NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
646694 | 6kn4 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HO5' THM 1 HO5' T5 1 18.187 28.581 43.756 2 H5'1 THM 1 H5' T5 1 20.599 27.953 45.300 3 H5'2 THM 1 H5'' T5 1 20.079 29.444 44.413 4 H4' THM 1 H4' T5 1 21.824 27.864 43.400 5 H3' THM 1 H3' T5 1 19.648 29.315 42.125 6 H2'1 THM 1 H2' T5 1 18.782 27.516 40.924 7 H2'2 THM 1 H2'' T5 1 20.312 27.691 39.980 8 H1' THM 1 H1' T5 1 21.539 26.414 41.262 9 HN3 THM 1 H3 T5 1 21.289 22.293 39.458 10 HM51 THM 1 H71 T5 1 16.363 23.949 41.083 11 HM52 THM 1 H72 T5 1 16.394 23.085 39.506 12 HM53 THM 1 H73 T5 1 16.626 22.186 40.897 13 H6 THM 1 H6 T5 1 18.075 25.464 41.169 14 H5' DT 2 H5' DT 2 24.449 30.402 41.297 15 H5'' DT 2 H5'' DT 2 24.633 32.157 40.961 16 H4' DT 2 H4' DT 2 25.925 30.627 39.543 17 H3' DT 2 H3' DT 2 24.393 32.620 38.503 18 H2' DT 2 H2' DT 2 22.820 31.352 37.554 19 H2'' DT 2 H2'' DT 2 24.029 31.037 36.224 20 H1' DT 2 H1' DT 2 24.859 29.159 37.000 21 H3 DT 2 H3 DT 2 22.373 25.551 36.306 22 H71 DT 2 H71 DT 2 19.048 29.717 37.624 23 H72 DT 2 H72 DT 2 18.486 28.625 36.348 24 H73 DT 2 H73 DT 2 18.619 28.147 38.055 25 H6 DT 2 H6 DT 2 21.398 29.843 38.170 26 H5' DA 3 H5' DA 3 28.285 31.317 36.244 27 H5'' DA 3 H5'' DA 3 29.089 32.854 35.860 28 H4' DA 3 H4' DA 3 30.107 31.079 34.579 29 H3' DA 3 H3' DA 3 28.815 33.045 33.032 30 H2' DA 3 H2' DA 3 27.064 31.817 32.417 31 H2'' DA 3 H2'' DA 3 28.219 31.367 31.037 32 H1' DA 3 H1' DA 3 28.585 29.179 32.157 33 H8 DA 3 H8 DA 3 25.733 30.557 34.361 34 H61 DA 3 H61 DA 3 22.357 26.634 30.858 35 H62 DA 3 H62 DA 3 22.292 27.683 32.307 36 H2 DA 3 H2 DA 3 26.571 26.115 29.899 37 H5' DG 4 H5' DG 4 30.831 29.475 30.540 38 H5'' DG 4 H5'' DG 4 32.027 30.140 29.508 39 H4' DG 4 H4' DG 4 31.110 28.539 28.275 40 H3' DG 4 H3' DG 4 30.808 31.164 27.159 41 H2' DG 4 H2' DG 4 28.625 31.138 27.481 42 H2'' DG 4 H2'' DG 4 28.814 30.206 25.823 43 H1' DG 4 H1' DG 4 28.506 28.168 26.900 44 H8 DG 4 H8 DG 4 26.674 31.012 28.923 45 H1 DG 4 H1 DG 4 23.243 25.802 27.036 46 H21 DG 4 H21 DG 4 24.687 24.347 26.041 47 H22 DG 4 H22 DG 4 26.414 24.759 26.022 48 H5' DG 5 H5' DG 5 31.951 26.759 25.458 49 H5'' DG 5 H5'' DG 5 33.426 26.567 24.370 50 H4' DG 5 H4' DG 5 31.388 25.706 23.494 51 H3' DG 5 H3' DG 5 32.109 28.152 21.860 52 H2' DG 5 H2' DG 5 30.108 28.649 21.728 53 H2'' DG 5 H2'' DG 5 29.702 27.197 20.871 54 H1' DG 5 H1' DG 5 29.342 25.949 23.029 55 H8 DG 5 H8 DG 5 28.770 29.623 23.827 56 H1 DG 5 H1 DG 5 23.207 26.550 23.587 57 H21 DG 5 H21 DG 5 23.586 24.441 23.093 58 H22 DG 5 H22 DG 5 25.305 23.808 22.832 59 H5' DG 6 H5' DG 6 30.037 24.722 19.587 60 H5'' DG 6 H5'' DG 6 30.844 24.392 17.968 61 H4' DG 6 H4' DG 6 28.428 23.857 17.854 62 H3' DG 6 H3' DG 6 29.462 25.996 16.272 63 H2' DG 6 H2' DG 6 27.601 27.326 16.793 64 H2'' DG 6 H2'' DG 6 26.526 26.115 16.200 65 H1' DG 6 H1' DG 6 26.052 24.937 18.151 66 H8 DG 6 H8 DG 6 27.697 28.164 19.693 67 H1 DG 6 H1 DG 6 21.546 27.092 20.795 68 H21 DG 6 H21 DG 6 21.001 25.025 19.446 69 H22 DG 6 H22 DG 6 22.442 24.062 19.261 70 H5'1 TMP 7 H5' T3 7 25.777 23.083 13.703 71 H5'2 TMP 7 H5'' T3 7 26.393 23.484 12.101 72 H4' TMP 7 H4' T3 7 24.087 23.573 12.069 73 H3' TMP 7 H3' T3 7 25.799 25.735 11.052 74 HO3' TMP 7 HO3' T3 7 24.156 24.602 9.736 75 H2'1 TMP 7 H2' T3 7 25.244 27.289 12.516 76 H2'2 TMP 7 H2'' T3 7 23.688 27.559 11.466 77 H1' TMP 7 H1' T3 7 22.537 25.919 12.507 78 HN3 TMP 7 H3 T3 7 21.234 30.108 14.004 79 H51 TMP 7 H71 T3 7 25.226 30.251 16.652 80 H52 TMP 7 H72 T3 7 24.282 29.339 17.789 81 H53 TMP 7 H73 T3 7 25.590 28.521 16.707 82 H6 TMP 7 H6 T3 7 24.548 26.934 15.303 83 HO5' THM 8 HO5' T5 8 10.213 17.056 32.747 84 H5'1 THM 8 H5' T5 8 9.184 17.756 34.749 85 H5'2 THM 8 H5'' T5 8 9.127 18.878 33.324 86 H4' THM 8 H4' T5 8 9.666 20.075 35.585 87 H3' THM 8 H3' T5 8 10.666 20.449 33.020 88 H2'1 THM 8 H2' T5 8 12.856 20.360 33.434 89 H2'2 THM 8 H2'' T5 8 12.637 21.856 34.292 90 H1' THM 8 H1' T5 8 12.408 20.751 36.283 91 HN3 THM 8 H3 T5 8 16.545 19.425 37.602 92 HM51 THM 8 H71 T5 8 15.609 15.482 35.134 93 HM52 THM 8 H72 T5 8 14.859 16.111 33.505 94 HM53 THM 8 H73 T5 8 16.563 16.371 33.948 95 H6 THM 8 H6 T5 8 13.461 17.996 34.100 96 H5' DT 9 H5' DT 9 10.897 24.083 36.028 97 H5'' DT 9 H5'' DT 9 9.874 25.265 35.290 98 H4' DT 9 H4' DT 9 11.739 26.431 36.265 99 H3' DT 9 H3' DT 9 11.457 26.726 33.387 100 H2' DT 9 H2' DT 9 13.361 25.291 33.166 101 H2'' DT 9 H2'' DT 9 14.043 27.003 33.142 102 H1' DT 9 H1' DT 9 14.285 26.829 35.591 103 H3 DT 9 H3 DT 9 18.245 24.785 36.605 104 H71 DT 9 H71 DT 9 15.781 21.762 32.899 105 H72 DT 9 H72 DT 9 17.586 21.752 33.283 106 H73 DT 9 H73 DT 9 16.548 20.971 34.335 107 H6 DT 9 H6 DT 9 14.651 23.624 33.574 108 H5' DA 10 H5' DA 10 12.970 30.094 36.297 109 H5'' DA 10 H5'' DA 10 12.359 31.704 35.798 110 H4' DA 10 H4' DA 10 14.546 32.018 36.949 111 H3' DA 10 H3' DA 10 13.685 33.132 34.596 112 H2' DA 10 H2' DA 10 14.945 31.788 33.170 113 H2'' DA 10 H2'' DA 10 16.130 33.010 33.399 114 H1' DA 10 H1' DA 10 17.335 31.681 34.932 115 H8 DA 10 H8 DA 10 14.986 29.211 33.030 116 H61 DA 10 H61 DA 10 20.343 26.059 32.707 117 H62 DA 10 H62 DA 10 18.591 25.758 32.332 118 H2 DA 10 H2 DA 10 21.368 29.838 33.940 119 H5' DG 11 H5' DG 11 17.626 35.284 35.532 120 H5'' DG 11 H5'' DG 11 17.554 37.020 35.088 121 H4' DG 11 H4' DG 11 19.651 35.932 34.131 122 H3' DG 11 H3' DG 11 17.611 37.255 32.567 123 H2' DG 11 H2' DG 11 17.326 35.571 31.270 124 H2'' DG 11 H2'' DG 11 18.888 36.074 30.373 125 H1' DG 11 H1' DG 11 20.146 34.590 31.600 126 H8 DG 11 H8 DG 11 16.525 33.485 30.972 127 H1 DG 11 H1 DG 11 20.845 29.244 29.223 128 H21 DG 11 H21 DG 11 22.970 30.096 29.448 129 H22 DG 11 H22 DG 11 23.245 31.290 30.759 130 H5' DG 12 H5' DG 12 22.131 37.146 30.707 131 H5'' DG 12 H5'' DG 12 22.367 38.897 30.366 132 H4' DG 12 H4' DG 12 23.294 37.378 28.724 133 H3' DG 12 H3' DG 12 21.052 38.864 27.709 134 H2' DG 12 H2' DG 12 20.514 36.941 26.226 135 H2'' DG 12 H2'' DG 12 22.071 36.980 25.525 136 H1' DG 12 H1' DG 12 23.217 35.800 27.370 137 H8 DG 12 H8 DG 12 19.586 34.939 28.175 138 H1 DG 12 H1 DG 12 22.708 30.095 25.209 139 H21 DG 12 H21 DG 12 24.826 30.757 24.646 140 H22 DG 12 H22 DG 12 25.170 32.486 24.810 141 H5' DG 13 H5' DG 13 25.261 39.426 25.100 142 H5'' DG 13 H5'' DG 13 24.883 40.620 23.895 143 H4' DG 13 H4' DG 13 26.017 38.698 22.698 144 H3' DG 13 H3' DG 13 23.176 39.651 22.180 145 H2' DG 13 H2' DG 13 22.891 37.766 21.230 146 H2'' DG 13 H2'' DG 13 24.345 37.742 20.204 147 H1' DG 13 H1' DG 13 25.430 36.284 21.816 148 H8 DG 13 H8 DG 13 21.889 36.810 23.233 149 H1 DG 13 H1 DG 13 23.263 30.693 21.836 150 H21 DG 13 H21 DG 13 25.389 30.459 21.260 151 H22 DG 13 H22 DG 13 26.336 31.923 21.026 152 H5'1 TMP 14 H5' T3 14 26.827 39.836 18.570 153 H5'2 TMP 14 H5'' T3 14 26.456 40.863 17.349 154 H4' TMP 14 H4' T3 14 27.475 39.074 16.553 155 H3' TMP 14 H3' T3 14 24.417 38.715 16.116 156 HO3' TMP 14 HO3' T3 14 24.890 39.672 14.075 157 H2'1 TMP 14 H2' T3 14 24.671 36.810 15.215 158 H2'2 TMP 14 H2'' T3 14 26.255 37.114 14.326 159 H1' TMP 14 H1' T3 14 27.382 36.212 16.035 160 HN3 TMP 14 H3 T3 14 25.045 32.444 18.151 161 H51 TMP 14 H71 T3 14 22.078 36.042 19.981 162 H52 TMP 14 H72 T3 14 21.619 36.613 18.239 163 H53 TMP 14 H73 T3 14 21.200 35.069 18.844 164 H6 TMP 14 H6 T3 14 24.025 37.100 17.569 165 HO5' THM 15 HO5' T5 15 25.219 11.830 34.700 166 H5'1 THM 15 H5' T5 15 23.774 10.247 34.064 167 H5'2 THM 15 H5'' T5 15 24.718 10.792 32.670 168 H4' THM 15 H4' T5 15 22.163 10.431 32.527 169 H3' THM 15 H3' T5 15 23.514 12.170 30.884 170 H2'1 THM 15 H2' T5 15 23.382 14.096 32.478 171 H2'2 THM 15 H2'' T5 15 22.086 14.530 31.458 172 H1' THM 15 H1' T5 15 20.444 13.149 32.674 173 HN3 THM 15 H3 T5 15 19.132 15.686 36.128 174 HM51 THM 15 H71 T5 15 23.454 17.787 36.002 175 HM52 THM 15 H72 T5 15 23.744 16.620 37.331 176 HM53 THM 15 H73 T5 15 24.516 16.430 35.626 177 H6 THM 15 H6 T5 15 23.430 14.756 34.335 178 H5' DT 16 H5' DT 16 19.144 12.874 31.288 179 H5'' DT 16 H5'' DT 16 18.402 12.617 29.685 180 H4' DT 16 H4' DT 16 16.936 13.970 30.949 181 H3' DT 16 H3' DT 16 17.756 14.815 28.450 182 H2' DT 16 H2' DT 16 19.202 16.615 29.185 183 H2'' DT 16 H2'' DT 16 17.689 17.524 29.200 184 H1' DT 16 H1' DT 16 17.254 16.831 31.338 185 H3 DT 16 H3 DT 16 19.267 20.087 33.659 186 H71 DT 16 H71 DT 16 23.339 18.919 31.483 187 H72 DT 16 H72 DT 16 23.498 17.355 32.378 188 H73 DT 16 H73 DT 16 22.935 17.411 30.672 189 H6 DT 16 H6 DT 16 20.859 16.567 30.713 190 H5' DA 17 H5' DA 17 14.193 17.629 31.049 191 H5'' DA 17 H5'' DA 17 13.011 16.881 30.019 192 H4' DA 17 H4' DA 17 11.993 18.936 30.661 193 H3' DA 17 H3' DA 17 12.447 18.547 28.086 194 H2' DA 17 H2' DA 17 14.315 19.737 27.842 195 H2'' DA 17 H2'' DA 17 13.189 21.098 27.504 196 H1' DA 17 H1' DA 17 13.350 21.932 29.762 197 H8 DA 17 H8 DA 17 16.346 19.913 28.464 198 H61 DA 17 H61 DA 17 19.575 24.737 30.682 199 H62 DA 17 H62 DA 17 19.851 23.146 29.877 200 H2 DA 17 H2 DA 17 15.490 25.610 31.515 201 H5' DG 18 H5' DG 18 9.913 22.768 28.436 202 H5'' DG 18 H5'' DG 18 8.813 22.899 26.997 203 H4' DG 18 H4' DG 18 10.079 24.943 27.424 204 H3' DG 18 H3' DG 18 10.087 23.525 24.907 205 H2' DG 18 H2' DG 18 12.382 23.326 25.137 206 H2'' DG 18 H2'' DG 18 12.414 24.888 24.313 207 H1' DG 18 H1' DG 18 12.296 25.922 26.584 208 H8 DG 18 H8 DG 18 14.262 22.811 25.969 209 H1 DG 18 H1 DG 18 17.636 27.882 28.081 210 H21 DG 18 H21 DG 18 16.120 29.544 28.834 211 H22 DG 18 H22 DG 18 14.544 29.448 28.057 212 H5' DG 19 H5' DG 19 8.829 28.183 25.134 213 H5'' DG 19 H5'' DG 19 7.756 29.025 23.932 214 H4' DG 19 H4' DG 19 9.676 30.359 24.543 215 H3' DG 19 H3' DG 19 10.083 29.507 21.734 216 H2' DG 19 H2' DG 19 12.156 30.009 21.927 217 H2'' DG 19 H2'' DG 19 11.808 31.627 22.694 218 H1' DG 19 H1' DG 19 11.917 30.611 24.882 219 H8 DG 19 H8 DG 19 12.628 27.398 22.846 220 H1 DG 19 H1 DG 19 17.763 29.886 25.693 221 H21 DG 19 H21 DG 19 17.296 32.020 26.429 222 H22 DG 19 H22 DG 19 15.602 32.590 26.290 223 H5' DG 20 H5' DG 20 9.919 34.282 22.955 224 H5'' DG 20 H5'' DG 20 9.430 35.121 21.578 225 H4' DG 20 H4' DG 20 11.276 36.465 22.412 226 H3' DG 20 H3' DG 20 11.125 35.472 19.816 227 H2' DG 20 H2' DG 20 13.052 34.453 19.791 228 H2'' DG 20 H2'' DG 20 14.005 36.003 20.003 229 H1' DG 20 H1' DG 20 14.229 35.776 22.332 230 H8 DG 20 H8 DG 20 13.050 32.505 20.830 231 H1 DG 20 H1 DG 20 19.179 32.343 22.933 232 H21 DG 20 H21 DG 20 19.623 34.271 23.742 233 H22 DG 20 H22 DG 20 18.534 35.547 24.107 234 H5'1 TMP 21 H5' T3 21 14.055 39.848 20.528 235 H5'2 TMP 21 H5'' T3 21 13.594 40.526 18.918 236 H4' TMP 21 H4' T3 21 16.038 40.997 19.105 237 H3' TMP 21 H3' T3 21 15.519 38.574 17.423 238 HO3' TMP 21 HO3' T3 21 15.208 40.254 16.023 239 H2'1 TMP 21 H2' T3 21 17.851 38.270 17.201 240 H2'2 TMP 21 H2'' T3 21 18.189 40.046 17.708 241 H1' TMP 21 H1' T3 21 18.619 39.150 19.725 242 HN3 TMP 21 H3 T3 21 19.651 35.034 21.178 243 H51 TMP 21 H71 T3 21 16.070 33.256 18.853 244 H52 TMP 21 H72 T3 21 15.343 34.622 17.995 245 H53 TMP 21 H73 T3 21 16.647 33.664 17.288 246 H6 TMP 21 H6 T3 21 16.073 36.855 18.449 247 HO5' THM 22 HO5' T5 22 26.503 25.736 39.843 248 H5'1 THM 22 H5' T5 22 28.160 24.965 40.781 249 H5'2 THM 22 H5'' T5 22 28.918 25.938 39.458 250 H4' THM 22 H4' T5 22 29.903 23.597 39.623 251 H3' THM 22 H3' T5 22 29.602 24.824 37.367 252 H2'1 THM 22 H2' T5 22 27.443 24.045 36.935 253 H2'2 THM 22 H2'' T5 22 28.326 22.846 35.897 254 H1' THM 22 H1' T5 22 28.452 21.322 37.692 255 HN3 THM 22 H3 T5 22 24.589 18.929 37.933 256 HM51 THM 22 H71 T5 22 23.579 24.251 37.116 257 HM52 THM 22 H72 T5 22 22.606 23.186 36.105 258 HM53 THM 22 H73 T5 22 22.299 23.160 37.794 259 H6 THM 22 H6 T5 22 25.645 23.698 37.697 260 H5' DT 23 H5' DT 23 30.650 19.997 36.887 261 H5'' DT 23 H5'' DT 23 31.811 19.877 35.735 262 H4' DT 23 H4' DT 23 29.713 18.404 35.199 263 H3' DT 23 H3' DT 23 31.129 20.144 33.473 264 H2' DT 23 H2' DT 23 29.494 21.493 33.018 265 H2'' DT 23 H2'' DT 23 28.905 20.332 31.887 266 H1' DT 23 H1' DT 23 27.488 19.160 33.471 267 H3 DT 23 H3 DT 23 23.457 20.967 34.045 268 H71 DT 23 H71 DT 23 25.349 25.346 33.355 269 H72 DT 23 H72 DT 23 27.170 24.963 33.383 270 H73 DT 23 H73 DT 23 26.260 24.696 31.927 271 H6 DT 23 H6 DT 23 27.989 22.719 33.549 272 H5' DA 24 H5' DA 24 28.011 17.518 31.977 273 H5'' DA 24 H5'' DA 24 28.633 16.190 30.969 274 H4' DA 24 H4' DA 24 26.466 16.586 30.234 275 H3' DA 24 H3' DA 24 28.385 17.854 28.435 276 H2' DA 24 H2' DA 24 27.011 19.723 27.867 277 H2'' DA 24 H2'' DA 24 25.921 18.484 27.290 278 H1' DA 24 H1' DA 24 24.679 18.457 29.332 279 H8 DA 24 H8 DA 24 27.072 21.552 30.087 280 H61 DA 24 H61 DA 24 21.777 24.811 29.185 281 H62 DA 24 H62 DA 24 23.402 24.964 29.762 282 H2 DA 24 H2 DA 24 20.951 20.357 28.582 283 H5' DG 25 H5' DG 25 24.577 15.712 26.893 284 H5'' DG 25 H5'' DG 25 24.749 15.060 25.286 285 H4' DG 25 H4' DG 25 22.656 16.374 25.793 286 H3' DG 25 H3' DG 25 24.235 16.597 23.468 287 H2' DG 25 H2' DG 25 24.134 19.023 23.733 288 H2'' DG 25 H2'' DG 25 22.499 18.765 23.122 289 H1' DG 25 H1' DG 25 21.526 18.549 25.311 290 H8 DG 25 H8 DG 25 24.856 20.607 25.693 291 H1 DG 25 H1 DG 25 19.316 23.851 26.363 292 H21 DG 25 H21 DG 25 17.661 22.470 26.120 293 H22 DG 25 H22 DG 25 17.982 20.771 25.739 294 H5' DG 26 H5' DG 26 19.754 17.624 22.797 295 H5'' DG 26 H5'' DG 26 19.384 16.604 21.349 296 H4' DG 26 H4' DG 26 18.283 18.574 21.347 297 H3' DG 26 H3' DG 26 20.444 19.025 19.507 298 H2' DG 26 H2' DG 26 20.279 21.181 19.663 299 H2'' DG 26 H2'' DG 26 18.613 21.281 19.528 300 H1' DG 26 H1' DG 26 18.186 20.833 21.846 301 H8 DG 26 H8 DG 26 22.054 21.346 21.902 302 H1 DG 26 H1 DG 26 18.519 26.436 23.906 303 H21 DG 26 H21 DG 26 16.305 26.072 23.561 304 H22 DG 26 H22 DG 26 15.908 24.439 23.185 305 H5' DG 27 H5' DG 27 16.465 20.806 18.817 306 H5'' DG 27 H5'' DG 27 15.705 19.921 17.493 307 H4' DG 27 H4' DG 27 14.571 21.772 17.410 308 H3' DG 27 H3' DG 27 16.246 21.767 15.205 309 H2' DG 27 H2' DG 27 17.769 23.249 16.534 310 H2'' DG 27 H2'' DG 27 16.970 24.410 15.594 311 H1' DG 27 H1' DG 27 15.331 24.702 17.327 312 H8 DG 27 H8 DG 27 18.853 23.528 18.330 313 H1 DG 27 H1 DG 27 17.416 29.201 20.883 314 H21 DG 27 H21 DG 27 15.254 29.804 20.041 315 H22 DG 27 H22 DG 27 14.595 28.589 18.892 316 H5'1 TMP 28 H5' T3 28 13.192 25.612 14.488 317 H5'2 TMP 28 H5'' T3 28 13.083 25.732 12.750 318 H4' TMP 28 H4' T3 28 13.723 27.843 13.434 319 H3' TMP 28 H3' T3 28 15.540 26.486 11.738 320 HO3' TMP 28 HO3' T3 28 14.689 28.157 10.793 321 H2'1 TMP 28 H2' T3 28 17.438 26.612 13.323 322 H2'2 TMP 28 H2'' T3 28 17.447 28.248 12.645 323 H1' TMP 28 H1' T3 28 16.089 29.131 14.293 324 HN3 TMP 28 H3 T3 28 18.431 30.361 17.828 325 H51 TMP 28 H71 T3 28 20.304 25.546 16.309 326 H52 TMP 28 H72 T3 28 21.532 26.863 16.350 327 H53 TMP 28 H73 T3 28 20.653 26.169 17.776 328 H6 TMP 28 H6 T3 28 18.667 26.386 15.182 329 H1 DM2 101 H23 M2 29 26.962 27.897 37.953 330 H2 DM2 101 H26 M2 29 26.956 26.211 36.067 331 H3 DM2 101 H25 M2 29 28.815 26.001 34.643 332 HO8 DM2 101 H21 M2 29 33.466 30.482 36.098 333 H10 DM2 101 H1 M2 29 34.479 33.182 37.710 334 H111 DM2 101 H2 M2 29 34.405 33.214 40.080 335 H112 DM2 101 H3 M2 29 34.765 34.847 39.468 336 HO12 DM2 101 H12 M2 29 32.781 36.162 39.198 337 H141 DM2 101 H18 M2 29 33.597 35.271 43.860 338 H142 DM2 101 H19 M2 29 33.831 36.405 42.458 339 HO14 DM2 101 H24 M2 29 35.699 34.828 41.839 340 H151 DM2 101 H4 M2 29 30.910 34.788 39.409 341 H152 DM2 101 H5 M2 29 30.801 33.979 41.008 342 HO17 DM2 101 H22 M2 29 28.979 31.195 40.595 343 H211 DM2 101 H27 M2 29 30.694 27.783 32.334 344 H212 DM2 101 H28 M2 29 29.206 27.221 33.097 345 H213 DM2 101 H29 M2 29 30.531 26.163 32.773 346 H1' DM2 101 H6 M2 29 32.680 33.690 35.850 347 H2'1 DM2 101 H7 M2 29 31.267 35.759 35.854 348 H2'2 DM2 101 H8 M2 29 32.058 35.471 34.293 349 H3' DM2 101 H9 M2 29 32.870 37.447 36.486 350 HN'1 DM2 101 H16 M2 29 31.738 37.864 33.797 351 HN'2 DM2 101 H17 M2 29 32.388 39.078 34.665 352 H4' DM2 101 H10 M2 29 34.749 38.080 35.108 353 HO4' DM2 101 H20 M2 29 34.172 36.055 33.072 354 H5' DM2 101 H11 M2 29 35.151 36.268 36.439 355 H6'1 DM2 101 H13 M2 29 37.136 36.659 34.500 356 H6'2 DM2 101 H14 M2 29 37.085 35.204 35.553 357 H6'3 DM2 101 H15 M2 29 36.299 35.211 33.948 358 H1 DM2 102 H23 M2 30 19.023 21.280 14.100 359 H2 DM2 102 H26 M2 30 19.504 23.674 15.178 360 H3 DM2 102 H25 M2 30 21.778 24.303 15.501 361 HO8 DM2 102 H21 M2 30 25.616 18.818 14.163 362 H10 DM2 102 H1 M2 30 26.219 16.690 11.690 363 H111 DM2 102 H2 M2 30 25.886 16.587 9.460 364 H112 DM2 102 H3 M2 30 25.843 14.950 9.818 365 HO12 DM2 102 H12 M2 30 24.443 14.473 7.880 366 H141 DM2 102 H18 M2 30 21.647 16.317 7.548 367 H142 DM2 102 H19 M2 30 23.001 16.029 6.400 368 HO14 DM2 102 H24 M2 30 22.914 18.650 6.628 369 H151 DM2 102 H4 M2 30 22.808 14.663 10.874 370 H152 DM2 102 H5 M2 30 21.738 15.760 9.865 371 HO17 DM2 102 H22 M2 30 19.644 17.861 11.503 372 H211 DM2 102 H27 M2 30 23.454 22.960 17.685 373 H212 DM2 102 H28 M2 30 22.962 24.304 16.801 374 H213 DM2 102 H29 M2 30 24.707 23.897 16.974 375 H1' DM2 102 H6 M2 30 25.802 15.635 14.007 376 H2'1 DM2 102 H7 M2 30 24.902 13.239 14.156 377 H2'2 DM2 102 H8 M2 30 26.499 13.402 15.053 378 H3' DM2 102 H9 M2 30 25.959 12.178 12.328 379 HN'1 DM2 102 H16 M2 30 25.475 10.752 13.991 380 HN'2 DM2 102 H17 M2 30 27.162 10.317 13.674 381 H4' DM2 102 H10 M2 30 28.450 11.994 12.062 382 HO4' DM2 102 H20 M2 30 28.513 12.699 14.856 383 H5' DM2 102 H11 M2 30 27.902 14.031 11.309 384 H6'1 DM2 102 H13 M2 30 30.384 13.621 11.922 385 H6'2 DM2 102 H14 M2 30 30.057 15.342 11.771 386 H6'3 DM2 102 H15 M2 30 30.034 14.561 13.383 Start of MODEL 2 1 HO5' THM 1 HO5' T5 1 17.632 28.717 43.576 2 H5'1 THM 1 H5' T5 1 19.633 28.264 44.757 3 H5'2 THM 1 H5'' T5 1 20.159 29.860 44.216 4 H4' THM 1 H4' T5 1 21.473 28.269 42.875 5 H3' THM 1 H3' T5 1 19.671 30.322 41.760 6 H2'1 THM 1 H2' T5 1 18.510 28.869 40.438 7 H2'2 THM 1 H2'' T5 1 20.063 28.825 39.408 8 H1' THM 1 H1' T5 1 20.947 26.967 40.636 9 HN3 THM 1 H3 T5 1 18.763 23.309 38.733 10 HM51 THM 1 H71 T5 1 14.730 26.119 39.076 11 HM52 THM 1 H72 T5 1 14.633 25.027 40.394 12 HM53 THM 1 H73 T5 1 14.980 26.731 40.671 13 H6 THM 1 H6 T5 1 17.300 27.145 41.059 14 H5' DT 2 H5' DT 2 24.364 30.622 40.507 15 H5'' DT 2 H5'' DT 2 24.767 32.265 40.173 16 H4' DT 2 H4' DT 2 25.766 30.751 38.509 17 H3' DT 2 H3' DT 2 24.220 32.664 37.550 18 H2' DT 2 H2' DT 2 22.608 31.260 36.786 19 H2'' DT 2 H2'' DT 2 23.700 31.171 35.315 20 H1' DT 2 H1' DT 2 24.849 29.280 36.176 21 H3 DT 2 H3 DT 2 22.550 25.918 34.258 22 H71 DT 2 H71 DT 2 19.092 29.050 36.864 23 H72 DT 2 H72 DT 2 18.499 27.678 35.819 24 H73 DT 2 H73 DT 2 18.916 27.485 37.627 25 H6 DT 2 H6 DT 2 21.206 29.500 37.172 26 H5' DA 3 H5' DA 3 29.176 32.167 36.275 27 H5'' DA 3 H5'' DA 3 29.716 33.567 35.386 28 H4' DA 3 H4' DA 3 30.461 31.493 34.513 29 H3' DA 3 H3' DA 3 29.355 33.589 33.104 30 H2' DA 3 H2' DA 3 27.377 32.397 32.509 31 H2'' DA 3 H2'' DA 3 28.366 31.844 31.059 32 H1' DA 3 H1' DA 3 28.916 29.705 32.134 33 H8 DA 3 H8 DA 3 25.720 31.406 33.896 34 H61 DA 3 H61 DA 3 22.696 26.759 30.953 35 H62 DA 3 H62 DA 3 22.416 28.245 31.914 36 H2 DA 3 H2 DA 3 26.774 26.396 29.986 37 H5' DG 4 H5' DG 4 31.950 30.542 30.034 38 H5'' DG 4 H5'' DG 4 32.564 31.850 29.063 39 H4' DG 4 H4' DG 4 31.901 29.690 27.688 40 H3' DG 4 H3' DG 4 31.655 32.345 26.836 41 H2' DG 4 H2' DG 4 29.425 32.066 27.602 42 H2'' DG 4 H2'' DG 4 29.206 31.745 25.856 43 H1' DG 4 H1' DG 4 29.442 29.407 26.579 44 H8 DG 4 H8 DG 4 27.585 31.904 28.956 45 H1 DG 4 H1 DG 4 24.176 26.774 27.299 46 H21 DG 4 H21 DG 4 25.450 25.222 26.353 47 H22 DG 4 H22 DG 4 27.065 25.652 25.814 48 H5' DG 5 H5' DG 5 31.344 28.546 23.791 49 H5'' DG 5 H5'' DG 5 32.300 28.792 22.454 50 H4' DG 5 H4' DG 5 30.548 27.372 21.775 51 H3' DG 5 H3' DG 5 29.694 30.046 20.789 52 H2' DG 5 H2' DG 5 27.683 29.435 20.709 53 H2'' DG 5 H2'' DG 5 27.931 27.811 20.145 54 H1' DG 5 H1' DG 5 28.222 26.831 22.389 55 H8 DG 5 H8 DG 5 27.886 30.288 24.009 56 H1 DG 5 H1 DG 5 22.411 26.889 23.969 57 H21 DG 5 H21 DG 5 22.745 24.832 22.818 58 H22 DG 5 H22 DG 5 24.268 24.659 21.974 59 H5' DG 6 H5' DG 6 29.944 26.369 17.940 60 H5'' DG 6 H5'' DG 6 30.890 26.800 16.489 61 H4' DG 6 H4' DG 6 29.421 25.024 15.918 62 H3' DG 6 H3' DG 6 29.084 27.336 14.504 63 H2' DG 6 H2' DG 6 27.340 28.036 15.836 64 H2'' DG 6 H2'' DG 6 26.398 27.317 14.423 65 H1' DG 6 H1' DG 6 26.070 25.295 15.920 66 H8 DG 6 H8 DG 6 27.184 28.253 17.932 67 H1 DG 6 H1 DG 6 21.440 26.024 19.359 68 H21 DG 6 H21 DG 6 21.319 23.922 18.484 69 H22 DG 6 H22 DG 6 22.728 23.417 17.544 70 H5'1 TMP 7 H5' T3 7 25.773 24.298 12.549 71 H5'2 TMP 7 H5'' T3 7 26.145 24.312 10.890 72 H4' TMP 7 H4' T3 7 23.688 24.183 11.500 73 H3' TMP 7 H3' T3 7 24.690 26.202 9.640 74 HO3' TMP 7 HO3' T3 7 23.368 24.323 8.894 75 H2'1 TMP 7 H2' T3 7 24.008 27.957 10.750 76 H2'2 TMP 7 H2'' T3 7 22.591 27.678 9.963 77 H1' TMP 7 H1' T3 7 21.791 26.130 11.716 78 HN3 TMP 7 H3 T3 7 20.052 30.104 13.340 79 H51 TMP 7 H71 T3 7 23.382 28.928 16.935 80 H52 TMP 7 H72 T3 7 24.644 28.841 15.681 81 H53 TMP 7 H73 T3 7 24.233 30.341 16.018 82 H6 TMP 7 H6 T3 7 24.086 27.651 13.924 83 HO5' THM 8 HO5' T5 8 10.567 17.242 32.026 84 H5'1 THM 8 H5' T5 8 9.334 17.122 33.905 85 H5'2 THM 8 H5'' T5 8 9.009 18.724 33.076 86 H4' THM 8 H4' T5 8 9.256 18.931 35.484 87 H3' THM 8 H3' T5 8 10.428 20.700 33.599 88 H2'1 THM 8 H2' T5 8 12.753 19.979 34.247 89 H2'2 THM 8 H2'' T5 8 12.294 21.270 35.461 90 H1' THM 8 H1' T5 8 11.849 19.847 36.958 91 HN3 THM 8 H3 T5 8 16.137 18.956 38.052 92 HM51 THM 8 H71 T5 8 14.721 15.263 34.278 93 HM52 THM 8 H72 T5 8 15.918 16.323 33.750 94 HM53 THM 8 H73 T5 8 16.285 15.170 35.140 95 H6 THM 8 H6 T5 8 13.142 17.168 34.601 96 H5' DT 9 H5' DT 9 10.628 23.389 37.465 97 H5'' DT 9 H5'' DT 9 9.493 24.734 36.870 98 H4' DT 9 H4' DT 9 11.412 25.861 37.857 99 H3' DT 9 H3' DT 9 10.769 26.287 35.072 100 H2' DT 9 H2' DT 9 12.670 25.206 34.253 101 H2'' DT 9 H2'' DT 9 13.348 26.839 34.472 102 H1' DT 9 H1' DT 9 14.224 26.343 36.520 103 H3 DT 9 H3 DT 9 18.111 24.527 35.564 104 H71 DT 9 H71 DT 9 14.137 21.571 33.182 105 H72 DT 9 H72 DT 9 15.927 21.297 32.749 106 H73 DT 9 H73 DT 9 15.275 20.548 34.128 107 H6 DT 9 H6 DT 9 13.655 23.270 34.683 108 H5' DA 10 H5' DA 10 13.711 29.623 37.442 109 H5'' DA 10 H5'' DA 10 12.469 30.862 37.109 110 H4' DA 10 H4' DA 10 14.758 31.938 37.290 111 H3' DA 10 H3' DA 10 13.078 32.411 35.166 112 H2' DA 10 H2' DA 10 14.593 31.297 33.390 113 H2'' DA 10 H2'' DA 10 15.429 32.802 33.677 114 H1' DA 10 H1' DA 10 17.042 31.868 35.023 115 H8 DA 10 H8 DA 10 14.995 28.914 33.711 116 H61 DA 10 H61 DA 10 20.660 27.237 31.502 117 H62 DA 10 H62 DA 10 19.059 26.573 31.559 118 H2 DA 10 H2 DA 10 21.048 30.864 33.952 119 H5' DG 11 H5' DG 11 17.025 34.813 35.520 120 H5'' DG 11 H5'' DG 11 16.931 36.496 35.278 121 H4' DG 11 H4' DG 11 18.917 35.711 34.270 122 H3' DG 11 H3' DG 11 16.902 36.802 32.389 123 H2' DG 11 H2' DG 11 17.267 35.332 30.953 124 H2'' DG 11 H2'' DG 11 18.842 36.060 30.633 125 H1' DG 11 H1' DG 11 19.908 34.415 32.042 126 H8 DG 11 H8 DG 11 16.453 32.976 31.145 127 H1 DG 11 H1 DG 11 21.538 29.587 29.427 128 H21 DG 11 H21 DG 11 23.423 30.779 29.775 129 H22 DG 11 H22 DG 11 23.325 32.259 30.646 130 H5' DG 12 H5' DG 12 21.184 37.791 31.470 131 H5'' DG 12 H5'' DG 12 21.740 39.419 30.989 132 H4' DG 12 H4' DG 12 22.656 37.604 30.000 133 H3' DG 12 H3' DG 12 21.282 39.370 27.997 134 H2' DG 12 H2' DG 12 20.768 37.497 26.777 135 H2'' DG 12 H2'' DG 12 22.527 37.199 26.537 136 H1' DG 12 H1' DG 12 22.845 35.911 28.606 137 H8 DG 12 H8 DG 12 19.026 35.786 28.085 138 H1 DG 12 H1 DG 12 21.983 30.493 26.329 139 H21 DG 12 H21 DG 12 24.108 30.930 25.777 140 H22 DG 12 H22 DG 12 24.784 32.500 25.971 141 H5' DG 13 H5' DG 13 25.700 37.344 26.923 142 H5'' DG 13 H5'' DG 13 26.542 38.714 26.367 143 H4' DG 13 H4' DG 13 27.399 36.987 25.005 144 H3' DG 13 H3' DG 13 25.791 38.822 23.477 145 H2' DG 13 H2' DG 13 24.437 37.310 23.038 146 H2'' DG 13 H2'' DG 13 25.570 36.735 21.596 147 H1' DG 13 H1' DG 13 26.366 35.057 22.950 148 H8 DG 13 H8 DG 13 23.058 35.740 24.751 149 H1 DG 13 H1 DG 13 23.078 30.371 21.081 150 H21 DG 13 H21 DG 13 24.669 30.460 19.782 151 H22 DG 13 H22 DG 13 26.165 31.430 20.230 152 H5'1 TMP 14 H5' T3 14 29.381 38.191 19.208 153 H5'2 TMP 14 H5'' T3 14 28.548 39.634 19.095 154 H4' TMP 14 H4' T3 14 28.356 38.221 17.042 155 H3' TMP 14 H3' T3 14 25.846 39.188 18.330 156 HO3' TMP 14 HO3' T3 14 27.341 40.602 17.296 157 H2'1 TMP 14 H2' T3 14 24.668 38.093 16.712 158 H2'2 TMP 14 H2'' T3 14 25.948 38.275 15.470 159 H1' TMP 14 H1' T3 14 26.788 36.416 15.715 160 HN3 TMP 14 H3 T3 14 24.494 32.700 16.062 161 H51 TMP 14 H71 T3 14 22.281 36.101 19.618 162 H52 TMP 14 H72 T3 14 21.971 34.433 19.614 163 H53 TMP 14 H73 T3 14 23.305 35.096 20.709 164 H6 TMP 14 H6 T3 14 24.990 36.536 18.951 165 HO5' THM 15 HO5' T5 15 25.923 13.810 33.036 166 H5'1 THM 15 H5' T5 15 25.520 11.803 32.708 167 H5'2 THM 15 H5'' T5 15 25.133 12.192 30.941 168 H4' THM 15 H4' T5 15 23.188 11.148 32.180 169 H3' THM 15 H3' T5 15 23.307 13.359 30.407 170 H2'1 THM 15 H2' T5 15 22.571 14.864 32.067 171 H2'2 THM 15 H2'' T5 15 20.949 14.394 31.391 172 H1' THM 15 H1' T5 15 20.693 12.853 33.190 173 HN3 THM 15 H3 T5 15 19.337 15.808 36.380 174 HM51 THM 15 H71 T5 15 23.750 18.030 35.882 175 HM52 THM 15 H72 T5 15 24.021 16.770 37.025 176 HM53 THM 15 H73 T5 15 24.700 16.678 35.308 177 H6 THM 15 H6 T5 15 23.580 14.955 34.146 178 H5' DT 16 H5' DT 16 18.805 12.835 31.399 179 H5'' DT 16 H5'' DT 16 17.800 12.555 30.098 180 H4' DT 16 H4' DT 16 16.734 14.130 31.605 181 H3' DT 16 H3' DT 16 17.456 14.920 28.974 182 H2' DT 16 H2' DT 16 19.022 16.606 29.710 183 H2'' DT 16 H2'' DT 16 17.480 17.612 29.735 184 H1' DT 16 H1' DT 16 17.109 17.171 31.927 185 H3 DT 16 H3 DT 16 19.476 20.085 34.376 186 H71 DT 16 H71 DT 16 22.857 17.543 30.998 187 H72 DT 16 H72 DT 16 23.441 18.707 32.327 188 H73 DT 16 H73 DT 16 23.143 17.026 32.694 189 H6 DT 16 H6 DT 16 20.731 16.822 30.972 190 H5' DA 17 H5' DA 17 14.011 18.103 30.835 191 H5'' DA 17 H5'' DA 17 12.826 17.844 29.533 192 H4' DA 17 H4' DA 17 12.591 19.852 30.161 193 H3' DA 17 H3' DA 17 13.330 19.105 27.677 194 H2' DA 17 H2' DA 17 15.424 20.456 27.605 195 H2'' DA 17 H2'' DA 17 14.183 21.919 27.563 196 H1' DA 17 H1' DA 17 14.203 22.362 29.627 197 H8 DA 17 H8 DA 17 17.281 20.029 29.171 198 H61 DA 17 H61 DA 17 20.277 24.746 31.950 199 H62 DA 17 H62 DA 17 20.549 23.267 31.024 200 H2 DA 17 H2 DA 17 16.181 25.970 31.416 201 H5' DG 18 H5' DG 18 10.659 22.734 28.676 202 H5'' DG 18 H5'' DG 18 9.283 22.527 27.698 203 H4' DG 18 H4' DG 18 9.352 24.825 28.183 204 H3' DG 18 H3' DG 18 9.251 23.960 25.571 205 H2' DG 18 H2' DG 18 11.426 24.322 25.074 206 H2'' DG 18 H2'' DG 18 10.892 25.943 24.653 207 H1' DG 18 H1' DG 18 11.675 26.863 26.728 208 H8 DG 18 H8 DG 18 13.246 23.615 25.681 209 H1 DG 18 H1 DG 18 17.499 27.777 28.297 210 H21 DG 18 H21 DG 18 16.223 29.385 29.090 211 H22 DG 18 H22 DG 18 14.607 29.750 28.472 212 H5' DG 19 H5' DG 19 8.733 28.460 25.731 213 H5'' DG 19 H5'' DG 19 7.463 29.104 24.641 214 H4' DG 19 H4' DG 19 9.581 30.183 24.884 215 H3' DG 19 H3' DG 19 9.044 29.208 22.183 216 H2' DG 19 H2' DG 19 11.303 29.226 21.913 217 H2'' DG 19 H2'' DG 19 11.298 30.929 22.213 218 H1' DG 19 H1' DG 19 11.593 30.499 24.678 219 H8 DG 19 H8 DG 19 12.373 27.086 23.083 220 H1 DG 19 H1 DG 19 17.422 29.860 25.885 221 H21 DG 19 H21 DG 19 16.765 31.954 26.573 222 H22 DG 19 H22 DG 19 15.087 32.403 26.252 223 H5' DG 20 H5' DG 20 10.172 33.850 23.386 224 H5'' DG 20 H5'' DG 20 9.555 34.809 21.892 225 H4' DG 20 H4' DG 20 11.785 35.466 23.174 226 H3' DG 20 H3' DG 20 11.273 35.347 20.284 227 H2' DG 20 H2' DG 20 12.580 33.537 20.140 228 H2'' DG 20 H2'' DG 20 13.909 34.788 19.938 229 H1' DG 20 H1' DG 20 14.356 34.968 22.435 230 H8 DG 20 H8 DG 20 13.103 31.576 21.042 231 H1 DG 20 H1 DG 20 19.307 31.378 22.919 232 H21 DG 20 H21 DG 20 19.810 33.563 23.675 233 H22 DG 20 H22 DG 20 18.547 34.584 24.200 234 H5'1 TMP 21 H5' T3 21 15.065 38.747 21.074 235 H5'2 TMP 21 H5'' T3 21 15.293 39.417 19.535 236 H4' TMP 21 H4' T3 21 17.274 38.886 20.635 237 H3' TMP 21 H3' T3 21 16.593 37.747 17.881 238 HO3' TMP 21 HO3' T3 21 17.246 39.892 17.711 239 H2'1 TMP 21 H2' T3 21 18.752 36.595 17.795 240 H2'2 TMP 21 H2'' T3 21 19.532 37.683 19.065 241 H1' TMP 21 H1' T3 21 19.047 36.344 20.785 242 HN3 TMP 21 H3 T3 21 19.278 31.882 20.007 243 H51 TMP 21 H71 T3 21 14.583 32.595 18.474 244 H52 TMP 21 H72 T3 21 14.941 33.846 17.339 245 H53 TMP 21 H73 T3 21 15.538 32.316 16.949 246 H6 TMP 21 H6 T3 21 16.075 35.324 18.783 247 HO5' THM 22 HO5' T5 22 26.112 26.209 38.921 248 H5'1 THM 22 H5' T5 22 28.061 25.763 40.027 249 H5'2 THM 22 H5'' T5 22 28.542 26.368 38.475 250 H4' THM 22 H4' T5 22 29.515 24.283 39.551 251 H3' THM 22 H3' T5 22 29.465 24.967 36.780 252 H2'1 THM 22 H2' T5 22 27.492 24.000 36.275 253 H2'2 THM 22 H2'' T5 22 28.556 22.646 35.848 254 H1' THM 22 H1' T5 22 28.189 21.484 37.878 255 HN3 THM 22 H3 T5 22 24.280 19.484 37.896 256 HM51 THM 22 H71 T5 22 23.410 24.658 37.255 257 HM52 THM 22 H72 T5 22 22.598 23.848 35.849 258 HM53 THM 22 H73 T5 22 22.111 23.559 37.455 259 H6 THM 22 H6 T5 22 25.653 24.017 36.996 260 H5' DT 23 H5' DT 23 30.904 20.703 36.786 261 H5'' DT 23 H5'' DT 23 32.233 20.488 35.787 262 H4' DT 23 H4' DT 23 30.506 18.878 35.500 263 H3' DT 23 H3' DT 23 31.521 20.322 33.340 264 H2' DT 23 H2' DT 23 29.725 21.650 33.074 265 H2'' DT 23 H2'' DT 23 29.309 20.336 31.937 266 H1' DT 23 H1' DT 23 28.149 19.024 33.605 267 H3 DT 23 H3 DT 23 23.862 20.428 34.420 268 H71 DT 23 H71 DT 23 26.841 24.740 33.365 269 H72 DT 23 H72 DT 23 25.157 24.604 32.701 270 H73 DT 23 H73 DT 23 25.406 24.900 34.509 271 H6 DT 23 H6 DT 23 28.031 22.779 33.697 272 H5' DA 24 H5' DA 24 28.162 16.911 32.327 273 H5'' DA 24 H5'' DA 24 28.632 16.016 30.847 274 H4' DA 24 H4' DA 24 26.394 16.224 30.717 275 H3' DA 24 H3' DA 24 28.229 17.623 28.781 276 H2' DA 24 H2' DA 24 27.131 19.481 28.618 277 H2'' DA 24 H2'' DA 24 25.663 18.610 27.924 278 H1' DA 24 H1' DA 24 24.457 18.466 29.991 279 H8 DA 24 H8 DA 24 27.334 21.213 30.081 280 H61 DA 24 H61 DA 24 22.193 24.749 30.088 281 H62 DA 24 H62 DA 24 23.921 24.957 30.001 282 H2 DA 24 H2 DA 24 20.973 20.634 29.737 283 H5' DG 25 H5' DG 25 24.196 16.448 27.500 284 H5'' DG 25 H5'' DG 25 24.050 15.455 25.961 285 H4' DG 25 H4' DG 25 22.130 16.731 25.882 286 H3' DG 25 H3' DG 25 24.206 17.199 24.031 287 H2' DG 25 H2' DG 25 24.177 19.354 24.259 288 H2'' DG 25 H2'' DG 25 22.750 19.610 23.396 289 H1' DG 25 H1' DG 25 21.504 19.601 25.403 290 H8 DG 25 H8 DG 25 25.395 20.543 26.010 291 H1 DG 25 H1 DG 25 20.764 25.010 26.620 292 H21 DG 25 H21 DG 25 18.601 23.890 26.266 293 H22 DG 25 H22 DG 25 18.761 22.179 25.885 294 H5' DG 26 H5' DG 26 19.836 17.750 22.279 295 H5'' DG 26 H5'' DG 26 19.660 16.817 20.666 296 H4' DG 26 H4' DG 26 18.640 18.871 20.628 297 H3' DG 26 H3' DG 26 21.181 19.372 19.080 298 H2' DG 26 H2' DG 26 20.816 21.450 19.612 299 H2'' DG 26 H2'' DG 26 19.088 21.396 18.989 300 H1' DG 26 H1' DG 26 18.322 20.886 21.250 301 H8 DG 26 H8 DG 26 21.872 21.580 22.193 302 H1 DG 26 H1 DG 26 18.138 26.504 23.628 303 H21 DG 26 H21 DG 26 16.096 26.124 22.791 304 H22 DG 26 H22 DG 26 15.701 24.589 22.001 305 H5' DG 27 H5' DG 27 16.687 20.257 17.282 306 H5'' DG 27 H5'' DG 27 16.779 19.716 15.602 307 H4' DG 27 H4' DG 27 15.211 21.228 16.022 308 H3' DG 27 H3' DG 27 17.068 21.979 14.021 309 H2' DG 27 H2' DG 27 18.219 23.218 15.440 310 H2'' DG 27 H2'' DG 27 17.144 24.557 14.728 311 H1' DG 27 H1' DG 27 15.683 24.513 16.593 312 H8 DG 27 H8 DG 27 18.921 22.889 17.455 313 H1 DG 27 H1 DG 27 17.972 28.622 20.318 314 H21 DG 27 H21 DG 27 15.766 29.293 20.073 315 H22 DG 27 H22 DG 27 14.735 28.468 18.894 316 H5'1 TMP 28 H5' T3 28 13.772 24.582 13.127 317 H5'2 TMP 28 H5'' T3 28 13.290 25.006 11.360 318 H4' TMP 28 H4' T3 28 13.796 26.930 12.299 319 H3' TMP 28 H3' T3 28 15.634 26.277 10.290 320 HO3' TMP 28 HO3' T3 28 14.024 28.142 10.344 321 H2'1 TMP 28 H2' T3 28 17.443 26.365 12.005 322 H2'2 TMP 28 H2'' T3 28 17.383 28.078 11.508 323 H1' TMP 28 H1' T3 28 15.862 28.609 13.222 324 HN3 TMP 28 H3 T3 28 17.635 29.483 17.101 325 H51 TMP 28 H71 T3 28 21.492 26.961 15.284 326 H52 TMP 28 H72 T3 28 20.591 25.608 16.230 327 H53 TMP 28 H73 T3 28 20.467 25.685 14.519 328 H6 TMP 28 H6 T3 28 18.604 26.390 13.665 329 H1 DM2 101 H23 M2 29 26.781 28.810 38.079 330 H2 DM2 101 H26 M2 29 26.638 27.376 35.888 331 H3 DM2 101 H25 M2 29 28.360 26.607 34.822 332 HO8 DM2 101 H21 M2 29 33.326 30.605 36.682 333 H10 DM2 101 H1 M2 29 35.052 32.305 38.968 334 H111 DM2 101 H2 M2 29 34.947 31.764 41.234 335 H112 DM2 101 H3 M2 29 35.450 33.386 41.195 336 HO12 DM2 101 H12 M2 29 34.439 34.313 43.487 337 H141 DM2 101 H18 M2 29 33.256 30.391 41.478 338 H142 DM2 101 H19 M2 29 31.754 30.639 42.093 339 HO14 DM2 101 H24 M2 29 33.937 29.596 43.730 340 H151 DM2 101 H4 M2 29 32.128 34.446 40.862 341 H152 DM2 101 H5 M2 29 31.251 33.409 41.919 342 HO17 DM2 101 H22 M2 29 28.636 32.301 40.450 343 H211 DM2 101 H27 M2 29 31.226 27.279 32.959 344 H212 DM2 101 H28 M2 29 29.440 27.320 33.308 345 H213 DM2 101 H29 M2 29 30.506 25.957 33.787 346 H1' DM2 101 H6 M2 29 32.711 34.172 37.695 347 H2'1 DM2 101 H7 M2 29 32.434 36.237 39.146 348 H2'2 DM2 101 H8 M2 29 32.752 36.571 37.450 349 H3' DM2 101 H9 M2 29 34.928 36.468 39.730 350 HN'1 DM2 101 H16 M2 29 33.329 38.572 38.367 351 HN'2 DM2 101 H17 M2 29 34.635 39.045 39.282 352 H4' DM2 101 H10 M2 29 36.347 37.476 38.086 353 HO4' DM2 101 H20 M2 29 35.647 37.657 35.769 354 H5' DM2 101 H11 M2 29 36.220 34.951 38.172 355 H6'1 DM2 101 H13 M2 29 37.506 36.123 36.071 356 H6'2 DM2 101 H14 M2 29 37.478 34.343 36.191 357 H6'3 DM2 101 H15 M2 29 36.322 35.169 35.133 358 H1 DM2 102 H23 M2 30 19.135 21.169 12.318 359 H2 DM2 102 H26 M2 30 19.596 23.120 13.557 360 H3 DM2 102 H25 M2 30 22.042 24.007 13.889 361 HO8 DM2 102 H21 M2 30 26.052 19.048 11.993 362 H10 DM2 102 H1 M2 30 26.386 15.690 10.952 363 H111 DM2 102 H2 M2 30 25.864 13.527 10.365 364 H112 DM2 102 H3 M2 30 24.887 13.190 11.791 365 HO12 DM2 102 H12 M2 30 24.134 12.016 9.041 366 H141 DM2 102 H18 M2 30 22.004 15.527 8.080 367 H142 DM2 102 H19 M2 30 22.014 13.770 8.010 368 HO14 DM2 102 H24 M2 30 22.118 14.126 5.862 369 H151 DM2 102 H4 M2 30 22.623 13.955 11.762 370 H152 DM2 102 H5 M2 30 21.754 14.338 10.280 371 HO17 DM2 102 H22 M2 30 20.008 17.050 11.032 372 H211 DM2 102 H27 M2 30 24.337 22.577 16.097 373 H212 DM2 102 H28 M2 30 22.833 23.130 15.573 374 H213 DM2 102 H29 M2 30 24.280 24.068 15.263 375 H1' DM2 102 H6 M2 30 27.765 14.957 12.321 376 H2'1 DM2 102 H7 M2 30 27.545 16.151 14.513 377 H2'2 DM2 102 H8 M2 30 28.622 14.774 14.781 378 H3' DM2 102 H9 M2 30 25.653 14.712 15.546 379 HN'1 DM2 102 H16 M2 30 27.542 15.895 16.916 380 HN'2 DM2 102 H17 M2 30 26.298 14.996 17.625 381 H4' DM2 102 H10 M2 30 25.933 12.409 16.208 382 HO4' DM2 102 H20 M2 30 28.591 13.100 16.013 383 H5' DM2 102 H11 M2 30 25.146 12.928 13.993 384 H6'1 DM2 102 H13 M2 30 26.055 10.387 14.591 385 H6'2 DM2 102 H14 M2 30 25.656 10.771 12.863 386 H6'3 DM2 102 H15 M2 30 27.272 10.723 13.450 Start of MODEL 3 1 HO5' THM 1 HO5' T5 1 18.093 28.392 43.827 2 H5'1 THM 1 H5' T5 1 20.281 28.606 44.542 3 H5'2 THM 1 H5'' T5 1 20.281 30.183 43.677 4 H4' THM 1 H4' T5 1 21.428 28.361 42.392 5 H3' THM 1 H3' T5 1 19.384 30.451 41.550 6 H2'1 THM 1 H2' T5 1 18.293 29.260 40.067 7 H2'2 THM 1 H2'' T5 1 19.882 29.080 39.073 8 H1' THM 1 H1' T5 1 20.605 27.293 40.107 9 HN3 THM 1 H3 T5 1 19.001 23.205 39.005 10 HM51 THM 1 H71 T5 1 14.542 25.319 38.970 11 HM52 THM 1 H72 T5 1 14.945 24.402 40.532 12 HM53 THM 1 H73 T5 1 14.731 26.208 40.536 13 H6 THM 1 H6 T5 1 17.019 27.474 40.412 14 H5' DT 2 H5' DT 2 24.222 30.238 40.677 15 H5'' DT 2 H5'' DT 2 24.950 31.763 40.262 16 H4' DT 2 H4' DT 2 25.730 30.204 38.663 17 H3' DT 2 H3' DT 2 24.114 32.636 37.581 18 H2' DT 2 H2' DT 2 22.631 31.179 36.665 19 H2'' DT 2 H2'' DT 2 23.765 31.097 35.334 20 H1' DT 2 H1' DT 2 24.772 29.129 36.383 21 H3 DT 2 H3 DT 2 22.515 25.577 34.711 22 H71 DT 2 H71 DT 2 18.932 29.123 36.749 23 H72 DT 2 H72 DT 2 18.425 27.975 35.615 24 H73 DT 2 H73 DT 2 18.859 27.409 37.211 25 H6 DT 2 H6 DT 2 21.197 29.662 36.907 26 H5' DA 3 H5' DA 3 28.724 31.733 36.217 27 H5'' DA 3 H5'' DA 3 29.199 33.361 35.447 28 H4' DA 3 H4' DA 3 30.485 31.501 34.366 29 H3' DA 3 H3' DA 3 29.100 33.435 33.150 30 H2' DA 3 H2' DA 3 27.241 32.266 32.546 31 H2'' DA 3 H2'' DA 3 28.176 31.751 31.159 32 H1' DA 3 H1' DA 3 28.997 29.809 31.958 33 H8 DA 3 H8 DA 3 25.978 31.013 34.002 34 H61 DA 3 H61 DA 3 22.772 26.335 31.567 35 H62 DA 3 H62 DA 3 22.478 27.937 32.244 36 H2 DA 3 H2 DA 3 26.854 26.113 30.083 37 H5' DG 4 H5' DG 4 31.778 30.516 30.221 38 H5'' DG 4 H5'' DG 4 32.842 31.673 29.393 39 H4' DG 4 H4' DG 4 32.378 29.860 27.932 40 H3' DG 4 H3' DG 4 31.946 32.135 26.828 41 H2' DG 4 H2' DG 4 29.481 32.078 27.027 42 H2'' DG 4 H2'' DG 4 29.609 31.364 25.456 43 H1' DG 4 H1' DG 4 29.565 29.074 26.587 44 H8 DG 4 H8 DG 4 27.962 31.944 28.740 45 H1 DG 4 H1 DG 4 24.208 27.021 27.888 46 H21 DG 4 H21 DG 4 25.162 25.569 26.401 47 H22 DG 4 H22 DG 4 26.926 25.648 26.349 48 H5' DG 5 H5' DG 5 31.397 28.558 23.741 49 H5'' DG 5 H5'' DG 5 32.362 29.134 22.302 50 H4' DG 5 H4' DG 5 30.357 27.660 21.971 51 H3' DG 5 H3' DG 5 30.469 30.385 20.730 52 H2' DG 5 H2' DG 5 28.120 30.612 21.074 53 H2'' DG 5 H2'' DG 5 27.939 29.172 20.123 54 H1' DG 5 H1' DG 5 28.284 27.594 21.989 55 H8 DG 5 H8 DG 5 27.636 30.890 23.810 56 H1 DG 5 H1 DG 5 22.663 26.647 24.172 57 H21 DG 5 H21 DG 5 23.360 24.796 23.096 58 H22 DG 5 H22 DG 5 24.960 24.781 22.448 59 H5' DG 6 H5' DG 6 30.414 26.408 17.440 60 H5'' DG 6 H5'' DG 6 30.949 27.207 15.892 61 H4' DG 6 H4' DG 6 29.707 25.332 15.495 62 H3' DG 6 H3' DG 6 29.012 27.638 14.343 63 H2' DG 6 H2' DG 6 27.183 27.922 15.601 64 H2'' DG 6 H2'' DG 6 26.318 26.897 14.445 65 H1' DG 6 H1' DG 6 26.257 25.048 16.134 66 H8 DG 6 H8 DG 6 27.133 28.215 18.253 67 H1 DG 6 H1 DG 6 21.673 25.287 19.618 68 H21 DG 6 H21 DG 6 21.947 22.997 19.025 69 H22 DG 6 H22 DG 6 22.889 22.687 17.628 70 H5'1 TMP 7 H5' T3 7 25.711 24.106 12.355 71 H5'2 TMP 7 H5'' T3 7 26.411 24.534 10.698 72 H4' TMP 7 H4' T3 7 23.888 24.158 10.626 73 H3' TMP 7 H3' T3 7 25.276 26.622 9.845 74 HO3' TMP 7 HO3' T3 7 24.571 26.063 7.922 75 H2'1 TMP 7 H2' T3 7 24.206 27.980 11.186 76 H2'2 TMP 7 H2'' T3 7 22.854 28.057 9.919 77 H1' TMP 7 H1' T3 7 21.767 26.232 11.299 78 HN3 TMP 7 H3 T3 7 19.769 29.597 13.498 79 H51 TMP 7 H71 T3 7 25.149 29.492 14.479 80 H52 TMP 7 H72 T3 7 24.104 30.604 15.425 81 H53 TMP 7 H73 T3 7 24.409 28.901 15.898 82 H6 TMP 7 H6 T3 7 24.234 27.537 13.579 83 HO5' THM 8 HO5' T5 8 10.711 17.040 31.853 84 H5'1 THM 8 H5' T5 8 9.165 17.294 33.495 85 H5'2 THM 8 H5'' T5 8 9.266 18.822 32.634 86 H4' THM 8 H4' T5 8 9.264 18.958 35.175 87 H3' THM 8 H3' T5 8 10.602 20.569 33.177 88 H2'1 THM 8 H2' T5 8 12.723 19.789 33.725 89 H2'2 THM 8 H2'' T5 8 12.722 21.170 34.803 90 H1' THM 8 H1' T5 8 11.757 19.919 36.659 91 HN3 THM 8 H3 T5 8 15.709 19.488 38.219 92 HM51 THM 8 H71 T5 8 16.806 15.780 35.291 93 HM52 THM 8 H72 T5 8 15.286 15.070 35.597 94 HM53 THM 8 H73 T5 8 15.565 16.042 34.095 95 H6 THM 8 H6 T5 8 13.447 17.211 34.637 96 H5' DT 9 H5' DT 9 11.152 23.307 36.996 97 H5'' DT 9 H5'' DT 9 9.913 24.523 36.656 98 H4' DT 9 H4' DT 9 11.879 25.698 37.509 99 H3' DT 9 H3' DT 9 11.031 26.383 35.139 100 H2' DT 9 H2' DT 9 12.708 25.030 33.905 101 H2'' DT 9 H2'' DT 9 13.587 26.635 34.075 102 H1' DT 9 H1' DT 9 14.347 26.208 36.280 103 H3 DT 9 H3 DT 9 18.355 24.378 35.245 104 H71 DT 9 H71 DT 9 14.512 21.120 33.145 105 H72 DT 9 H72 DT 9 16.072 21.154 32.458 106 H73 DT 9 H73 DT 9 15.791 20.401 34.066 107 H6 DT 9 H6 DT 9 13.843 23.102 34.146 108 H5' DA 10 H5' DA 10 14.465 29.606 37.604 109 H5'' DA 10 H5'' DA 10 13.160 30.773 37.296 110 H4' DA 10 H4' DA 10 15.031 31.900 37.506 111 H3' DA 10 H3' DA 10 13.353 32.375 35.461 112 H2' DA 10 H2' DA 10 14.599 31.256 33.693 113 H2'' DA 10 H2'' DA 10 15.460 32.883 33.601 114 H1' DA 10 H1' DA 10 17.216 31.901 34.688 115 H8 DA 10 H8 DA 10 15.128 28.926 33.841 116 H61 DA 10 H61 DA 10 20.476 27.410 30.924 117 H62 DA 10 H62 DA 10 18.890 26.695 31.315 118 H2 DA 10 H2 DA 10 21.302 30.703 33.418 119 H5' DG 11 H5' DG 11 17.261 35.327 35.496 120 H5'' DG 11 H5'' DG 11 17.015 36.983 34.840 121 H4' DG 11 H4' DG 11 19.006 35.906 34.114 122 H3' DG 11 H3' DG 11 16.997 37.083 32.328 123 H2' DG 11 H2' DG 11 17.135 35.418 30.936 124 H2'' DG 11 H2'' DG 11 18.744 35.909 30.458 125 H1' DG 11 H1' DG 11 19.796 34.484 31.790 126 H8 DG 11 H8 DG 11 16.172 33.218 31.062 127 H1 DG 11 H1 DG 11 21.172 29.637 28.969 128 H21 DG 11 H21 DG 11 23.102 30.686 29.359 129 H22 DG 11 H22 DG 11 23.045 32.267 30.156 130 H5' DG 12 H5' DG 12 21.427 37.913 31.505 131 H5'' DG 12 H5'' DG 12 21.917 39.469 30.848 132 H4' DG 12 H4' DG 12 22.960 37.379 30.014 133 H3' DG 12 H3' DG 12 21.411 39.000 27.956 134 H2' DG 12 H2' DG 12 21.126 37.010 26.835 135 H2'' DG 12 H2'' DG 12 22.897 36.667 26.891 136 H1' DG 12 H1' DG 12 22.679 35.433 28.841 137 H8 DG 12 H8 DG 12 19.041 35.776 28.271 138 H1 DG 12 H1 DG 12 21.418 30.454 25.508 139 H21 DG 12 H21 DG 12 23.530 30.560 25.503 140 H22 DG 12 H22 DG 12 24.324 31.745 26.552 141 H5' DG 13 H5' DG 13 25.920 37.075 26.730 142 H5'' DG 13 H5'' DG 13 26.701 38.483 26.113 143 H4' DG 13 H4' DG 13 27.561 36.751 24.904 144 H3' DG 13 H3' DG 13 26.052 38.686 23.569 145 H2' DG 13 H2' DG 13 24.291 37.306 23.247 146 H2'' DG 13 H2'' DG 13 25.337 37.133 21.763 147 H1' DG 13 H1' DG 13 26.372 35.044 22.736 148 H8 DG 13 H8 DG 13 23.096 35.726 24.782 149 H1 DG 13 H1 DG 13 23.307 30.286 21.032 150 H21 DG 13 H21 DG 13 24.990 30.502 19.646 151 H22 DG 13 H22 DG 13 26.222 31.772 19.983 152 H5'1 TMP 14 H5' T3 14 29.350 37.842 19.209 153 H5'2 TMP 14 H5'' T3 14 28.428 39.395 19.222 154 H4' TMP 14 H4' T3 14 28.427 38.521 16.869 155 H3' TMP 14 H3' T3 14 25.992 38.860 18.426 156 HO3' TMP 14 HO3' T3 14 25.532 40.765 17.009 157 H2'1 TMP 14 H2' T3 14 24.526 38.174 16.843 158 H2'2 TMP 14 H2'' T3 14 25.762 38.382 15.577 159 H1' TMP 14 H1' T3 14 26.598 36.397 15.815 160 HN3 TMP 14 H3 T3 14 23.743 33.021 16.652 161 H51 TMP 14 H71 T3 14 21.657 35.681 19.832 162 H52 TMP 14 H72 T3 14 22.688 34.833 21.063 163 H53 TMP 14 H73 T3 14 23.093 36.465 20.656 164 H6 TMP 14 H6 T3 14 25.190 36.633 19.353 165 HO5' THM 15 HO5' T5 15 26.082 13.401 32.774 166 H5'1 THM 15 H5' T5 15 25.323 11.530 31.781 167 H5'2 THM 15 H5'' T5 15 24.987 12.255 30.373 168 H4' THM 15 H4' T5 15 23.294 11.131 31.633 169 H3' THM 15 H3' T5 15 23.165 13.157 29.939 170 H2'1 THM 15 H2' T5 15 22.803 14.825 31.688 171 H2'2 THM 15 H2'' T5 15 21.103 14.544 31.382 172 H1' THM 15 H1' T5 15 20.954 12.587 32.878 173 HN3 THM 15 H3 T5 15 19.070 15.673 35.719 174 HM51 THM 15 H71 T5 15 22.997 17.795 36.170 175 HM52 THM 15 H72 T5 15 23.828 16.465 37.052 176 HM53 THM 15 H73 T5 15 24.262 16.768 35.400 177 H6 THM 15 H6 T5 15 23.574 14.850 34.431 178 H5' DT 16 H5' DT 16 18.832 12.817 31.395 179 H5'' DT 16 H5'' DT 16 17.767 12.695 29.975 180 H4' DT 16 H4' DT 16 16.731 14.123 31.528 181 H3' DT 16 H3' DT 16 17.546 15.067 29.025 182 H2' DT 16 H2' DT 16 19.146 16.396 29.859 183 H2'' DT 16 H2'' DT 16 17.675 17.617 30.017 184 H1' DT 16 H1' DT 16 17.180 16.935 32.088 185 H3 DT 16 H3 DT 16 19.338 19.741 34.774 186 H71 DT 16 H71 DT 16 22.847 17.815 31.169 187 H72 DT 16 H72 DT 16 23.225 19.264 31.978 188 H73 DT 16 H73 DT 16 23.459 17.682 32.835 189 H6 DT 16 H6 DT 16 20.820 16.943 31.140 190 H5' DA 17 H5' DA 17 14.399 18.292 31.499 191 H5'' DA 17 H5'' DA 17 13.162 17.565 30.405 192 H4' DA 17 H4' DA 17 12.358 19.719 30.617 193 H3' DA 17 H3' DA 17 13.024 18.943 28.022 194 H2' DA 17 H2' DA 17 15.098 19.979 27.804 195 H2'' DA 17 H2'' DA 17 14.093 21.293 27.117 196 H1' DA 17 H1' DA 17 14.022 22.407 29.292 197 H8 DA 17 H8 DA 17 17.010 19.894 28.988 198 H61 DA 17 H61 DA 17 20.018 24.403 31.885 199 H62 DA 17 H62 DA 17 20.380 22.974 30.924 200 H2 DA 17 H2 DA 17 15.886 25.500 31.890 201 H5' DG 18 H5' DG 18 9.776 22.448 28.772 202 H5'' DG 18 H5'' DG 18 8.670 22.399 27.473 203 H4' DG 18 H4' DG 18 8.777 24.825 28.166 204 H3' DG 18 H3' DG 18 9.107 23.904 25.578 205 H2' DG 18 H2' DG 18 11.267 24.031 25.442 206 H2'' DG 18 H2'' DG 18 11.042 25.833 24.874 207 H1' DG 18 H1' DG 18 11.512 26.563 27.232 208 H8 DG 18 H8 DG 18 13.313 23.378 25.981 209 H1 DG 18 H1 DG 18 16.987 27.919 28.855 210 H21 DG 18 H21 DG 18 15.963 29.450 29.681 211 H22 DG 18 H22 DG 18 14.203 29.318 29.799 212 H5' DG 19 H5' DG 19 8.422 28.658 25.985 213 H5'' DG 19 H5'' DG 19 7.084 29.398 24.832 214 H4' DG 19 H4' DG 19 9.156 30.683 25.171 215 H3' DG 19 H3' DG 19 9.169 29.196 22.493 216 H2' DG 19 H2' DG 19 11.546 29.626 22.587 217 H2'' DG 19 H2'' DG 19 11.316 31.270 23.094 218 H1' DG 19 H1' DG 19 11.374 30.723 25.337 219 H8 DG 19 H8 DG 19 11.973 27.323 23.743 220 H1 DG 19 H1 DG 19 17.529 30.104 25.571 221 H21 DG 19 H21 DG 19 17.182 32.034 26.239 222 H22 DG 19 H22 DG 19 15.583 32.805 26.041 223 H5' DG 20 H5' DG 20 10.053 33.655 22.862 224 H5'' DG 20 H5'' DG 20 9.623 34.554 21.388 225 H4' DG 20 H4' DG 20 11.505 35.466 22.695 226 H3' DG 20 H3' DG 20 11.372 35.092 19.741 227 H2' DG 20 H2' DG 20 12.971 33.569 19.888 228 H2'' DG 20 H2'' DG 20 14.113 34.970 19.818 229 H1' DG 20 H1' DG 20 14.254 35.069 22.350 230 H8 DG 20 H8 DG 20 13.235 31.515 21.144 231 H1 DG 20 H1 DG 20 19.183 31.689 23.569 232 H21 DG 20 H21 DG 20 19.913 33.878 23.380 233 H22 DG 20 H22 DG 20 18.626 35.034 23.657 234 H5'1 TMP 21 H5' T3 21 14.789 38.274 21.300 235 H5'2 TMP 21 H5'' T3 21 14.895 39.413 19.986 236 H4' TMP 21 H4' T3 21 17.215 38.870 20.912 237 H3' TMP 21 H3' T3 21 16.332 37.926 18.284 238 HO3' TMP 21 HO3' T3 21 18.106 39.566 17.629 239 H2'1 TMP 21 H2' T3 21 18.491 36.709 17.842 240 H2'2 TMP 21 H2'' T3 21 19.258 37.986 18.858 241 H1' TMP 21 H1' T3 21 19.067 36.536 20.641 242 HN3 TMP 21 H3 T3 21 19.359 32.055 19.846 243 H51 TMP 21 H71 T3 21 14.666 32.844 17.771 244 H52 TMP 21 H72 T3 21 15.433 34.224 16.921 245 H53 TMP 21 H73 T3 21 15.828 32.494 16.406 246 H6 TMP 21 H6 T3 21 16.185 35.424 18.441 247 HO5' THM 22 HO5' T5 22 26.336 26.211 39.668 248 H5'1 THM 22 H5' T5 22 27.923 25.016 40.803 249 H5'2 THM 22 H5'' T5 22 28.611 25.987 39.468 250 H4' THM 22 H4' T5 22 29.329 23.600 39.835 251 H3' THM 22 H3' T5 22 29.215 25.076 37.546 252 H2'1 THM 22 H2' T5 22 27.436 24.065 36.533 253 H2'2 THM 22 H2'' T5 22 28.710 22.905 35.987 254 H1' THM 22 H1' T5 22 28.246 21.284 37.504 255 HN3 THM 22 H3 T5 22 24.256 19.227 37.772 256 HM51 THM 22 H71 T5 22 23.550 24.578 37.369 257 HM52 THM 22 H72 T5 22 22.622 23.702 36.247 258 HM53 THM 22 H73 T5 22 22.267 23.595 38.084 259 H6 THM 22 H6 T5 22 25.569 23.757 37.376 260 H5' DT 23 H5' DT 23 30.291 20.733 37.063 261 H5'' DT 23 H5'' DT 23 31.755 20.390 36.095 262 H4' DT 23 H4' DT 23 30.309 18.685 35.663 263 H3' DT 23 H3' DT 23 31.418 20.214 33.724 264 H2' DT 23 H2' DT 23 29.458 21.472 33.189 265 H2'' DT 23 H2'' DT 23 29.148 20.282 32.082 266 H1' DT 23 H1' DT 23 27.835 19.007 33.410 267 H3 DT 23 H3 DT 23 23.597 20.568 34.025 268 H71 DT 23 H71 DT 23 25.043 24.802 34.484 269 H72 DT 23 H72 DT 23 26.714 24.834 34.534 270 H73 DT 23 H73 DT 23 25.841 24.840 32.991 271 H6 DT 23 H6 DT 23 27.847 22.740 33.905 272 H5' DA 24 H5' DA 24 28.299 17.304 32.300 273 H5'' DA 24 H5'' DA 24 29.159 16.280 31.128 274 H4' DA 24 H4' DA 24 26.850 16.431 30.789 275 H3' DA 24 H3' DA 24 28.440 17.532 28.637 276 H2' DA 24 H2' DA 24 27.478 19.718 28.848 277 H2'' DA 24 H2'' DA 24 26.161 18.921 27.795 278 H1' DA 24 H1' DA 24 24.851 18.508 29.750 279 H8 DA 24 H8 DA 24 27.353 21.341 30.652 280 H61 DA 24 H61 DA 24 22.317 24.866 29.858 281 H62 DA 24 H62 DA 24 23.961 25.075 30.394 282 H2 DA 24 H2 DA 24 21.067 20.713 29.125 283 H5' DG 25 H5' DG 25 24.094 16.089 27.392 284 H5'' DG 25 H5'' DG 25 24.193 15.435 25.758 285 H4' DG 25 H4' DG 25 22.102 16.740 26.003 286 H3' DG 25 H3' DG 25 24.171 17.123 24.058 287 H2' DG 25 H2' DG 25 24.329 19.247 24.583 288 H2'' DG 25 H2'' DG 25 22.867 19.615 23.622 289 H1' DG 25 H1' DG 25 21.560 19.532 25.740 290 H8 DG 25 H8 DG 25 25.202 20.714 26.363 291 H1 DG 25 H1 DG 25 20.499 25.118 26.566 292 H21 DG 25 H21 DG 25 18.439 23.901 26.315 293 H22 DG 25 H22 DG 25 18.473 22.184 26.154 294 H5' DG 26 H5' DG 26 19.368 17.693 22.168 295 H5'' DG 26 H5'' DG 26 19.437 16.676 20.646 296 H4' DG 26 H4' DG 26 18.229 18.673 20.301 297 H3' DG 26 H3' DG 26 21.050 19.226 19.387 298 H2' DG 26 H2' DG 26 20.399 21.507 19.278 299 H2'' DG 26 H2'' DG 26 18.778 21.213 18.853 300 H1' DG 26 H1' DG 26 18.040 21.108 21.134 301 H8 DG 26 H8 DG 26 21.669 21.510 21.640 302 H1 DG 26 H1 DG 26 18.156 26.373 24.033 303 H21 DG 26 H21 DG 26 16.169 26.026 23.377 304 H22 DG 26 H22 DG 26 15.784 24.714 22.205 305 H5' DG 27 H5' DG 27 17.080 20.101 17.577 306 H5'' DG 27 H5'' DG 27 17.121 19.654 15.812 307 H4' DG 27 H4' DG 27 15.383 21.479 16.345 308 H3' DG 27 H3' DG 27 17.467 21.896 14.333 309 H2' DG 27 H2' DG 27 18.306 23.418 15.684 310 H2'' DG 27 H2'' DG 27 17.213 24.568 14.832 311 H1' DG 27 H1' DG 27 15.675 24.368 16.692 312 H8 DG 27 H8 DG 27 19.333 23.484 17.596 313 H1 DG 27 H1 DG 27 17.077 28.557 20.909 314 H21 DG 27 H21 DG 27 14.998 28.955 20.333 315 H22 DG 27 H22 DG 27 14.205 27.857 19.381 316 H5'1 TMP 28 H5' T3 28 13.750 24.686 13.470 317 H5'2 TMP 28 H5'' T3 28 13.368 24.560 11.722 318 H4' TMP 28 H4' T3 28 13.747 26.637 11.986 319 H3' TMP 28 H3' T3 28 15.924 25.486 10.589 320 HO3' TMP 28 HO3' T3 28 15.078 27.367 9.641 321 H2'1 TMP 28 H2' T3 28 17.417 25.702 12.486 322 H2'2 TMP 28 H2'' T3 28 17.653 27.189 11.533 323 H1' TMP 28 H1' T3 28 16.043 28.436 12.903 324 HN3 TMP 28 H3 T3 28 17.319 29.715 16.958 325 H51 TMP 28 H71 T3 28 21.281 26.994 15.346 326 H52 TMP 28 H72 T3 28 20.740 26.667 16.901 327 H53 TMP 28 H73 T3 28 20.307 25.535 15.730 328 H6 TMP 28 H6 T3 28 18.729 26.314 13.908 329 H1 DM2 101 H23 M2 29 27.181 28.395 37.941 330 H2 DM2 101 H26 M2 29 27.186 26.451 36.171 331 H3 DM2 101 H25 M2 29 28.929 26.176 34.887 332 HO8 DM2 101 H21 M2 29 34.041 30.870 36.744 333 H10 DM2 101 H1 M2 29 34.759 33.098 38.801 334 H111 DM2 101 H2 M2 29 34.565 31.897 40.970 335 H112 DM2 101 H3 M2 29 35.178 33.586 41.259 336 HO12 DM2 101 H12 M2 29 33.884 34.006 43.586 337 H141 DM2 101 H18 M2 29 32.260 30.205 41.426 338 H142 DM2 101 H19 M2 29 31.196 30.862 42.478 339 HO14 DM2 101 H24 M2 29 33.212 29.286 43.492 340 H151 DM2 101 H4 M2 29 31.698 34.297 41.106 341 H152 DM2 101 H5 M2 29 30.977 33.021 42.176 342 HO17 DM2 101 H22 M2 29 28.743 31.481 40.264 343 H211 DM2 101 H27 M2 29 30.654 28.271 32.497 344 H212 DM2 101 H28 M2 29 29.410 27.316 33.273 345 H213 DM2 101 H29 M2 29 30.915 26.561 32.763 346 H1' DM2 101 H6 M2 29 32.542 34.818 37.776 347 H2'1 DM2 101 H7 M2 29 32.731 36.893 39.382 348 H2'2 DM2 101 H8 M2 29 32.618 37.292 37.661 349 H3' DM2 101 H9 M2 29 35.025 37.610 39.503 350 HN'1 DM2 101 H16 M2 29 34.077 39.263 37.305 351 HN'2 DM2 101 H17 M2 29 35.081 39.653 38.521 352 H4' DM2 101 H10 M2 29 36.639 37.644 37.780 353 HO4' DM2 101 H20 M2 29 36.083 37.534 35.628 354 H5' DM2 101 H11 M2 29 36.119 35.293 38.495 355 H6'1 DM2 101 H13 M2 29 37.597 35.705 36.434 356 H6'2 DM2 101 H14 M2 29 36.748 34.135 36.180 357 H6'3 DM2 101 H15 M2 29 36.313 35.527 35.230 358 H1 DM2 102 H23 M2 30 19.087 20.908 13.053 359 H2 DM2 102 H26 M2 30 19.455 23.193 13.779 360 H3 DM2 102 H25 M2 30 21.654 24.201 13.548 361 HO8 DM2 102 H21 M2 30 25.826 18.956 12.404 362 H10 DM2 102 H1 M2 30 25.891 15.680 11.155 363 H111 DM2 102 H2 M2 30 25.531 13.331 10.829 364 H112 DM2 102 H3 M2 30 24.228 13.202 11.967 365 HO12 DM2 102 H12 M2 30 23.738 11.933 9.757 366 H141 DM2 102 H18 M2 30 22.482 13.847 7.637 367 H142 DM2 102 H19 M2 30 23.896 12.976 7.182 368 HO14 DM2 102 H24 M2 30 24.674 14.617 5.773 369 H151 DM2 102 H4 M2 30 21.914 14.087 11.446 370 H152 DM2 102 H5 M2 30 21.632 14.763 9.840 371 HO17 DM2 102 H22 M2 30 19.765 17.390 10.859 372 H211 DM2 102 H27 M2 30 24.653 23.632 15.400 373 H212 DM2 102 H28 M2 30 22.812 23.731 15.162 374 H213 DM2 102 H29 M2 30 23.998 24.830 14.431 375 H1' DM2 102 H6 M2 30 27.601 15.325 12.735 376 H2'1 DM2 102 H7 M2 30 26.997 16.228 15.042 377 H2'2 DM2 102 H8 M2 30 28.262 15.070 14.858 378 H3' DM2 102 H9 M2 30 25.441 14.364 15.920 379 HN'1 DM2 102 H16 M2 30 26.498 15.428 17.696 380 HN'2 DM2 102 H17 M2 30 26.788 13.842 17.852 381 H4' DM2 102 H10 M2 30 26.191 12.167 16.150 382 HO4' DM2 102 H20 M2 30 28.768 13.176 16.151 383 H5' DM2 102 H11 M2 30 25.364 12.611 14.015 384 H6'1 DM2 102 H13 M2 30 26.290 10.211 14.334 385 H6'2 DM2 102 H14 M2 30 26.155 10.877 12.626 386 H6'3 DM2 102 H15 M2 30 27.779 10.675 13.478 Start of MODEL 4 1 HO5' THM 1 HO5' T5 1 18.026 29.440 44.693 2 H5'1 THM 1 H5' T5 1 20.119 28.451 44.233 3 H5'2 THM 1 H5'' T5 1 19.858 30.252 43.649 4 H4' THM 1 H4' T5 1 21.209 28.422 42.379 5 H3' THM 1 H3' T5 1 19.352 30.432 41.327 6 H2'1 THM 1 H2' T5 1 18.314 28.948 39.779 7 H2'2 THM 1 H2'' T5 1 19.899 28.988 38.984 8 H1' THM 1 H1' T5 1 20.674 27.136 40.279 9 HN3 THM 1 H3 T5 1 19.101 23.577 37.978 10 HM51 THM 1 H71 T5 1 14.929 25.665 38.647 11 HM52 THM 1 H72 T5 1 14.877 24.415 39.861 12 HM53 THM 1 H73 T5 1 15.012 26.067 40.425 13 H6 THM 1 H6 T5 1 17.152 27.010 40.724 14 H5' DT 2 H5' DT 2 23.964 30.349 40.520 15 H5'' DT 2 H5'' DT 2 24.730 31.979 40.337 16 H4' DT 2 H4' DT 2 25.744 30.834 38.681 17 H3' DT 2 H3' DT 2 24.027 32.567 37.587 18 H2' DT 2 H2' DT 2 22.396 31.110 36.570 19 H2'' DT 2 H2'' DT 2 23.667 30.905 35.299 20 H1' DT 2 H1' DT 2 24.676 29.208 36.263 21 H3 DT 2 H3 DT 2 22.314 25.782 34.894 22 H71 DT 2 H71 DT 2 18.986 29.404 36.808 23 H72 DT 2 H72 DT 2 18.387 28.305 35.464 24 H73 DT 2 H73 DT 2 18.193 27.845 37.189 25 H6 DT 2 H6 DT 2 21.045 29.597 37.384 26 H5' DA 3 H5' DA 3 28.532 31.257 35.711 27 H5'' DA 3 H5'' DA 3 29.168 32.928 35.258 28 H4' DA 3 H4' DA 3 30.467 31.229 33.947 29 H3' DA 3 H3' DA 3 29.083 33.246 32.652 30 H2' DA 3 H2' DA 3 27.215 31.947 31.840 31 H2'' DA 3 H2'' DA 3 28.519 31.613 30.621 32 H1' DA 3 H1' DA 3 28.796 29.432 31.496 33 H8 DA 3 H8 DA 3 26.116 30.764 33.996 34 H61 DA 3 H61 DA 3 22.844 26.043 31.713 35 H62 DA 3 H62 DA 3 23.053 27.231 33.027 36 H2 DA 3 H2 DA 3 26.562 26.328 29.412 37 H5' DG 4 H5' DG 4 31.675 30.613 30.167 38 H5'' DG 4 H5'' DG 4 32.833 31.430 29.198 39 H4' DG 4 H4' DG 4 32.090 29.542 27.921 40 H3' DG 4 H3' DG 4 31.700 31.867 26.773 41 H2' DG 4 H2' DG 4 29.395 31.955 26.832 42 H2'' DG 4 H2'' DG 4 29.605 31.170 25.202 43 H1' DG 4 H1' DG 4 29.352 28.984 26.402 44 H8 DG 4 H8 DG 4 27.802 31.992 28.453 45 H1 DG 4 H1 DG 4 23.889 26.868 27.504 46 H21 DG 4 H21 DG 4 24.849 25.395 26.144 47 H22 DG 4 H22 DG 4 26.559 25.495 25.729 48 H5' DG 5 H5' DG 5 31.611 28.642 23.584 49 H5'' DG 5 H5'' DG 5 32.520 28.997 22.082 50 H4' DG 5 H4' DG 5 30.339 27.806 22.009 51 H3' DG 5 H3' DG 5 30.058 30.619 20.808 52 H2' DG 5 H2' DG 5 27.939 30.587 21.803 53 H2'' DG 5 H2'' DG 5 27.551 29.392 20.412 54 H1' DG 5 H1' DG 5 28.345 27.672 22.282 55 H8 DG 5 H8 DG 5 27.475 30.780 24.279 56 H1 DG 5 H1 DG 5 22.397 26.788 23.880 57 H21 DG 5 H21 DG 5 23.290 24.818 22.789 58 H22 DG 5 H22 DG 5 24.893 24.736 22.085 59 H5' DG 6 H5' DG 6 30.066 26.534 18.053 60 H5'' DG 6 H5'' DG 6 30.987 27.123 16.753 61 H4' DG 6 H4' DG 6 29.638 25.519 15.899 62 H3' DG 6 H3' DG 6 28.974 27.873 14.764 63 H2' DG 6 H2' DG 6 27.002 28.135 16.025 64 H2'' DG 6 H2'' DG 6 26.264 27.229 14.699 65 H1' DG 6 H1' DG 6 26.441 25.212 15.961 66 H8 DG 6 H8 DG 6 27.237 28.340 18.350 67 H1 DG 6 H1 DG 6 21.512 25.511 19.562 68 H21 DG 6 H21 DG 6 21.841 23.264 18.782 69 H22 DG 6 H22 DG 6 23.090 23.080 17.559 70 H5'1 TMP 7 H5' T3 7 26.416 24.342 12.242 71 H5'2 TMP 7 H5'' T3 7 26.746 24.473 10.615 72 H4' TMP 7 H4' T3 7 24.388 24.245 10.477 73 H3' TMP 7 H3' T3 7 25.649 26.571 9.315 74 HO3' TMP 7 HO3' T3 7 24.348 26.074 7.818 75 H2'1 TMP 7 H2' T3 7 24.655 28.180 11.086 76 H2'2 TMP 7 H2'' T3 7 23.485 28.156 9.760 77 H1' TMP 7 H1' T3 7 22.250 26.371 10.671 78 HN3 TMP 7 H3 T3 7 20.145 29.536 13.495 79 H51 TMP 7 H71 T3 7 25.212 29.386 14.678 80 H52 TMP 7 H72 T3 7 24.190 30.608 15.492 81 H53 TMP 7 H73 T3 7 24.260 28.990 16.133 82 H6 TMP 7 H6 T3 7 24.447 27.571 13.350 83 HO5' THM 8 HO5' T5 8 11.087 16.742 32.268 84 H5'1 THM 8 H5' T5 8 9.404 17.265 33.898 85 H5'2 THM 8 H5'' T5 8 9.090 18.509 32.760 86 H4' THM 8 H4' T5 8 9.302 19.273 35.136 87 H3' THM 8 H3' T5 8 10.617 20.519 32.838 88 H2'1 THM 8 H2' T5 8 12.832 19.968 33.715 89 H2'2 THM 8 H2'' T5 8 12.573 21.320 34.630 90 H1' THM 8 H1' T5 8 11.640 20.175 36.513 91 HN3 THM 8 H3 T5 8 15.908 19.776 37.981 92 HM51 THM 8 H71 T5 8 15.483 15.212 36.067 93 HM52 THM 8 H72 T5 8 14.870 15.820 34.404 94 HM53 THM 8 H73 T5 8 16.559 16.071 34.910 95 H6 THM 8 H6 T5 8 13.341 17.401 34.810 96 H5' DT 9 H5' DT 9 11.052 23.394 36.797 97 H5'' DT 9 H5'' DT 9 10.185 24.713 36.315 98 H4' DT 9 H4' DT 9 12.048 25.504 37.377 99 H3' DT 9 H3' DT 9 11.573 26.252 34.638 100 H2' DT 9 H2' DT 9 13.228 24.938 33.902 101 H2'' DT 9 H2'' DT 9 14.154 26.462 33.910 102 H1' DT 9 H1' DT 9 14.901 25.838 36.344 103 H3 DT 9 H3 DT 9 18.804 24.051 35.375 104 H71 DT 9 H71 DT 9 14.896 21.148 33.060 105 H72 DT 9 H72 DT 9 16.570 21.064 32.426 106 H73 DT 9 H73 DT 9 16.156 20.166 33.909 107 H6 DT 9 H6 DT 9 14.230 22.922 34.146 108 H5' DA 10 H5' DA 10 14.864 29.392 37.338 109 H5'' DA 10 H5'' DA 10 13.727 30.562 37.464 110 H4' DA 10 H4' DA 10 15.682 31.873 37.445 111 H3' DA 10 H3' DA 10 13.650 32.342 35.713 112 H2' DA 10 H2' DA 10 14.446 31.283 33.826 113 H2'' DA 10 H2'' DA 10 15.324 32.671 33.357 114 H1' DA 10 H1' DA 10 17.450 32.037 34.599 115 H8 DA 10 H8 DA 10 15.184 28.978 33.240 116 H61 DA 10 H61 DA 10 20.700 26.827 31.583 117 H62 DA 10 H62 DA 10 18.990 26.405 31.594 118 H2 DA 10 H2 DA 10 21.478 30.687 33.159 119 H5' DG 11 H5' DG 11 17.475 34.411 35.482 120 H5'' DG 11 H5'' DG 11 17.207 36.287 35.391 121 H4' DG 11 H4' DG 11 19.279 35.767 34.276 122 H3' DG 11 H3' DG 11 17.227 37.161 33.179 123 H2' DG 11 H2' DG 11 16.453 35.306 31.987 124 H2'' DG 11 H2'' DG 11 17.366 36.123 30.672 125 H1' DG 11 H1' DG 11 19.485 34.916 31.377 126 H8 DG 11 H8 DG 11 15.867 33.590 30.795 127 H1 DG 11 H1 DG 11 20.426 29.616 28.750 128 H21 DG 11 H21 DG 11 22.339 30.302 29.359 129 H22 DG 11 H22 DG 11 22.574 31.895 30.198 130 H5' DG 12 H5' DG 12 21.585 37.340 31.409 131 H5'' DG 12 H5'' DG 12 22.295 38.922 31.136 132 H4' DG 12 H4' DG 12 23.199 37.047 29.839 133 H3' DG 12 H3' DG 12 21.761 39.064 28.290 134 H2' DG 12 H2' DG 12 20.385 37.211 27.590 135 H2'' DG 12 H2'' DG 12 21.481 37.023 26.372 136 H1' DG 12 H1' DG 12 22.760 35.486 28.141 137 H8 DG 12 H8 DG 12 18.980 35.574 28.409 138 H1 DG 12 H1 DG 12 21.478 30.323 25.452 139 H21 DG 12 H21 DG 12 23.676 30.348 26.059 140 H22 DG 12 H22 DG 12 24.331 31.686 27.002 141 H5' DG 13 H5' DG 13 25.604 36.557 26.576 142 H5'' DG 13 H5'' DG 13 26.547 38.009 26.211 143 H4' DG 13 H4' DG 13 27.386 36.337 24.736 144 H3' DG 13 H3' DG 13 26.156 38.455 23.544 145 H2' DG 13 H2' DG 13 24.207 36.910 22.876 146 H2'' DG 13 H2'' DG 13 25.343 36.588 21.503 147 H1' DG 13 H1' DG 13 26.279 34.722 22.551 148 H8 DG 13 H8 DG 13 23.018 35.591 24.579 149 H1 DG 13 H1 DG 13 22.828 30.156 21.121 150 H21 DG 13 H21 DG 13 24.895 29.919 20.163 151 H22 DG 13 H22 DG 13 26.063 31.130 20.059 152 H5'1 TMP 14 H5' T3 14 28.959 37.306 19.184 153 H5'2 TMP 14 H5'' T3 14 29.050 39.144 18.869 154 H4' TMP 14 H4' T3 14 28.466 38.246 16.979 155 H3' TMP 14 H3' T3 14 25.744 38.568 18.504 156 HO3' TMP 14 HO3' T3 14 26.389 40.533 18.047 157 H2'1 TMP 14 H2' T3 14 24.476 37.631 16.621 158 H2'2 TMP 14 H2'' T3 14 25.959 38.063 15.576 159 H1' TMP 14 H1' T3 14 26.337 35.933 15.897 160 HN3 TMP 14 H3 T3 14 23.646 32.651 17.463 161 H51 TMP 14 H71 T3 14 21.230 36.308 19.642 162 H52 TMP 14 H72 T3 14 22.101 35.581 20.984 163 H53 TMP 14 H73 T3 14 22.583 37.178 20.329 164 H6 TMP 14 H6 T3 14 24.561 36.982 19.159 165 HO5' THM 15 HO5' T5 15 25.118 13.203 33.162 166 H5'1 THM 15 H5' T5 15 25.258 11.098 32.267 167 H5'2 THM 15 H5'' T5 15 25.153 11.751 30.678 168 H4' THM 15 H4' T5 15 22.970 10.915 31.821 169 H3' THM 15 H3' T5 15 23.452 13.109 30.033 170 H2'1 THM 15 H2' T5 15 23.281 14.518 31.767 171 H2'2 THM 15 H2'' T5 15 21.726 14.553 31.013 172 H1' THM 15 H1' T5 15 20.910 12.872 32.391 173 HN3 THM 15 H3 T5 15 19.369 14.760 36.319 174 HM51 THM 15 H71 T5 15 22.914 17.894 36.156 175 HM52 THM 15 H72 T5 15 24.032 16.621 36.606 176 HM53 THM 15 H73 T5 15 23.874 17.198 34.868 177 H6 THM 15 H6 T5 15 23.292 15.310 33.613 178 H5' DT 16 H5' DT 16 18.888 12.838 31.281 179 H5'' DT 16 H5'' DT 16 17.935 13.020 29.743 180 H4' DT 16 H4' DT 16 16.703 14.136 31.480 181 H3' DT 16 H3' DT 16 17.470 15.161 28.882 182 H2' DT 16 H2' DT 16 19.018 16.656 29.795 183 H2'' DT 16 H2'' DT 16 17.544 17.728 30.158 184 H1' DT 16 H1' DT 16 17.179 16.862 32.213 185 H3 DT 16 H3 DT 16 19.532 19.817 34.516 186 H71 DT 16 H71 DT 16 22.825 17.279 31.090 187 H72 DT 16 H72 DT 16 23.227 18.977 31.444 188 H73 DT 16 H73 DT 16 23.513 17.650 32.668 189 H6 DT 16 H6 DT 16 20.719 16.556 31.257 190 H5' DA 17 H5' DA 17 13.815 18.316 31.774 191 H5'' DA 17 H5'' DA 17 12.942 17.330 30.605 192 H4' DA 17 H4' DA 17 11.910 19.476 30.992 193 H3' DA 17 H3' DA 17 12.563 18.726 28.290 194 H2' DA 17 H2' DA 17 14.444 20.158 28.081 195 H2'' DA 17 H2'' DA 17 13.240 21.352 27.662 196 H1' DA 17 H1' DA 17 13.331 22.432 29.642 197 H8 DA 17 H8 DA 17 16.392 19.783 29.101 198 H61 DA 17 H61 DA 17 19.937 24.490 31.307 199 H62 DA 17 H62 DA 17 20.142 22.992 30.478 200 H2 DA 17 H2 DA 17 15.935 25.872 31.546 201 H5' DG 18 H5' DG 18 9.697 22.442 28.854 202 H5'' DG 18 H5'' DG 18 8.367 22.364 27.727 203 H4' DG 18 H4' DG 18 8.881 24.623 28.254 204 H3' DG 18 H3' DG 18 9.028 23.874 25.618 205 H2' DG 18 H2' DG 18 11.232 23.775 25.565 206 H2'' DG 18 H2'' DG 18 11.124 25.529 24.962 207 H1' DG 18 H1' DG 18 11.486 26.416 27.266 208 H8 DG 18 H8 DG 18 13.360 23.167 26.242 209 H1 DG 18 H1 DG 18 16.843 27.745 29.024 210 H21 DG 18 H21 DG 18 15.598 29.532 29.303 211 H22 DG 18 H22 DG 18 13.849 29.334 29.451 212 H5' DG 19 H5' DG 19 8.607 29.035 25.948 213 H5'' DG 19 H5'' DG 19 7.401 29.512 24.685 214 H4' DG 19 H4' DG 19 9.296 30.908 24.792 215 H3' DG 19 H3' DG 19 9.460 29.084 22.352 216 H2' DG 19 H2' DG 19 11.698 29.370 22.365 217 H2'' DG 19 H2'' DG 19 11.579 31.042 22.492 218 H1' DG 19 H1' DG 19 11.615 31.031 24.874 219 H8 DG 19 H8 DG 19 12.005 27.341 24.013 220 H1 DG 19 H1 DG 19 17.702 29.854 25.907 221 H21 DG 19 H21 DG 19 17.441 31.985 26.178 222 H22 DG 19 H22 DG 19 15.785 32.638 26.298 223 H5' DG 20 H5' DG 20 10.143 33.910 22.870 224 H5'' DG 20 H5'' DG 20 9.573 34.729 21.419 225 H4' DG 20 H4' DG 20 11.352 35.733 22.258 226 H3' DG 20 H3' DG 20 11.573 34.949 19.523 227 H2' DG 20 H2' DG 20 13.199 33.637 19.718 228 H2'' DG 20 H2'' DG 20 14.177 35.116 19.669 229 H1' DG 20 H1' DG 20 14.362 35.224 22.056 230 H8 DG 20 H8 DG 20 13.394 31.813 20.730 231 H1 DG 20 H1 DG 20 19.382 32.030 22.941 232 H21 DG 20 H21 DG 20 19.835 34.440 23.291 233 H22 DG 20 H22 DG 20 18.372 35.450 23.466 234 H5'1 TMP 21 H5' T3 21 14.465 38.417 21.155 235 H5'2 TMP 21 H5'' T3 21 14.814 39.567 19.886 236 H4' TMP 21 H4' T3 21 16.645 38.890 21.160 237 H3' TMP 21 H3' T3 21 16.796 38.478 18.198 238 HO3' TMP 21 HO3' T3 21 18.530 39.945 18.401 239 H2'1 TMP 21 H2' T3 21 18.442 36.914 18.173 240 H2'2 TMP 21 H2'' T3 21 19.495 37.672 19.354 241 H1' TMP 21 H1' T3 21 18.586 36.280 20.955 242 HN3 TMP 21 H3 T3 21 19.039 32.094 19.489 243 H51 TMP 21 H71 T3 21 14.626 32.495 17.723 244 H52 TMP 21 H72 T3 21 14.450 34.142 17.197 245 H53 TMP 21 H73 T3 21 15.633 33.054 16.404 246 H6 TMP 21 H6 T3 21 15.940 35.634 18.442 247 HO5' THM 22 HO5' T5 22 26.411 26.222 39.516 248 H5'1 THM 22 H5' T5 22 27.917 25.383 40.550 249 H5'2 THM 22 H5'' T5 22 28.725 26.034 39.287 250 H4' THM 22 H4' T5 22 29.415 23.650 39.897 251 H3' THM 22 H3' T5 22 29.536 24.866 37.472 252 H2'1 THM 22 H2' T5 22 27.558 23.909 36.481 253 H2'2 THM 22 H2'' T5 22 28.659 22.734 35.944 254 H1' THM 22 H1' T5 22 28.252 21.286 37.925 255 HN3 THM 22 H3 T5 22 24.084 19.345 38.035 256 HM51 THM 22 H71 T5 22 23.562 24.700 36.835 257 HM52 THM 22 H72 T5 22 22.549 23.511 35.771 258 HM53 THM 22 H73 T5 22 22.136 23.645 37.358 259 H6 THM 22 H6 T5 22 25.535 23.827 37.169 260 H5' DT 23 H5' DT 23 30.381 20.626 36.920 261 H5'' DT 23 H5'' DT 23 31.860 20.079 36.122 262 H4' DT 23 H4' DT 23 30.004 18.602 35.573 263 H3' DT 23 H3' DT 23 31.373 20.174 33.654 264 H2' DT 23 H2' DT 23 29.576 21.661 33.282 265 H2'' DT 23 H2'' DT 23 29.228 20.478 32.024 266 H1' DT 23 H1' DT 23 27.810 19.096 33.587 267 H3 DT 23 H3 DT 23 23.596 20.601 33.921 268 H71 DT 23 H71 DT 23 26.480 24.913 34.504 269 H72 DT 23 H72 DT 23 26.409 24.717 32.619 270 H73 DT 23 H73 DT 23 24.983 25.151 33.647 271 H6 DT 23 H6 DT 23 27.877 22.835 33.770 272 H5' DA 24 H5' DA 24 28.520 17.210 31.981 273 H5'' DA 24 H5'' DA 24 29.025 16.216 30.640 274 H4' DA 24 H4' DA 24 26.790 16.720 30.538 275 H3' DA 24 H3' DA 24 28.594 17.668 28.413 276 H2' DA 24 H2' DA 24 27.703 19.769 28.442 277 H2'' DA 24 H2'' DA 24 26.305 19.025 27.522 278 H1' DA 24 H1' DA 24 25.041 18.831 29.606 279 H8 DA 24 H8 DA 24 27.574 21.796 29.963 280 H61 DA 24 H61 DA 24 22.163 24.926 29.955 281 H62 DA 24 H62 DA 24 23.947 25.097 29.989 282 H2 DA 24 H2 DA 24 21.296 20.780 29.463 283 H5' DG 25 H5' DG 25 24.169 16.993 27.627 284 H5'' DG 25 H5'' DG 25 24.207 15.733 26.430 285 H4' DG 25 H4' DG 25 22.374 17.099 25.931 286 H3' DG 25 H3' DG 25 24.195 17.213 23.912 287 H2' DG 25 H2' DG 25 24.161 19.516 24.021 288 H2'' DG 25 H2'' DG 25 22.541 19.349 23.140 289 H1' DG 25 H1' DG 25 21.382 19.804 25.372 290 H8 DG 25 H8 DG 25 25.002 20.941 25.702 291 H1 DG 25 H1 DG 25 20.520 25.161 27.127 292 H21 DG 25 H21 DG 25 18.621 24.156 27.101 293 H22 DG 25 H22 DG 25 18.387 22.572 26.298 294 H5' DG 26 H5' DG 26 19.741 17.805 22.388 295 H5'' DG 26 H5'' DG 26 19.694 17.020 20.896 296 H4' DG 26 H4' DG 26 18.776 19.036 20.602 297 H3' DG 26 H3' DG 26 21.520 19.497 19.599 298 H2' DG 26 H2' DG 26 20.945 21.812 19.712 299 H2'' DG 26 H2'' DG 26 19.336 21.561 19.144 300 H1' DG 26 H1' DG 26 18.476 21.182 21.404 301 H8 DG 26 H8 DG 26 22.194 21.742 22.131 302 H1 DG 26 H1 DG 26 18.207 26.444 24.330 303 H21 DG 26 H21 DG 26 16.156 25.957 23.953 304 H22 DG 26 H22 DG 26 15.697 24.543 23.033 305 H5' DG 27 H5' DG 27 17.376 20.630 18.069 306 H5'' DG 27 H5'' DG 27 17.321 19.646 16.594 307 H4' DG 27 H4' DG 27 15.452 21.063 16.796 308 H3' DG 27 H3' DG 27 17.236 21.537 14.700 309 H2' DG 27 H2' DG 27 18.241 23.201 15.850 310 H2'' DG 27 H2'' DG 27 17.074 24.398 15.051 311 H1' DG 27 H1' DG 27 15.763 24.492 16.819 312 H8 DG 27 H8 DG 27 19.361 23.215 17.559 313 H1 DG 27 H1 DG 27 17.627 28.327 21.110 314 H21 DG 27 H21 DG 27 15.287 28.948 20.512 315 H22 DG 27 H22 DG 27 14.776 28.185 19.098 316 H5'1 TMP 28 H5' T3 28 13.808 24.723 13.305 317 H5'2 TMP 28 H5'' T3 28 13.492 24.492 11.685 318 H4' TMP 28 H4' T3 28 13.875 26.974 12.216 319 H3' TMP 28 H3' T3 28 16.082 25.761 10.588 320 HO3' TMP 28 HO3' T3 28 14.993 27.374 9.292 321 H2'1 TMP 28 H2' T3 28 17.651 26.395 11.969 322 H2'2 TMP 28 H2'' T3 28 17.424 27.960 11.301 323 H1' TMP 28 H1' T3 28 15.770 28.564 12.914 324 HN3 TMP 28 H3 T3 28 17.655 29.899 16.880 325 H51 TMP 28 H71 T3 28 21.143 27.038 16.123 326 H52 TMP 28 H72 T3 28 20.172 25.643 16.613 327 H53 TMP 28 H73 T3 28 20.654 25.857 14.854 328 H6 TMP 28 H6 T3 28 18.534 26.295 13.926 329 H1 DM2 101 H23 M2 29 26.898 28.358 38.384 330 H2 DM2 101 H26 M2 29 26.705 26.783 36.319 331 H3 DM2 101 H25 M2 29 28.627 26.202 35.118 332 HO8 DM2 101 H21 M2 29 33.047 31.212 36.413 333 H10 DM2 101 H1 M2 29 34.622 33.064 38.704 334 H111 DM2 101 H2 M2 29 35.111 32.573 40.858 335 H112 DM2 101 H3 M2 29 35.022 34.212 40.981 336 HO12 DM2 101 H12 M2 29 34.509 34.316 43.243 337 H141 DM2 101 H18 M2 29 32.474 30.628 41.498 338 H142 DM2 101 H19 M2 29 31.720 31.137 42.875 339 HO14 DM2 101 H24 M2 29 34.010 29.433 43.239 340 H151 DM2 101 H4 M2 29 31.738 34.599 41.123 341 H152 DM2 101 H5 M2 29 31.154 33.393 42.246 342 HO17 DM2 101 H22 M2 29 28.603 31.823 40.731 343 H211 DM2 101 H27 M2 29 30.450 28.248 32.702 344 H212 DM2 101 H28 M2 29 29.147 27.516 33.505 345 H213 DM2 101 H29 M2 29 30.435 26.494 33.057 346 H1' DM2 101 H6 M2 29 32.407 34.609 37.393 347 H2'1 DM2 101 H7 M2 29 32.141 37.004 38.347 348 H2'2 DM2 101 H8 M2 29 32.806 36.890 36.678 349 H3' DM2 101 H9 M2 29 34.267 37.374 39.322 350 HN'1 DM2 101 H16 M2 29 34.181 39.078 37.052 351 HN'2 DM2 101 H17 M2 29 34.771 39.483 38.526 352 H4' DM2 101 H10 M2 29 36.320 37.330 38.270 353 HO4' DM2 101 H20 M2 29 36.833 37.577 36.201 354 H5' DM2 101 H11 M2 29 35.913 35.171 38.431 355 H6'1 DM2 101 H13 M2 29 37.823 35.077 36.808 356 H6'2 DM2 101 H14 M2 29 36.679 33.873 36.323 357 H6'3 DM2 101 H15 M2 29 36.668 35.326 35.476 358 H1 DM2 102 H23 M2 30 18.786 21.132 13.010 359 H2 DM2 102 H26 M2 30 19.330 23.564 13.776 360 H3 DM2 102 H25 M2 30 21.559 24.369 13.505 361 HO8 DM2 102 H21 M2 30 25.413 18.800 13.245 362 H10 DM2 102 H1 M2 30 25.678 15.796 11.386 363 H111 DM2 102 H2 M2 30 25.335 13.354 11.115 364 H112 DM2 102 H3 M2 30 24.052 13.415 12.156 365 HO12 DM2 102 H12 M2 30 24.140 12.078 9.775 366 H141 DM2 102 H18 M2 30 22.762 14.655 7.336 367 H142 DM2 102 H19 M2 30 23.793 13.259 7.190 368 HO14 DM2 102 H24 M2 30 25.136 14.578 5.988 369 H151 DM2 102 H4 M2 30 21.756 14.077 11.147 370 H152 DM2 102 H5 M2 30 21.715 14.967 9.616 371 HO17 DM2 102 H22 M2 30 19.556 17.344 11.182 372 H211 DM2 102 H27 M2 30 24.417 23.069 15.345 373 H212 DM2 102 H28 M2 30 22.659 23.383 15.408 374 H213 DM2 102 H29 M2 30 23.901 24.582 14.779 375 H1' DM2 102 H6 M2 30 27.107 16.062 13.062 376 H2'1 DM2 102 H7 M2 30 26.191 16.243 15.427 377 H2'2 DM2 102 H8 M2 30 27.837 15.673 15.453 378 H3' DM2 102 H9 M2 30 25.278 14.137 15.808 379 HN'1 DM2 102 H16 M2 30 26.465 15.270 17.678 380 HN'2 DM2 102 H17 M2 30 25.928 13.904 17.938 381 H4' DM2 102 H10 M2 30 26.249 12.017 15.948 382 HO4' DM2 102 H20 M2 30 28.403 12.819 16.665 383 H5' DM2 102 H11 M2 30 25.573 12.777 13.726 384 H6'1 DM2 102 H13 M2 30 26.347 10.706 13.499 385 H6'2 DM2 102 H14 M2 30 27.244 11.451 12.207 386 H6'3 DM2 102 H15 M2 30 28.084 11.109 13.735 Start of MODEL 5 1 HO5' THM 1 HO5' T5 1 17.509 29.318 44.317 2 H5'1 THM 1 H5' T5 1 19.741 28.414 44.498 3 H5'2 THM 1 H5'' T5 1 19.728 29.995 43.765 4 H4' THM 1 H4' T5 1 21.169 28.240 42.607 5 H3' THM 1 H3' T5 1 19.221 30.259 41.548 6 H2'1 THM 1 H2' T5 1 18.543 28.930 39.966 7 H2'2 THM 1 H2'' T5 1 20.200 29.062 39.112 8 H1' THM 1 H1' T5 1 20.929 27.113 40.369 9 HN3 THM 1 H3 T5 1 19.384 23.437 38.122 10 HM51 THM 1 H71 T5 1 14.838 25.213 39.409 11 HM52 THM 1 H72 T5 1 15.410 24.186 40.807 12 HM53 THM 1 H73 T5 1 15.319 25.974 40.958 13 H6 THM 1 H6 T5 1 17.317 27.156 40.513 14 H5' DT 2 H5' DT 2 23.981 30.588 40.278 15 H5'' DT 2 H5'' DT 2 24.329 32.229 40.098 16 H4' DT 2 H4' DT 2 25.769 30.912 38.683 17 H3' DT 2 H3' DT 2 24.054 32.878 37.573 18 H2' DT 2 H2' DT 2 22.579 31.244 36.598 19 H2'' DT 2 H2'' DT 2 23.681 31.263 35.137 20 H1' DT 2 H1' DT 2 24.810 29.347 35.895 21 H3 DT 2 H3 DT 2 22.643 25.748 34.645 22 H71 DT 2 H71 DT 2 18.965 29.195 36.918 23 H72 DT 2 H72 DT 2 18.464 28.169 35.736 24 H73 DT 2 H73 DT 2 18.911 27.506 37.248 25 H6 DT 2 H6 DT 2 21.283 29.815 36.941 26 H5' DA 3 H5' DA 3 28.415 31.863 35.865 27 H5'' DA 3 H5'' DA 3 29.330 33.183 35.242 28 H4' DA 3 H4' DA 3 30.307 31.499 34.114 29 H3' DA 3 H3' DA 3 29.015 33.643 32.793 30 H2' DA 3 H2' DA 3 27.165 32.290 32.099 31 H2'' DA 3 H2'' DA 3 28.062 31.853 30.719 32 H1' DA 3 H1' DA 3 28.806 29.829 31.633 33 H8 DA 3 H8 DA 3 25.740 31.106 33.731 34 H61 DA 3 H61 DA 3 23.049 26.290 30.967 35 H62 DA 3 H62 DA 3 22.688 27.797 31.872 36 H2 DA 3 H2 DA 3 27.118 26.391 29.506 37 H5' DG 4 H5' DG 4 31.283 30.168 30.394 38 H5'' DG 4 H5'' DG 4 32.589 31.076 29.503 39 H4' DG 4 H4' DG 4 32.230 29.189 28.214 40 H3' DG 4 H3' DG 4 31.738 31.709 27.128 41 H2' DG 4 H2' DG 4 29.640 31.521 27.129 42 H2'' DG 4 H2'' DG 4 29.933 30.873 25.446 43 H1' DG 4 H1' DG 4 29.387 28.797 26.349 44 H8 DG 4 H8 DG 4 27.895 31.870 28.333 45 H1 DG 4 H1 DG 4 23.829 26.819 27.255 46 H21 DG 4 H21 DG 4 25.045 25.165 26.764 47 H22 DG 4 H22 DG 4 26.626 25.329 26.042 48 H5' DG 5 H5' DG 5 31.498 27.857 23.810 49 H5'' DG 5 H5'' DG 5 32.615 28.392 22.469 50 H4' DG 5 H4' DG 5 30.404 27.432 21.687 51 H3' DG 5 H3' DG 5 30.650 30.256 21.067 52 H2' DG 5 H2' DG 5 28.375 30.402 21.544 53 H2'' DG 5 H2'' DG 5 28.054 29.339 20.087 54 H1' DG 5 H1' DG 5 28.300 27.447 21.784 55 H8 DG 5 H8 DG 5 27.722 30.640 23.616 56 H1 DG 5 H1 DG 5 22.657 26.768 23.819 57 H21 DG 5 H21 DG 5 23.404 24.770 23.309 58 H22 DG 5 H22 DG 5 24.992 24.559 22.609 59 H5' DG 6 H5' DG 6 30.628 26.465 17.997 60 H5'' DG 6 H5'' DG 6 31.238 27.323 16.544 61 H4' DG 6 H4' DG 6 29.759 25.217 16.043 62 H3' DG 6 H3' DG 6 29.294 27.647 14.700 63 H2' DG 6 H2' DG 6 27.414 27.975 15.929 64 H2'' DG 6 H2'' DG 6 26.564 26.859 14.606 65 H1' DG 6 H1' DG 6 26.710 25.125 16.159 66 H8 DG 6 H8 DG 6 27.400 28.486 18.151 67 H1 DG 6 H1 DG 6 21.573 26.058 19.407 68 H21 DG 6 H21 DG 6 21.557 24.148 18.777 69 H22 DG 6 H22 DG 6 22.876 23.411 17.902 70 H5'1 TMP 7 H5' T3 7 26.530 24.370 12.421 71 H5'2 TMP 7 H5'' T3 7 27.038 24.702 10.801 72 H4' TMP 7 H4' T3 7 24.624 24.324 10.805 73 H3' TMP 7 H3' T3 7 25.905 26.635 9.770 74 HO3' TMP 7 HO3' T3 7 24.760 24.746 8.671 75 H2'1 TMP 7 H2' T3 7 24.625 28.168 10.911 76 H2'2 TMP 7 H2'' T3 7 23.206 27.932 9.819 77 H1' TMP 7 H1' T3 7 22.382 26.089 11.393 78 HN3 TMP 7 H3 T3 7 19.921 29.435 13.267 79 H51 TMP 7 H71 T3 7 23.402 30.222 16.102 80 H52 TMP 7 H72 T3 7 22.905 28.598 16.801 81 H53 TMP 7 H73 T3 7 24.477 28.871 16.042 82 H6 TMP 7 H6 T3 7 24.274 27.604 13.936 83 HO5' THM 8 HO5' T5 8 10.385 16.873 32.410 84 H5'1 THM 8 H5' T5 8 9.141 17.160 34.515 85 H5'2 THM 8 H5'' T5 8 8.860 18.181 33.144 86 H4' THM 8 H4' T5 8 8.964 19.596 35.157 87 H3' THM 8 H3' T5 8 10.144 20.187 32.764 88 H2'1 THM 8 H2' T5 8 12.478 19.594 33.348 89 H2'2 THM 8 H2'' T5 8 12.564 21.313 33.765 90 H1' THM 8 H1' T5 8 11.827 20.787 36.087 91 HN3 THM 8 H3 T5 8 15.874 19.824 37.896 92 HM51 THM 8 H71 T5 8 14.947 15.357 35.588 93 HM52 THM 8 H72 T5 8 15.071 16.117 34.027 94 HM53 THM 8 H73 T5 8 16.465 16.080 35.080 95 H6 THM 8 H6 T5 8 13.183 17.584 34.651 96 H5' DT 9 H5' DT 9 11.170 23.135 36.530 97 H5'' DT 9 H5'' DT 9 10.221 24.576 36.044 98 H4' DT 9 H4' DT 9 11.971 25.436 37.273 99 H3' DT 9 H3' DT 9 11.549 26.257 34.573 100 H2' DT 9 H2' DT 9 13.482 25.156 33.587 101 H2'' DT 9 H2'' DT 9 14.115 26.719 34.114 102 H1' DT 9 H1' DT 9 14.808 26.078 36.241 103 H3 DT 9 H3 DT 9 18.828 24.151 35.317 104 H71 DT 9 H71 DT 9 15.183 21.211 32.741 105 H72 DT 9 H72 DT 9 16.925 21.004 32.595 106 H73 DT 9 H73 DT 9 15.985 20.199 33.859 107 H6 DT 9 H6 DT 9 14.322 23.072 33.898 108 H5' DA 10 H5' DA 10 15.192 29.019 36.886 109 H5'' DA 10 H5'' DA 10 13.712 30.087 37.269 110 H4' DA 10 H4' DA 10 15.635 31.424 37.473 111 H3' DA 10 H3' DA 10 13.795 32.209 35.588 112 H2' DA 10 H2' DA 10 14.993 31.268 33.566 113 H2'' DA 10 H2'' DA 10 15.633 32.799 33.610 114 H1' DA 10 H1' DA 10 17.601 31.939 34.355 115 H8 DA 10 H8 DA 10 15.222 29.190 32.939 116 H61 DA 10 H61 DA 10 20.598 26.838 30.879 117 H62 DA 10 H62 DA 10 18.840 26.690 30.728 118 H2 DA 10 H2 DA 10 21.674 30.115 33.467 119 H5' DG 11 H5' DG 11 17.619 34.858 35.755 120 H5'' DG 11 H5'' DG 11 17.112 36.564 35.366 121 H4' DG 11 H4' DG 11 19.248 35.911 34.284 122 H3' DG 11 H3' DG 11 17.058 37.096 32.938 123 H2' DG 11 H2' DG 11 16.874 35.465 31.449 124 H2'' DG 11 H2'' DG 11 18.315 36.269 30.530 125 H1' DG 11 H1' DG 11 19.720 34.701 31.388 126 H8 DG 11 H8 DG 11 15.986 33.515 31.082 127 H1 DG 11 H1 DG 11 20.242 29.310 28.816 128 H21 DG 11 H21 DG 11 22.223 29.803 29.513 129 H22 DG 11 H22 DG 11 22.469 31.164 30.552 130 H5' DG 12 H5' DG 12 21.341 37.521 31.576 131 H5'' DG 12 H5'' DG 12 22.033 39.124 31.135 132 H4' DG 12 H4' DG 12 22.812 37.128 29.916 133 H3' DG 12 H3' DG 12 21.300 38.725 28.072 134 H2' DG 12 H2' DG 12 21.209 36.947 26.641 135 H2'' DG 12 H2'' DG 12 22.910 36.467 26.994 136 H1' DG 12 H1' DG 12 22.493 35.354 28.868 137 H8 DG 12 H8 DG 12 18.832 35.175 28.572 138 H1 DG 12 H1 DG 12 21.835 30.395 25.397 139 H21 DG 12 H21 DG 12 23.940 30.869 25.287 140 H22 DG 12 H22 DG 12 24.636 32.405 25.811 141 H5' DG 13 H5' DG 13 25.666 36.339 26.521 142 H5'' DG 13 H5'' DG 13 26.601 37.605 26.385 143 H4' DG 13 H4' DG 13 27.448 36.148 24.676 144 H3' DG 13 H3' DG 13 26.130 38.375 23.766 145 H2' DG 13 H2' DG 13 24.341 37.223 23.033 146 H2'' DG 13 H2'' DG 13 25.217 36.876 21.580 147 H1' DG 13 H1' DG 13 25.947 34.758 22.317 148 H8 DG 13 H8 DG 13 22.824 35.800 24.303 149 H1 DG 13 H1 DG 13 22.281 30.268 21.364 150 H21 DG 13 H21 DG 13 24.022 29.943 19.920 151 H22 DG 13 H22 DG 13 25.357 31.027 20.061 152 H5'1 TMP 14 H5' T3 14 29.241 38.281 19.069 153 H5'2 TMP 14 H5'' T3 14 28.242 39.634 18.990 154 H4' TMP 14 H4' T3 14 28.275 38.270 16.941 155 H3' TMP 14 H3' T3 14 25.689 38.809 18.528 156 HO3' TMP 14 HO3' T3 14 26.706 40.579 17.445 157 H2'1 TMP 14 H2' T3 14 24.457 37.830 16.601 158 H2'2 TMP 14 H2'' T3 14 25.890 37.726 15.642 159 H1' TMP 14 H1' T3 14 26.485 35.815 16.122 160 HN3 TMP 14 H3 T3 14 24.091 32.205 17.634 161 H51 TMP 14 H71 T3 14 21.046 35.362 19.428 162 H52 TMP 14 H72 T3 14 22.047 35.531 20.858 163 H53 TMP 14 H73 T3 14 21.970 36.800 19.711 164 H6 TMP 14 H6 T3 14 24.363 36.789 19.106 165 HO5' THM 15 HO5' T5 15 24.973 12.581 33.052 166 H5'1 THM 15 H5' T5 15 24.569 10.465 32.157 167 H5'2 THM 15 H5'' T5 15 24.612 11.357 30.538 168 H4' THM 15 H4' T5 15 22.452 10.777 31.595 169 H3' THM 15 H3' T5 15 23.221 13.188 30.304 170 H2'1 THM 15 H2' T5 15 22.730 14.715 31.993 171 H2'2 THM 15 H2'' T5 15 20.975 14.290 31.468 172 H1' THM 15 H1' T5 15 20.668 12.680 33.094 173 HN3 THM 15 H3 T5 15 19.833 14.765 36.953 174 HM51 THM 15 H71 T5 15 23.473 17.407 36.266 175 HM52 THM 15 H72 T5 15 24.551 16.080 36.715 176 HM53 THM 15 H73 T5 15 24.552 16.759 34.967 177 H6 THM 15 H6 T5 15 23.574 14.895 33.880 178 H5' DT 16 H5' DT 16 18.936 12.997 30.854 179 H5'' DT 16 H5'' DT 16 18.060 13.008 29.356 180 H4' DT 16 H4' DT 16 16.818 14.309 31.026 181 H3' DT 16 H3' DT 16 17.501 15.489 28.530 182 H2' DT 16 H2' DT 16 19.054 16.916 29.462 183 H2'' DT 16 H2'' DT 16 17.646 17.886 29.594 184 H1' DT 16 H1' DT 16 17.292 17.113 31.856 185 H3 DT 16 H3 DT 16 19.921 19.526 34.605 186 H71 DT 16 H71 DT 16 23.011 17.323 30.702 187 H72 DT 16 H72 DT 16 23.386 18.881 31.438 188 H73 DT 16 H73 DT 16 23.759 17.416 32.317 189 H6 DT 16 H6 DT 16 20.888 16.667 30.917 190 H5' DA 17 H5' DA 17 14.016 18.293 31.711 191 H5'' DA 17 H5'' DA 17 12.972 17.273 30.680 192 H4' DA 17 H4' DA 17 11.709 19.246 31.083 193 H3' DA 17 H3' DA 17 12.167 18.557 28.531 194 H2' DA 17 H2' DA 17 13.923 20.031 27.971 195 H2'' DA 17 H2'' DA 17 12.649 21.205 27.694 196 H1' DA 17 H1' DA 17 12.954 22.352 29.783 197 H8 DA 17 H8 DA 17 15.957 20.019 28.748 198 H61 DA 17 H61 DA 17 19.520 24.662 31.264 199 H62 DA 17 H62 DA 17 19.581 23.238 30.141 200 H2 DA 17 H2 DA 17 15.450 25.741 31.982 201 H5' DG 18 H5' DG 18 9.829 22.799 29.292 202 H5'' DG 18 H5'' DG 18 8.354 22.892 28.344 203 H4' DG 18 H4' DG 18 9.074 25.013 28.451 204 H3' DG 18 H3' DG 18 8.694 23.840 26.070 205 H2' DG 18 H2' DG 18 11.031 23.528 25.643 206 H2'' DG 18 H2'' DG 18 10.843 25.171 24.945 207 H1' DG 18 H1' DG 18 11.562 26.256 26.983 208 H8 DG 18 H8 DG 18 13.096 22.947 26.075 209 H1 DG 18 H1 DG 18 17.043 27.268 28.520 210 H21 DG 18 H21 DG 18 15.969 29.073 29.019 211 H22 DG 18 H22 DG 18 14.253 29.264 28.541 212 H5' DG 19 H5' DG 19 8.931 28.579 25.766 213 H5'' DG 19 H5'' DG 19 7.655 29.171 24.713 214 H4' DG 19 H4' DG 19 9.638 30.284 24.760 215 H3' DG 19 H3' DG 19 9.444 29.069 22.060 216 H2' DG 19 H2' DG 19 11.655 28.973 22.000 217 H2'' DG 19 H2'' DG 19 11.901 30.700 22.186 218 H1' DG 19 H1' DG 19 11.862 30.512 24.690 219 H8 DG 19 H8 DG 19 12.653 26.971 23.614 220 H1 DG 19 H1 DG 19 17.755 29.981 25.934 221 H21 DG 19 H21 DG 19 17.034 32.054 26.650 222 H22 DG 19 H22 DG 19 15.414 32.648 26.329 223 H5' DG 20 H5' DG 20 10.163 33.833 22.856 224 H5'' DG 20 H5'' DG 20 9.647 34.669 21.351 225 H4' DG 20 H4' DG 20 11.315 35.909 22.252 226 H3' DG 20 H3' DG 20 11.425 35.014 19.599 227 H2' DG 20 H2' DG 20 13.318 33.914 19.768 228 H2'' DG 20 H2'' DG 20 14.242 35.504 19.870 229 H1' DG 20 H1' DG 20 14.518 35.312 22.215 230 H8 DG 20 H8 DG 20 13.213 31.999 20.599 231 H1 DG 20 H1 DG 20 18.858 31.476 23.569 232 H21 DG 20 H21 DG 20 19.327 33.690 24.450 233 H22 DG 20 H22 DG 20 18.031 34.919 24.302 234 H5'1 TMP 21 H5' T3 21 14.109 38.176 20.905 235 H5'2 TMP 21 H5'' T3 21 14.486 39.582 19.998 236 H4' TMP 21 H4' T3 21 16.526 38.789 21.261 237 H3' TMP 21 H3' T3 21 16.602 38.081 18.219 238 HO3' TMP 21 HO3' T3 21 18.369 39.828 18.417 239 H2'1 TMP 21 H2' T3 21 18.539 37.087 18.390 240 H2'2 TMP 21 H2'' T3 21 19.013 37.824 19.831 241 H1' TMP 21 H1' T3 21 18.301 36.209 21.127 242 HN3 TMP 21 H3 T3 21 18.777 32.020 19.276 243 H51 TMP 21 H71 T3 21 14.920 32.485 16.854 244 H52 TMP 21 H72 T3 21 14.511 34.250 17.107 245 H53 TMP 21 H73 T3 21 15.553 33.799 15.882 246 H6 TMP 21 H6 T3 21 15.866 35.656 18.351 247 HO5' THM 22 HO5' T5 22 25.847 24.889 40.169 248 H5'1 THM 22 H5' T5 22 27.915 25.421 40.845 249 H5'2 THM 22 H5'' T5 22 28.278 26.040 39.208 250 H4' THM 22 H4' T5 22 29.231 23.866 40.331 251 H3' THM 22 H3' T5 22 29.501 24.941 37.696 252 H2'1 THM 22 H2' T5 22 27.412 24.162 37.108 253 H2'2 THM 22 H2'' T5 22 28.531 22.967 36.296 254 H1' THM 22 H1' T5 22 28.257 21.345 38.108 255 HN3 THM 22 H3 T5 22 24.410 19.034 37.637 256 HM51 THM 22 H71 T5 22 23.293 24.333 36.858 257 HM52 THM 22 H72 T5 22 22.764 23.244 35.790 258 HM53 THM 22 H73 T5 22 22.104 23.259 37.459 259 H6 THM 22 H6 T5 22 25.447 23.772 37.370 260 H5' DT 23 H5' DT 23 31.011 20.086 36.863 261 H5'' DT 23 H5'' DT 23 32.146 20.265 35.541 262 H4' DT 23 H4' DT 23 30.219 18.618 35.402 263 H3' DT 23 H3' DT 23 31.540 19.983 33.346 264 H2' DT 23 H2' DT 23 29.831 21.629 33.308 265 H2'' DT 23 H2'' DT 23 29.418 20.488 31.945 266 H1' DT 23 H1' DT 23 28.005 19.120 33.543 267 H3 DT 23 H3 DT 23 23.924 20.889 33.360 268 H71 DT 23 H71 DT 23 27.246 24.765 32.381 269 H72 DT 23 H72 DT 23 25.696 25.178 33.000 270 H73 DT 23 H73 DT 23 26.913 25.039 34.223 271 H6 DT 23 H6 DT 23 28.261 22.864 33.790 272 H5' DA 24 H5' DA 24 28.433 17.092 31.845 273 H5'' DA 24 H5'' DA 24 28.699 16.040 30.525 274 H4' DA 24 H4' DA 24 26.573 16.644 30.162 275 H3' DA 24 H3' DA 24 28.530 17.797 28.357 276 H2' DA 24 H2' DA 24 27.424 19.667 28.204 277 H2'' DA 24 H2'' DA 24 25.998 18.973 27.424 278 H1' DA 24 H1' DA 24 24.836 18.660 29.525 279 H8 DA 24 H8 DA 24 27.330 21.623 30.043 280 H61 DA 24 H61 DA 24 22.188 25.009 29.316 281 H62 DA 24 H62 DA 24 24.005 25.003 29.653 282 H2 DA 24 H2 DA 24 20.942 20.861 29.163 283 H5' DG 25 H5' DG 25 24.378 16.833 27.629 284 H5'' DG 25 H5'' DG 25 24.200 15.474 26.563 285 H4' DG 25 H4' DG 25 22.207 16.724 26.213 286 H3' DG 25 H3' DG 25 24.107 17.082 24.196 287 H2' DG 25 H2' DG 25 23.998 19.313 24.360 288 H2'' DG 25 H2'' DG 25 22.342 19.177 23.651 289 H1' DG 25 H1' DG 25 21.295 19.499 25.833 290 H8 DG 25 H8 DG 25 24.990 20.713 25.955 291 H1 DG 25 H1 DG 25 20.372 24.992 26.986 292 H21 DG 25 H21 DG 25 18.341 23.659 27.152 293 H22 DG 25 H22 DG 25 18.479 21.956 26.735 294 H5' DG 26 H5' DG 26 19.893 17.882 22.352 295 H5'' DG 26 H5'' DG 26 19.784 17.056 20.705 296 H4' DG 26 H4' DG 26 18.776 19.272 20.674 297 H3' DG 26 H3' DG 26 21.400 19.288 19.497 298 H2' DG 26 H2' DG 26 21.632 21.409 20.395 299 H2'' DG 26 H2'' DG 26 20.353 22.064 19.599 300 H1' DG 26 H1' DG 26 18.877 21.353 21.340 301 H8 DG 26 H8 DG 26 22.296 21.711 22.884 302 H1 DG 26 H1 DG 26 18.335 26.666 24.248 303 H21 DG 26 H21 DG 26 16.123 25.917 23.692 304 H22 DG 26 H22 DG 26 15.962 24.379 22.990 305 H5' DG 27 H5' DG 27 17.169 20.331 17.844 306 H5'' DG 27 H5'' DG 27 17.279 19.804 16.141 307 H4' DG 27 H4' DG 27 15.262 21.233 16.634 308 H3' DG 27 H3' DG 27 16.916 21.665 14.586 309 H2' DG 27 H2' DG 27 18.017 23.329 15.626 310 H2'' DG 27 H2'' DG 27 16.812 24.572 14.830 311 H1' DG 27 H1' DG 27 15.792 24.575 16.933 312 H8 DG 27 H8 DG 27 19.418 23.266 17.524 313 H1 DG 27 H1 DG 27 17.819 28.401 21.253 314 H21 DG 27 H21 DG 27 16.081 29.582 20.166 315 H22 DG 27 H22 DG 27 15.316 28.839 18.813 316 H5'1 TMP 28 H5' T3 28 13.724 24.969 13.748 317 H5'2 TMP 28 H5'' T3 28 13.293 24.820 11.981 318 H4' TMP 28 H4' T3 28 13.679 27.204 12.371 319 H3' TMP 28 H3' T3 28 15.585 25.805 10.783 320 HO3' TMP 28 HO3' T3 28 15.014 27.153 9.562 321 H2'1 TMP 28 H2' T3 28 17.333 26.097 12.020 322 H2'2 TMP 28 H2'' T3 28 17.466 27.803 11.388 323 H1' TMP 28 H1' T3 28 16.025 28.710 12.973 324 HN3 TMP 28 H3 T3 28 17.713 29.816 17.114 325 H51 TMP 28 H71 T3 28 21.339 26.694 15.699 326 H52 TMP 28 H72 T3 28 20.419 25.890 16.847 327 H53 TMP 28 H73 T3 28 20.307 25.407 15.140 328 H6 TMP 28 H6 T3 28 18.657 26.366 13.818 329 H1 DM2 101 H23 M2 29 26.609 28.429 38.596 330 H2 DM2 101 H26 M2 29 26.581 26.853 36.639 331 H3 DM2 101 H25 M2 29 28.350 26.352 35.477 332 HO8 DM2 101 H21 M2 29 32.935 30.961 36.587 333 H10 DM2 101 H1 M2 29 34.626 32.877 38.716 334 H111 DM2 101 H2 M2 29 35.176 32.615 40.902 335 H112 DM2 101 H3 M2 29 35.087 34.305 40.866 336 HO12 DM2 101 H12 M2 29 34.432 34.504 43.403 337 H141 DM2 101 H18 M2 29 33.471 30.832 41.328 338 H142 DM2 101 H19 M2 29 32.101 31.005 42.532 339 HO14 DM2 101 H24 M2 29 33.437 29.812 43.993 340 H151 DM2 101 H4 M2 29 31.723 34.541 41.013 341 H152 DM2 101 H5 M2 29 31.189 33.459 42.274 342 HO17 DM2 101 H22 M2 29 28.629 31.402 40.926 343 H211 DM2 101 H27 M2 29 30.507 27.405 32.884 344 H212 DM2 101 H28 M2 29 28.853 27.400 33.788 345 H213 DM2 101 H29 M2 29 29.879 26.036 33.822 346 H1' DM2 101 H6 M2 29 32.666 34.372 37.218 347 H2'1 DM2 101 H7 M2 29 32.268 36.564 38.285 348 H2'2 DM2 101 H8 M2 29 32.598 36.727 36.570 349 H3' DM2 101 H9 M2 29 34.256 37.251 38.994 350 HN'1 DM2 101 H16 M2 29 33.608 38.922 36.610 351 HN'2 DM2 101 H17 M2 29 34.502 39.517 37.885 352 H4' DM2 101 H10 M2 29 36.304 37.768 37.666 353 HO4' DM2 101 H20 M2 29 36.222 36.835 35.375 354 H5' DM2 101 H11 M2 29 36.029 35.585 38.662 355 H6'1 DM2 101 H13 M2 29 38.086 35.715 37.391 356 H6'2 DM2 101 H14 M2 29 37.346 34.198 37.171 357 H6'3 DM2 101 H15 M2 29 37.291 35.347 35.793 358 H1 DM2 102 H23 M2 30 18.900 21.250 13.150 359 H2 DM2 102 H26 M2 30 19.317 23.567 13.840 360 H3 DM2 102 H25 M2 30 21.622 24.470 13.760 361 HO8 DM2 102 H21 M2 30 25.509 19.060 12.968 362 H10 DM2 102 H1 M2 30 25.835 15.876 11.671 363 H111 DM2 102 H2 M2 30 25.603 13.644 11.125 364 H112 DM2 102 H3 M2 30 24.358 13.305 12.168 365 HO12 DM2 102 H12 M2 30 24.108 12.466 9.330 366 H141 DM2 102 H18 M2 30 22.705 16.199 8.147 367 H142 DM2 102 H19 M2 30 22.318 14.406 8.133 368 HO14 DM2 102 H24 M2 30 24.557 15.398 6.644 369 H151 DM2 102 H4 M2 30 21.990 14.013 11.759 370 H152 DM2 102 H5 M2 30 21.507 14.701 10.128 371 HO17 DM2 102 H22 M2 30 19.608 17.460 11.546 372 H211 DM2 102 H27 M2 30 23.794 22.429 15.718 373 H212 DM2 102 H28 M2 30 22.759 23.882 15.525 374 H213 DM2 102 H29 M2 30 24.608 23.858 15.352 375 H1' DM2 102 H6 M2 30 27.024 16.222 13.599 376 H2'1 DM2 102 H7 M2 30 26.026 16.081 15.948 377 H2'2 DM2 102 H8 M2 30 27.655 15.402 15.866 378 H3' DM2 102 H9 M2 30 25.207 13.631 15.631 379 HN'1 DM2 102 H16 M2 30 25.621 14.639 17.983 380 HN'2 DM2 102 H17 M2 30 25.301 12.977 17.647 381 H4' DM2 102 H10 M2 30 26.723 11.791 15.873 382 HO4' DM2 102 H20 M2 30 28.544 12.817 16.889 383 H5' DM2 102 H11 M2 30 26.016 12.581 13.647 384 H6'1 DM2 102 H13 M2 30 27.350 10.933 13.066 385 H6'2 DM2 102 H14 M2 30 28.239 12.144 12.165 386 H6'3 DM2 102 H15 M2 30 28.907 11.703 13.750 Start of MODEL 6 1 HO5' THM 1 HO5' T5 1 17.047 29.824 44.039 2 H5'1 THM 1 H5' T5 1 19.166 29.604 44.568 3 H5'2 THM 1 H5'' T5 1 18.970 31.100 43.398 4 H4' THM 1 H4' T5 1 20.955 29.636 43.014 5 H3' THM 1 H3' T5 1 19.196 30.837 41.239 6 H2'1 THM 1 H2' T5 1 18.744 28.858 39.983 7 H2'2 THM 1 H2'' T5 1 20.382 29.149 39.284 8 H1' THM 1 H1' T5 1 21.307 27.786 40.896 9 HN3 THM 1 H3 T5 1 20.582 24.355 38.004 10 HM51 THM 1 H71 T5 1 15.970 24.548 39.815 11 HM52 THM 1 H72 T5 1 16.880 23.210 40.536 12 HM53 THM 1 H73 T5 1 16.551 24.625 41.583 13 H6 THM 1 H6 T5 1 17.963 26.594 41.328 14 H5' DT 2 H5' DT 2 23.865 30.705 40.080 15 H5'' DT 2 H5'' DT 2 24.401 32.287 39.619 16 H4' DT 2 H4' DT 2 25.643 30.697 38.360 17 H3' DT 2 H3' DT 2 24.064 32.854 37.252 18 H2' DT 2 H2' DT 2 22.340 31.533 36.418 19 H2'' DT 2 H2'' DT 2 23.413 31.342 34.992 20 H1' DT 2 H1' DT 2 24.424 29.423 35.802 21 H3 DT 2 H3 DT 2 21.914 25.831 34.570 22 H71 DT 2 H71 DT 2 18.578 29.229 37.253 23 H72 DT 2 H72 DT 2 18.086 27.822 36.414 24 H73 DT 2 H73 DT 2 18.788 27.608 38.002 25 H6 DT 2 H6 DT 2 21.011 29.851 36.940 26 H5' DA 3 H5' DA 3 28.094 31.247 35.580 27 H5'' DA 3 H5'' DA 3 29.083 32.696 35.827 28 H4' DA 3 H4' DA 3 30.191 31.777 34.213 29 H3' DA 3 H3' DA 3 28.862 33.628 32.988 30 H2' DA 3 H2' DA 3 27.138 32.335 31.974 31 H2'' DA 3 H2'' DA 3 28.214 32.034 30.665 32 H1' DA 3 H1' DA 3 28.868 29.892 31.591 33 H8 DA 3 H8 DA 3 25.716 31.226 33.624 34 H61 DA 3 H61 DA 3 22.825 26.226 31.335 35 H62 DA 3 H62 DA 3 22.635 27.768 32.175 36 H2 DA 3 H2 DA 3 26.955 26.044 29.974 37 H5' DG 4 H5' DG 4 31.479 30.357 30.219 38 H5'' DG 4 H5'' DG 4 32.374 31.030 28.987 39 H4' DG 4 H4' DG 4 31.289 29.001 28.297 40 H3' DG 4 H3' DG 4 30.868 31.467 26.738 41 H2' DG 4 H2' DG 4 28.743 31.424 27.424 42 H2'' DG 4 H2'' DG 4 28.672 30.674 25.787 43 H1' DG 4 H1' DG 4 28.828 28.387 26.871 44 H8 DG 4 H8 DG 4 26.977 31.246 28.730 45 H1 DG 4 H1 DG 4 23.488 26.027 27.430 46 H21 DG 4 H21 DG 4 24.723 24.616 26.383 47 H22 DG 4 H22 DG 4 26.527 24.807 26.136 48 H5' DG 5 H5' DG 5 31.705 26.898 23.918 49 H5'' DG 5 H5'' DG 5 33.008 27.564 22.701 50 H4' DG 5 H4' DG 5 30.973 26.455 21.786 51 H3' DG 5 H3' DG 5 31.313 29.380 21.157 52 H2' DG 5 H2' DG 5 29.173 29.603 21.045 53 H2'' DG 5 H2'' DG 5 29.128 28.267 19.748 54 H1' DG 5 H1' DG 5 28.831 26.755 21.547 55 H8 DG 5 H8 DG 5 28.512 29.917 23.624 56 H1 DG 5 H1 DG 5 23.097 26.536 23.627 57 H21 DG 5 H21 DG 5 23.454 24.735 22.718 58 H22 DG 5 H22 DG 5 24.984 24.300 22.000 59 H5' DG 6 H5' DG 6 30.416 26.076 18.446 60 H5'' DG 6 H5'' DG 6 31.206 25.822 16.836 61 H4' DG 6 H4' DG 6 29.050 24.929 16.891 62 H3' DG 6 H3' DG 6 29.453 27.157 15.127 63 H2' DG 6 H2' DG 6 27.781 28.139 15.835 64 H2'' DG 6 H2'' DG 6 26.555 27.101 14.961 65 H1' DG 6 H1' DG 6 26.341 25.530 16.783 66 H8 DG 6 H8 DG 6 27.228 28.960 18.237 67 H1 DG 6 H1 DG 6 21.525 26.841 19.861 68 H21 DG 6 H21 DG 6 21.232 24.744 19.075 69 H22 DG 6 H22 DG 6 22.718 23.871 18.641 70 H5'1 TMP 7 H5' T3 7 25.898 23.673 13.008 71 H5'2 TMP 7 H5'' T3 7 26.560 23.712 11.347 72 H4' TMP 7 H4' T3 7 24.055 23.999 11.234 73 H3' TMP 7 H3' T3 7 25.717 26.101 10.373 74 HO3' TMP 7 HO3' T3 7 24.925 25.688 8.404 75 H2'1 TMP 7 H2' T3 7 24.857 27.738 11.361 76 H2'2 TMP 7 H2'' T3 7 23.502 27.627 10.196 77 H1' TMP 7 H1' T3 7 22.294 26.223 11.585 78 HN3 TMP 7 H3 T3 7 20.349 29.649 13.825 79 H51 TMP 7 H71 T3 7 24.937 30.704 15.109 80 H52 TMP 7 H72 T3 7 24.093 29.884 16.469 81 H53 TMP 7 H73 T3 7 25.418 29.102 15.697 82 H6 TMP 7 H6 T3 7 24.873 27.805 13.819 83 HO5' THM 8 HO5' T5 8 10.714 16.660 32.735 84 H5'1 THM 8 H5' T5 8 9.265 17.681 34.316 85 H5'2 THM 8 H5'' T5 8 9.121 18.578 32.800 86 H4' THM 8 H4' T5 8 9.262 19.698 35.064 87 H3' THM 8 H3' T5 8 10.321 20.574 32.698 88 H2'1 THM 8 H2' T5 8 12.467 19.792 33.117 89 H2'2 THM 8 H2'' T5 8 12.582 21.510 33.648 90 H1' THM 8 H1' T5 8 11.953 20.941 35.943 91 HN3 THM 8 H3 T5 8 15.855 19.625 37.988 92 HM51 THM 8 H71 T5 8 15.682 15.697 35.283 93 HM52 THM 8 H72 T5 8 14.962 16.313 33.796 94 HM53 THM 8 H73 T5 8 16.699 16.822 34.222 95 H6 THM 8 H6 T5 8 13.492 17.984 34.184 96 H5' DT 9 H5' DT 9 9.839 24.396 36.048 97 H5'' DT 9 H5'' DT 9 9.159 25.625 34.814 98 H4' DT 9 H4' DT 9 10.567 26.597 36.549 99 H3' DT 9 H3' DT 9 10.846 27.134 33.890 100 H2' DT 9 H2' DT 9 12.760 26.000 33.326 101 H2'' DT 9 H2'' DT 9 13.532 27.453 33.989 102 H1' DT 9 H1' DT 9 13.808 26.795 36.123 103 H3 DT 9 H3 DT 9 17.712 24.603 36.301 104 H71 DT 9 H71 DT 9 14.575 22.187 32.640 105 H72 DT 9 H72 DT 9 16.264 22.126 32.517 106 H73 DT 9 H73 DT 9 15.530 21.079 33.754 107 H6 DT 9 H6 DT 9 13.594 23.864 33.842 108 H5' DA 10 H5' DA 10 14.280 29.071 36.641 109 H5'' DA 10 H5'' DA 10 13.253 30.513 36.837 110 H4' DA 10 H4' DA 10 15.290 31.270 37.475 111 H3' DA 10 H3' DA 10 13.987 32.476 35.473 112 H2' DA 10 H2' DA 10 15.373 31.564 33.689 113 H2'' DA 10 H2'' DA 10 16.416 32.884 34.025 114 H1' DA 10 H1' DA 10 17.890 31.696 35.256 115 H8 DA 10 H8 DA 10 15.493 29.361 33.338 116 H61 DA 10 H61 DA 10 20.600 26.778 31.107 117 H62 DA 10 H62 DA 10 18.860 26.563 31.203 118 H2 DA 10 H2 DA 10 21.838 29.910 33.745 119 H5' DG 11 H5' DG 11 18.052 34.195 35.863 120 H5'' DG 11 H5'' DG 11 18.200 35.891 35.944 121 H4' DG 11 H4' DG 11 19.829 35.122 34.425 122 H3' DG 11 H3' DG 11 17.515 36.498 33.100 123 H2' DG 11 H2' DG 11 17.716 35.090 31.265 124 H2'' DG 11 H2'' DG 11 19.304 35.735 30.994 125 H1' DG 11 H1' DG 11 20.327 33.970 32.240 126 H8 DG 11 H8 DG 11 16.587 32.946 31.400 127 H1 DG 11 H1 DG 11 21.223 29.228 29.009 128 H21 DG 11 H21 DG 11 23.118 30.424 29.186 129 H22 DG 11 H22 DG 11 23.120 32.030 29.821 130 H5' DG 12 H5' DG 12 21.728 37.395 31.437 131 H5'' DG 12 H5'' DG 12 21.881 39.167 30.861 132 H4' DG 12 H4' DG 12 23.052 37.620 29.465 133 H3' DG 12 H3' DG 12 20.665 38.821 28.115 134 H2' DG 12 H2' DG 12 20.474 36.892 26.912 135 H2'' DG 12 H2'' DG 12 22.204 37.131 26.349 136 H1' DG 12 H1' DG 12 23.075 35.797 28.127 137 H8 DG 12 H8 DG 12 19.519 34.658 28.698 138 H1 DG 12 H1 DG 12 22.833 30.454 25.143 139 H21 DG 12 H21 DG 12 25.061 31.045 25.303 140 H22 DG 12 H22 DG 12 25.520 32.584 25.949 141 H5' DG 13 H5' DG 13 24.758 38.103 26.822 142 H5'' DG 13 H5'' DG 13 25.507 39.424 26.048 143 H4' DG 13 H4' DG 13 26.159 37.113 25.289 144 H3' DG 13 H3' DG 13 25.148 39.000 23.299 145 H2' DG 13 H2' DG 13 23.380 37.418 22.964 146 H2'' DG 13 H2'' DG 13 24.650 36.867 21.718 147 H1' DG 13 H1' DG 13 25.535 35.367 23.500 148 H8 DG 13 H8 DG 13 21.662 36.115 24.325 149 H1 DG 13 H1 DG 13 22.753 30.458 21.441 150 H21 DG 13 H21 DG 13 24.547 30.486 20.528 151 H22 DG 13 H22 DG 13 25.633 31.912 20.561 152 H5'1 TMP 14 H5' T3 14 28.711 37.838 19.725 153 H5'2 TMP 14 H5'' T3 14 28.477 39.435 19.465 154 H4' TMP 14 H4' T3 14 28.296 38.356 17.282 155 H3' TMP 14 H3' T3 14 25.439 38.530 18.234 156 HO3' TMP 14 HO3' T3 14 25.749 40.066 16.241 157 H2'1 TMP 14 H2' T3 14 24.864 37.378 16.431 158 H2'2 TMP 14 H2'' T3 14 26.363 37.744 15.416 159 H1' TMP 14 H1' T3 14 26.991 35.672 16.018 160 HN3 TMP 14 H3 T3 14 24.038 32.395 16.234 161 H51 TMP 14 H71 T3 14 21.657 34.289 20.016 162 H52 TMP 14 H72 T3 14 22.893 35.622 20.457 163 H53 TMP 14 H73 T3 14 21.711 35.903 19.293 164 H6 TMP 14 H6 T3 14 24.611 36.404 18.972 165 HO5' THM 15 HO5' T5 15 24.986 11.710 33.296 166 H5'1 THM 15 H5' T5 15 24.016 9.805 32.393 167 H5'2 THM 15 H5'' T5 15 23.999 10.428 30.788 168 H4' THM 15 H4' T5 15 21.908 10.261 31.823 169 H3' THM 15 H3' T5 15 22.970 12.662 30.336 170 H2'1 THM 15 H2' T5 15 23.018 13.970 31.998 171 H2'2 THM 15 H2'' T5 15 21.311 14.304 31.493 172 H1' THM 15 H1' T5 15 20.548 12.866 33.184 173 HN3 THM 15 H3 T5 15 20.326 15.913 36.361 174 HM51 THM 15 H71 T5 15 25.059 16.086 36.390 175 HM52 THM 15 H72 T5 15 24.950 14.803 37.572 176 HM53 THM 15 H73 T5 15 25.544 14.412 35.877 177 H6 THM 15 H6 T5 15 23.958 13.527 34.412 178 H5' DT 16 H5' DT 16 18.253 13.107 31.156 179 H5'' DT 16 H5'' DT 16 17.744 12.954 29.447 180 H4' DT 16 H4' DT 16 16.157 14.489 30.619 181 H3' DT 16 H3' DT 16 17.263 15.303 28.317 182 H2' DT 16 H2' DT 16 19.134 16.497 29.363 183 H2'' DT 16 H2'' DT 16 17.977 17.783 29.012 184 H1' DT 16 H1' DT 16 16.952 17.587 31.254 185 H3 DT 16 H3 DT 16 19.331 20.123 34.033 186 H71 DT 16 H71 DT 16 22.711 16.610 31.552 187 H72 DT 16 H72 DT 16 23.343 18.119 32.085 188 H73 DT 16 H73 DT 16 22.881 16.918 33.368 189 H6 DT 16 H6 DT 16 20.507 16.501 31.156 190 H5' DA 17 H5' DA 17 13.229 17.122 30.286 191 H5'' DA 17 H5'' DA 17 11.732 16.773 29.190 192 H4' DA 17 H4' DA 17 11.547 18.777 30.545 193 H3' DA 17 H3' DA 17 11.303 18.863 27.769 194 H2' DA 17 H2' DA 17 13.263 19.941 27.274 195 H2'' DA 17 H2'' DA 17 12.297 21.451 27.665 196 H1' DA 17 H1' DA 17 13.100 21.717 29.818 197 H8 DA 17 H8 DA 17 15.718 19.096 28.416 198 H61 DA 17 H61 DA 17 19.791 23.587 30.036 199 H62 DA 17 H62 DA 17 19.721 21.976 29.569 200 H2 DA 17 H2 DA 17 15.616 25.085 30.785 201 H5' DG 18 H5' DG 18 10.073 23.004 29.612 202 H5'' DG 18 H5'' DG 18 8.558 23.463 28.653 203 H4' DG 18 H4' DG 18 9.863 25.426 28.772 204 H3' DG 18 H3' DG 18 9.444 24.177 26.331 205 H2' DG 18 H2' DG 18 11.462 24.369 25.609 206 H2'' DG 18 H2'' DG 18 11.163 26.151 25.499 207 H1' DG 18 H1' DG 18 12.298 26.406 27.619 208 H8 DG 18 H8 DG 18 13.367 22.937 25.988 209 H1 DG 18 H1 DG 18 17.937 27.025 28.098 210 H21 DG 18 H21 DG 18 16.945 28.775 28.861 211 H22 DG 18 H22 DG 18 15.177 28.924 28.602 212 H5' DG 19 H5' DG 19 9.019 28.635 26.098 213 H5'' DG 19 H5'' DG 19 7.721 29.154 25.050 214 H4' DG 19 H4' DG 19 9.685 30.696 24.818 215 H3' DG 19 H3' DG 19 9.729 29.011 22.338 216 H2' DG 19 H2' DG 19 11.867 29.611 22.239 217 H2'' DG 19 H2'' DG 19 11.498 31.366 22.619 218 H1' DG 19 H1' DG 19 11.931 30.949 24.940 219 H8 DG 19 H8 DG 19 12.473 27.541 23.338 220 H1 DG 19 H1 DG 19 17.814 29.767 26.016 221 H21 DG 19 H21 DG 19 17.500 31.782 26.850 222 H22 DG 19 H22 DG 19 16.057 32.680 26.495 223 H5' DG 20 H5' DG 20 9.639 33.510 22.942 224 H5'' DG 20 H5'' DG 20 8.827 34.296 21.597 225 H4' DG 20 H4' DG 20 10.828 35.584 22.555 226 H3' DG 20 H3' DG 20 10.687 35.228 19.892 227 H2' DG 20 H2' DG 20 12.240 33.716 19.792 228 H2'' DG 20 H2'' DG 20 13.337 35.214 19.622 229 H1' DG 20 H1' DG 20 13.731 35.266 22.005 230 H8 DG 20 H8 DG 20 12.793 31.641 20.670 231 H1 DG 20 H1 DG 20 18.452 31.949 23.783 232 H21 DG 20 H21 DG 20 18.647 33.999 24.720 233 H22 DG 20 H22 DG 20 17.497 35.288 24.394 234 H5'1 TMP 21 H5' T3 21 13.742 38.534 21.380 235 H5'2 TMP 21 H5'' T3 21 14.068 39.774 20.253 236 H4' TMP 21 H4' T3 21 16.134 39.068 21.176 237 H3' TMP 21 H3' T3 21 15.751 38.731 18.391 238 HO3' TMP 21 HO3' T3 21 16.752 40.677 19.030 239 H2'1 TMP 21 H2' T3 21 16.978 36.859 17.949 240 H2'2 TMP 21 H2'' T3 21 18.281 37.694 18.662 241 H1' TMP 21 H1' T3 21 17.985 36.785 20.776 242 HN3 TMP 21 H3 T3 21 18.716 32.431 20.666 243 H51 TMP 21 H71 T3 21 14.657 31.585 18.223 244 H52 TMP 21 H72 T3 21 14.263 33.213 18.288 245 H53 TMP 21 H73 T3 21 15.139 32.744 16.855 246 H6 TMP 21 H6 T3 21 15.391 35.174 18.694 247 HO5' THM 22 HO5' T5 22 26.048 25.580 39.789 248 H5'1 THM 22 H5' T5 22 28.025 25.800 40.599 249 H5'2 THM 22 H5'' T5 22 28.687 26.538 39.137 250 H4' THM 22 H4' T5 22 29.578 24.319 39.717 251 H3' THM 22 H3' T5 22 29.346 25.448 37.173 252 H2'1 THM 22 H2' T5 22 27.363 24.442 36.670 253 H2'2 THM 22 H2'' T5 22 28.388 23.195 35.984 254 H1' THM 22 H1' T5 22 28.450 21.905 37.924 255 HN3 THM 22 H3 T5 22 24.812 19.307 37.947 256 HM51 THM 22 H71 T5 22 23.189 24.344 36.853 257 HM52 THM 22 H72 T5 22 22.323 23.081 36.115 258 HM53 THM 22 H73 T5 22 22.052 23.288 37.779 259 H6 THM 22 H6 T5 22 25.342 24.066 37.581 260 H5' DT 23 H5' DT 23 31.029 20.787 36.833 261 H5'' DT 23 H5'' DT 23 32.195 20.813 35.492 262 H4' DT 23 H4' DT 23 30.511 18.879 35.367 263 H3' DT 23 H3' DT 23 31.693 20.278 33.241 264 H2' DT 23 H2' DT 23 29.771 21.435 32.870 265 H2'' DT 23 H2'' DT 23 29.414 20.063 31.695 266 H1' DT 23 H1' DT 23 28.423 18.832 33.668 267 H3 DT 23 H3 DT 23 24.060 19.853 33.009 268 H71 DT 23 H71 DT 23 26.598 24.452 32.698 269 H72 DT 23 H72 DT 23 24.820 24.380 32.976 270 H73 DT 23 H73 DT 23 25.953 24.594 34.313 271 H6 DT 23 H6 DT 23 27.936 22.546 33.638 272 H5' DA 24 H5' DA 24 29.106 16.611 31.658 273 H5'' DA 24 H5'' DA 24 29.632 16.093 30.144 274 H4' DA 24 H4' DA 24 27.250 16.487 30.063 275 H3' DA 24 H3' DA 24 29.083 17.750 28.127 276 H2' DA 24 H2' DA 24 28.057 19.555 28.344 277 H2'' DA 24 H2'' DA 24 26.703 18.845 27.363 278 H1' DA 24 H1' DA 24 25.530 18.282 29.613 279 H8 DA 24 H8 DA 24 27.886 21.418 30.312 280 H61 DA 24 H61 DA 24 22.542 24.441 29.007 281 H62 DA 24 H62 DA 24 24.169 24.698 29.620 282 H2 DA 24 H2 DA 24 21.664 20.339 28.892 283 H5' DG 25 H5' DG 25 24.871 16.422 27.303 284 H5'' DG 25 H5'' DG 25 24.893 15.109 26.010 285 H4' DG 25 H4' DG 25 22.686 16.283 25.817 286 H3' DG 25 H3' DG 25 24.448 16.657 23.636 287 H2' DG 25 H2' DG 25 24.560 18.812 23.976 288 H2'' DG 25 H2'' DG 25 22.948 18.873 23.074 289 H1' DG 25 H1' DG 25 21.829 18.741 25.189 290 H8 DG 25 H8 DG 25 25.097 20.578 25.777 291 H1 DG 25 H1 DG 25 19.853 24.025 26.528 292 H21 DG 25 H21 DG 25 18.207 22.983 26.109 293 H22 DG 25 H22 DG 25 18.337 21.292 25.428 294 H5' DG 26 H5' DG 26 19.889 17.489 21.860 295 H5'' DG 26 H5'' DG 26 19.990 16.983 20.183 296 H4' DG 26 H4' DG 26 18.701 18.977 20.569 297 H3' DG 26 H3' DG 26 21.276 19.472 19.210 298 H2' DG 26 H2' DG 26 21.147 21.495 19.871 299 H2'' DG 26 H2'' DG 26 19.490 21.712 19.360 300 H1' DG 26 H1' DG 26 18.634 20.906 21.515 301 H8 DG 26 H8 DG 26 22.245 21.561 22.026 302 H1 DG 26 H1 DG 26 18.593 26.497 23.967 303 H21 DG 26 H21 DG 26 16.541 25.916 23.841 304 H22 DG 26 H22 DG 26 16.036 24.324 23.240 305 H5' DG 27 H5' DG 27 17.036 20.703 17.802 306 H5'' DG 27 H5'' DG 27 16.823 19.891 16.315 307 H4' DG 27 H4' DG 27 15.094 21.481 16.354 308 H3' DG 27 H3' DG 27 17.087 21.835 14.477 309 H2' DG 27 H2' DG 27 18.147 23.443 15.727 310 H2'' DG 27 H2'' DG 27 17.276 24.689 14.758 311 H1' DG 27 H1' DG 27 15.737 24.960 16.469 312 H8 DG 27 H8 DG 27 19.069 23.080 17.688 313 H1 DG 27 H1 DG 27 17.523 28.466 20.947 314 H21 DG 27 H21 DG 27 15.490 29.442 19.955 315 H22 DG 27 H22 DG 27 14.671 28.506 18.843 316 H5'1 TMP 28 H5' T3 28 13.520 25.248 13.450 317 H5'2 TMP 28 H5'' T3 28 13.806 25.366 11.725 318 H4' TMP 28 H4' T3 28 13.607 27.634 12.658 319 H3' TMP 28 H3' T3 28 15.661 26.592 10.935 320 HO3' TMP 28 HO3' T3 28 14.295 28.307 10.494 321 H2'1 TMP 28 H2' T3 28 17.347 26.836 12.361 322 H2'2 TMP 28 H2'' T3 28 17.434 28.567 11.680 323 H1' TMP 28 H1' T3 28 15.832 29.295 13.201 324 HN3 TMP 28 H3 T3 28 17.671 30.461 17.346 325 H51 TMP 28 H71 T3 28 20.070 25.926 15.730 326 H52 TMP 28 H72 T3 28 21.217 27.242 15.775 327 H53 TMP 28 H73 T3 28 20.286 26.770 17.287 328 H6 TMP 28 H6 T3 28 18.378 26.915 14.217 329 H1 DM2 101 H23 M2 29 26.660 28.624 37.957 330 H2 DM2 101 H26 M2 29 26.532 27.129 36.083 331 H3 DM2 101 H25 M2 29 28.396 26.463 34.743 332 HO8 DM2 101 H21 M2 29 33.426 30.545 36.671 333 H10 DM2 101 H1 M2 29 34.860 32.939 38.787 334 H111 DM2 101 H2 M2 29 35.126 32.735 41.005 335 H112 DM2 101 H3 M2 29 35.114 34.357 40.836 336 HO12 DM2 101 H12 M2 29 32.902 34.848 43.375 337 H141 DM2 101 H18 M2 29 33.252 31.044 41.271 338 H142 DM2 101 H19 M2 29 32.152 30.661 42.491 339 HO14 DM2 101 H24 M2 29 34.451 30.240 43.871 340 H151 DM2 101 H4 M2 29 31.412 34.402 40.671 341 H152 DM2 101 H5 M2 29 30.998 33.380 41.915 342 HO17 DM2 101 H22 M2 29 28.662 31.439 40.690 343 H211 DM2 101 H27 M2 29 30.509 28.336 32.475 344 H212 DM2 101 H28 M2 29 28.985 27.680 33.176 345 H213 DM2 101 H29 M2 29 30.341 26.635 32.871 346 H1' DM2 101 H6 M2 29 33.143 34.272 36.979 347 H2'1 DM2 101 H7 M2 29 32.103 36.537 37.895 348 H2'2 DM2 101 H8 M2 29 32.668 36.325 36.212 349 H3' DM2 101 H9 M2 29 34.131 37.727 38.682 350 HN'1 DM2 101 H16 M2 29 33.052 38.903 36.178 351 HN'2 DM2 101 H17 M2 29 34.114 39.558 37.291 352 H4' DM2 101 H10 M2 29 36.018 38.195 37.143 353 HO4' DM2 101 H20 M2 29 36.197 37.222 35.142 354 H5' DM2 101 H11 M2 29 36.157 36.036 38.547 355 H6'1 DM2 101 H13 M2 29 38.022 36.488 37.477 356 H6'2 DM2 101 H14 M2 29 37.707 34.739 37.386 357 H6'3 DM2 101 H15 M2 29 37.498 35.634 35.945 358 H1 DM2 102 H23 M2 30 19.025 21.532 12.931 359 H2 DM2 102 H26 M2 30 19.527 23.873 13.776 360 H3 DM2 102 H25 M2 30 21.631 24.490 14.318 361 HO8 DM2 102 H21 M2 30 25.784 19.203 13.211 362 H10 DM2 102 H1 M2 30 26.363 15.994 12.652 363 H111 DM2 102 H2 M2 30 25.831 14.893 10.604 364 H112 DM2 102 H3 M2 30 25.393 13.520 11.664 365 HO12 DM2 102 H12 M2 30 24.251 12.458 10.557 366 H141 DM2 102 H18 M2 30 21.190 14.918 9.890 367 H142 DM2 102 H19 M2 30 21.832 14.260 8.369 368 HO14 DM2 102 H24 M2 30 21.907 16.472 7.485 369 H151 DM2 102 H4 M2 30 22.895 13.906 12.926 370 H152 DM2 102 H5 M2 30 21.584 14.511 11.969 371 HO17 DM2 102 H22 M2 30 19.951 17.189 12.670 372 H211 DM2 102 H27 M2 30 24.052 23.316 16.683 373 H212 DM2 102 H28 M2 30 22.632 24.152 15.964 374 H213 DM2 102 H29 M2 30 24.310 24.708 15.730 375 H1' DM2 102 H6 M2 30 26.059 15.888 15.463 376 H2'1 DM2 102 H7 M2 30 25.120 13.729 16.357 377 H2'2 DM2 102 H8 M2 30 26.587 14.290 16.952 378 H3' DM2 102 H9 M2 30 26.064 12.082 14.704 379 HN'1 DM2 102 H16 M2 30 25.392 11.131 16.804 380 HN'2 DM2 102 H17 M2 30 26.744 10.438 16.344 381 H4' DM2 102 H10 M2 30 28.539 11.675 14.842 382 HO4' DM2 102 H20 M2 30 28.620 12.611 17.141 383 H5' DM2 102 H11 M2 30 27.717 13.370 13.261 384 H6'1 DM2 102 H13 M2 30 29.905 13.459 12.719 385 H6'2 DM2 102 H14 M2 30 29.354 15.070 13.025 386 H6'3 DM2 102 H15 M2 30 30.293 14.305 14.192 Start of MODEL 7 1 HO5' THM 1 HO5' T5 1 16.971 29.946 43.799 2 H5'1 THM 1 H5' T5 1 19.090 29.288 44.712 3 H5'2 THM 1 H5'' T5 1 19.174 30.986 44.085 4 H4' THM 1 H4' T5 1 21.161 29.526 43.335 5 H3' THM 1 H3' T5 1 19.429 31.087 41.627 6 H2'1 THM 1 H2' T5 1 18.808 29.279 40.276 7 H2'2 THM 1 H2'' T5 1 20.362 29.576 39.478 8 H1' THM 1 H1' T5 1 21.426 28.099 40.908 9 HN3 THM 1 H3 T5 1 20.289 24.513 38.406 10 HM51 THM 1 H71 T5 1 15.707 25.419 39.874 11 HM52 THM 1 H72 T5 1 16.208 23.985 40.693 12 HM53 THM 1 H73 T5 1 16.065 25.514 41.501 13 H6 THM 1 H6 T5 1 17.875 27.291 41.312 14 H5' DT 2 H5' DT 2 23.851 30.908 39.981 15 H5'' DT 2 H5'' DT 2 24.341 32.492 39.205 16 H4' DT 2 H4' DT 2 25.221 30.704 38.070 17 H3' DT 2 H3' DT 2 23.758 32.678 36.885 18 H2' DT 2 H2' DT 2 22.028 31.247 35.967 19 H2'' DT 2 H2'' DT 2 23.203 30.984 34.767 20 H1' DT 2 H1' DT 2 24.147 29.119 35.809 21 H3 DT 2 H3 DT 2 21.763 25.395 35.163 22 H71 DT 2 H71 DT 2 18.553 28.997 37.649 23 H72 DT 2 H72 DT 2 17.934 28.148 36.255 24 H73 DT 2 H73 DT 2 18.200 27.271 37.684 25 H6 DT 2 H6 DT 2 20.698 29.714 37.031 26 H5' DA 3 H5' DA 3 28.373 31.276 35.770 27 H5'' DA 3 H5'' DA 3 29.225 32.722 35.407 28 H4' DA 3 H4' DA 3 30.124 30.940 33.888 29 H3' DA 3 H3' DA 3 29.007 33.192 32.845 30 H2' DA 3 H2' DA 3 27.185 32.034 31.725 31 H2'' DA 3 H2'' DA 3 28.521 31.446 30.567 32 H1' DA 3 H1' DA 3 28.638 29.407 31.590 33 H8 DA 3 H8 DA 3 25.342 30.985 33.213 34 H61 DA 3 H61 DA 3 22.875 25.667 31.609 35 H62 DA 3 H62 DA 3 22.628 27.131 32.505 36 H2 DA 3 H2 DA 3 26.911 25.638 30.046 37 H5' DG 4 H5' DG 4 31.365 30.040 30.319 38 H5'' DG 4 H5'' DG 4 32.396 30.816 29.002 39 H4' DG 4 H4' DG 4 31.362 28.748 28.238 40 H3' DG 4 H3' DG 4 31.145 31.144 26.886 41 H2' DG 4 H2' DG 4 28.771 31.021 26.796 42 H2'' DG 4 H2'' DG 4 28.995 29.769 25.660 43 H1' DG 4 H1' DG 4 28.885 27.957 27.350 44 H8 DG 4 H8 DG 4 27.066 30.941 28.809 45 H1 DG 4 H1 DG 4 23.371 26.047 27.051 46 H21 DG 4 H21 DG 4 24.545 24.705 25.855 47 H22 DG 4 H22 DG 4 26.317 24.655 26.062 48 H5' DG 5 H5' DG 5 31.923 27.151 24.361 49 H5'' DG 5 H5'' DG 5 33.280 27.426 23.143 50 H4' DG 5 H4' DG 5 31.208 26.517 22.225 51 H3' DG 5 H3' DG 5 31.455 29.249 21.172 52 H2' DG 5 H2' DG 5 29.231 29.304 21.059 53 H2'' DG 5 H2'' DG 5 29.265 27.879 19.979 54 H1' DG 5 H1' DG 5 28.936 26.528 22.222 55 H8 DG 5 H8 DG 5 28.505 30.154 23.376 56 H1 DG 5 H1 DG 5 23.076 26.833 23.525 57 H21 DG 5 H21 DG 5 23.301 24.983 22.457 58 H22 DG 5 H22 DG 5 24.683 24.759 21.461 59 H5' DG 6 H5' DG 6 30.695 25.358 18.374 60 H5'' DG 6 H5'' DG 6 31.204 25.689 16.738 61 H4' DG 6 H4' DG 6 29.148 24.381 16.694 62 H3' DG 6 H3' DG 6 29.126 26.997 15.368 63 H2' DG 6 H2' DG 6 27.367 27.764 16.454 64 H2'' DG 6 H2'' DG 6 26.321 26.544 15.624 65 H1' DG 6 H1' DG 6 26.261 24.998 17.181 66 H8 DG 6 H8 DG 6 27.614 28.101 18.654 67 H1 DG 6 H1 DG 6 21.651 26.987 20.340 68 H21 DG 6 H21 DG 6 21.074 24.962 19.452 69 H22 DG 6 H22 DG 6 22.428 23.830 19.198 70 H5'1 TMP 7 H5' T3 7 26.083 23.845 13.003 71 H5'2 TMP 7 H5'' T3 7 26.659 23.909 11.497 72 H4' TMP 7 H4' T3 7 24.318 23.990 11.331 73 H3' TMP 7 H3' T3 7 25.742 26.020 9.959 74 HO3' TMP 7 HO3' T3 7 23.917 25.663 8.628 75 H2'1 TMP 7 H2' T3 7 24.651 27.701 10.951 76 H2'2 TMP 7 H2'' T3 7 23.212 27.226 10.141 77 H1' TMP 7 H1' T3 7 22.352 25.978 11.746 78 HN3 TMP 7 H3 T3 7 20.512 29.438 13.977 79 H51 TMP 7 H71 T3 7 24.926 30.600 15.334 80 H52 TMP 7 H72 T3 7 24.286 29.685 16.733 81 H53 TMP 7 H73 T3 7 25.498 28.927 15.504 82 H6 TMP 7 H6 T3 7 24.830 27.554 13.891 83 HO5' THM 8 HO5' T5 8 10.587 17.113 32.374 84 H5'1 THM 8 H5' T5 8 9.292 17.936 34.040 85 H5'2 THM 8 H5'' T5 8 9.159 19.057 32.610 86 H4' THM 8 H4' T5 8 9.368 19.956 35.131 87 H3' THM 8 H3' T5 8 10.540 20.841 32.755 88 H2'1 THM 8 H2' T5 8 12.668 20.246 33.210 89 H2'2 THM 8 H2'' T5 8 12.654 21.806 34.040 90 H1' THM 8 H1' T5 8 12.133 20.947 36.194 91 HN3 THM 8 H3 T5 8 16.056 19.757 37.743 92 HM51 THM 8 H71 T5 8 15.587 15.707 35.212 93 HM52 THM 8 H72 T5 8 15.068 16.405 33.657 94 HM53 THM 8 H73 T5 8 16.728 16.513 34.232 95 H6 THM 8 H6 T5 8 13.539 18.081 34.025 96 H5' DT 9 H5' DT 9 9.904 24.164 36.298 97 H5'' DT 9 H5'' DT 9 8.928 25.635 35.609 98 H4' DT 9 H4' DT 9 10.603 26.629 36.793 99 H3' DT 9 H3' DT 9 10.626 26.963 33.901 100 H2' DT 9 H2' DT 9 12.496 26.003 33.531 101 H2'' DT 9 H2'' DT 9 13.106 27.527 33.841 102 H1' DT 9 H1' DT 9 13.661 27.002 35.991 103 H3 DT 9 H3 DT 9 17.258 24.478 36.801 104 H71 DT 9 H71 DT 9 14.609 22.204 32.666 105 H72 DT 9 H72 DT 9 16.451 21.947 32.920 106 H73 DT 9 H73 DT 9 15.258 21.279 34.052 107 H6 DT 9 H6 DT 9 13.575 24.078 33.708 108 H5' DA 10 H5' DA 10 14.084 29.048 37.137 109 H5'' DA 10 H5'' DA 10 12.950 30.401 37.372 110 H4' DA 10 H4' DA 10 15.020 31.279 37.695 111 H3' DA 10 H3' DA 10 13.625 32.582 35.590 112 H2' DA 10 H2' DA 10 14.736 31.207 33.881 113 H2'' DA 10 H2'' DA 10 15.718 32.683 33.942 114 H1' DA 10 H1' DA 10 17.418 31.575 35.106 115 H8 DA 10 H8 DA 10 15.001 28.566 34.011 116 H61 DA 10 H61 DA 10 20.324 26.740 31.181 117 H62 DA 10 H62 DA 10 18.696 26.331 31.310 118 H2 DA 10 H2 DA 10 21.275 30.311 33.468 119 H5' DG 11 H5' DG 11 18.004 34.346 35.970 120 H5'' DG 11 H5'' DG 11 17.924 36.154 35.763 121 H4' DG 11 H4' DG 11 19.577 35.325 34.498 122 H3' DG 11 H3' DG 11 17.502 36.551 32.906 123 H2' DG 11 H2' DG 11 17.711 35.081 31.260 124 H2'' DG 11 H2'' DG 11 19.358 35.572 30.952 125 H1' DG 11 H1' DG 11 20.348 33.977 32.153 126 H8 DG 11 H8 DG 11 16.709 32.737 31.720 127 H1 DG 11 H1 DG 11 21.559 29.330 29.108 128 H21 DG 11 H21 DG 11 23.254 30.763 29.086 129 H22 DG 11 H22 DG 11 23.164 32.193 30.060 130 H5' DG 12 H5' DG 12 21.797 36.939 31.337 131 H5'' DG 12 H5'' DG 12 22.432 38.701 31.050 132 H4' DG 12 H4' DG 12 23.084 37.545 29.189 133 H3' DG 12 H3' DG 12 20.587 38.932 28.516 134 H2' DG 12 H2' DG 12 20.201 37.324 27.119 135 H2'' DG 12 H2'' DG 12 21.693 37.513 26.175 136 H1' DG 12 H1' DG 12 22.938 36.032 27.853 137 H8 DG 12 H8 DG 12 19.379 35.200 28.379 138 H1 DG 12 H1 DG 12 22.814 30.569 25.497 139 H21 DG 12 H21 DG 12 24.770 31.348 25.171 140 H22 DG 12 H22 DG 12 25.177 32.888 25.985 141 H5' DG 13 H5' DG 13 24.598 38.367 26.636 142 H5'' DG 13 H5'' DG 13 25.179 39.638 25.704 143 H4' DG 13 H4' DG 13 26.148 37.438 25.002 144 H3' DG 13 H3' DG 13 24.706 39.138 22.933 145 H2' DG 13 H2' DG 13 23.431 37.575 22.563 146 H2'' DG 13 H2'' DG 13 24.708 36.785 21.527 147 H1' DG 13 H1' DG 13 25.374 35.451 23.305 148 H8 DG 13 H8 DG 13 21.807 36.283 24.290 149 H1 DG 13 H1 DG 13 22.230 30.837 20.905 150 H21 DG 13 H21 DG 13 24.292 30.400 20.603 151 H22 DG 13 H22 DG 13 25.544 31.684 20.604 152 H5'1 TMP 14 H5' T3 14 29.045 37.958 19.839 153 H5'2 TMP 14 H5'' T3 14 28.485 39.563 19.269 154 H4' TMP 14 H4' T3 14 28.742 38.007 17.270 155 H3' TMP 14 H3' T3 14 25.748 38.262 18.146 156 HO3' TMP 14 HO3' T3 14 25.873 40.137 17.257 157 H2'1 TMP 14 H2' T3 14 25.016 37.417 16.233 158 H2'2 TMP 14 H2'' T3 14 26.845 37.549 15.447 159 H1' TMP 14 H1' T3 14 27.216 35.636 16.256 160 HN3 TMP 14 H3 T3 14 24.123 32.514 16.440 161 H51 TMP 14 H71 T3 14 22.101 34.928 20.287 162 H52 TMP 14 H72 T3 14 22.540 36.602 19.922 163 H53 TMP 14 H73 T3 14 21.281 35.852 18.902 164 H6 TMP 14 H6 T3 14 24.633 36.725 18.951 165 HO5' THM 15 HO5' T5 15 24.509 11.598 32.963 166 H5'1 THM 15 H5' T5 15 23.542 9.671 32.388 167 H5'2 THM 15 H5'' T5 15 23.329 10.176 30.709 168 H4' THM 15 H4' T5 15 21.367 10.477 32.163 169 H3' THM 15 H3' T5 15 22.699 12.427 30.382 170 H2'1 THM 15 H2' T5 15 22.563 14.194 31.726 171 H2'2 THM 15 H2'' T5 15 20.782 14.190 31.641 172 H1' THM 15 H1' T5 15 20.340 12.928 33.425 173 HN3 THM 15 H3 T5 15 20.437 16.369 36.287 174 HM51 THM 15 H71 T5 15 25.336 16.069 35.875 175 HM52 THM 15 H72 T5 15 25.017 14.946 37.397 176 HM53 THM 15 H73 T5 15 25.483 14.362 35.811 177 H6 THM 15 H6 T5 15 23.910 13.482 34.335 178 H5' DT 16 H5' DT 16 18.252 13.365 31.040 179 H5'' DT 16 H5'' DT 16 17.344 13.072 29.641 180 H4' DT 16 H4' DT 16 16.225 14.824 30.803 181 H3' DT 16 H3' DT 16 17.439 15.430 28.279 182 H2' DT 16 H2' DT 16 19.064 16.695 29.271 183 H2'' DT 16 H2'' DT 16 17.852 18.007 29.164 184 H1' DT 16 H1' DT 16 17.014 17.724 31.292 185 H3 DT 16 H3 DT 16 19.476 20.028 34.214 186 H71 DT 16 H71 DT 16 22.651 16.503 31.669 187 H72 DT 16 H72 DT 16 23.389 18.123 31.804 188 H73 DT 16 H73 DT 16 23.186 17.174 33.238 189 H6 DT 16 H6 DT 16 20.428 16.797 30.814 190 H5' DA 17 H5' DA 17 13.416 16.839 30.286 191 H5'' DA 17 H5'' DA 17 11.906 16.554 29.385 192 H4' DA 17 H4' DA 17 11.649 18.439 30.377 193 H3' DA 17 H3' DA 17 11.472 18.457 27.547 194 H2' DA 17 H2' DA 17 13.516 19.790 27.279 195 H2'' DA 17 H2'' DA 17 12.366 21.100 27.412 196 H1' DA 17 H1' DA 17 13.033 21.450 29.771 197 H8 DA 17 H8 DA 17 15.724 18.938 28.521 198 H61 DA 17 H61 DA 17 19.622 23.761 29.446 199 H62 DA 17 H62 DA 17 19.687 22.058 28.913 200 H2 DA 17 H2 DA 17 15.695 25.141 30.331 201 H5' DG 18 H5' DG 18 10.664 22.421 28.791 202 H5'' DG 18 H5'' DG 18 9.016 23.147 28.379 203 H4' DG 18 H4' DG 18 10.220 24.982 28.341 204 H3' DG 18 H3' DG 18 9.604 24.030 25.662 205 H2' DG 18 H2' DG 18 11.701 24.330 25.082 206 H2'' DG 18 H2'' DG 18 11.534 26.084 24.944 207 H1' DG 18 H1' DG 18 12.263 26.241 27.315 208 H8 DG 18 H8 DG 18 13.860 23.175 25.649 209 H1 DG 18 H1 DG 18 17.883 27.734 27.988 210 H21 DG 18 H21 DG 18 16.515 29.289 29.284 211 H22 DG 18 H22 DG 18 14.762 29.007 29.130 212 H5' DG 19 H5' DG 19 9.564 28.587 26.130 213 H5'' DG 19 H5'' DG 19 8.217 29.407 25.294 214 H4' DG 19 H4' DG 19 10.150 30.564 24.818 215 H3' DG 19 H3' DG 19 9.622 28.781 22.519 216 H2' DG 19 H2' DG 19 11.872 29.044 21.938 217 H2'' DG 19 H2'' DG 19 11.745 30.856 22.179 218 H1' DG 19 H1' DG 19 12.400 30.667 24.460 219 H8 DG 19 H8 DG 19 12.811 27.110 23.101 220 H1 DG 19 H1 DG 19 18.153 29.633 25.847 221 H21 DG 19 H21 DG 19 17.528 31.276 26.917 222 H22 DG 19 H22 DG 19 15.962 32.116 26.798 223 H5' DG 20 H5' DG 20 10.086 33.523 23.236 224 H5'' DG 20 H5'' DG 20 8.947 34.196 21.960 225 H4' DG 20 H4' DG 20 10.606 35.798 22.717 226 H3' DG 20 H3' DG 20 10.388 35.349 20.121 227 H2' DG 20 H2' DG 20 12.263 34.096 19.967 228 H2'' DG 20 H2'' DG 20 13.298 35.452 19.789 229 H1' DG 20 H1' DG 20 13.943 35.510 22.070 230 H8 DG 20 H8 DG 20 12.692 32.211 20.759 231 H1 DG 20 H1 DG 20 18.576 31.897 23.288 232 H21 DG 20 H21 DG 20 19.062 34.034 23.971 233 H22 DG 20 H22 DG 20 17.777 35.236 23.948 234 H5'1 TMP 21 H5' T3 21 13.535 38.229 21.358 235 H5'2 TMP 21 H5'' T3 21 13.869 39.604 20.343 236 H4' TMP 21 H4' T3 21 15.769 38.592 21.429 237 H3' TMP 21 H3' T3 21 15.573 38.858 18.430 238 HO3' TMP 21 HO3' T3 21 17.262 40.413 18.822 239 H2'1 TMP 21 H2' T3 21 17.146 37.153 18.143 240 H2'2 TMP 21 H2'' T3 21 18.358 38.047 19.280 241 H1' TMP 21 H1' T3 21 17.552 36.841 21.044 242 HN3 TMP 21 H3 T3 21 18.966 32.570 20.515 243 H51 TMP 21 H71 T3 21 15.237 31.585 18.108 244 H52 TMP 21 H72 T3 21 14.258 33.156 18.173 245 H53 TMP 21 H73 T3 21 15.349 32.865 16.823 246 H6 TMP 21 H6 T3 21 15.325 35.079 18.720 247 HO5' THM 22 HO5' T5 22 26.652 26.632 38.912 248 H5'1 THM 22 H5' T5 22 28.424 26.187 39.809 249 H5'2 THM 22 H5'' T5 22 28.863 26.669 38.216 250 H4' THM 22 H4' T5 22 30.116 24.644 39.144 251 H3' THM 22 H3' T5 22 29.700 25.337 36.487 252 H2'1 THM 22 H2' T5 22 27.536 24.213 36.227 253 H2'2 THM 22 H2'' T5 22 28.542 22.796 35.798 254 H1' THM 22 H1' T5 22 28.674 21.802 37.818 255 HN3 THM 22 H3 T5 22 24.979 19.434 38.543 256 HM51 THM 22 H71 T5 22 23.512 24.611 37.033 257 HM52 THM 22 H72 T5 22 22.749 23.175 36.469 258 HM53 THM 22 H73 T5 22 22.443 23.854 38.174 259 H6 THM 22 H6 T5 22 25.732 24.110 37.604 260 H5' DT 23 H5' DT 23 30.882 20.748 36.588 261 H5'' DT 23 H5'' DT 23 32.280 20.540 35.483 262 H4' DT 23 H4' DT 23 30.513 18.664 35.219 263 H3' DT 23 H3' DT 23 31.774 20.386 33.234 264 H2' DT 23 H2' DT 23 29.671 21.587 32.676 265 H2'' DT 23 H2'' DT 23 29.292 20.068 31.728 266 H1' DT 23 H1' DT 23 28.266 18.916 33.342 267 H3 DT 23 H3 DT 23 24.037 19.885 32.927 268 H71 DT 23 H71 DT 23 24.958 24.267 34.451 269 H72 DT 23 H72 DT 23 26.513 24.556 33.753 270 H73 DT 23 H73 DT 23 25.117 24.518 32.657 271 H6 DT 23 H6 DT 23 27.874 22.670 33.611 272 H5' DA 24 H5' DA 24 29.249 16.661 31.477 273 H5'' DA 24 H5'' DA 24 29.611 16.172 29.853 274 H4' DA 24 H4' DA 24 27.139 16.475 30.025 275 H3' DA 24 H3' DA 24 28.979 17.814 28.155 276 H2' DA 24 H2' DA 24 27.630 19.655 27.852 277 H2'' DA 24 H2'' DA 24 26.311 18.713 27.348 278 H1' DA 24 H1' DA 24 25.353 18.380 29.431 279 H8 DA 24 H8 DA 24 27.709 21.572 29.750 280 H61 DA 24 H61 DA 24 22.025 24.265 29.639 281 H62 DA 24 H62 DA 24 23.638 24.839 30.019 282 H2 DA 24 H2 DA 24 21.506 20.239 28.938 283 H5' DG 25 H5' DG 25 24.946 16.240 27.032 284 H5'' DG 25 H5'' DG 25 24.925 15.297 25.627 285 H4' DG 25 H4' DG 25 22.939 16.360 25.499 286 H3' DG 25 H3' DG 25 24.966 16.970 23.416 287 H2' DG 25 H2' DG 25 24.752 19.140 23.874 288 H2'' DG 25 H2'' DG 25 23.333 19.147 22.780 289 H1' DG 25 H1' DG 25 21.928 18.729 24.894 290 H8 DG 25 H8 DG 25 25.323 20.658 25.891 291 H1 DG 25 H1 DG 25 19.872 24.249 26.157 292 H21 DG 25 H21 DG 25 18.125 23.014 26.065 293 H22 DG 25 H22 DG 25 18.112 21.387 25.464 294 H5' DG 26 H5' DG 26 20.266 17.388 22.163 295 H5'' DG 26 H5'' DG 26 19.972 16.671 20.709 296 H4' DG 26 H4' DG 26 18.854 18.753 21.012 297 H3' DG 26 H3' DG 26 21.031 19.379 19.072 298 H2' DG 26 H2' DG 26 20.802 21.522 19.665 299 H2'' DG 26 H2'' DG 26 19.019 21.472 19.626 300 H1' DG 26 H1' DG 26 18.822 20.805 21.938 301 H8 DG 26 H8 DG 26 22.443 21.344 22.097 302 H1 DG 26 H1 DG 26 18.900 26.451 23.583 303 H21 DG 26 H21 DG 26 16.921 26.076 23.239 304 H22 DG 26 H22 DG 26 16.416 24.450 22.703 305 H5' DG 27 H5' DG 27 16.594 20.449 17.556 306 H5'' DG 27 H5'' DG 27 16.950 20.205 15.973 307 H4' DG 27 H4' DG 27 15.015 21.715 16.092 308 H3' DG 27 H3' DG 27 17.248 22.239 14.592 309 H2' DG 27 H2' DG 27 18.089 23.746 15.915 310 H2'' DG 27 H2'' DG 27 16.940 24.929 15.086 311 H1' DG 27 H1' DG 27 15.455 24.847 16.775 312 H8 DG 27 H8 DG 27 18.674 23.203 18.264 313 H1 DG 27 H1 DG 27 17.702 29.158 20.603 314 H21 DG 27 H21 DG 27 15.501 29.658 20.195 315 H22 DG 27 H22 DG 27 14.520 28.737 19.021 316 H5'1 TMP 28 H5' T3 28 13.655 25.341 13.297 317 H5'2 TMP 28 H5'' T3 28 13.772 25.408 11.639 318 H4' TMP 28 H4' T3 28 13.931 27.593 12.565 319 H3' TMP 28 H3' T3 28 15.890 26.735 10.781 320 HO3' TMP 28 HO3' T3 28 14.640 28.763 10.356 321 H2'1 TMP 28 H2' T3 28 17.460 26.617 12.287 322 H2'2 TMP 28 H2'' T3 28 17.659 28.464 11.851 323 H1' TMP 28 H1' T3 28 15.957 29.002 13.560 324 HN3 TMP 28 H3 T3 28 18.060 29.899 17.574 325 H51 TMP 28 H71 T3 28 20.177 25.293 15.675 326 H52 TMP 28 H72 T3 28 21.321 26.690 15.512 327 H53 TMP 28 H73 T3 28 20.888 26.208 17.047 328 H6 TMP 28 H6 T3 28 18.698 26.609 14.027 329 H1 DM2 101 H23 M2 29 26.845 28.860 37.600 330 H2 DM2 101 H26 M2 29 26.650 27.207 35.663 331 H3 DM2 101 H25 M2 29 28.612 26.595 34.506 332 HO8 DM2 101 H21 M2 29 33.323 31.172 36.027 333 H10 DM2 101 H1 M2 29 34.490 33.149 38.534 334 H111 DM2 101 H2 M2 29 34.900 32.695 40.739 335 H112 DM2 101 H3 M2 29 34.808 34.514 40.662 336 HO12 DM2 101 H12 M2 29 33.984 34.458 43.018 337 H141 DM2 101 H18 M2 29 33.178 30.714 40.971 338 H142 DM2 101 H19 M2 29 31.611 30.920 41.823 339 HO14 DM2 101 H24 M2 29 33.797 30.067 43.367 340 H151 DM2 101 H4 M2 29 31.456 34.863 40.753 341 H152 DM2 101 H5 M2 29 30.884 33.680 41.823 342 HO17 DM2 101 H22 M2 29 28.619 31.385 40.496 343 H211 DM2 101 H27 M2 29 30.933 28.474 32.426 344 H212 DM2 101 H28 M2 29 29.354 27.733 33.036 345 H213 DM2 101 H29 M2 29 30.802 26.722 32.780 346 H1' DM2 101 H6 M2 29 32.639 34.389 36.936 347 H2'1 DM2 101 H7 M2 29 31.974 36.608 37.489 348 H2'2 DM2 101 H8 M2 29 32.913 36.762 36.038 349 H3' DM2 101 H9 M2 29 33.886 37.242 38.771 350 HN'1 DM2 101 H16 M2 29 33.578 38.741 36.233 351 HN'2 DM2 101 H17 M2 29 34.153 39.630 37.427 352 H4' DM2 101 H10 M2 29 36.013 37.498 38.123 353 HO4' DM2 101 H20 M2 29 36.653 37.959 35.689 354 H5' DM2 101 H11 M2 29 35.769 35.346 38.376 355 H6'1 DM2 101 H13 M2 29 37.889 36.037 36.937 356 H6'2 DM2 101 H14 M2 29 37.454 34.297 36.836 357 H6'3 DM2 101 H15 M2 29 37.078 35.415 35.621 358 H1 DM2 102 H23 M2 30 18.781 21.345 13.628 359 H2 DM2 102 H26 M2 30 19.321 23.824 14.031 360 H3 DM2 102 H25 M2 30 21.578 24.580 13.986 361 HO8 DM2 102 H21 M2 30 25.581 18.873 14.715 362 H10 DM2 102 H1 M2 30 26.149 16.047 13.007 363 H111 DM2 102 H2 M2 30 25.587 15.627 10.767 364 H112 DM2 102 H3 M2 30 25.748 14.178 11.478 365 HO12 DM2 102 H12 M2 30 24.478 12.684 11.191 366 H141 DM2 102 H18 M2 30 22.057 13.784 9.093 367 H142 DM2 102 H19 M2 30 22.850 14.620 7.824 368 HO14 DM2 102 H24 M2 30 21.234 16.283 7.931 369 H151 DM2 102 H4 M2 30 23.002 14.115 12.912 370 H152 DM2 102 H5 M2 30 21.625 14.556 11.864 371 HO17 DM2 102 H22 M2 30 19.691 17.290 12.444 372 H211 DM2 102 H27 M2 30 23.463 23.451 16.724 373 H212 DM2 102 H28 M2 30 22.575 24.570 15.721 374 H213 DM2 102 H29 M2 30 24.322 24.765 15.914 375 H1' DM2 102 H6 M2 30 25.324 15.788 15.846 376 H2'1 DM2 102 H7 M2 30 25.015 13.560 16.381 377 H2'2 DM2 102 H8 M2 30 26.549 13.976 17.125 378 H3' DM2 102 H9 M2 30 26.158 12.498 14.422 379 HN'1 DM2 102 H16 M2 30 25.710 10.981 16.167 380 HN'2 DM2 102 H17 M2 30 27.238 10.632 15.589 381 H4' DM2 102 H10 M2 30 28.532 12.473 14.107 382 HO4' DM2 102 H20 M2 30 29.971 13.070 15.828 383 H5' DM2 102 H11 M2 30 27.523 14.369 13.351 384 H6'1 DM2 102 H13 M2 30 29.897 14.891 13.017 385 H6'2 DM2 102 H14 M2 30 29.197 16.267 13.624 386 H6'3 DM2 102 H15 M2 30 29.974 15.292 14.801 Start of MODEL 8 1 HO5' THM 1 HO5' T5 1 18.382 26.918 43.669 2 H5'1 THM 1 H5' T5 1 20.102 27.901 45.447 3 H5'2 THM 1 H5'' T5 1 19.683 29.352 44.328 4 H4' THM 1 H4' T5 1 21.730 27.779 43.666 5 H3' THM 1 H3' T5 1 19.666 29.259 41.948 6 H2'1 THM 1 H2' T5 1 19.126 27.595 40.758 7 H2'2 THM 1 H2'' T5 1 20.621 27.624 39.909 8 H1' THM 1 H1' T5 1 21.616 26.086 41.428 9 HN3 THM 1 H3 T5 1 20.652 22.290 39.546 10 HM51 THM 1 H71 T5 1 15.817 24.759 40.635 11 HM52 THM 1 H72 T5 1 16.226 24.378 38.975 12 HM53 THM 1 H73 T5 1 15.914 23.101 40.266 13 H6 THM 1 H6 T5 1 17.971 25.790 41.352 14 H5' DT 2 H5' DT 2 24.425 30.138 41.577 15 H5'' DT 2 H5'' DT 2 25.029 31.701 41.230 16 H4' DT 2 H4' DT 2 26.069 30.183 39.629 17 H3' DT 2 H3' DT 2 24.411 32.219 38.482 18 H2' DT 2 H2' DT 2 22.844 31.033 37.613 19 H2'' DT 2 H2'' DT 2 23.792 30.823 36.323 20 H1' DT 2 H1' DT 2 24.919 28.785 37.020 21 H3 DT 2 H3 DT 2 22.183 25.848 35.197 22 H71 DT 2 H71 DT 2 19.200 29.278 38.479 23 H72 DT 2 H72 DT 2 18.684 28.886 36.806 24 H73 DT 2 H73 DT 2 18.495 27.582 37.981 25 H6 DT 2 H6 DT 2 21.598 29.515 38.393 26 H5' DA 3 H5' DA 3 28.319 30.990 36.447 27 H5'' DA 3 H5'' DA 3 29.072 32.556 36.285 28 H4' DA 3 H4' DA 3 30.206 30.965 34.804 29 H3' DA 3 H3' DA 3 29.183 33.238 33.320 30 H2' DA 3 H2' DA 3 27.035 32.155 32.970 31 H2'' DA 3 H2'' DA 3 27.918 31.700 31.459 32 H1' DA 3 H1' DA 3 28.379 29.646 32.030 33 H8 DA 3 H8 DA 3 25.419 30.652 34.462 34 H61 DA 3 H61 DA 3 22.415 26.619 30.788 35 H62 DA 3 H62 DA 3 22.137 27.882 31.990 36 H2 DA 3 H2 DA 3 26.548 26.152 29.948 37 H5' DG 4 H5' DG 4 30.785 29.416 30.904 38 H5'' DG 4 H5'' DG 4 31.944 30.133 29.742 39 H4' DG 4 H4' DG 4 30.890 28.065 28.744 40 H3' DG 4 H3' DG 4 31.217 30.568 27.502 41 H2' DG 4 H2' DG 4 29.106 31.174 27.698 42 H2'' DG 4 H2'' DG 4 28.978 30.507 26.161 43 H1' DG 4 H1' DG 4 28.427 28.299 26.881 44 H8 DG 4 H8 DG 4 26.898 31.483 28.702 45 H1 DG 4 H1 DG 4 22.756 26.541 27.457 46 H21 DG 4 H21 DG 4 23.872 25.021 26.772 47 H22 DG 4 H22 DG 4 25.653 25.066 26.361 48 H5' DG 5 H5' DG 5 31.910 26.355 24.944 49 H5'' DG 5 H5'' DG 5 33.168 26.238 23.682 50 H4' DG 5 H4' DG 5 31.089 25.419 22.875 51 H3' DG 5 H3' DG 5 31.598 28.241 21.872 52 H2' DG 5 H2' DG 5 29.384 28.325 21.489 53 H2'' DG 5 H2'' DG 5 29.294 26.683 20.704 54 H1' DG 5 H1' DG 5 28.905 25.583 22.710 55 H8 DG 5 H8 DG 5 28.906 29.154 23.942 56 H1 DG 5 H1 DG 5 22.950 26.645 23.868 57 H21 DG 5 H21 DG 5 23.331 24.441 23.077 58 H22 DG 5 H22 DG 5 24.856 24.034 22.308 59 H5' DG 6 H5' DG 6 30.702 24.564 18.980 60 H5'' DG 6 H5'' DG 6 31.145 25.073 17.316 61 H4' DG 6 H4' DG 6 28.955 23.945 17.653 62 H3' DG 6 H3' DG 6 29.408 26.516 16.058 63 H2' DG 6 H2' DG 6 27.569 27.277 17.118 64 H2'' DG 6 H2'' DG 6 26.425 26.205 16.322 65 H1' DG 6 H1' DG 6 26.436 24.768 17.955 66 H8 DG 6 H8 DG 6 27.621 28.061 19.215 67 H1 DG 6 H1 DG 6 21.472 26.802 20.467 68 H21 DG 6 H21 DG 6 21.076 24.824 19.771 69 H22 DG 6 H22 DG 6 22.343 23.688 19.479 70 H5'1 TMP 7 H5' T3 7 25.797 23.689 14.063 71 H5'2 TMP 7 H5'' T3 7 26.527 23.718 12.457 72 H4' TMP 7 H4' T3 7 24.019 23.914 12.159 73 H3' TMP 7 H3' T3 7 25.798 26.085 11.259 74 HO3' TMP 7 HO3' T3 7 25.066 25.066 9.439 75 H2'1 TMP 7 H2' T3 7 24.259 27.910 11.947 76 H2'2 TMP 7 H2'' T3 7 23.171 27.122 10.712 77 H1' TMP 7 H1' T3 7 22.179 25.858 12.519 78 HN3 TMP 7 H3 T3 7 20.257 29.740 14.134 79 H51 TMP 7 H71 T3 7 24.719 30.690 15.811 80 H52 TMP 7 H72 T3 7 23.890 29.806 17.181 81 H53 TMP 7 H73 T3 7 25.243 29.115 16.333 82 H6 TMP 7 H6 T3 7 24.594 27.455 14.743 83 HO5' THM 8 HO5' T5 8 10.707 16.797 32.860 84 H5'1 THM 8 H5' T5 8 9.639 17.676 34.322 85 H5'2 THM 8 H5'' T5 8 9.341 18.663 32.885 86 H4' THM 8 H4' T5 8 9.619 19.891 34.955 87 H3' THM 8 H3' T5 8 10.730 20.718 32.532 88 H2'1 THM 8 H2' T5 8 13.055 19.836 33.182 89 H2'2 THM 8 H2'' T5 8 13.091 21.546 33.740 90 H1' THM 8 H1' T5 8 12.387 20.933 35.823 91 HN3 THM 8 H3 T5 8 16.129 19.137 37.931 92 HM51 THM 8 H71 T5 8 15.445 15.372 35.111 93 HM52 THM 8 H72 T5 8 14.974 16.072 33.705 94 HM53 THM 8 H73 T5 8 16.729 16.188 34.228 95 H6 THM 8 H6 T5 8 13.862 18.160 33.931 96 H5' DT 9 H5' DT 9 11.166 24.231 36.125 97 H5'' DT 9 H5'' DT 9 10.052 25.307 35.267 98 H4' DT 9 H4' DT 9 11.896 26.809 36.229 99 H3' DT 9 H3' DT 9 11.642 26.803 33.388 100 H2' DT 9 H2' DT 9 13.265 25.317 33.001 101 H2'' DT 9 H2'' DT 9 14.320 26.787 32.861 102 H1' DT 9 H1' DT 9 14.813 26.842 35.233 103 H3 DT 9 H3 DT 9 18.558 24.519 35.951 104 H71 DT 9 H71 DT 9 15.312 21.379 33.068 105 H72 DT 9 H72 DT 9 16.957 21.588 32.655 106 H73 DT 9 H73 DT 9 16.540 20.778 34.258 107 H6 DT 9 H6 DT 9 14.440 23.354 33.711 108 H5' DA 10 H5' DA 10 13.445 30.059 36.534 109 H5'' DA 10 H5'' DA 10 12.497 31.582 36.528 110 H4' DA 10 H4' DA 10 14.514 32.056 37.180 111 H3' DA 10 H3' DA 10 13.744 33.123 34.744 112 H2' DA 10 H2' DA 10 15.015 32.063 33.379 113 H2'' DA 10 H2'' DA 10 16.303 33.241 33.761 114 H1' DA 10 H1' DA 10 17.414 31.868 35.207 115 H8 DA 10 H8 DA 10 15.012 29.546 33.071 116 H61 DA 10 H61 DA 10 20.383 26.644 31.567 117 H62 DA 10 H62 DA 10 18.623 26.551 31.379 118 H2 DA 10 H2 DA 10 21.375 30.054 34.030 119 H5' DG 11 H5' DG 11 18.098 35.282 35.432 120 H5'' DG 11 H5'' DG 11 17.983 36.943 35.046 121 H4' DG 11 H4' DG 11 19.670 36.128 33.822 122 H3' DG 11 H3' DG 11 17.464 37.242 32.364 123 H2' DG 11 H2' DG 11 17.114 35.437 31.253 124 H2'' DG 11 H2'' DG 11 18.569 36.000 30.263 125 H1' DG 11 H1' DG 11 20.017 34.698 31.570 126 H8 DG 11 H8 DG 11 16.500 33.513 31.101 127 H1 DG 11 H1 DG 11 21.200 29.346 29.456 128 H21 DG 11 H21 DG 11 23.103 30.341 29.723 129 H22 DG 11 H22 DG 11 23.205 31.544 31.022 130 H5' DG 12 H5' DG 12 21.689 37.426 30.759 131 H5'' DG 12 H5'' DG 12 22.066 39.158 30.369 132 H4' DG 12 H4' DG 12 23.305 37.314 29.038 133 H3' DG 12 H3' DG 12 20.936 38.715 27.540 134 H2' DG 12 H2' DG 12 20.665 36.786 26.609 135 H2'' DG 12 H2'' DG 12 22.097 36.958 25.751 136 H1' DG 12 H1' DG 12 23.039 35.602 27.655 137 H8 DG 12 H8 DG 12 19.302 35.032 28.326 138 H1 DG 12 H1 DG 12 22.576 30.132 25.754 139 H21 DG 12 H21 DG 12 24.525 30.772 25.146 140 H22 DG 12 H22 DG 12 25.125 32.326 25.753 141 H5' DG 13 H5' DG 13 25.476 39.266 25.014 142 H5'' DG 13 H5'' DG 13 25.213 40.678 24.078 143 H4' DG 13 H4' DG 13 26.094 38.748 22.433 144 H3' DG 13 H3' DG 13 23.221 39.545 22.119 145 H2' DG 13 H2' DG 13 22.809 37.846 21.261 146 H2'' DG 13 H2'' DG 13 24.213 37.656 20.234 147 H1' DG 13 H1' DG 13 25.341 36.245 21.680 148 H8 DG 13 H8 DG 13 22.081 36.865 23.409 149 H1 DG 13 H1 DG 13 23.028 30.713 21.728 150 H21 DG 13 H21 DG 13 25.075 30.531 21.245 151 H22 DG 13 H22 DG 13 26.081 31.866 20.923 152 H5'1 TMP 14 H5' T3 14 26.744 39.843 18.350 153 H5'2 TMP 14 H5'' T3 14 25.787 40.751 17.056 154 H4' TMP 14 H4' T3 14 27.341 39.064 16.203 155 H3' TMP 14 H3' T3 14 24.353 38.644 16.011 156 HO3' TMP 14 HO3' T3 14 24.972 39.948 14.139 157 H2'1 TMP 14 H2' T3 14 24.518 36.609 14.900 158 H2'2 TMP 14 H2'' T3 14 26.229 36.880 14.203 159 H1' TMP 14 H1' T3 14 27.210 35.832 16.152 160 HN3 TMP 14 H3 T3 14 24.934 32.239 17.571 161 H51 TMP 14 H71 T3 14 21.735 35.863 19.454 162 H52 TMP 14 H72 T3 14 21.316 36.435 17.844 163 H53 TMP 14 H73 T3 14 20.993 34.778 18.235 164 H6 TMP 14 H6 T3 14 23.736 37.079 17.457 165 HO5' THM 15 HO5' T5 15 26.077 11.965 33.160 166 H5'1 THM 15 H5' T5 15 24.497 10.152 32.997 167 H5'2 THM 15 H5'' T5 15 24.852 10.947 31.503 168 H4' THM 15 H4' T5 15 22.292 10.472 31.983 169 H3' THM 15 H3' T5 15 23.653 12.458 30.584 170 H2'1 THM 15 H2' T5 15 23.531 14.093 32.301 171 H2'2 THM 15 H2'' T5 15 22.068 14.494 31.281 172 H1' THM 15 H1' T5 15 20.745 12.981 32.593 173 HN3 THM 15 H3 T5 15 18.994 15.388 36.011 174 HM51 THM 15 H71 T5 15 23.490 17.602 35.910 175 HM52 THM 15 H72 T5 15 23.427 16.516 37.298 176 HM53 THM 15 H73 T5 15 24.389 16.126 35.792 177 H6 THM 15 H6 T5 15 23.489 14.658 34.190 178 H5' DT 16 H5' DT 16 19.008 12.617 30.907 179 H5'' DT 16 H5'' DT 16 18.385 12.861 29.143 180 H4' DT 16 H4' DT 16 16.978 13.768 31.017 181 H3' DT 16 H3' DT 16 17.624 14.741 28.650 182 H2' DT 16 H2' DT 16 19.110 16.447 29.380 183 H2'' DT 16 H2'' DT 16 17.703 17.401 29.623 184 H1' DT 16 H1' DT 16 17.215 16.545 31.683 185 H3 DT 16 H3 DT 16 19.264 19.955 34.063 186 H71 DT 16 H71 DT 16 23.411 18.555 31.716 187 H72 DT 16 H72 DT 16 23.235 17.304 32.979 188 H73 DT 16 H73 DT 16 22.883 16.956 31.264 189 H6 DT 16 H6 DT 16 20.795 16.434 31.182 190 H5' DA 17 H5' DA 17 13.908 17.666 31.307 191 H5'' DA 17 H5'' DA 17 12.810 17.065 30.004 192 H4' DA 17 H4' DA 17 12.016 19.034 30.824 193 H3' DA 17 H3' DA 17 12.579 18.525 28.102 194 H2' DA 17 H2' DA 17 14.552 19.870 27.901 195 H2'' DA 17 H2'' DA 17 13.354 21.169 27.652 196 H1' DA 17 H1' DA 17 13.507 22.095 29.733 197 H8 DA 17 H8 DA 17 16.440 19.612 29.223 198 H61 DA 17 H61 DA 17 19.773 24.407 31.130 199 H62 DA 17 H62 DA 17 20.092 22.836 30.418 200 H2 DA 17 H2 DA 17 15.863 25.714 31.173 201 H5' DG 18 H5' DG 18 10.074 22.854 28.703 202 H5'' DG 18 H5'' DG 18 8.909 22.799 27.454 203 H4' DG 18 H4' DG 18 9.780 25.048 27.504 204 H3' DG 18 H3' DG 18 9.909 23.667 25.107 205 H2' DG 18 H2' DG 18 12.180 23.421 25.175 206 H2'' DG 18 H2'' DG 18 12.214 25.041 24.452 207 H1' DG 18 H1' DG 18 12.680 26.055 26.292 208 H8 DG 18 H8 DG 18 14.199 22.565 25.997 209 H1 DG 18 H1 DG 18 17.922 27.366 28.223 210 H21 DG 18 H21 DG 18 16.460 29.241 28.614 211 H22 DG 18 H22 DG 18 14.758 29.020 28.569 212 H5' DG 19 H5' DG 19 9.188 28.513 25.610 213 H5'' DG 19 H5'' DG 19 8.014 29.316 24.582 214 H4' DG 19 H4' DG 19 10.057 30.542 24.812 215 H3' DG 19 H3' DG 19 9.671 29.450 22.112 216 H2' DG 19 H2' DG 19 11.896 29.347 21.942 217 H2'' DG 19 H2'' DG 19 12.084 31.139 22.224 218 H1' DG 19 H1' DG 19 12.042 30.738 24.701 219 H8 DG 19 H8 DG 19 12.999 27.415 23.079 220 H1 DG 19 H1 DG 19 18.104 30.429 25.816 221 H21 DG 19 H21 DG 19 17.562 32.476 26.277 222 H22 DG 19 H22 DG 19 15.909 32.955 26.344 223 H5' DG 20 H5' DG 20 10.772 34.303 23.028 224 H5'' DG 20 H5'' DG 20 9.843 35.157 21.695 225 H4' DG 20 H4' DG 20 11.582 36.376 22.293 226 H3' DG 20 H3' DG 20 11.190 35.578 19.816 227 H2' DG 20 H2' DG 20 12.910 34.210 19.610 228 H2'' DG 20 H2'' DG 20 13.934 35.547 19.234 229 H1' DG 20 H1' DG 20 14.835 35.875 21.427 230 H8 DG 20 H8 DG 20 13.432 32.303 20.709 231 H1 DG 20 H1 DG 20 19.086 32.395 23.736 232 H21 DG 20 H21 DG 20 19.758 34.709 23.893 233 H22 DG 20 H22 DG 20 18.437 35.846 23.535 234 H5'1 TMP 21 H5' T3 21 13.730 39.794 20.034 235 H5'2 TMP 21 H5'' T3 21 13.813 40.528 18.468 236 H4' TMP 21 H4' T3 21 16.002 40.733 19.392 237 H3' TMP 21 H3' T3 21 16.022 38.469 17.383 238 HO3' TMP 21 HO3' T3 21 16.352 40.256 16.004 239 H2'1 TMP 21 H2' T3 21 18.157 38.139 17.771 240 H2'2 TMP 21 H2'' T3 21 18.583 39.723 18.275 241 H1' TMP 21 H1' T3 21 18.222 39.120 20.463 242 HN3 TMP 21 H3 T3 21 20.157 34.958 21.015 243 H51 TMP 21 H71 T3 21 16.375 32.978 18.617 244 H52 TMP 21 H72 T3 21 15.604 34.303 17.916 245 H53 TMP 21 H73 T3 21 17.086 33.821 17.164 246 H6 TMP 21 H6 T3 21 16.190 36.593 18.756 247 HO5' THM 22 HO5' T5 22 25.998 25.444 39.676 248 H5'1 THM 22 H5' T5 22 27.750 24.884 40.719 249 H5'2 THM 22 H5'' T5 22 28.545 25.902 39.441 250 H4' THM 22 H4' T5 22 29.719 23.766 39.750 251 H3' THM 22 H3' T5 22 29.366 24.785 37.389 252 H2'1 THM 22 H2' T5 22 27.359 23.890 36.733 253 H2'2 THM 22 H2'' T5 22 28.557 22.661 36.052 254 H1' THM 22 H1' T5 22 28.518 21.357 37.843 255 HN3 THM 22 H3 T5 22 24.670 18.761 38.069 256 HM51 THM 22 H71 T5 22 23.404 23.810 36.702 257 HM52 THM 22 H72 T5 22 22.157 22.597 36.453 258 HM53 THM 22 H73 T5 22 22.481 23.338 38.126 259 H6 THM 22 H6 T5 22 25.444 23.434 37.617 260 H5' DT 23 H5' DT 23 30.605 20.284 36.877 261 H5'' DT 23 H5'' DT 23 31.761 19.930 35.592 262 H4' DT 23 H4' DT 23 29.710 18.555 35.465 263 H3' DT 23 H3' DT 23 30.905 20.168 33.563 264 H2' DT 23 H2' DT 23 28.960 21.351 32.779 265 H2'' DT 23 H2'' DT 23 28.522 19.917 31.995 266 H1' DT 23 H1' DT 23 27.450 18.919 33.895 267 H3 DT 23 H3 DT 23 23.407 20.466 33.832 268 H71 DT 23 H71 DT 23 25.538 24.765 32.889 269 H72 DT 23 H72 DT 23 24.935 24.991 34.495 270 H73 DT 23 H73 DT 23 26.719 24.754 34.000 271 H6 DT 23 H6 DT 23 27.558 22.735 33.972 272 H5' DA 24 H5' DA 24 27.963 16.708 31.755 273 H5'' DA 24 H5'' DA 24 28.618 15.778 30.481 274 H4' DA 24 H4' DA 24 26.458 16.474 29.916 275 H3' DA 24 H3' DA 24 28.563 17.846 28.337 276 H2' DA 24 H2' DA 24 27.145 19.764 28.168 277 H2'' DA 24 H2'' DA 24 25.962 18.767 27.308 278 H1' DA 24 H1' DA 24 24.812 18.397 29.305 279 H8 DA 24 H8 DA 24 27.222 21.328 30.042 280 H61 DA 24 H61 DA 24 22.038 24.580 29.912 281 H62 DA 24 H62 DA 24 23.783 24.793 30.161 282 H2 DA 24 H2 DA 24 20.767 20.542 29.770 283 H5' DG 25 H5' DG 25 24.905 16.195 26.954 284 H5'' DG 25 H5'' DG 25 24.785 15.235 25.539 285 H4' DG 25 H4' DG 25 22.761 16.454 25.701 286 H3' DG 25 H3' DG 25 24.429 17.145 23.534 287 H2' DG 25 H2' DG 25 24.222 19.375 23.722 288 H2'' DG 25 H2'' DG 25 22.670 19.184 23.024 289 H1' DG 25 H1' DG 25 21.518 18.863 25.186 290 H8 DG 25 H8 DG 25 25.020 20.799 25.333 291 H1 DG 25 H1 DG 25 19.719 24.193 26.818 292 H21 DG 25 H21 DG 25 17.914 22.652 26.508 293 H22 DG 25 H22 DG 25 18.253 21.008 26.006 294 H5' DG 26 H5' DG 26 19.994 17.524 22.550 295 H5'' DG 26 H5'' DG 26 19.548 16.804 21.055 296 H4' DG 26 H4' DG 26 18.400 18.930 21.340 297 H3' DG 26 H3' DG 26 20.744 19.196 19.421 298 H2' DG 26 H2' DG 26 20.439 21.390 19.886 299 H2'' DG 26 H2'' DG 26 18.661 21.379 19.664 300 H1' DG 26 H1' DG 26 18.374 20.895 21.793 301 H8 DG 26 H8 DG 26 22.044 21.365 22.402 302 H1 DG 26 H1 DG 26 18.378 26.445 24.165 303 H21 DG 26 H21 DG 26 16.311 25.937 23.584 304 H22 DG 26 H22 DG 26 15.913 24.451 22.812 305 H5' DG 27 H5' DG 27 16.764 20.827 18.623 306 H5'' DG 27 H5'' DG 27 15.930 19.842 17.376 307 H4' DG 27 H4' DG 27 14.627 21.385 16.865 308 H3' DG 27 H3' DG 27 16.536 21.676 14.963 309 H2' DG 27 H2' DG 27 17.848 22.972 16.269 310 H2'' DG 27 H2'' DG 27 17.052 24.239 15.289 311 H1' DG 27 H1' DG 27 15.566 24.835 17.092 312 H8 DG 27 H8 DG 27 18.672 23.149 18.237 313 H1 DG 27 H1 DG 27 17.889 28.892 20.971 314 H21 DG 27 H21 DG 27 15.843 29.695 20.323 315 H22 DG 27 H22 DG 27 15.059 28.802 18.976 316 H5'1 TMP 28 H5' T3 28 13.528 25.311 14.463 317 H5'2 TMP 28 H5'' T3 28 13.274 25.474 12.830 318 H4' TMP 28 H4' T3 28 13.770 27.646 13.804 319 H3' TMP 28 H3' T3 28 15.749 26.456 11.828 320 HO3' TMP 28 HO3' T3 28 14.033 28.251 11.506 321 H2'1 TMP 28 H2' T3 28 17.434 26.794 13.223 322 H2'2 TMP 28 H2'' T3 28 17.455 28.374 12.546 323 H1' TMP 28 H1' T3 28 15.822 29.044 14.498 324 HN3 TMP 28 H3 T3 28 18.256 30.142 18.008 325 H51 TMP 28 H71 T3 28 20.370 25.867 15.634 326 H52 TMP 28 H72 T3 28 21.465 26.798 16.673 327 H53 TMP 28 H73 T3 28 20.373 25.842 17.480 328 H6 TMP 28 H6 T3 28 18.568 26.477 14.890 329 H1 DM2 101 H23 M2 29 27.112 28.139 38.387 330 H2 DM2 101 H26 M2 29 26.684 26.721 36.487 331 H3 DM2 101 H25 M2 29 28.411 26.058 34.919 332 HO8 DM2 101 H21 M2 29 33.002 30.884 35.698 333 H10 DM2 101 H1 M2 29 34.217 33.610 37.452 334 H111 DM2 101 H2 M2 29 34.092 33.410 39.903 335 H112 DM2 101 H3 M2 29 34.610 34.947 39.286 336 HO12 DM2 101 H12 M2 29 32.623 36.335 38.749 337 H141 DM2 101 H18 M2 29 33.603 36.719 42.654 338 H142 DM2 101 H19 M2 29 34.831 36.135 41.542 339 HO14 DM2 101 H24 M2 29 35.117 35.981 44.097 340 H151 DM2 101 H4 M2 29 30.717 35.115 39.352 341 H152 DM2 101 H5 M2 29 30.586 34.221 40.761 342 HO17 DM2 101 H22 M2 29 28.599 31.538 39.999 343 H211 DM2 101 H27 M2 29 30.136 28.040 32.610 344 H212 DM2 101 H28 M2 29 28.874 27.025 33.362 345 H213 DM2 101 H29 M2 29 30.359 26.263 32.847 346 H1' DM2 101 H6 M2 29 31.794 33.858 35.671 347 H2'1 DM2 101 H7 M2 29 30.952 36.008 35.546 348 H2'2 DM2 101 H8 M2 29 31.898 35.610 34.007 349 H3' DM2 101 H9 M2 29 33.056 37.192 36.522 350 HN'1 DM2 101 H16 M2 29 32.491 38.199 33.757 351 HN'2 DM2 101 H17 M2 29 33.156 39.056 34.895 352 H4' DM2 101 H10 M2 29 34.975 37.636 35.264 353 HO4' DM2 101 H20 M2 29 33.645 36.191 33.137 354 H5' DM2 101 H11 M2 29 35.060 35.640 36.549 355 H6'1 DM2 101 H13 M2 29 37.034 35.691 35.199 356 H6'2 DM2 101 H14 M2 29 36.529 33.973 35.235 357 H6'3 DM2 101 H15 M2 29 36.176 34.842 33.721 358 H1 DM2 102 H23 M2 30 19.044 21.582 13.664 359 H2 DM2 102 H26 M2 30 19.550 23.581 14.795 360 H3 DM2 102 H25 M2 30 21.752 24.261 15.018 361 HO8 DM2 102 H21 M2 30 25.670 19.137 13.703 362 H10 DM2 102 H1 M2 30 26.177 16.377 11.657 363 H111 DM2 102 H2 M2 30 25.875 16.100 9.214 364 H112 DM2 102 H3 M2 30 25.604 14.457 9.806 365 HO12 DM2 102 H12 M2 30 24.358 14.404 7.757 366 H141 DM2 102 H18 M2 30 21.795 16.958 7.950 367 H142 DM2 102 H19 M2 30 22.718 16.128 6.740 368 HO14 DM2 102 H24 M2 30 22.939 19.059 7.459 369 H151 DM2 102 H4 M2 30 22.700 14.563 10.738 370 H152 DM2 102 H5 M2 30 21.768 15.721 9.715 371 HO17 DM2 102 H22 M2 30 19.868 17.784 11.644 372 H211 DM2 102 H27 M2 30 24.466 23.260 17.348 373 H212 DM2 102 H28 M2 30 22.789 23.794 16.777 374 H213 DM2 102 H29 M2 30 24.164 24.654 16.028 375 H1' DM2 102 H6 M2 30 25.095 15.409 14.319 376 H2'1 DM2 102 H7 M2 30 24.261 13.017 13.961 377 H2'2 DM2 102 H8 M2 30 25.420 13.263 15.205 378 H3' DM2 102 H9 M2 30 25.744 11.887 12.445 379 HN'1 DM2 102 H16 M2 30 25.082 10.728 14.584 380 HN'2 DM2 102 H17 M2 30 26.362 10.050 13.749 381 H4' DM2 102 H10 M2 30 28.090 11.821 12.517 382 HO4' DM2 102 H20 M2 30 28.319 13.336 14.840 383 H5' DM2 102 H11 M2 30 27.102 13.979 11.631 384 H6'1 DM2 102 H13 M2 30 29.726 13.865 11.701 385 H6'2 DM2 102 H14 M2 30 28.972 15.470 11.766 386 H6'3 DM2 102 H15 M2 30 29.733 14.613 13.216
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