 2.380 -5.854 117 H42 C 11 H42 C 11 1.581 2.544 -5.782 118 H5 C 11 H5 C 11 2.800 2.783 -3.720 119 H6 C 11 H6 C 11 2.613 2.929 -1.281 120 HN1 PSU 12 HN1 PSU 12 0.301 -0.739 -2.885 121 HN3 PSU 12 HN3 PSU 12 -2.971 -0.945 -5.300 122 H6 PSU 12 H6 PSU 12 -1.078 -0.918 -0.891 123 H1' PSU 12 H1' PSU 12 -4.689 -0.685 -0.974 124 H2' PSU 12 H2' PSU 12 -3.649 -3.262 -1.244 125 HO2' PSU 12 HO2' PSU 12 -5.849 -2.464 -0.639 126 H3' PSU 12 H3' PSU 12 -1.961 -3.131 0.391 127 H4' PSU 12 H4' PSU 12 -3.715 -1.344 2.103 128 H5' PSU 12 H5' PSU 12 -1.545 -0.189 2.498 129 H5'' PSU 12 H5'' PSU 12 -1.485 -1.907 2.941 130 H5' C 13 H5' C 13 -5.491 -4.740 0.966 131 H5'' C 13 H5'' C 13 -5.800 -6.388 1.551 132 H4' C 13 H4' C 13 -7.005 -6.297 -0.469 133 H3' C 13 H3' C 13 -4.270 -7.549 -0.816 134 H2' C 13 H2' C 13 -4.542 -7.675 -3.122 135 HO2' C 13 HO2' C 13 -7.364 -7.403 -2.827 136 H1' C 13 H1' C 13 -6.339 -5.518 -3.479 137 H41 C 13 H41 C 13 -0.962 -3.792 -6.375 138 H42 C 13 H42 C 13 -0.050 -3.958 -4.892 139 H5 C 13 H5 C 13 -1.018 -4.707 -2.827 140 H6 C 13 H6 C 13 -3.072 -5.454 -1.721 141 HN1 PSU 14 HN1 PSU 14 -2.505 -8.147 -3.801 142 HN3 PSU 14 HN3 PSU 14 -1.428 -8.667 -7.693 143 H6 PSU 14 H6 PSU 14 -4.433 -9.609 -4.070 144 H1' PSU 14 H1' PSU 14 -5.435 -10.950 -7.338 145 H2' PSU 14 H2' PSU 14 -3.782 -12.427 -5.717 146 HO2' PSU 14 HO2' PSU 14 -6.283 -13.574 -6.003 147 H3' PSU 14 H3' PSU 14 -4.658 -11.835 -3.614 148 H4' PSU 14 H4' PSU 14 -7.494 -11.824 -4.653 149 H5' PSU 14 H5' PSU 14 -7.183 -9.474 -3.392 150 H5'' PSU 14 H5'' PSU 14 -7.504 -10.982 -2.511 151 H5' C 15 H5' C 15 -5.603 -15.362 -5.602 152 H5'' C 15 H5'' C 15 -5.109 -16.916 -4.903 153 H4' C 15 H4' C 15 -4.275 -16.799 -7.177 154 H3' C 15 H3' C 15 -2.203 -16.412 -4.999 155 H2' C 15 H2' C 15 -0.521 -16.309 -6.627 156 HO2' C 15 HO2' C 15 -1.515 -16.758 -8.959 157 H1' C 15 H1' C 15 -1.981 -14.890 -8.523 158 H41 C 15 H41 C 15 1.810 -10.644 -5.705 159 H42 C 15 H42 C 15 0.849 -10.702 -4.244 160 H5 C 15 H5 C 15 -1.017 -12.198 -3.950 161 H6 C 15 H6 C 15 -2.359 -13.965 -4.990 Start of MODEL 19 1 H5' G 1 H5' G 1 9.690 -9.384 -11.421 2 H5'' G 1 H5'' G 1 9.569 -7.658 -11.815 3 H4' G 1 H4' G 1 8.035 -8.790 -13.265 4 H3' G 1 H3' G 1 6.784 -7.336 -10.925 5 H2' G 1 H2' G 1 4.644 -8.111 -11.491 6 HO2' G 1 HO2' G 1 4.850 -7.522 -13.736 7 H1' G 1 H1' G 1 5.304 -10.630 -12.420 8 H8 G 1 H8 G 1 6.863 -9.353 -9.144 9 H1 G 1 H1 G 1 1.297 -12.371 -8.392 10 H21 G 1 H21 G 1 0.426 -12.859 -10.371 11 H22 G 1 H22 G 1 1.217 -12.443 -11.876 12 H5' A 2 H5' A 2 5.282 -6.097 -15.463 13 H5'' A 2 H5'' A 2 4.238 -4.681 -15.228 14 H4' A 2 H4' A 2 3.282 -6.697 -16.558 15 H3' A 2 H3' A 2 1.922 -5.210 -14.295 16 H2' A 2 H2' A 2 0.038 -6.662 -14.455 17 HO2' A 2 HO2' A 2 -0.490 -7.540 -16.317 18 H1' A 2 H1' A 2 1.404 -8.991 -14.595 19 H8 A 2 H8 A 2 3.360 -6.547 -12.473 20 H61 A 2 H61 A 2 -0.211 -8.157 -7.728 21 H62 A 2 H62 A 2 1.210 -7.262 -8.217 22 H2 A 2 H2 A 2 -1.922 -10.013 -11.449 23 H5' G 3 H5' G 3 -1.502 -4.628 -16.888 24 H5'' G 3 H5'' G 3 -2.058 -3.038 -16.330 25 H4' G 3 H4' G 3 -3.491 -5.121 -15.725 26 H3' G 3 H3' G 3 -2.572 -2.996 -13.744 27 H2' G 3 H2' G 3 -3.877 -4.099 -12.089 28 HO2' G 3 HO2' G 3 -5.417 -5.693 -12.652 29 H1' G 3 H1' G 3 -3.242 -6.682 -12.855 30 H8 G 3 H8 G 3 0.030 -5.089 -12.936 31 H1 G 3 H1 G 3 -2.167 -5.234 -6.953 32 H21 G 3 H21 G 3 -4.328 -5.733 -6.950 33 H22 G 3 H22 G 3 -5.227 -6.028 -8.421 34 H5' A 4 H5' A 4 -7.123 -1.640 -14.529 35 H5'' A 4 H5'' A 4 -7.071 0.073 -14.066 36 H4' A 4 H4' A 4 -8.572 -1.521 -12.672 37 H3' A 4 H3' A 4 -6.578 0.484 -11.583 38 H2' A 4 H2' A 4 -7.111 -0.189 -9.368 39 HO2' A 4 HO2' A 4 -8.987 -2.002 -9.524 40 H1' A 4 H1' A 4 -7.219 -2.879 -9.793 41 H8 A 4 H8 A 4 -4.319 -1.975 -11.843 42 H61 A 4 H61 A 4 -1.043 -1.067 -6.699 43 H62 A 4 H62 A 4 -0.959 -1.259 -8.436 44 H2 A 4 H2 A 4 -5.383 -1.351 -5.568 45 H5' G 5 H5' G 5 -9.550 0.549 -9.449 46 H5'' G 5 H5'' G 5 -10.828 1.774 -9.571 47 H4' G 5 H4' G 5 -10.718 1.467 -7.271 48 H3' G 5 H3' G 5 -8.858 3.710 -8.091 49 H2' G 5 H2' G 5 -8.029 3.905 -5.897 50 HO2' G 5 HO2' G 5 -9.208 2.733 -4.149 51 H1' G 5 H1' G 5 -8.063 1.231 -5.188 52 H8 G 5 H8 G 5 -6.632 1.783 -8.643 53 H1 G 5 H1 G 5 -2.415 2.886 -3.997 54 H21 G 5 H21 G 5 -3.437 2.877 -2.026 55 H22 G 5 H22 G 5 -5.156 2.604 -1.861 56 HN1 PSU 6 HN1 PSU 6 -7.093 7.220 -10.596 57 HN3 PSU 6 HN3 PSU 6 -3.116 7.854 -10.009 58 H6 PSU 6 H6 PSU 6 -7.480 6.991 -8.201 59 H1' PSU 6 H1' PSU 6 -4.847 6.667 -5.804 60 H2' PSU 6 H2' PSU 6 -5.527 9.353 -6.362 61 HO2' PSU 6 HO2' PSU 6 -4.227 9.173 -4.674 62 H3' PSU 6 H3' PSU 6 -7.842 9.192 -6.145 63 H4' PSU 6 H4' PSU 6 -7.563 6.956 -4.114 64 H5' PSU 6 H5' PSU 6 -9.814 7.281 -4.600 65 H5'' PSU 6 H5'' PSU 6 -9.492 7.787 -6.270 66 HN1 PSU 7 HN1 PSU 7 -7.033 13.865 -6.815 67 HN3 PSU 7 HN3 PSU 7 -3.390 15.243 -7.994 68 H6 PSU 7 H6 PSU 7 -6.018 12.376 -5.177 69 H1' PSU 7 H1' PSU 7 -2.602 11.542 -5.152 70 H2' PSU 7 H2' PSU 7 -2.812 13.947 -3.763 71 HO2' PSU 7 HO2' PSU 7 -1.225 11.905 -3.826 72 H3' PSU 7 H3' PSU 7 -4.650 13.498 -2.418 73 H4' PSU 7 H4' PSU 7 -4.095 10.545 -2.215 74 H5' PSU 7 H5' PSU 7 -6.371 10.385 -2.095 75 H5'' PSU 7 H5'' PSU 7 -6.229 12.086 -1.612 76 H5' G 8 H5' G 8 -0.440 12.499 -2.241 77 H5'' G 8 H5'' G 8 0.896 11.937 -1.220 78 H4' G 8 H4' G 8 0.642 14.505 -1.902 79 H3' G 8 H3' G 8 2.165 13.184 -0.001 80 H2' G 8 H2' G 8 0.720 13.435 1.849 81 HO2' G 8 HO2' G 8 2.422 14.602 2.601 82 H1' G 8 H1' G 8 -0.176 16.183 1.024 83 H8 G 8 H8 G 8 -2.134 12.884 1.208 84 H1 G 8 H1 G 8 -3.318 16.904 6.014 85 H21 G 8 H21 G 8 -1.961 18.657 5.887 86 H22 G 8 H22 G 8 -0.767 18.828 4.620 87 H5' G 9 H5' G 9 3.782 13.250 -3.259 88 H5'' G 9 H5'' G 9 3.645 12.779 -1.554 89 H4' G 9 H4' G 9 6.263 13.263 -3.023 90 H3' G 9 H3' G 9 4.530 10.887 -2.857 91 H2' G 9 H2' G 9 5.893 9.503 -1.570 92 HO2' G 9 HO2' G 9 8.053 11.120 -2.513 93 H1' G 9 H1' G 9 7.216 11.216 0.037 94 H8 G 9 H8 G 9 5.802 11.462 2.239 95 H1 G 9 H1 G 9 0.505 9.423 -0.655 96 H21 G 9 H21 G 9 0.835 9.304 -2.842 97 H22 G 9 H22 G 9 2.361 9.726 -3.586 98 H5' G 10 H5' G 10 6.973 7.982 -2.721 99 H5'' G 10 H5'' G 10 6.291 6.865 -3.916 100 H4' G 10 H4' G 10 5.635 7.093 -1.160 101 H3' G 10 H3' G 10 4.944 5.333 -3.432 102 H2' G 10 H2' G 10 2.671 5.136 -3.100 103 HO2' G 10 HO2' G 10 3.458 5.282 -0.403 104 H1' G 10 H1' G 10 1.970 7.380 -1.684 105 H8 G 10 H8 G 10 4.085 8.365 -4.657 106 H1 G 10 H1 G 10 -1.979 7.144 -6.209 107 H21 G 10 H21 G 10 -3.027 6.210 -4.490 108 H22 G 10 H22 G 10 -2.233 5.892 -2.965 109 H5' C 11 H5' C 11 4.561 3.228 0.862 110 H5'' C 11 H5'' C 11 4.576 1.465 0.656 111 H4' C 11 H4' C 11 2.614 2.397 1.982 112 H3' C 11 H3' C 11 2.398 0.598 -0.433 113 H2' C 11 H2' C 11 0.048 0.765 -0.468 114 HO2' C 11 HO2' C 11 -1.124 1.596 1.331 115 H1' C 11 H1' C 11 -0.242 3.385 0.105 116 H41 C 11 H41 C 11 -0.243 2.755 -6.244 117 H42 C 11 H42 C 11 1.503 2.835 -6.260 118 H5 C 11 H5 C 11 2.843 2.907 -4.255 119 H6 C 11 H6 C 11 2.791 2.930 -1.806 120 HN1 PSU 12 HN1 PSU 12 0.858 -1.094 -2.468 121 HN3 PSU 12 HN3 PSU 12 -2.295 -1.310 -5.032 122 H6 PSU 12 H6 PSU 12 -0.616 -1.207 -0.534 123 H1' PSU 12 H1' PSU 12 -4.254 -1.044 -0.819 124 H2' PSU 12 H2' PSU 12 -3.187 -3.544 -0.908 125 HO2' PSU 12 HO2' PSU 12 -4.629 -2.684 1.396 126 H3' PSU 12 H3' PSU 12 -1.281 -3.169 0.447 127 H4' PSU 12 H4' PSU 12 -2.908 -1.543 2.411 128 H5' PSU 12 H5' PSU 12 -0.819 -0.081 2.207 129 H5'' PSU 12 H5'' PSU 12 -0.581 -1.693 2.912 130 H5' C 13 H5' C 13 -5.020 -5.334 1.378 131 H5'' C 13 H5'' C 13 -4.639 -7.062 1.510 132 H4' C 13 H4' C 13 -6.431 -6.645 -0.149 133 H3' C 13 H3' C 13 -3.752 -7.751 -1.039 134 H2' C 13 H2' C 13 -4.465 -7.785 -3.276 135 HO2' C 13 HO2' C 13 -7.122 -7.577 -2.235 136 H1' C 13 H1' C 13 -6.061 -5.509 -3.251 137 H41 C 13 H41 C 13 -0.679 -3.886 -6.207 138 H42 C 13 H42 C 13 0.243 -4.083 -4.733 139 H5 C 13 H5 C 13 -0.718 -4.852 -2.670 140 H6 C 13 H6 C 13 -2.776 -5.591 -1.561 141 HN1 PSU 14 HN1 PSU 14 -2.601 -8.451 -4.261 142 HN3 PSU 14 HN3 PSU 14 -1.845 -9.170 -8.194 143 H6 PSU 14 H6 PSU 14 -4.710 -9.660 -4.372 144 H1' PSU 14 H1' PSU 14 -6.159 -10.771 -7.515 145 H2' PSU 14 H2' PSU 14 -4.507 -12.604 -6.314 146 HO2' PSU 14 HO2' PSU 14 -7.292 -12.750 -6.917 147 H3' PSU 14 H3' PSU 14 -5.007 -12.159 -4.056 148 H4' PSU 14 H4' PSU 14 -7.932 -11.719 -4.671 149 H5' PSU 14 H5' PSU 14 -7.492 -9.735 -3.138 150 H5'' PSU 14 H5'' PSU 14 -7.270 -11.335 -2.402 151 H5' C 15 H5' C 15 -6.625 -15.381 -6.273 152 H5'' C 15 H5'' C 15 -6.197 -17.013 -5.719 153 H4' C 15 H4' C 15 -5.686 -16.808 -8.094 154 H3' C 15 H3' C 15 -3.360 -16.905 -6.161 155 H2' C 15 H2' C 15 -1.829 -16.812 -7.937 156 HO2' C 15 HO2' C 15 -3.449 -16.795 -10.105 157 H1' C 15 H1' C 15 -3.155 -14.941 -9.448 158 H41 C 15 H41 C 15 1.105 -11.660 -6.056 159 H42 C 15 H42 C 15 0.133 -11.827 -4.611 160 H5 C 15 H5 C 15 -1.899 -13.116 -4.530 161 H6 C 15 H6 C 15 -3.425 -14.548 -5.809 Start of MODEL 20 1 H5' G 1 H5' G 1 9.763 -7.141 -9.791 2 H5'' G 1 H5'' G 1 9.824 -5.707 -10.837 3 H4' G 1 H4' G 1 8.459 -6.950 -12.175 4 H3' G 1 H3' G 1 6.661 -5.742 -10.064 5 H2' G 1 H2' G 1 4.834 -7.050 -10.767 6 HO2' G 1 HO2' G 1 5.259 -8.333 -12.870 7 H1' G 1 H1' G 1 6.162 -9.383 -11.367 8 H8 G 1 H8 G 1 7.344 -7.774 -8.136 9 H1 G 1 H1 G 1 2.005 -11.192 -7.455 10 H21 G 1 H21 G 1 1.249 -11.817 -9.444 11 H22 G 1 H22 G 1 2.064 -11.395 -10.934 12 H5' A 2 H5' A 2 5.342 -5.388 -14.827 13 H5'' A 2 H5'' A 2 4.259 -3.981 -14.790 14 H4' A 2 H4' A 2 3.420 -6.031 -16.082 15 H3' A 2 H3' A 2 1.900 -4.571 -13.914 16 H2' A 2 H2' A 2 0.102 -6.113 -14.063 17 HO2' A 2 HO2' A 2 -0.234 -6.418 -16.200 18 H1' A 2 H1' A 2 1.554 -8.395 -14.199 19 H8 A 2 H8 A 2 3.377 -5.966 -11.969 20 H61 A 2 H61 A 2 -0.336 -7.729 -7.384 21 H62 A 2 H62 A 2 1.095 -6.813 -7.799 22 H2 A 2 H2 A 2 -1.909 -9.490 -11.210 23 H5' G 3 H5' G 3 -1.370 -4.450 -16.689 24 H5'' G 3 H5'' G 3 -2.131 -2.890 -16.318 25 H4' G 3 H4' G 3 -3.410 -5.047 -15.664 26 H3' G 3 H3' G 3 -2.862 -2.710 -13.791 27 H2' G 3 H2' G 3 -4.152 -3.812 -12.139 28 HO2' G 3 HO2' G 3 -5.877 -4.374 -13.617 29 H1' G 3 H1' G 3 -3.277 -6.390 -12.688 30 H8 G 3 H8 G 3 -0.142 -4.523 -12.614 31 H1 G 3 H1 G 3 -2.750 -4.664 -6.803 32 H21 G 3 H21 G 3 -4.863 -5.328 -6.932 33 H22 G 3 H22 G 3 -5.626 -5.739 -8.452 34 H5' A 4 H5' A 4 -7.479 -2.004 -14.878 35 H5'' A 4 H5'' A 4 -7.685 -0.292 -14.452 36 H4' A 4 H4' A 4 -9.027 -2.046 -13.096 37 H3' A 4 H3' A 4 -7.366 0.216 -11.959 38 H2' A 4 H2' A 4 -7.884 -0.500 -9.747 39 HO2' A 4 HO2' A 4 -10.077 -1.572 -11.021 40 H1' A 4 H1' A 4 -7.533 -3.162 -10.115 41 H8 A 4 H8 A 4 -4.868 -1.729 -12.237 42 H61 A 4 H61 A 4 -1.635 -0.450 -7.154 43 H62 A 4 H62 A 4 -1.580 -0.558 -8.899 44 H2 A 4 H2 A 4 -5.822 -1.528 -5.915 45 H5' G 5 H5' G 5 -10.183 0.017 -9.570 46 H5'' G 5 H5'' G 5 -11.396 1.314 -9.607 47 H4' G 5 H4' G 5 -10.931 1.117 -7.322 48 H3' G 5 H3' G 5 -9.193 3.259 -8.585 49 H2' G 5 H2' G 5 -8.115 3.624 -6.522 50 HO2' G 5 HO2' G 5 -10.518 2.578 -5.507 51 H1' G 5 H1' G 5 -8.114 0.993 -5.607 52 H8 G 5 H8 G 5 -6.966 1.374 -9.208 53 H1 G 5 H1 G 5 -2.351 2.496 -4.951 54 H21 G 5 H21 G 5 -3.211 2.580 -2.904 55 H22 G 5 H22 G 5 -4.919 2.361 -2.593 56 HN1 PSU 6 HN1 PSU 6 -7.724 7.038 -10.694 57 HN3 PSU 6 HN3 PSU 6 -3.718 7.508 -10.154 58 H6 PSU 6 H6 PSU 6 -8.072 6.693 -8.307 59 H1' PSU 6 H1' PSU 6 -5.416 6.134 -5.993 60 H2' PSU 6 H2' PSU 6 -5.957 8.870 -6.376 61 HO2' PSU 6 HO2' PSU 6 -4.648 7.658 -4.727 62 H3' PSU 6 H3' PSU 6 -8.280 8.822 -6.150 63 H4' PSU 6 H4' PSU 6 -8.123 6.476 -4.240 64 H5' PSU 6 H5' PSU 6 -10.348 7.097 -4.757 65 H5'' PSU 6 H5'' PSU 6 -9.955 7.428 -6.456 66 HN1 PSU 7 HN1 PSU 7 -5.257 12.040 -7.577 67 HN3 PSU 7 HN3 PSU 7 -1.373 13.244 -7.425 68 H6 PSU 7 H6 PSU 7 -4.999 10.704 -5.560 69 H1' PSU 7 H1' PSU 7 -2.049 9.631 -4.291 70 H2' PSU 7 H2' PSU 7 -1.918 12.226 -3.309 71 HO2' PSU 7 HO2' PSU 7 -1.786 9.824 -1.758 72 H3' PSU 7 H3' PSU 7 -4.118 12.426 -2.517 73 H4' PSU 7 H4' PSU 7 -4.130 9.507 -1.683 74 H5' PSU 7 H5' PSU 7 -6.412 9.627 -1.977 75 H5'' PSU 7 H5'' PSU 7 -6.086 11.332 -1.601 76 H5' G 8 H5' G 8 0.163 11.329 -1.607 77 H5'' G 8 H5'' G 8 1.064 11.342 -0.080 78 H4' G 8 H4' G 8 0.620 13.504 -1.966 79 H3' G 8 H3' G 8 2.728 12.674 -0.449 80 H2' G 8 H2' G 8 2.043 13.238 1.716 81 HO2' G 8 HO2' G 8 3.583 15.027 0.738 82 H1' G 8 H1' G 8 0.445 15.636 1.132 83 H8 G 8 H8 G 8 -0.584 11.935 1.646 84 H1 G 8 H1 G 8 -1.883 15.781 6.558 85 H21 G 8 H21 G 8 -1.098 17.816 6.158 86 H22 G 8 H22 G 8 -0.254 18.224 4.680 87 H5' G 9 H5' G 9 3.919 12.535 -3.817 88 H5'' G 9 H5'' G 9 4.116 12.292 -2.071 89 H4' G 9 H4' G 9 6.427 12.739 -3.988 90 H3' G 9 H3' G 9 4.864 10.307 -3.419 91 H2' G 9 H2' G 9 6.478 9.075 -2.286 92 HO2' G 9 HO2' G 9 8.812 9.885 -2.575 93 H1' G 9 H1' G 9 7.960 10.955 -1.030 94 H8 G 9 H8 G 9 7.039 10.964 1.369 95 H1 G 9 H1 G 9 1.240 9.105 -0.494 96 H21 G 9 H21 G 9 1.111 9.157 -2.710 97 H22 G 9 H22 G 9 2.453 9.650 -3.716 98 H5' G 10 H5' G 10 7.006 7.317 -3.473 99 H5'' G 10 H5'' G 10 6.118 6.229 -4.553 100 H4' G 10 H4' G 10 5.704 6.631 -1.777 101 H3' G 10 H3' G 10 4.582 4.928 -3.929 102 H2' G 10 H2' G 10 2.358 4.980 -3.312 103 HO2' G 10 HO2' G 10 3.501 4.816 -0.835 104 H1' G 10 H1' G 10 2.096 7.342 -1.942 105 H8 G 10 H8 G 10 3.890 8.091 -5.142 106 H1 G 10 H1 G 10 -2.348 7.113 -6.042 107 H21 G 10 H21 G 10 -3.256 6.274 -4.195 108 H22 G 10 H22 G 10 -2.323 5.958 -2.749 109 H5' C 11 H5' C 11 4.410 2.939 0.436 110 H5'' C 11 H5'' C 11 4.188 1.187 0.271 111 H4' C 11 H4' C 11 2.505 2.379 1.769 112 H3' C 11 H3' C 11 1.805 0.574 -0.550 113 H2' C 11 H2' C 11 -0.503 1.018 -0.301 114 HO2' C 11 HO2' C 11 0.131 2.294 2.176 115 H1' C 11 H1' C 11 -0.405 3.663 0.077 116 H41 C 11 H41 C 11 -0.891 2.596 -6.202 117 H42 C 11 H42 C 11 0.853 2.572 -6.327 118 H5 C 11 H5 C 11 2.316 2.690 -4.417 119 H6 C 11 H6 C 11 2.424 2.855 -1.975 120 HN1 PSU 12 HN1 PSU 12 -0.336 -0.418 -2.876 121 HN3 PSU 12 HN3 PSU 12 -3.843 -0.910 -4.884 122 H6 PSU 12 H6 PSU 12 -1.433 -0.788 -0.733 123 H1' PSU 12 H1' PSU 12 -5.034 -0.947 -0.375 124 H2' PSU 12 H2' PSU 12 -3.797 -3.378 -0.851 125 HO2' PSU 12 HO2' PSU 12 -5.908 -3.024 0.070 126 H3' PSU 12 H3' PSU 12 -1.861 -3.066 0.451 127 H4' PSU 12 H4' PSU 12 -3.439 -1.556 2.549 128 H5' PSU 12 H5' PSU 12 -1.387 -0.109 2.490 129 H5'' PSU 12 H5'' PSU 12 -1.057 -1.799 2.920 130 H5' C 13 H5' C 13 -5.635 -5.384 1.382 131 H5'' C 13 H5'' C 13 -5.079 -7.061 1.557 132 H4' C 13 H4' C 13 -6.952 -6.895 -0.050 133 H3' C 13 H3' C 13 -4.206 -7.784 -0.932 134 H2' C 13 H2' C 13 -4.820 -7.846 -3.189 135 HO2' C 13 HO2' C 13 -7.160 -7.792 -3.733 136 H1' C 13 H1' C 13 -6.625 -5.749 -3.259 137 H41 C 13 H41 C 13 -1.283 -3.502 -5.850 138 H42 C 13 H42 C 13 -0.404 -3.726 -4.353 139 H5 C 13 H5 C 13 -1.381 -4.687 -2.381 140 H6 C 13 H6 C 13 -3.418 -5.629 -1.399 141 HN1 PSU 14 HN1 PSU 14 -2.622 -8.523 -3.862 142 HN3 PSU 14 HN3 PSU 14 -1.620 -8.891 -7.788 143 H6 PSU 14 H6 PSU 14 -4.693 -9.756 -4.201 144 H1' PSU 14 H1' PSU 14 -5.900 -10.682 -7.518 145 H2' PSU 14 H2' PSU 14 -4.311 -12.532 -6.275 146 HO2' PSU 14 HO2' PSU 14 -7.024 -12.665 -7.122 147 H3' PSU 14 H3' PSU 14 -4.966 -12.176 -4.037 148 H4' PSU 14 H4' PSU 14 -7.854 -11.781 -4.819 149 H5' PSU 14 H5' PSU 14 -7.495 -9.786 -3.231 150 H5'' PSU 14 H5'' PSU 14 -7.405 -11.411 -2.521 151 H5' C 15 H5' C 15 -5.866 -14.738 -6.841 152 H5'' C 15 H5'' C 15 -5.754 -16.467 -6.451 153 H4' C 15 H4' C 15 -4.584 -16.258 -8.496 154 H3' C 15 H3' C 15 -2.713 -16.189 -6.112 155 H2' C 15 H2' C 15 -0.869 -16.039 -7.558 156 HO2' C 15 HO2' C 15 -1.146 -16.370 -9.854 157 H1' C 15 H1' C 15 -2.018 -14.316 -9.386 158 H41 C 15 H41 C 15 1.477 -10.600 -5.610 159 H42 C 15 H42 C 15 0.423 -10.905 -4.248 160 H5 C 15 H5 C 15 -1.458 -12.411 -4.348 161 H6 C 15 H6 C 15 -2.722 -13.960 -5.770
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