NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
623489 | 5odf | 34157 | cing | 1-original | 16 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H5 DCZ 1 H5 DC 1 28.904 10.079 25.781 2 H6 DCZ 1 H6 DC 1 31.182 9.586 25.039 3 HN41 DCZ 1 H41 DC 1 26.050 8.410 24.179 4 HN42 DCZ 1 H42 DC 1 26.564 9.640 25.338 5 H1' DCZ 1 H1' DC 1 31.912 7.069 22.373 6 H2'1 DCZ 1 H2' DC 1 31.619 9.892 22.077 7 H2'2 DCZ 1 H2'' DC 1 32.816 8.821 21.297 8 H3' DCZ 1 H3' DC 1 33.092 10.400 23.885 9 H4' DCZ 1 H4' DC 1 34.617 7.908 23.028 10 H5'1 DCZ 1 H5' DC 1 35.207 7.692 25.401 11 H5'2 DCZ 1 H5'' DC 1 35.847 9.176 24.699 12 HO5' DCZ 1 HO5' DC 1 34.339 10.386 25.833 13 H5' DG 2 H5' DG 2 33.127 10.608 19.910 14 H5'' DG 2 H5'' DG 2 33.803 12.089 19.241 15 H4' DG 2 H4' DG 2 31.595 11.445 18.285 16 H3' DG 2 H3' DG 2 32.423 13.999 18.784 17 H2' DG 2 H2' DG 2 31.467 14.156 20.961 18 H2'' DG 2 H2'' DG 2 30.173 14.876 19.979 19 H1' DG 2 H1' DG 2 28.942 12.871 19.862 20 H8 DG 2 H8 DG 2 31.352 12.831 22.943 21 H1 DG 2 H1 DG 2 25.064 12.094 24.232 22 H21 DG 2 H21 DG 2 23.963 12.127 22.378 23 H22 DG 2 H22 DG 2 24.774 12.265 20.802 24 H5' DA 3 H5' DA 3 27.662 13.771 17.844 25 H5'' DA 3 H5'' DA 3 27.806 14.399 16.205 26 H4' DA 3 H4' DA 3 25.647 14.900 16.819 27 H3' DA 3 H3' DA 3 27.294 16.969 16.125 28 H2' DA 3 H2' DA 3 27.827 17.792 18.224 29 H2'' DA 3 H2'' DA 3 26.306 18.679 18.047 30 H1' DA 3 H1' DA 3 25.153 17.305 19.481 31 H8 DA 3 H8 DA 3 28.990 16.768 19.793 32 H61 DA 3 H61 DA 3 27.544 15.267 25.729 33 H62 DA 3 H62 DA 3 28.928 15.425 24.644 34 H2 DA 3 H2 DA 3 23.919 16.304 23.731 35 H5' DT 4 H5' DT 4 22.985 18.117 17.263 36 H5'' DT 4 H5'' DT 4 22.307 19.419 16.283 37 H4' DT 4 H4' DT 4 21.698 19.693 18.601 38 H3' DT 4 H3' DT 4 23.151 21.763 17.179 39 H2' DT 4 H2' DT 4 24.803 21.969 18.704 40 H2'' DT 4 H2'' DT 4 23.626 22.790 19.730 41 H1' DT 4 H1' DT 4 23.031 20.835 20.903 42 H3 DT 4 H3 DT 4 26.254 19.755 23.911 43 H71 DT 4 H71 DT 4 29.459 21.062 20.522 44 H72 DT 4 H72 DT 4 29.336 19.329 20.208 45 H73 DT 4 H73 DT 4 28.639 20.487 19.053 46 H6 DT 4 H6 DT 4 26.360 20.659 19.182 47 H5' DG 5 H5' DG 5 20.491 21.707 20.891 48 H5'' DG 5 H5'' DG 5 19.176 22.685 20.267 49 H4' DG 5 H4' DG 5 18.803 22.601 22.527 50 H3' DG 5 H3' DG 5 19.176 25.049 21.340 51 H2' DG 5 H2' DG 5 21.349 25.491 22.049 52 H2'' DG 5 H2'' DG 5 20.520 26.104 23.498 53 H1' DG 5 H1' DG 5 21.038 24.235 24.756 54 H8 DG 5 H8 DG 5 23.136 24.084 21.465 55 H1 DG 5 H1 DG 5 26.243 22.479 26.897 56 H21 DG 5 H21 DG 5 24.910 22.851 28.605 57 H22 DG 5 H22 DG 5 23.286 23.485 28.346 58 H5' DT 6 H5' DT 6 17.760 25.224 25.832 59 H5'' DT 6 H5'' DT 6 16.824 26.679 26.212 60 H4' DT 6 H4' DT 6 18.522 26.320 27.911 61 H3' DT 6 H3' DT 6 19.179 28.634 26.039 62 H2' DT 6 H2' DT 6 21.074 28.981 27.370 63 H2'' DT 6 H2'' DT 6 20.310 28.163 28.773 64 H1' DT 6 H1' DT 6 21.237 26.291 28.319 65 H3 DT 6 H3 DT 6 25.538 26.008 27.122 66 H71 DT 6 H71 DT 6 24.411 28.300 23.053 67 H72 DT 6 H72 DT 6 23.958 26.665 22.573 68 H73 DT 6 H73 DT 6 22.695 27.885 22.855 69 H6 DT 6 H6 DT 6 21.586 27.638 24.872 70 H5' DA 7 H5' DA 7 18.929 29.426 30.560 71 H5'' DA 7 H5'' DA 7 18.934 31.127 31.041 72 H4' DA 7 H4' DA 7 20.764 29.599 32.010 73 H3' DA 7 H3' DA 7 21.433 32.219 30.664 74 H2' DA 7 H2' DA 7 23.737 31.735 30.885 75 H2'' DA 7 H2'' DA 7 23.462 30.579 32.209 76 H1' DA 7 H1' DA 7 23.577 28.948 30.783 77 H8 DA 7 H8 DA 7 22.103 30.897 27.841 78 H61 DA 7 H61 DA 7 27.318 28.754 25.130 79 H62 DA 7 H62 DA 7 25.830 29.631 24.802 80 H2 DA 7 H2 DA 7 27.826 28.354 29.403 81 H5' DC 8 H5' DC 8 23.922 31.418 34.064 82 H5'' DC 8 H5'' DC 8 24.246 32.797 35.096 83 H4' DC 8 H4' DC 8 26.306 31.691 34.248 84 H3' DC 8 H3' DC 8 25.766 34.449 34.384 85 H2' DC 8 H2' DC 8 25.650 34.764 32.080 86 H2'' DC 8 H2'' DC 8 27.406 34.972 32.277 87 H1' DC 8 H1' DC 8 27.845 32.671 31.768 88 H41 DC 8 H41 DC 8 26.357 32.459 25.567 89 H42 DC 8 H42 DC 8 24.736 33.020 25.893 90 H5 DC 8 H5 DC 8 23.964 33.699 28.051 91 H6 DC 8 H6 DC 8 24.547 33.843 30.416 92 H5' DA 9 H5' DA 9 30.154 33.865 33.400 93 H5'' DA 9 H5'' DA 9 31.208 35.063 34.159 94 H4' DA 9 H4' DA 9 31.606 35.044 31.792 95 H3' DA 9 H3' DA 9 30.526 37.475 33.011 96 H2' DA 9 H2' DA 9 28.974 37.765 31.388 97 H2'' DA 9 H2'' DA 9 30.322 38.210 30.316 98 H1' DA 9 H1' DA 9 30.574 35.972 29.507 99 H8 DA 9 H8 DA 9 26.990 36.914 30.743 100 H61 DA 9 H61 DA 9 25.512 35.745 24.764 101 H62 DA 9 H62 DA 9 24.832 36.380 26.269 102 H2 DA 9 H2 DA 9 29.585 34.579 25.326 103 H5' DT 10 H5' DT 10 33.471 37.508 29.526 104 H5'' DT 10 H5'' DT 10 34.419 38.976 29.278 105 H4' DT 10 H4' DT 10 33.491 38.126 27.192 106 H3' DT 10 H3' DT 10 32.200 40.724 28.084 107 H2' DT 10 H2' DT 10 31.091 40.699 25.975 108 H2'' DT 10 H2'' DT 10 32.279 39.580 25.262 109 H1' DT 10 H1' DT 10 31.023 37.850 25.815 110 H3 DT 10 H3 DT 10 26.750 38.795 24.933 111 H71 DT 10 H71 DT 10 26.294 39.521 29.700 112 H72 DT 10 H72 DT 10 27.870 40.235 30.091 113 H73 DT 10 H73 DT 10 26.655 41.179 29.199 114 H6 DT 10 H6 DT 10 29.615 39.618 28.727 115 H5' DC 11 H5' DC 11 33.692 40.847 24.016 116 H5'' DC 11 H5'' DC 11 34.567 42.340 23.669 117 H4' DC 11 H4' DC 11 32.956 41.845 21.903 118 H3' DC 11 H3' DC 11 33.197 44.352 23.099 119 H2' DC 11 H2' DC 11 31.251 43.968 24.483 120 H2'' DC 11 H2'' DC 11 30.547 44.883 23.123 121 H1' DC 11 H1' DC 11 30.159 42.833 21.871 122 H41 DC 11 H41 DC 11 25.229 42.113 26.202 123 H42 DC 11 H42 DC 11 24.663 42.038 24.536 124 H5 DC 11 H5 DC 11 27.639 42.409 26.680 125 H6 DC 11 H6 DC 11 29.841 42.574 25.617 126 H5' DG 12 H5' DG 12 29.551 44.762 20.439 127 H5'' DG 12 H5'' DG 12 29.619 46.220 19.445 128 H4' DG 12 H4' DG 12 27.488 46.170 20.514 129 H3' DG 12 H3' DG 12 29.203 48.378 20.929 130 HO3' DG 12 HO3' DG 12 27.204 49.487 21.298 131 H2' DG 12 H2' DG 12 29.642 47.771 23.194 132 H2'' DG 12 H2'' DG 12 28.216 48.841 23.419 133 H1' DG 12 H1' DG 12 26.696 46.951 23.247 134 H8 DG 12 H8 DG 12 30.140 46.212 24.944 135 H1 DG 12 H1 DG 12 24.892 45.062 28.511 136 H21 DG 12 H21 DG 12 23.077 45.696 27.334 137 H22 DG 12 H22 DG 12 23.269 46.288 25.694 138 H5 DCZ 13 H5 DC 13 20.524 47.697 16.985 139 H6 DCZ 13 H6 DC 13 18.973 45.886 17.561 140 HN41 DCZ 13 H41 DC 13 23.062 47.170 14.376 141 HN42 DCZ 13 H42 DC 13 22.377 48.311 15.535 142 H1' DCZ 13 H1' DC 13 18.867 42.675 15.673 143 H2'1 DCZ 13 H2' DC 13 19.529 43.455 18.531 144 H2'2 DCZ 13 H2'' DC 13 19.892 41.931 17.674 145 H3' DCZ 13 H3' DC 13 17.723 42.135 19.311 146 H4' DCZ 13 H4' DC 13 15.951 42.885 17.361 147 H5'1 DCZ 13 H5' DC 13 15.880 45.158 18.258 148 H5'2 DCZ 13 H5'' DC 13 15.823 43.898 19.488 149 HO5' DCZ 13 HO5' DC 13 17.156 45.648 20.132 150 H5' DG 14 H5' DG 14 19.427 40.281 15.937 151 H5'' DG 14 H5'' DG 14 18.815 38.641 15.740 152 H4' DG 14 H4' DG 14 21.121 39.063 14.871 153 H3' DG 14 H3' DG 14 20.202 36.724 15.944 154 H2' DG 14 H2' DG 14 20.831 37.119 18.142 155 H2'' DG 14 H2'' DG 14 22.291 36.270 17.627 156 H1' DG 14 H1' DG 14 23.528 38.234 17.333 157 H8 DG 14 H8 DG 14 20.513 38.475 19.774 158 H1 DG 14 H1 DG 14 25.872 41.453 21.753 159 H21 DG 14 H21 DG 14 27.343 41.438 20.125 160 H22 DG 14 H22 DG 14 26.999 40.631 18.584 161 H5' DA 15 H5' DA 15 24.525 37.829 15.042 162 H5'' DA 15 H5'' DA 15 25.098 36.654 13.864 163 H4' DA 15 H4' DA 15 26.975 37.711 14.840 164 H3' DA 15 H3' DA 15 26.768 34.973 14.754 165 H2' DA 15 H2' DA 15 26.131 34.630 16.980 166 H2'' DA 15 H2'' DA 15 27.894 34.569 17.221 167 H1' DA 15 H1' DA 15 28.014 36.783 17.988 168 H8 DA 15 H8 DA 15 24.328 35.509 18.103 169 H61 DA 15 H61 DA 15 24.485 37.841 23.914 170 H62 DA 15 H62 DA 15 23.439 36.989 22.781 171 H2 DA 15 H2 DA 15 28.370 38.453 22.167 172 H5' DT 16 H5' DT 16 30.942 36.138 16.679 173 H5'' DT 16 H5'' DT 16 32.169 34.977 16.157 174 H4' DT 16 H4' DT 16 32.297 35.232 18.551 175 H3' DT 16 H3' DT 16 31.135 32.609 17.626 176 H2' DT 16 H2' DT 16 30.406 32.105 19.700 177 H2'' DT 16 H2'' DT 16 31.913 32.666 20.475 178 H1' DT 16 H1' DT 16 31.162 34.786 20.801 179 H3 DT 16 H3 DT 16 27.671 34.914 23.626 180 H71 DT 16 H71 DT 16 25.458 31.824 20.580 181 H72 DT 16 H72 DT 16 24.841 33.388 20.052 182 H73 DT 16 H73 DT 16 25.992 32.506 19.026 183 H6 DT 16 H6 DT 16 28.229 33.086 19.201 184 H5' DG 17 H5' DG 17 34.665 32.470 20.601 185 H5'' DG 17 H5'' DG 17 35.798 31.253 20.020 186 H4' DG 17 H4' DG 17 35.700 31.164 22.405 187 H3' DG 17 H3' DG 17 35.237 28.866 20.845 188 H2' DG 17 H2' DG 17 32.976 28.668 21.317 189 H2'' DG 17 H2'' DG 17 33.574 27.836 22.775 190 H1' DG 17 H1' DG 17 33.323 29.747 24.135 191 H8 DG 17 H8 DG 17 31.156 30.001 20.893 192 H1 DG 17 H1 DG 17 28.187 31.796 26.352 193 H21 DG 17 H21 DG 17 29.602 31.554 28.043 194 H22 DG 17 H22 DG 17 31.232 30.946 27.735 195 H5' DT 18 H5' DT 18 36.494 29.015 25.233 196 H5'' DT 18 H5'' DT 18 37.464 27.674 25.842 197 H4' DT 18 H4' DT 18 35.958 28.721 27.513 198 H3' DT 18 H3' DT 18 36.273 25.924 27.076 199 H2' DT 18 H2' DT 18 34.064 25.515 26.498 200 H2'' DT 18 H2'' DT 18 33.799 25.589 28.270 201 H1' DT 18 H1' DT 18 33.192 27.869 28.207 202 H3 DT 18 H3 DT 18 28.944 28.228 26.729 203 H71 DT 18 H71 DT 18 31.935 26.064 22.704 204 H72 DT 18 H72 DT 18 30.200 25.722 22.839 205 H73 DT 18 H73 DT 18 30.735 27.310 22.286 206 H6 DT 18 H6 DT 18 32.985 26.504 24.727 207 H5' DA 19 H5' DA 19 34.650 26.698 31.504 208 H5'' DA 19 H5'' DA 19 35.302 25.480 32.596 209 H4' DA 19 H4' DA 19 32.881 25.688 32.756 210 H3' DA 19 H3' DA 19 34.092 23.101 32.156 211 H2' DA 19 H2' DA 19 32.615 22.639 30.464 212 H2'' DA 19 H2'' DA 19 31.385 22.456 31.739 213 H1' DA 19 H1' DA 19 30.648 24.708 31.534 214 H8 DA 19 H8 DA 19 32.558 23.635 28.309 215 H61 DA 19 H61 DA 19 27.312 25.372 25.423 216 H62 DA 19 H62 DA 19 28.888 24.630 25.165 217 H2 DA 19 H2 DA 19 26.635 25.807 29.673 218 H5' DC 20 H5' DC 20 30.222 23.817 34.325 219 H5'' DC 20 H5'' DC 20 29.865 22.776 35.701 220 H4' DC 20 H4' DC 20 27.861 23.258 34.434 221 H3' DC 20 H3' DC 20 28.668 20.600 35.020 222 H2' DC 20 H2' DC 20 29.014 20.048 32.760 223 H2'' DC 20 H2'' DC 20 27.262 19.696 32.837 224 H1' DC 20 H1' DC 20 26.696 21.949 32.174 225 H41 DC 20 H41 DC 20 28.183 21.852 26.034 226 H42 DC 20 H42 DC 20 29.836 21.365 26.369 227 H5 DC 20 H5 DC 20 30.635 20.815 28.565 228 H6 DC 20 H6 DC 20 30.054 20.819 30.940 229 H5' DA 21 H5' DA 21 24.263 20.675 33.534 230 H5'' DA 21 H5'' DA 21 23.302 19.485 34.411 231 H4' DA 21 H4' DA 21 22.903 19.080 32.125 232 H3' DA 21 H3' DA 21 24.219 17.021 33.631 233 H2' DA 21 H2' DA 21 26.198 17.321 32.331 234 H2'' DA 21 H2'' DA 21 25.335 16.066 31.384 235 H1' DA 21 H1' DA 21 24.154 17.837 30.096 236 H8 DA 21 H8 DA 21 27.920 17.585 30.783 237 H61 DA 21 H61 DA 21 28.383 18.960 24.700 238 H62 DA 21 H62 DA 21 29.276 18.327 26.081 239 H2 DA 21 H2 DA 21 24.280 19.652 25.869 240 H5' DT 22 H5' DT 22 20.466 17.744 31.624 241 H5'' DT 22 H5'' DT 22 18.973 16.838 31.887 242 H4' DT 22 H4' DT 22 19.103 17.715 29.629 243 H3' DT 22 H3' DT 22 18.511 15.038 30.126 244 H2' DT 22 H2' DT 22 20.561 14.176 29.406 245 H2'' DT 22 H2'' DT 22 19.752 14.237 27.819 246 H1' DT 22 H1' DT 22 20.670 16.320 27.253 247 H3 DT 22 H3 DT 22 24.919 15.600 25.890 248 H71 DT 22 H71 DT 22 26.080 14.230 30.332 249 H72 DT 22 H72 DT 22 24.498 13.778 31.008 250 H73 DT 22 H73 DT 22 25.322 12.723 29.845 251 H6 DT 22 H6 DT 22 22.623 14.682 30.020 252 H5' DC 23 H5' DC 23 18.418 16.168 25.713 253 H5'' DC 23 H5'' DC 23 17.000 15.574 24.847 254 H4' DC 23 H4' DC 23 19.013 15.305 23.516 255 H3' DC 23 H3' DC 23 17.193 13.246 23.813 256 H2' DC 23 H2' DC 23 18.525 12.222 25.592 257 H2'' DC 23 H2'' DC 23 18.984 11.269 24.155 258 H1' DC 23 H1' DC 23 20.747 12.823 23.606 259 H41 DC 23 H41 DC 23 25.272 11.078 27.441 260 H42 DC 23 H42 DC 23 24.227 10.854 28.849 261 H5 DC 23 H5 DC 23 21.833 11.368 28.729 262 H6 DC 23 H6 DC 23 20.052 12.121 27.222 263 H5' DG 24 H5' DG 24 20.919 11.540 21.859 264 H5'' DG 24 H5'' DG 24 20.592 10.544 20.441 265 H4' DG 24 H4' DG 24 22.098 9.367 21.922 266 H3' DG 24 H3' DG 24 19.726 8.175 21.023 267 HO3' DG 24 HO3' DG 24 20.831 6.208 21.496 268 H2' DG 24 H2' DG 24 18.612 8.460 23.103 269 H2'' DG 24 H2'' DG 24 19.294 6.816 23.331 270 H1' DG 24 H1' DG 24 21.289 7.709 24.377 271 H8 DG 24 H8 DG 24 17.818 9.310 25.041 272 H1 DG 24 H1 DG 24 21.515 8.439 30.253 273 H21 DG 24 H21 DG 24 23.517 7.643 29.589 274 H22 DG 24 H22 DG 24 23.842 7.435 27.877 275 H33 CWN 101 H33 PA6 25 29.824 27.464 30.784 276 H35 CWN 101 H35 PA6 25 33.102 28.734 33.336 277 H031 CWN 101 H031 PA6 25 20.717 16.450 20.623 278 H032 CWN 101 H032 PA6 25 22.057 17.317 19.849 279 H042 CWN 101 H042 PA6 25 22.900 18.066 22.044 280 H041 CWN 101 H041 PA6 25 21.616 17.200 22.886 281 H052 CWN 101 H052 PA6 25 19.903 18.655 21.806 282 H051 CWN 101 H051 PA6 25 21.179 19.503 20.912 283 HN02 CWN 101 HN02 PA6 25 22.156 20.192 23.106 284 HN01 CWN 101 HN01 PA6 25 23.606 15.873 21.186 285 H004 CWN 101 H004 PA6 25 23.145 15.466 18.811 286 H005 CWN 101 H005 PA6 25 21.742 14.462 19.279 287 H006 CWN 101 H006 PA6 25 23.398 13.942 19.696 288 H001 CWN 101 H001 PA6 25 22.727 13.756 22.081 289 H002 CWN 101 H002 PA6 25 21.073 14.300 21.695 290 H003 CWN 101 H003 PA6 25 22.031 15.148 22.938 291 HN03 CWN 101 HN03 PA6 25 22.784 19.972 27.883 292 H13 CWN 101 H13 PA6 25 23.545 21.102 29.400 293 HN1 CWN 101 HN1 PA6 25 24.569 22.742 31.200 294 H15 CWN 101 H15 PA6 25 21.050 22.071 32.808 295 H112 CWN 101 H112 PA6 25 19.367 19.872 32.283 296 H111 CWN 101 H111 PA6 25 18.846 19.896 30.589 297 H113 CWN 101 H113 PA6 25 18.705 21.367 31.578 298 HN2 CWN 101 HN2 PA6 25 28.317 25.931 31.725 299 HN3 CWN 101 HN3 PA6 25 31.759 29.004 29.685 300 H25 CWN 101 H25 PA6 25 26.705 26.120 35.256 301 H223 CWN 101 H223 PA6 25 23.368 25.084 35.499 302 H222 CWN 101 H222 PA6 25 24.831 25.300 36.496 303 H221 CWN 101 H221 PA6 25 24.318 23.658 36.021 304 HN4 CWN 101 HN4 PA6 25 32.512 31.815 26.007 305 H23 CWN 101 H23 PA6 25 26.168 24.253 31.380 306 HN9 CWN 101 HN9 PA6 25 31.438 34.481 27.100 307 HN5 CWN 101 HN5 PA6 25 30.031 31.808 30.628 308 H332 CWN 101 H332 PA6 25 32.660 27.544 35.362 309 H331 CWN 101 H331 PA6 25 31.599 26.116 35.244 310 H333 CWN 101 H333 PA6 25 30.927 27.694 35.768 311 HN6 CWN 101 HN6 PA6 25 26.308 28.714 31.776 312 HN7 CWN 101 HN7 PA6 25 22.754 25.557 30.316 313 H44 CWN 101 H44 PA6 25 36.054 31.987 27.502 314 H443 CWN 101 H443 PA6 25 36.190 31.139 30.904 315 H442 CWN 101 H442 PA6 25 37.252 31.132 29.473 316 H441 CWN 101 H441 PA6 25 36.612 29.594 30.109 317 H081 CWN 101 H081 PA6 25 22.297 18.757 25.893 318 H082 CWN 101 H082 PA6 25 20.615 18.610 26.411 319 H53 CWN 101 H53 PA6 25 30.820 33.437 28.713 320 H55 CWN 101 H55 PA6 25 33.654 32.654 31.900 321 H553 CWN 101 H553 PA6 25 35.149 35.429 30.320 322 H551 CWN 101 H551 PA6 25 35.760 34.022 29.397 323 H552 CWN 101 H552 PA6 25 35.592 33.923 31.171 324 H63 CWN 101 H63 PA6 25 28.491 30.232 31.055 325 H65 CWN 101 H65 PA6 25 27.937 29.292 35.252 326 H663 CWN 101 H663 PA6 25 29.738 30.504 36.284 327 H661 CWN 101 H661 PA6 25 30.436 31.850 35.355 328 H662 CWN 101 H662 PA6 25 31.232 30.250 35.344 329 H75 CWN 101 H75 PA6 25 21.337 26.686 33.788 330 H771 CWN 101 H771 PA6 25 23.011 29.401 35.281 331 H773 CWN 101 H773 PA6 25 23.678 27.926 36.050 332 H772 CWN 101 H772 PA6 25 21.939 28.028 35.668 333 H921 CWN 101 H921 PA6 25 33.696 33.349 23.371 334 H922 CWN 101 H922 PA6 25 32.268 33.221 24.391 335 H932 CWN 101 H932 PA6 25 33.179 35.589 23.606 336 H931 CWN 101 H931 PA6 25 34.421 35.379 24.824 337 H942 CWN 101 H942 PA6 25 31.427 35.738 25.161 338 H943 CWN 101 H943 PA6 25 32.749 36.697 25.830 339 H73 CWN 101 H73 PA6 25 24.834 27.005 31.230 340 H072 CWN 101 H072 PA6 25 20.344 21.126 25.824 341 H071 CWN 101 H071 PA6 25 21.943 21.043 25.080 342 H883 CWN 101 H883 PA6 25 18.240 23.754 31.686 343 H881 CWN 101 H881 PA6 25 17.174 23.710 30.279 344 H882 CWN 101 H882 PA6 25 17.864 25.251 30.803 345 H83 CWN 101 H83 PA6 25 21.274 22.898 27.188 Start of MODEL 2 1 H5 DCZ 1 H5 DC 1 29.684 10.248 25.827 2 H6 DCZ 1 H6 DC 1 31.700 9.634 24.597 3 HN41 DCZ 1 H41 DC 1 26.466 8.733 24.945 4 HN42 DCZ 1 H42 DC 1 27.290 9.999 25.855 5 H1' DCZ 1 H1' DC 1 31.533 7.310 21.640 6 H2'1 DCZ 1 H2' DC 1 31.720 10.120 22.001 7 H2'2 DCZ 1 H2'' DC 1 32.543 9.120 20.778 8 H3' DCZ 1 H3' DC 1 33.589 9.906 23.541 9 H4' DCZ 1 H4' DC 1 34.413 7.623 21.712 10 H5'1 DCZ 1 H5' DC 1 35.523 6.688 23.678 11 H5'2 DCZ 1 H5'' DC 1 36.200 8.261 23.252 12 HO5' DCZ 1 HO5' DC 1 35.847 8.006 25.555 13 H5' DG 2 H5' DG 2 33.254 10.963 19.527 14 H5'' DG 2 H5'' DG 2 33.911 12.537 19.091 15 H4' DG 2 H4' DG 2 31.626 11.954 18.172 16 H3' DG 2 H3' DG 2 32.546 14.451 18.752 17 H2' DG 2 H2' DG 2 31.801 14.464 21.016 18 H2'' DG 2 H2'' DG 2 30.450 15.311 20.221 19 H1' DG 2 H1' DG 2 29.141 13.360 20.051 20 H8 DG 2 H8 DG 2 31.752 13.221 22.958 21 H1 DG 2 H1 DG 2 25.606 12.037 24.548 22 H21 DG 2 H21 DG 2 24.424 11.970 22.755 23 H22 DG 2 H22 DG 2 25.133 12.233 21.145 24 H5' DA 3 H5' DA 3 27.663 14.087 18.358 25 H5'' DA 3 H5'' DA 3 27.814 14.569 16.672 26 H4' DA 3 H4' DA 3 25.630 15.042 17.164 27 H3' DA 3 H3' DA 3 27.181 17.146 16.394 28 H2' DA 3 H2' DA 3 27.672 18.104 18.448 29 H2'' DA 3 H2'' DA 3 26.108 18.897 18.238 30 H1' DA 3 H1' DA 3 25.064 17.582 19.791 31 H8 DA 3 H8 DA 3 28.921 17.162 20.007 32 H61 DA 3 H61 DA 3 27.670 15.440 25.926 33 H62 DA 3 H62 DA 3 29.023 15.690 24.819 34 H2 DA 3 H2 DA 3 23.960 16.377 24.035 35 H5' DT 4 H5' DT 4 22.801 17.993 17.454 36 H5'' DT 4 H5'' DT 4 22.008 19.230 16.470 37 H4' DT 4 H4' DT 4 21.340 19.407 18.789 38 H3' DT 4 H3' DT 4 22.500 21.609 17.343 39 H2' DT 4 H2' DT 4 24.226 21.949 18.765 40 H2'' DT 4 H2'' DT 4 23.049 22.733 19.822 41 H1' DT 4 H1' DT 4 22.627 20.776 21.079 42 H3 DT 4 H3 DT 4 26.005 19.988 24.004 43 H71 DT 4 H71 DT 4 28.204 20.868 19.087 44 H72 DT 4 H72 DT 4 28.993 21.555 20.524 45 H73 DT 4 H73 DT 4 29.026 19.810 20.255 46 H6 DT 4 H6 DT 4 25.920 20.879 19.273 47 H5' DG 5 H5' DG 5 20.286 21.429 21.349 48 H5'' DG 5 H5'' DG 5 18.801 22.119 20.713 49 H4' DG 5 H4' DG 5 18.479 22.260 22.952 50 H3' DG 5 H3' DG 5 18.644 24.649 21.596 51 H2' DG 5 H2' DG 5 20.783 25.305 22.215 52 H2'' DG 5 H2'' DG 5 19.959 25.925 23.662 53 H1' DG 5 H1' DG 5 20.687 24.186 24.993 54 H8 DG 5 H8 DG 5 22.642 24.037 21.615 55 H1 DG 5 H1 DG 5 26.081 22.789 26.946 56 H21 DG 5 H21 DG 5 24.791 23.085 28.705 57 H22 DG 5 H22 DG 5 23.117 23.603 28.501 58 H5' DT 6 H5' DT 6 17.455 24.814 26.052 59 H5'' DT 6 H5'' DT 6 16.381 26.139 26.518 60 H4' DT 6 H4' DT 6 18.218 25.854 28.119 61 H3' DT 6 H3' DT 6 18.171 28.394 26.508 62 H2' DT 6 H2' DT 6 20.323 28.898 27.095 63 H2'' DT 6 H2'' DT 6 20.059 28.317 28.760 64 H1' DT 6 H1' DT 6 20.800 26.310 28.444 65 H3 DT 6 H3 DT 6 25.127 26.268 27.269 66 H71 DT 6 H71 DT 6 23.793 28.343 23.090 67 H72 DT 6 H72 DT 6 23.605 26.631 22.705 68 H73 DT 6 H73 DT 6 22.165 27.654 22.890 69 H6 DT 6 H6 DT 6 21.085 27.524 24.943 70 H5' DA 7 H5' DA 7 18.823 28.608 31.102 71 H5'' DA 7 H5'' DA 7 18.496 30.197 31.801 72 H4' DA 7 H4' DA 7 20.722 29.314 32.425 73 H3' DA 7 H3' DA 7 20.716 31.817 30.713 74 H2' DA 7 H2' DA 7 23.091 31.796 30.884 75 H2'' DA 7 H2'' DA 7 23.065 30.711 32.293 76 H1' DA 7 H1' DA 7 23.414 29.049 30.965 77 H8 DA 7 H8 DA 7 21.470 30.661 28.063 78 H61 DA 7 H61 DA 7 26.738 29.104 25.056 79 H62 DA 7 H62 DA 7 25.158 29.843 24.804 80 H2 DA 7 H2 DA 7 27.511 28.739 29.280 81 H5' DC 8 H5' DC 8 23.318 31.603 34.158 82 H5'' DC 8 H5'' DC 8 23.547 33.065 35.095 83 H4' DC 8 H4' DC 8 25.679 31.931 34.413 84 H3' DC 8 H3' DC 8 25.096 34.667 34.445 85 H2' DC 8 H2' DC 8 24.972 34.913 32.137 86 H2'' DC 8 H2'' DC 8 26.715 35.192 32.335 87 H1' DC 8 H1' DC 8 27.259 32.908 31.858 88 H41 DC 8 H41 DC 8 25.610 32.649 25.688 89 H42 DC 8 H42 DC 8 23.956 33.063 26.087 90 H5 DC 8 H5 DC 8 23.228 33.702 28.252 91 H6 DC 8 H6 DC 8 23.872 33.860 30.594 92 H5' DA 9 H5' DA 9 29.574 34.308 33.544 93 H5'' DA 9 H5'' DA 9 30.501 35.660 34.198 94 H4' DA 9 H4' DA 9 30.882 35.429 31.827 95 H3' DA 9 H3' DA 9 29.645 37.905 32.811 96 H2' DA 9 H2' DA 9 28.252 38.094 31.041 97 H2'' DA 9 H2'' DA 9 29.671 38.283 29.983 98 H1' DA 9 H1' DA 9 29.807 36.003 29.472 99 H8 DA 9 H8 DA 9 26.210 36.865 30.760 100 H61 DA 9 H61 DA 9 24.797 36.076 24.704 101 H62 DA 9 H62 DA 9 24.084 36.552 26.252 102 H2 DA 9 H2 DA 9 28.887 34.916 25.245 103 H5' DT 10 H5' DT 10 32.520 37.840 29.265 104 H5'' DT 10 H5'' DT 10 33.622 39.217 29.230 105 H4' DT 10 H4' DT 10 32.916 38.698 26.987 106 H3' DT 10 H3' DT 10 31.608 41.219 28.045 107 H2' DT 10 H2' DT 10 30.693 41.508 25.897 108 H2'' DT 10 H2'' DT 10 31.936 40.499 25.116 109 H1' DT 10 H1' DT 10 30.626 38.709 25.274 110 H3 DT 10 H3 DT 10 26.448 40.206 24.161 111 H71 DT 10 H71 DT 10 25.371 39.353 28.742 112 H72 DT 10 H72 DT 10 26.911 39.671 29.566 113 H73 DT 10 H73 DT 10 25.920 41.019 28.955 114 H6 DT 10 H6 DT 10 28.848 39.619 28.306 115 H5' DC 11 H5' DC 11 33.900 41.597 24.282 116 H5'' DC 11 H5'' DC 11 34.902 43.049 24.247 117 H4' DC 11 H4' DC 11 33.721 42.688 22.123 118 H3' DC 11 H3' DC 11 33.902 45.150 23.360 119 H2' DC 11 H2' DC 11 31.759 44.995 24.390 120 H2'' DC 11 H2'' DC 11 31.333 45.908 22.928 121 H1' DC 11 H1' DC 11 30.835 43.922 21.684 122 H41 DC 11 H41 DC 11 25.751 43.204 25.838 123 H42 DC 11 H42 DC 11 25.230 42.927 24.176 124 H5 DC 11 H5 DC 11 28.104 43.541 26.375 125 H6 DC 11 H6 DC 11 30.336 43.753 25.406 126 H5' DG 12 H5' DG 12 30.976 45.511 19.886 127 H5'' DG 12 H5'' DG 12 31.218 46.955 18.901 128 H4' DG 12 H4' DG 12 28.878 46.707 19.397 129 H3' DG 12 H3' DG 12 30.280 49.100 20.123 130 HO3' DG 12 HO3' DG 12 28.270 50.037 19.564 131 H2' DG 12 H2' DG 12 29.904 48.763 22.428 132 H2'' DG 12 H2'' DG 12 28.368 49.600 22.020 133 H1' DG 12 H1' DG 12 27.263 47.478 21.565 134 H8 DG 12 H8 DG 12 29.967 47.390 24.390 135 H1 DG 12 H1 DG 12 23.904 46.095 26.173 136 H21 DG 12 H21 DG 12 22.602 46.072 24.335 137 H22 DG 12 H22 DG 12 23.317 46.367 22.760 138 H5 DCZ 13 H5 DC 13 17.632 48.163 17.249 139 H6 DCZ 13 H6 DC 13 16.906 45.884 17.780 140 HN41 DCZ 13 H41 DC 13 19.708 48.781 14.280 141 HN42 DCZ 13 H42 DC 13 18.942 49.489 15.704 142 H1' DCZ 13 H1' DC 13 17.624 42.960 15.591 143 H2'1 DCZ 13 H2' DC 13 18.537 43.918 18.334 144 H2'2 DCZ 13 H2'' DC 13 19.307 42.724 17.259 145 H3' DCZ 13 H3' DC 13 17.670 41.916 19.276 146 H4' DCZ 13 H4' DC 13 15.369 41.864 17.771 147 H5'1 DCZ 13 H5' DC 13 14.552 43.836 18.996 148 H5'2 DCZ 13 H5'' DC 13 15.337 42.645 20.033 149 HO5' DCZ 13 HO5' DC 13 15.977 44.791 20.593 150 H5' DG 14 H5' DG 14 19.802 41.209 15.677 151 H5'' DG 14 H5'' DG 14 19.478 39.513 15.349 152 H4' DG 14 H4' DG 14 21.650 40.476 14.442 153 H3' DG 14 H3' DG 14 21.097 37.896 15.099 154 H2' DG 14 H2' DG 14 21.701 38.058 17.368 155 H2'' DG 14 H2'' DG 14 23.207 37.426 16.689 156 H1' DG 14 H1' DG 14 24.246 39.530 16.601 157 H8 DG 14 H8 DG 14 21.453 39.109 19.264 158 H1 DG 14 H1 DG 14 26.808 42.024 21.353 159 H21 DG 14 H21 DG 14 28.104 42.442 19.678 160 H22 DG 14 H22 DG 14 27.680 41.967 18.023 161 H5' DA 15 H5' DA 15 25.499 39.048 14.750 162 H5'' DA 15 H5'' DA 15 26.334 38.003 13.599 163 H4' DA 15 H4' DA 15 27.869 38.716 15.304 164 H3' DA 15 H3' DA 15 27.431 36.009 14.662 165 H2' DA 15 H2' DA 15 26.524 35.316 16.643 166 H2'' DA 15 H2'' DA 15 28.199 35.291 17.234 167 H1' DA 15 H1' DA 15 28.018 37.358 18.309 168 H8 DA 15 H8 DA 15 24.514 35.868 17.449 169 H61 DA 15 H61 DA 15 23.223 37.376 23.398 170 H62 DA 15 H62 DA 15 22.512 36.632 21.968 171 H2 DA 15 H2 DA 15 27.313 38.436 22.646 172 H5' DT 16 H5' DT 16 31.263 36.944 17.164 173 H5'' DT 16 H5'' DT 16 32.599 35.839 16.801 174 H4' DT 16 H4' DT 16 32.354 36.129 19.214 175 H3' DT 16 H3' DT 16 31.713 33.443 18.044 176 H2' DT 16 H2' DT 16 30.510 32.801 19.829 177 H2'' DT 16 H2'' DT 16 31.791 33.312 20.961 178 H1' DT 16 H1' DT 16 30.927 35.426 21.242 179 H3 DT 16 H3 DT 16 27.067 35.148 23.533 180 H71 DT 16 H71 DT 16 25.604 32.115 19.928 181 H72 DT 16 H72 DT 16 24.826 33.666 19.622 182 H73 DT 16 H73 DT 16 26.144 33.129 18.561 183 H6 DT 16 H6 DT 16 28.357 33.694 19.116 184 H5' DG 17 H5' DG 17 34.736 32.813 21.585 185 H5'' DG 17 H5'' DG 17 35.820 31.524 21.048 186 H4' DG 17 H4' DG 17 34.976 30.961 23.228 187 H3' DG 17 H3' DG 17 34.693 29.155 21.093 188 H2' DG 17 H2' DG 17 32.371 29.706 20.791 189 H2'' DG 17 H2'' DG 17 32.289 28.268 21.857 190 H1' DG 17 H1' DG 17 32.313 29.683 23.857 191 H8 DG 17 H8 DG 17 30.188 30.496 20.745 192 H1 DG 17 H1 DG 17 27.560 32.175 26.413 193 H21 DG 17 H21 DG 17 29.047 31.869 28.007 194 H22 DG 17 H22 DG 17 30.665 31.279 27.610 195 H5' DT 18 H5' DT 18 36.088 29.803 25.216 196 H5'' DT 18 H5'' DT 18 37.170 28.850 26.229 197 H4' DT 18 H4' DT 18 35.290 29.627 27.513 198 H3' DT 18 H3' DT 18 35.983 26.889 27.433 199 H2' DT 18 H2' DT 18 34.031 26.336 26.170 200 H2'' DT 18 H2'' DT 18 33.438 26.123 27.854 201 H1' DT 18 H1' DT 18 32.778 28.459 27.965 202 H3 DT 18 H3 DT 18 28.502 28.628 26.673 203 H71 DT 18 H71 DT 18 31.312 26.259 22.648 204 H72 DT 18 H72 DT 18 29.593 25.911 22.921 205 H73 DT 18 H73 DT 18 30.062 27.452 22.202 206 H6 DT 18 H6 DT 18 32.487 26.918 24.549 207 H5' DA 19 H5' DA 19 35.866 24.853 31.898 208 H5'' DA 19 H5'' DA 19 35.349 23.728 30.651 209 H4' DA 19 H4' DA 19 33.767 25.883 32.056 210 H3' DA 19 H3' DA 19 33.839 22.968 31.975 211 H2' DA 19 H2' DA 19 32.199 22.801 30.387 212 H2'' DA 19 H2'' DA 19 31.079 23.216 31.718 213 H1' DA 19 H1' DA 19 31.141 25.546 31.179 214 H8 DA 19 H8 DA 19 32.472 23.982 27.907 215 H61 DA 19 H61 DA 19 26.940 25.630 25.560 216 H62 DA 19 H62 DA 19 28.478 24.868 25.167 217 H2 DA 19 H2 DA 19 26.738 26.222 29.848 218 H5' DC 20 H5' DC 20 30.239 24.356 34.113 219 H5'' DC 20 H5'' DC 20 29.930 23.474 35.611 220 H4' DC 20 H4' DC 20 27.904 23.638 34.390 221 H3' DC 20 H3' DC 20 28.965 21.071 35.006 222 H2' DC 20 H2' DC 20 29.217 20.483 32.750 223 H2'' DC 20 H2'' DC 20 27.499 20.021 32.923 224 H1' DC 20 H1' DC 20 26.752 22.217 32.234 225 H41 DC 20 H41 DC 20 28.009 22.191 26.034 226 H42 DC 20 H42 DC 20 29.693 21.778 26.310 227 H5 DC 20 H5 DC 20 30.577 21.194 28.467 228 H6 DC 20 H6 DC 20 30.092 21.193 30.860 229 H5' DA 21 H5' DA 21 24.593 21.004 33.729 230 H5'' DA 21 H5'' DA 21 23.632 19.825 34.623 231 H4' DA 21 H4' DA 21 23.163 19.424 32.361 232 H3' DA 21 H3' DA 21 24.564 17.358 33.790 233 H2' DA 21 H2' DA 21 26.463 17.665 32.389 234 H2'' DA 21 H2'' DA 21 25.545 16.428 31.469 235 H1' DA 21 H1' DA 21 24.304 18.215 30.278 236 H8 DA 21 H8 DA 21 28.109 17.964 30.787 237 H61 DA 21 H61 DA 21 28.243 19.248 24.671 238 H62 DA 21 H62 DA 21 29.211 18.618 26.003 239 H2 DA 21 H2 DA 21 24.189 19.883 26.030 240 H5' DT 22 H5' DT 22 20.696 17.958 31.830 241 H5'' DT 22 H5'' DT 22 19.234 17.043 32.208 242 H4' DT 22 H4' DT 22 19.239 17.721 29.899 243 H3' DT 22 H3' DT 22 18.761 15.086 30.554 244 H2' DT 22 H2' DT 22 20.923 14.311 30.013 245 H2'' DT 22 H2'' DT 22 20.143 14.091 28.430 246 H1' DT 22 H1' DT 22 20.868 16.177 27.609 247 H3 DT 22 H3 DT 22 25.134 15.820 26.221 248 H71 DT 22 H71 DT 22 26.454 14.538 30.644 249 H72 DT 22 H72 DT 22 24.918 13.978 31.349 250 H73 DT 22 H73 DT 22 25.790 12.987 30.156 251 H6 DT 22 H6 DT 22 22.981 14.804 30.407 252 H5' DC 23 H5' DC 23 19.116 15.969 26.173 253 H5'' DC 23 H5'' DC 23 17.719 15.454 25.224 254 H4' DC 23 H4' DC 23 19.729 15.105 23.955 255 H3' DC 23 H3' DC 23 17.870 13.073 24.305 256 H2' DC 23 H2' DC 23 19.204 11.974 26.006 257 H2'' DC 23 H2'' DC 23 19.688 11.077 24.536 258 H1' DC 23 H1' DC 23 21.460 12.626 24.078 259 H41 DC 23 H41 DC 23 25.856 10.908 28.114 260 H42 DC 23 H42 DC 23 24.778 10.883 29.513 261 H5 DC 23 H5 DC 23 22.425 11.446 29.307 262 H6 DC 23 H6 DC 23 20.682 12.107 27.719 263 H5' DG 24 H5' DG 24 21.310 11.236 21.911 264 H5'' DG 24 H5'' DG 24 20.693 10.278 20.560 265 H4' DG 24 H4' DG 24 22.201 8.888 21.745 266 H3' DG 24 H3' DG 24 19.481 8.086 21.575 267 HO3' DG 24 HO3' DG 24 20.388 6.019 21.571 268 H2' DG 24 H2' DG 24 19.124 8.448 23.897 269 H2'' DG 24 H2'' DG 24 19.648 6.729 23.929 270 H1' DG 24 H1' DG 24 21.985 7.402 24.193 271 H8 DG 24 H8 DG 24 19.093 9.108 26.114 272 H1 DG 24 H1 DG 24 24.332 7.680 29.596 273 H21 DG 24 H21 DG 24 25.952 6.976 28.209 274 H22 DG 24 H22 DG 24 25.648 6.890 26.485 275 H33 CWN 101 H33 PA6 25 29.516 28.068 30.828 276 H35 CWN 101 H35 PA6 25 33.311 28.576 32.882 277 H031 CWN 101 H031 PA6 25 20.667 16.183 21.050 278 H032 CWN 101 H032 PA6 25 21.849 17.277 20.307 279 H042 CWN 101 H042 PA6 25 22.671 17.925 22.584 280 H041 CWN 101 H041 PA6 25 21.412 16.943 23.329 281 H052 CWN 101 H052 PA6 25 19.652 18.359 22.316 282 H051 CWN 101 H051 PA6 25 20.874 19.264 21.396 283 HN02 CWN 101 HN02 PA6 25 21.837 20.042 23.560 284 HN01 CWN 101 HN01 PA6 25 23.634 15.995 21.488 285 H004 CWN 101 H004 PA6 25 23.634 14.151 19.883 286 H005 CWN 101 H005 PA6 25 23.119 15.672 19.115 287 H006 CWN 101 H006 PA6 25 21.900 14.445 19.567 288 H001 CWN 101 H001 PA6 25 21.373 14.054 21.992 289 H002 CWN 101 H002 PA6 25 22.273 14.948 23.248 290 H003 CWN 101 H003 PA6 25 23.104 13.713 22.270 291 HN03 CWN 101 HN03 PA6 25 22.683 20.217 28.153 292 H13 CWN 101 H13 PA6 25 23.512 21.322 29.661 293 HN1 CWN 101 HN1 PA6 25 24.554 23.023 31.391 294 H15 CWN 101 H15 PA6 25 21.093 22.342 33.116 295 H112 CWN 101 H112 PA6 25 19.204 19.682 31.651 296 H111 CWN 101 H111 PA6 25 18.625 21.205 30.924 297 H113 CWN 101 H113 PA6 25 19.029 21.142 32.659 298 HN2 CWN 101 HN2 PA6 25 28.247 26.271 31.739 299 HN3 CWN 101 HN3 PA6 25 31.466 29.468 29.569 300 H25 CWN 101 H25 PA6 25 26.751 26.511 35.318 301 H223 CWN 101 H223 PA6 25 24.451 24.021 36.226 302 H222 CWN 101 H222 PA6 25 23.432 25.384 35.670 303 H221 CWN 101 H221 PA6 25 24.904 25.702 36.625 304 HN4 CWN 101 HN4 PA6 25 31.861 32.172 25.827 305 H23 CWN 101 H23 PA6 25 26.128 24.546 31.501 306 HN9 CWN 101 HN9 PA6 25 30.825 34.738 27.065 307 HN5 CWN 101 HN5 PA6 25 29.545 32.103 30.673 308 H332 CWN 101 H332 PA6 25 33.059 26.880 34.656 309 H331 CWN 101 H331 PA6 25 31.538 25.986 34.845 310 H333 CWN 101 H333 PA6 25 31.687 27.640 35.515 311 HN6 CWN 101 HN6 PA6 25 25.967 28.845 31.881 312 HN7 CWN 101 HN7 PA6 25 22.482 25.587 30.501 313 H44 CWN 101 H44 PA6 25 35.288 32.962 27.368 314 H443 CWN 101 H443 PA6 25 36.134 30.742 30.084 315 H442 CWN 101 H442 PA6 25 35.540 32.282 30.783 316 H441 CWN 101 H441 PA6 25 36.600 32.298 29.347 317 H081 CWN 101 H081 PA6 25 22.189 18.936 26.226 318 H082 CWN 101 H082 PA6 25 20.598 18.563 26.908 319 H53 CWN 101 H53 PA6 25 30.286 33.658 28.679 320 H55 CWN 101 H55 PA6 25 33.019 33.371 32.033 321 H553 CWN 101 H553 PA6 25 34.655 35.103 31.454 322 H551 CWN 101 H551 PA6 25 34.248 36.250 30.155 323 H552 CWN 101 H552 PA6 25 35.149 34.750 29.772 324 H63 CWN 101 H63 PA6 25 28.047 30.523 31.136 325 H65 CWN 101 H65 PA6 25 27.629 29.448 35.316 326 H663 CWN 101 H663 PA6 25 29.530 30.494 36.321 327 H661 CWN 101 H661 PA6 25 30.020 32.012 35.524 328 H662 CWN 101 H662 PA6 25 30.966 30.511 35.264 329 H75 CWN 101 H75 PA6 25 21.014 26.805 33.920 330 H771 CWN 101 H771 PA6 25 21.523 28.324 35.685 331 H773 CWN 101 H773 PA6 25 22.625 29.653 35.245 332 H772 CWN 101 H772 PA6 25 23.240 28.243 36.162 333 H921 CWN 101 H921 PA6 25 32.801 33.798 23.170 334 H922 CWN 101 H922 PA6 25 31.453 33.632 24.291 335 H932 CWN 101 H932 PA6 25 32.223 36.045 23.522 336 H931 CWN 101 H931 PA6 25 33.586 35.830 24.598 337 H942 CWN 101 H942 PA6 25 30.648 36.164 25.253 338 H943 CWN 101 H943 PA6 25 32.037 37.064 25.841 339 H73 CWN 101 H73 PA6 25 24.546 27.054 31.405 340 H072 CWN 101 H072 PA6 25 19.863 20.943 26.277 341 H071 CWN 101 H071 PA6 25 21.415 21.153 25.457 342 H883 CWN 101 H883 PA6 25 16.928 23.720 30.391 343 H881 CWN 101 H881 PA6 25 17.633 25.235 30.965 344 H882 CWN 101 H882 PA6 25 17.962 23.713 31.825 345 H83 CWN 101 H83 PA6 25 21.079 22.916 27.371 Start of MODEL 3 1 H5 DCZ 1 H5 DC 1 28.832 9.558 24.285 2 H6 DCZ 1 H6 DC 1 31.099 8.931 23.615 3 HN41 DCZ 1 H41 DC 1 25.939 8.583 22.255 4 HN42 DCZ 1 H42 DC 1 26.522 9.436 23.679 5 H1' DCZ 1 H1' DC 1 31.780 7.018 20.464 6 H2'1 DCZ 1 H2' DC 1 31.794 9.832 20.947 7 H2'2 DCZ 1 H2'' DC 1 32.899 8.882 19.917 8 H3' DCZ 1 H3' DC 1 33.233 9.643 22.858 9 H4' DCZ 1 H4' DC 1 34.484 7.342 21.301 10 H5'1 DCZ 1 H5' DC 1 35.119 6.433 23.456 11 H5'2 DCZ 1 H5'' DC 1 35.782 8.061 23.292 12 HO5' DCZ 1 HO5' DC 1 33.428 7.328 24.766 13 H5' DG 2 H5' DG 2 33.419 10.983 19.188 14 H5'' DG 2 H5'' DG 2 34.042 12.606 18.930 15 H4' DG 2 H4' DG 2 31.756 12.101 17.983 16 H3' DG 2 H3' DG 2 32.641 14.520 18.903 17 H2' DG 2 H2' DG 2 31.839 14.230 21.127 18 H2'' DG 2 H2'' DG 2 30.485 15.140 20.414 19 H1' DG 2 H1' DG 2 29.232 13.184 19.973 20 H8 DG 2 H8 DG 2 31.841 12.277 22.746 21 H1 DG 2 H1 DG 2 25.704 12.843 24.671 22 H21 DG 2 H21 DG 2 24.506 13.401 22.973 23 H22 DG 2 H22 DG 2 25.196 13.576 21.339 24 H5' DA 3 H5' DA 3 27.818 14.061 18.460 25 H5'' DA 3 H5'' DA 3 27.941 14.725 16.833 26 H4' DA 3 H4' DA 3 25.736 15.045 17.403 27 H3' DA 3 H3' DA 3 27.205 17.250 16.777 28 H2' DA 3 H2' DA 3 27.708 18.002 18.939 29 H2'' DA 3 H2'' DA 3 26.162 18.846 18.748 30 H1' DA 3 H1' DA 3 25.015 17.362 20.079 31 H8 DA 3 H8 DA 3 28.850 16.785 20.517 32 H61 DA 3 H61 DA 3 27.193 15.637 26.463 33 H62 DA 3 H62 DA 3 28.604 15.696 25.400 34 H2 DA 3 H2 DA 3 23.657 16.757 24.333 35 H5' DT 4 H5' DT 4 22.749 18.242 17.824 36 H5'' DT 4 H5'' DT 4 22.134 19.697 17.030 37 H4' DT 4 H4' DT 4 21.605 19.728 19.405 38 H3' DT 4 H3' DT 4 23.640 21.762 18.491 39 H2' DT 4 H2' DT 4 24.038 22.388 20.648 40 H2'' DT 4 H2'' DT 4 22.359 22.085 21.170 41 H1' DT 4 H1' DT 4 22.744 20.062 21.868 42 H3 DT 4 H3 DT 4 26.037 19.863 24.880 43 H71 DT 4 H71 DT 4 29.070 21.334 21.415 44 H72 DT 4 H72 DT 4 29.114 19.589 21.138 45 H73 DT 4 H73 DT 4 28.294 20.648 19.971 46 H6 DT 4 H6 DT 4 25.988 20.651 20.127 47 H5' DG 5 H5' DG 5 19.919 22.020 20.758 48 H5'' DG 5 H5'' DG 5 18.831 23.319 20.268 49 H4' DG 5 H4' DG 5 18.493 22.784 22.594 50 H3' DG 5 H3' DG 5 18.910 25.353 21.637 51 H2' DG 5 H2' DG 5 21.079 25.633 22.420 52 H2'' DG 5 H2'' DG 5 20.218 26.148 23.904 53 H1' DG 5 H1' DG 5 20.515 24.075 24.955 54 H8 DG 5 H8 DG 5 22.968 24.191 21.921 55 H1 DG 5 H1 DG 5 25.640 22.821 27.632 56 H21 DG 5 H21 DG 5 24.250 23.369 29.210 57 H22 DG 5 H22 DG 5 22.644 23.980 28.832 58 H5' DT 6 H5' DT 6 17.207 25.516 26.189 59 H5'' DT 6 H5'' DT 6 16.237 26.990 26.339 60 H4' DT 6 H4' DT 6 17.786 26.792 28.219 61 H3' DT 6 H3' DT 6 18.526 28.983 26.240 62 H2' DT 6 H2' DT 6 20.364 29.462 27.611 63 H2'' DT 6 H2'' DT 6 19.575 28.715 29.040 64 H1' DT 6 H1' DT 6 20.592 26.874 28.745 65 H3 DT 6 H3 DT 6 24.846 26.490 27.470 66 H71 DT 6 H71 DT 6 23.195 26.919 22.924 67 H72 DT 6 H72 DT 6 21.928 28.146 23.154 68 H73 DT 6 H73 DT 6 23.642 28.583 23.305 69 H6 DT 6 H6 DT 6 20.855 28.015 25.212 70 H5' DA 7 H5' DA 7 18.239 29.991 30.674 71 H5'' DA 7 H5'' DA 7 18.127 31.707 31.084 72 H4' DA 7 H4' DA 7 20.008 30.402 32.180 73 H3' DA 7 H3' DA 7 20.627 32.880 30.557 74 H2' DA 7 H2' DA 7 22.945 32.487 30.910 75 H2'' DA 7 H2'' DA 7 22.634 31.442 32.314 76 H1' DA 7 H1' DA 7 22.888 29.732 31.000 77 H8 DA 7 H8 DA 7 21.323 31.465 27.951 78 H61 DA 7 H61 DA 7 26.556 29.202 25.369 79 H62 DA 7 H62 DA 7 25.047 30.036 24.978 80 H2 DA 7 H2 DA 7 27.073 29.061 29.632 81 H5' DC 8 H5' DC 8 23.052 32.422 34.098 82 H5'' DC 8 H5'' DC 8 23.307 33.877 35.044 83 H4' DC 8 H4' DC 8 25.412 32.693 34.442 84 H3' DC 8 H3' DC 8 24.907 35.451 34.347 85 H2' DC 8 H2' DC 8 24.859 35.596 32.026 86 H2'' DC 8 H2'' DC 8 26.606 35.830 32.266 87 H1' DC 8 H1' DC 8 27.084 33.508 31.920 88 H41 DC 8 H41 DC 8 25.720 32.893 25.716 89 H42 DC 8 H42 DC 8 24.094 33.480 25.980 90 H5 DC 8 H5 DC 8 23.275 34.266 28.068 91 H6 DC 8 H6 DC 8 23.803 34.544 30.435 92 H5' DA 9 H5' DA 9 29.390 34.824 33.649 93 H5'' DA 9 H5'' DA 9 30.384 36.156 34.269 94 H4' DA 9 H4' DA 9 30.819 35.745 31.934 95 H3' DA 9 H3' DA 9 29.656 38.353 32.728 96 H2' DA 9 H2' DA 9 28.537 38.602 30.790 97 H2'' DA 9 H2'' DA 9 30.071 38.488 29.893 98 H1' DA 9 H1' DA 9 29.903 36.228 29.526 99 H8 DA 9 H8 DA 9 26.338 37.500 30.565 100 H61 DA 9 H61 DA 9 25.040 36.071 24.590 101 H62 DA 9 H62 DA 9 24.330 36.827 26.023 102 H2 DA 9 H2 DA 9 29.100 34.960 25.327 103 H5' DT 10 H5' DT 10 32.884 37.995 29.572 104 H5'' DT 10 H5'' DT 10 33.994 39.366 29.444 105 H4' DT 10 H4' DT 10 33.261 38.706 27.234 106 H3' DT 10 H3' DT 10 32.112 41.323 28.222 107 H2' DT 10 H2' DT 10 30.693 41.436 26.460 108 H2'' DT 10 H2'' DT 10 31.876 40.730 25.323 109 H1' DT 10 H1' DT 10 31.166 38.666 25.566 110 H3 DT 10 H3 DT 10 26.878 38.859 24.190 111 H71 DT 10 H71 DT 10 26.095 41.507 28.263 112 H72 DT 10 H72 DT 10 25.609 39.874 28.719 113 H73 DT 10 H73 DT 10 27.116 40.550 29.370 114 H6 DT 10 H6 DT 10 29.096 40.096 28.297 115 H5' DC 11 H5' DC 11 34.201 40.846 24.315 116 H5'' DC 11 H5'' DC 11 35.078 42.249 23.704 117 H4' DC 11 H4' DC 11 33.823 41.077 21.951 118 H3' DC 11 H3' DC 11 33.818 43.847 22.238 119 H2' DC 11 H2' DC 11 31.689 43.899 23.269 120 H2'' DC 11 H2'' DC 11 31.207 44.151 21.572 121 H1' DC 11 H1' DC 11 30.911 41.789 21.200 122 H41 DC 11 H41 DC 11 25.723 42.877 25.086 123 H42 DC 11 H42 DC 11 25.235 42.040 23.602 124 H5 DC 11 H5 DC 11 28.085 43.217 25.617 125 H6 DC 11 H6 DC 11 30.353 42.997 24.722 126 H5' DG 12 H5' DG 12 31.139 41.948 18.944 127 H5'' DG 12 H5'' DG 12 31.536 42.681 17.388 128 H4' DG 12 H4' DG 12 29.209 42.098 17.418 129 H3' DG 12 H3' DG 12 30.068 44.757 16.861 130 HO3' DG 12 HO3' DG 12 28.157 44.752 15.568 131 H2' DG 12 H2' DG 12 29.101 45.593 18.875 132 H2'' DG 12 H2'' DG 12 27.701 45.767 17.760 133 H1' DG 12 H1' DG 12 26.914 43.521 18.337 134 H8 DG 12 H8 DG 12 28.769 44.985 21.451 135 H1 DG 12 H1 DG 12 22.325 44.916 21.732 136 H21 DG 12 H21 DG 12 21.536 44.136 19.771 137 H22 DG 12 H22 DG 12 22.658 43.673 18.505 138 H5 DCZ 13 H5 DC 13 15.948 47.450 15.223 139 H6 DCZ 13 H6 DC 13 15.290 45.130 15.635 140 HN41 DCZ 13 H41 DC 13 19.183 48.176 13.653 141 HN42 DCZ 13 H42 DC 13 17.711 48.847 14.368 142 H1' DCZ 13 H1' DC 13 17.275 42.221 14.511 143 H2'1 DCZ 13 H2' DC 13 16.948 43.528 17.237 144 H2'2 DCZ 13 H2'' DC 13 18.176 42.359 16.705 145 H3' DCZ 13 H3' DC 13 15.974 41.536 18.081 146 H4' DCZ 13 H4' DC 13 14.419 41.007 15.878 147 H5'1 DCZ 13 H5' DC 13 13.062 42.984 16.369 148 H5'2 DCZ 13 H5'' DC 13 13.470 42.040 17.805 149 HO5' DCZ 13 HO5' DC 13 13.665 44.307 18.175 150 H5' DG 14 H5' DG 14 19.552 40.982 15.179 151 H5'' DG 14 H5'' DG 14 18.718 39.452 14.926 152 H4' DG 14 H4' DG 14 21.029 39.373 14.184 153 H3' DG 14 H3' DG 14 19.834 37.348 15.599 154 H2' DG 14 H2' DG 14 20.597 37.955 17.712 155 H2'' DG 14 H2'' DG 14 21.923 36.879 17.280 156 H1' DG 14 H1' DG 14 23.363 38.630 16.689 157 H8 DG 14 H8 DG 14 20.416 39.800 18.971 158 H1 DG 14 H1 DG 14 26.325 41.194 21.108 159 H21 DG 14 H21 DG 14 27.796 40.625 19.596 160 H22 DG 14 H22 DG 14 27.293 39.906 18.059 161 H5' DA 15 H5' DA 15 24.254 37.683 14.666 162 H5'' DA 15 H5'' DA 15 24.619 36.306 13.630 163 H4' DA 15 H4' DA 15 26.653 37.097 14.523 164 H3' DA 15 H3' DA 15 25.864 34.454 14.782 165 H2' DA 15 H2' DA 15 25.328 34.484 17.035 166 H2'' DA 15 H2'' DA 15 27.069 34.171 17.232 167 H1' DA 15 H1' DA 15 27.559 36.403 17.748 168 H8 DA 15 H8 DA 15 23.703 35.868 17.990 169 H61 DA 15 H61 DA 15 24.422 38.540 23.621 170 H62 DA 15 H62 DA 15 23.203 37.850 22.550 171 H2 DA 15 H2 DA 15 28.319 38.231 21.822 172 H5' DT 16 H5' DT 16 30.241 35.214 16.216 173 H5'' DT 16 H5'' DT 16 31.295 33.824 15.896 174 H4' DT 16 H4' DT 16 31.607 34.566 18.180 175 H3' DT 16 H3' DT 16 30.116 31.958 17.865 176 H2' DT 16 H2' DT 16 29.571 31.931 20.034 177 H2'' DT 16 H2'' DT 16 31.164 32.543 20.575 178 H1' DT 16 H1' DT 16 30.533 34.703 20.546 179 H3 DT 16 H3 DT 16 27.266 35.279 23.580 180 H71 DT 16 H71 DT 16 24.571 32.271 20.900 181 H72 DT 16 H72 DT 16 24.113 33.847 20.252 182 H73 DT 16 H73 DT 16 25.103 32.746 19.268 183 H6 DT 16 H6 DT 16 27.398 33.091 19.292 184 H5' DG 17 H5' DG 17 33.607 32.192 20.731 185 H5'' DG 17 H5'' DG 17 34.739 30.968 20.147 186 H4' DG 17 H4' DG 17 35.021 31.101 22.460 187 H3' DG 17 H3' DG 17 34.365 28.671 21.282 188 H2' DG 17 H2' DG 17 32.166 28.528 21.954 189 H2'' DG 17 H2'' DG 17 32.863 27.882 23.453 190 H1' DG 17 H1' DG 17 32.569 29.857 24.625 191 H8 DG 17 H8 DG 17 30.500 29.973 21.312 192 H1 DG 17 H1 DG 17 27.515 32.302 26.554 193 H21 DG 17 H21 DG 17 28.850 32.076 28.291 194 H22 DG 17 H22 DG 17 30.451 31.351 28.085 195 H5' DT 18 H5' DT 18 35.507 29.408 25.554 196 H5'' DT 18 H5'' DT 18 36.626 28.250 26.275 197 H4' DT 18 H4' DT 18 35.136 29.309 27.908 198 H3' DT 18 H3' DT 18 35.598 26.528 27.748 199 H2' DT 18 H2' DT 18 33.429 25.960 27.125 200 H2'' DT 18 H2'' DT 18 33.141 26.069 28.893 201 H1' DT 18 H1' DT 18 32.419 28.323 28.759 202 H3 DT 18 H3 DT 18 28.208 28.710 27.201 203 H71 DT 18 H71 DT 18 31.148 26.129 23.400 204 H72 DT 18 H72 DT 18 29.400 25.856 23.540 205 H73 DT 18 H73 DT 18 29.992 27.384 22.885 206 H6 DT 18 H6 DT 18 32.187 26.653 25.408 207 H5' DA 19 H5' DA 19 33.732 27.518 31.966 208 H5'' DA 19 H5'' DA 19 34.391 26.425 33.187 209 H4' DA 19 H4' DA 19 31.982 26.481 33.202 210 H3' DA 19 H3' DA 19 33.343 23.915 32.733 211 H2' DA 19 H2' DA 19 31.846 23.303 31.118 212 H2'' DA 19 H2'' DA 19 30.623 23.211 32.413 213 H1' DA 19 H1' DA 19 29.865 25.415 32.047 214 H8 DA 19 H8 DA 19 31.732 24.084 28.887 215 H61 DA 19 H61 DA 19 26.527 25.789 25.923 216 H62 DA 19 H62 DA 19 28.056 24.937 25.725 217 H2 DA 19 H2 DA 19 25.892 26.541 30.137 218 H5' DC 20 H5' DC 20 29.530 24.770 34.897 219 H5'' DC 20 H5'' DC 20 29.182 23.852 36.364 220 H4' DC 20 H4' DC 20 27.154 24.309 35.112 221 H3' DC 20 H3' DC 20 27.861 21.717 35.959 222 H2' DC 20 H2' DC 20 28.297 20.958 33.771 223 H2'' DC 20 H2'' DC 20 26.557 20.570 33.847 224 H1' DC 20 H1' DC 20 25.944 22.734 32.947 225 H41 DC 20 H41 DC 20 27.616 22.118 26.882 226 H42 DC 20 H42 DC 20 29.221 21.557 27.308 227 H5 DC 20 H5 DC 20 29.925 21.157 29.563 228 H6 DC 20 H6 DC 20 29.285 21.393 31.903 229 H5' DA 21 H5' DA 21 23.772 21.719 34.103 230 H5'' DA 21 H5'' DA 21 22.577 20.783 35.000 231 H4' DA 21 H4' DA 21 22.334 20.074 32.815 232 H3' DA 21 H3' DA 21 23.357 18.108 34.604 233 H2' DA 21 H2' DA 21 25.477 18.155 33.438 234 H2'' DA 21 H2'' DA 21 24.595 16.847 32.571 235 H1' DA 21 H1' DA 21 23.610 18.528 31.031 236 H8 DA 21 H8 DA 21 27.313 18.091 31.894 237 H61 DA 21 H61 DA 21 28.032 19.073 25.737 238 H62 DA 21 H62 DA 21 28.869 18.470 27.168 239 H2 DA 21 H2 DA 21 23.939 19.983 26.726 240 H5' DT 22 H5' DT 22 19.753 18.260 32.138 241 H5'' DT 22 H5'' DT 22 18.369 17.178 32.314 242 H4' DT 22 H4' DT 22 18.657 17.912 30.014 243 H3' DT 22 H3' DT 22 18.299 15.235 30.651 244 H2' DT 22 H2' DT 22 20.569 14.643 30.315 245 H2'' DT 22 H2'' DT 22 19.942 14.359 28.665 246 H1' DT 22 H1' DT 22 20.510 16.554 27.941 247 H3 DT 22 H3 DT 22 24.796 16.196 26.644 248 H71 DT 22 H71 DT 22 24.509 14.577 31.840 249 H72 DT 22 H72 DT 22 25.596 13.740 30.713 250 H73 DT 22 H73 DT 22 25.998 15.366 31.257 251 H6 DT 22 H6 DT 22 22.592 15.393 30.854 252 H5' DC 23 H5' DC 23 18.529 16.214 26.007 253 H5'' DC 23 H5'' DC 23 17.229 15.367 25.168 254 H4' DC 23 H4' DC 23 19.242 15.385 23.830 255 H3' DC 23 H3' DC 23 17.820 13.051 24.176 256 H2' DC 23 H2' DC 23 19.239 12.331 26.016 257 H2'' DC 23 H2'' DC 23 19.917 11.427 24.632 258 H1' DC 23 H1' DC 23 21.420 13.199 24.091 259 H41 DC 23 H41 DC 23 25.960 12.111 28.123 260 H42 DC 23 H42 DC 23 24.884 11.707 29.467 261 H5 DC 23 H5 DC 23 22.461 11.891 29.236 262 H6 DC 23 H6 DC 23 20.664 12.446 27.672 263 H5' DG 24 H5' DG 24 21.986 12.306 22.190 264 H5'' DG 24 H5'' DG 24 21.887 11.229 20.795 265 H4' DG 24 H4' DG 24 23.813 10.692 22.200 266 H3' DG 24 H3' DG 24 21.995 8.764 21.295 267 HO3' DG 24 HO3' DG 24 23.755 7.329 21.641 268 H2' DG 24 H2' DG 24 20.936 8.533 23.417 269 H2'' DG 24 H2'' DG 24 22.192 7.254 23.543 270 H1' DG 24 H1' DG 24 23.755 8.776 24.573 271 H8 DG 24 H8 DG 24 19.974 9.316 25.389 272 H1 DG 24 H1 DG 24 23.877 8.372 30.434 273 H21 DG 24 H21 DG 24 25.987 8.143 29.674 274 H22 DG 24 H22 DG 24 26.312 8.294 27.956 275 H33 CWN 101 H33 PA6 25 29.101 28.134 31.339 276 H35 CWN 101 H35 PA6 25 32.336 29.542 33.875 277 H031 CWN 101 H031 PA6 25 20.308 16.719 21.199 278 H032 CWN 101 H032 PA6 25 21.407 17.979 20.621 279 H042 CWN 101 H042 PA6 25 22.152 18.300 23.061 280 H041 CWN 101 H041 PA6 25 20.807 17.288 23.548 281 H052 CWN 101 H052 PA6 25 19.168 18.867 22.626 282 H051 CWN 101 H051 PA6 25 20.440 19.809 21.828 283 HN02 CWN 101 HN02 PA6 25 21.170 20.675 23.939 284 HN01 CWN 101 HN01 PA6 25 23.276 16.709 21.696 285 H004 CWN 101 H004 PA6 25 23.438 15.092 19.865 286 H005 CWN 101 H005 PA6 25 22.792 16.637 19.275 287 H006 CWN 101 H006 PA6 25 21.694 15.264 19.552 288 H001 CWN 101 H001 PA6 25 21.170 14.581 21.893 289 H002 CWN 101 H002 PA6 25 21.953 15.383 23.282 290 H003 CWN 101 H003 PA6 25 22.917 14.364 22.191 291 HN03 CWN 101 HN03 PA6 25 22.124 20.644 28.734 292 H13 CWN 101 H13 PA6 25 22.864 21.789 30.232 293 HN1 CWN 101 HN1 PA6 25 23.794 23.595 31.906 294 H15 CWN 101 H15 PA6 25 20.205 23.056 33.419 295 H112 CWN 101 H112 PA6 25 18.444 20.259 32.007 296 H111 CWN 101 H111 PA6 25 17.900 21.752 31.188 297 H113 CWN 101 H113 PA6 25 18.202 21.755 32.945 298 HN2 CWN 101 HN2 PA6 25 27.584 26.694 32.309 299 HN3 CWN 101 HN3 PA6 25 31.045 29.592 30.189 300 H25 CWN 101 H25 PA6 25 25.822 27.275 35.708 301 H223 CWN 101 H223 PA6 25 22.380 26.424 35.737 302 H222 CWN 101 H222 PA6 25 23.740 26.833 36.812 303 H221 CWN 101 H221 PA6 25 23.247 25.127 36.619 304 HN4 CWN 101 HN4 PA6 25 31.682 32.124 26.409 305 H23 CWN 101 H23 PA6 25 25.437 24.996 32.038 306 HN9 CWN 101 HN9 PA6 25 30.840 35.005 27.290 307 HN5 CWN 101 HN5 PA6 25 29.322 32.487 30.907 308 H332 CWN 101 H332 PA6 25 31.848 28.464 35.963 309 H331 CWN 101 H331 PA6 25 30.790 27.030 35.895 310 H333 CWN 101 H333 PA6 25 30.106 28.630 36.323 311 HN6 CWN 101 HN6 PA6 25 25.558 29.492 32.078 312 HN7 CWN 101 HN7 PA6 25 22.053 26.227 30.700 313 H44 CWN 101 H44 PA6 25 35.229 32.540 27.839 314 H443 CWN 101 H443 PA6 25 36.468 31.840 29.857 315 H442 CWN 101 H442 PA6 25 35.871 30.343 30.617 316 H441 CWN 101 H441 PA6 25 35.410 31.939 31.288 317 H081 CWN 101 H081 PA6 25 21.783 19.277 26.834 318 H082 CWN 101 H082 PA6 25 20.186 18.842 27.474 319 H53 CWN 101 H53 PA6 25 30.224 33.914 28.881 320 H55 CWN 101 H55 PA6 25 32.878 33.460 32.281 321 H553 CWN 101 H553 PA6 25 34.438 36.104 30.452 322 H551 CWN 101 H551 PA6 25 35.129 34.569 29.841 323 H552 CWN 101 H552 PA6 25 34.809 34.778 31.585 324 H63 CWN 101 H63 PA6 25 27.754 30.990 31.369 325 H65 CWN 101 H65 PA6 25 27.051 30.219 35.578 326 H663 CWN 101 H663 PA6 25 30.438 31.175 35.640 327 H661 CWN 101 H661 PA6 25 28.950 31.254 36.622 328 H662 CWN 101 H662 PA6 25 29.518 32.708 35.757 329 H75 CWN 101 H75 PA6 25 20.364 27.888 33.815 330 H771 CWN 101 H771 PA6 25 22.207 30.716 35.124 331 H773 CWN 101 H773 PA6 25 22.321 29.263 36.163 332 H772 CWN 101 H772 PA6 25 20.782 29.683 35.361 333 H921 CWN 101 H921 PA6 25 32.570 33.377 23.655 334 H922 CWN 101 H922 PA6 25 31.310 33.535 24.867 335 H932 CWN 101 H932 PA6 25 32.202 35.700 23.677 336 H931 CWN 101 H931 PA6 25 33.653 35.516 24.640 337 H942 CWN 101 H942 PA6 25 30.891 36.383 25.430 338 H943 CWN 101 H943 PA6 25 32.463 37.013 25.928 339 H73 CWN 101 H73 PA6 25 24.115 27.690 31.633 340 H072 CWN 101 H072 PA6 25 19.350 21.154 26.713 341 H071 CWN 101 H071 PA6 25 20.914 21.405 25.931 342 H883 CWN 101 H883 PA6 25 17.470 24.528 31.982 343 H881 CWN 101 H881 PA6 25 16.483 24.360 30.526 344 H882 CWN 101 H882 PA6 25 17.144 25.943 30.951 345 H83 CWN 101 H83 PA6 25 20.741 23.310 27.741 Start of MODEL 4 1 H5 DCZ 1 H5 DC 1 28.539 10.033 24.739 2 H6 DCZ 1 H6 DC 1 30.805 9.692 23.879 3 HN41 DCZ 1 H41 DC 1 25.647 8.633 22.960 4 HN42 DCZ 1 H42 DC 1 26.204 9.584 24.342 5 H1' DCZ 1 H1' DC 1 31.475 7.620 20.830 6 H2'1 DCZ 1 H2' DC 1 31.520 10.442 21.180 7 H2'2 DCZ 1 H2'' DC 1 32.624 9.442 20.198 8 H3' DCZ 1 H3' DC 1 32.967 10.476 23.031 9 H4' DCZ 1 H4' DC 1 34.255 7.941 21.970 10 H5'1 DCZ 1 H5' DC 1 34.528 7.358 24.302 11 H5'2 DCZ 1 H5'' DC 1 35.146 8.996 24.070 12 HO5' DCZ 1 HO5' DC 1 32.590 8.276 25.164 13 H5' DG 2 H5' DG 2 33.605 11.449 19.203 14 H5'' DG 2 H5'' DG 2 34.219 13.068 18.878 15 H4' DG 2 H4' DG 2 31.956 12.491 17.916 16 H3' DG 2 H3' DG 2 32.686 14.989 18.677 17 H2' DG 2 H2' DG 2 32.045 14.703 20.983 18 H2'' DG 2 H2'' DG 2 30.637 15.569 20.335 19 H1' DG 2 H1' DG 2 29.424 13.569 19.965 20 H8 DG 2 H8 DG 2 32.106 12.904 22.728 21 H1 DG 2 H1 DG 2 25.939 12.917 24.641 22 H21 DG 2 H21 DG 2 24.695 13.363 22.943 23 H22 DG 2 H22 DG 2 25.368 13.614 21.312 24 H5' DA 3 H5' DA 3 27.761 14.436 19.323 25 H5'' DA 3 H5'' DA 3 27.984 14.367 17.582 26 H4' DA 3 H4' DA 3 25.825 14.969 17.635 27 H3' DA 3 H3' DA 3 27.233 17.153 16.892 28 H2' DA 3 H2' DA 3 27.578 18.177 18.972 29 H2'' DA 3 H2'' DA 3 25.993 18.892 18.641 30 H1' DA 3 H1' DA 3 24.937 17.596 20.184 31 H8 DA 3 H8 DA 3 28.784 17.133 20.594 32 H61 DA 3 H61 DA 3 27.191 15.700 26.505 33 H62 DA 3 H62 DA 3 28.604 15.911 25.471 34 H2 DA 3 H2 DA 3 23.603 16.631 24.374 35 H5' DT 4 H5' DT 4 22.832 17.955 17.828 36 H5'' DT 4 H5'' DT 4 22.037 19.148 16.794 37 H4' DT 4 H4' DT 4 21.447 19.540 19.094 38 H3' DT 4 H3' DT 4 22.865 21.571 17.550 39 H2' DT 4 H2' DT 4 24.396 22.017 19.136 40 H2'' DT 4 H2'' DT 4 23.103 22.776 20.069 41 H1' DT 4 H1' DT 4 22.628 20.833 21.311 42 H3 DT 4 H3 DT 4 25.776 20.106 24.494 43 H71 DT 4 H71 DT 4 28.339 20.790 19.722 44 H72 DT 4 H72 DT 4 29.050 21.470 21.202 45 H73 DT 4 H73 DT 4 29.042 19.723 20.959 46 H6 DT 4 H6 DT 4 26.046 20.870 19.745 47 H5' DG 5 H5' DG 5 20.013 21.704 21.023 48 H5'' DG 5 H5'' DG 5 18.695 22.770 20.537 49 H4' DG 5 H4' DG 5 18.652 22.663 22.881 50 H3' DG 5 H3' DG 5 18.962 25.092 21.530 51 H2' DG 5 H2' DG 5 21.162 25.509 22.154 52 H2'' DG 5 H2'' DG 5 20.383 26.173 23.618 53 H1' DG 5 H1' DG 5 20.771 24.219 24.868 54 H8 DG 5 H8 DG 5 23.106 24.216 21.729 55 H1 DG 5 H1 DG 5 25.933 22.877 27.382 56 H21 DG 5 H21 DG 5 24.501 23.252 28.994 57 H22 DG 5 H22 DG 5 22.869 23.802 28.629 58 H5' DT 6 H5' DT 6 17.485 25.276 25.971 59 H5'' DT 6 H5'' DT 6 16.472 26.681 26.338 60 H4' DT 6 H4' DT 6 18.173 26.320 28.072 61 H3' DT 6 H3' DT 6 18.543 28.795 26.358 62 H2' DT 6 H2' DT 6 20.518 29.234 27.498 63 H2'' DT 6 H2'' DT 6 19.925 28.401 28.973 64 H1' DT 6 H1' DT 6 20.856 26.557 28.501 65 H3 DT 6 H3 DT 6 25.158 26.415 27.406 66 H71 DT 6 H71 DT 6 23.657 26.835 22.819 67 H72 DT 6 H72 DT 6 22.317 27.988 23.009 68 H73 DT 6 H73 DT 6 24.001 28.519 23.212 69 H6 DT 6 H6 DT 6 21.202 27.863 25.041 70 H5' DA 7 H5' DA 7 18.616 29.439 30.877 71 H5'' DA 7 H5'' DA 7 18.344 31.116 31.358 72 H4' DA 7 H4' DA 7 20.491 30.135 32.199 73 H3' DA 7 H3' DA 7 20.701 32.520 30.334 74 H2' DA 7 H2' DA 7 23.059 32.375 30.597 75 H2'' DA 7 H2'' DA 7 22.921 31.395 32.078 76 H1' DA 7 H1' DA 7 23.214 29.611 30.892 77 H8 DA 7 H8 DA 7 21.504 31.240 27.834 78 H61 DA 7 H61 DA 7 26.783 29.248 25.107 79 H62 DA 7 H62 DA 7 25.241 30.032 24.755 80 H2 DA 7 H2 DA 7 27.330 28.931 29.362 81 H5' DC 8 H5' DC 8 23.100 32.333 33.937 82 H5'' DC 8 H5'' DC 8 23.423 33.824 34.798 83 H4' DC 8 H4' DC 8 25.456 32.428 34.295 84 H3' DC 8 H3' DC 8 25.172 35.206 34.192 85 H2' DC 8 H2' DC 8 25.202 35.354 31.864 86 H2'' DC 8 H2'' DC 8 26.951 35.464 32.168 87 H1' DC 8 H1' DC 8 27.274 33.116 31.834 88 H41 DC 8 H41 DC 8 26.120 32.670 25.577 89 H42 DC 8 H42 DC 8 24.498 33.293 25.792 90 H5 DC 8 H5 DC 8 23.631 34.069 27.872 91 H6 DC 8 H6 DC 8 24.103 34.321 30.252 92 H5' DA 9 H5' DA 9 29.679 34.473 33.615 93 H5'' DA 9 H5'' DA 9 30.615 35.784 34.344 94 H4' DA 9 H4' DA 9 31.164 35.604 32.001 95 H3' DA 9 H3' DA 9 29.861 38.048 32.992 96 H2' DA 9 H2' DA 9 28.488 38.240 31.223 97 H2'' DA 9 H2'' DA 9 29.912 38.567 30.215 98 H1' DA 9 H1' DA 9 30.188 36.307 29.588 99 H8 DA 9 H8 DA 9 26.540 37.265 30.636 100 H61 DA 9 H61 DA 9 25.362 35.887 24.634 101 H62 DA 9 H62 DA 9 24.616 36.608 26.069 102 H2 DA 9 H2 DA 9 29.411 34.781 25.431 103 H5' DT 10 H5' DT 10 33.005 38.038 29.715 104 H5'' DT 10 H5'' DT 10 33.929 39.525 29.478 105 H4' DT 10 H4' DT 10 33.199 38.604 27.351 106 H3' DT 10 H3' DT 10 31.702 41.140 28.103 107 H2' DT 10 H2' DT 10 30.719 41.025 25.981 108 H2'' DT 10 H2'' DT 10 32.022 40.001 25.308 109 H1' DT 10 H1' DT 10 30.894 38.174 25.787 110 H3 DT 10 H3 DT 10 26.624 38.834 24.550 111 H71 DT 10 H71 DT 10 26.106 41.359 28.703 112 H72 DT 10 H72 DT 10 25.713 39.709 29.198 113 H73 DT 10 H73 DT 10 27.236 40.450 29.737 114 H6 DT 10 H6 DT 10 29.129 39.886 28.541 115 H5' DC 11 H5' DC 11 34.107 40.624 24.455 116 H5'' DC 11 H5'' DC 11 34.956 42.047 23.855 117 H4' DC 11 H4' DC 11 33.920 40.623 22.080 118 H3' DC 11 H3' DC 11 34.013 43.379 22.077 119 H2' DC 11 H2' DC 11 31.806 43.665 22.941 120 H2'' DC 11 H2'' DC 11 31.474 43.765 21.192 121 H1' DC 11 H1' DC 11 31.026 41.434 21.018 122 H41 DC 11 H41 DC 11 25.861 42.313 25.089 123 H42 DC 11 H42 DC 11 25.364 41.620 23.536 124 H5 DC 11 H5 DC 11 28.257 42.785 25.532 125 H6 DC 11 H6 DC 11 30.495 42.702 24.524 126 H5' DG 12 H5' DG 12 31.412 42.110 18.316 127 H5'' DG 12 H5'' DG 12 31.965 43.079 16.944 128 H4' DG 12 H4' DG 12 29.611 43.201 16.929 129 H3' DG 12 H3' DG 12 31.078 45.619 17.320 130 HO3' DG 12 HO3' DG 12 29.267 46.513 16.206 131 H2' DG 12 H2' DG 12 30.253 45.849 19.545 132 H2'' DG 12 H2'' DG 12 28.971 46.730 18.641 133 H1' DG 12 H1' DG 12 27.704 44.648 18.350 134 H8 DG 12 H8 DG 12 29.446 45.444 21.741 135 H1 DG 12 H1 DG 12 23.146 44.069 21.957 136 H21 DG 12 H21 DG 12 22.485 43.422 19.894 137 H22 DG 12 H22 DG 12 23.661 43.345 18.594 138 H5 DCZ 13 H5 DC 13 17.689 47.208 15.695 139 H6 DCZ 13 H6 DC 13 16.597 45.014 15.650 140 HN41 DCZ 13 H41 DC 13 21.252 47.492 14.834 141 HN42 DCZ 13 H42 DC 13 19.814 48.342 15.406 142 H1' DCZ 13 H1' DC 13 18.267 41.925 14.487 143 H2'1 DCZ 13 H2' DC 13 17.760 43.004 17.283 144 H2'2 DCZ 13 H2'' DC 13 18.898 41.734 16.770 145 H3' DCZ 13 H3' DC 13 16.444 41.072 17.751 146 H4' DCZ 13 H4' DC 13 15.176 41.002 15.311 147 H5'1 DCZ 13 H5' DC 13 13.941 43.023 15.872 148 H5'2 DCZ 13 H5'' DC 13 14.082 41.935 17.246 149 HO5' DCZ 13 HO5' DC 13 15.570 43.341 18.210 150 H5' DG 14 H5' DG 14 19.849 40.269 14.872 151 H5'' DG 14 H5'' DG 14 19.255 38.636 14.587 152 H4' DG 14 H4' DG 14 21.602 38.973 13.909 153 H3' DG 14 H3' DG 14 20.592 36.697 15.049 154 H2' DG 14 H2' DG 14 21.095 37.224 17.268 155 H2'' DG 14 H2'' DG 14 22.566 36.322 16.882 156 H1' DG 14 H1' DG 14 23.837 38.246 16.494 157 H8 DG 14 H8 DG 14 20.767 38.723 18.850 158 H1 DG 14 H1 DG 14 26.386 41.123 20.903 159 H21 DG 14 H21 DG 14 27.851 40.981 19.256 160 H22 DG 14 H22 DG 14 27.369 40.382 17.663 161 H5' DA 15 H5' DA 15 25.002 37.636 14.564 162 H5'' DA 15 H5'' DA 15 25.661 36.399 13.497 163 H4' DA 15 H4' DA 15 27.457 37.382 14.665 164 H3' DA 15 H3' DA 15 27.017 34.645 14.697 165 H2' DA 15 H2' DA 15 26.300 34.422 16.882 166 H2'' DA 15 H2'' DA 15 28.040 34.388 17.249 167 H1' DA 15 H1' DA 15 28.097 36.621 17.931 168 H8 DA 15 H8 DA 15 24.401 35.386 17.730 169 H61 DA 15 H61 DA 15 24.010 37.946 23.439 170 H62 DA 15 H62 DA 15 23.069 37.051 22.244 171 H2 DA 15 H2 DA 15 28.033 38.518 22.038 172 H5' DT 16 H5' DT 16 31.196 35.805 16.552 173 H5'' DT 16 H5'' DT 16 32.385 34.527 16.258 174 H4' DT 16 H4' DT 16 32.463 35.114 18.590 175 H3' DT 16 H3' DT 16 30.994 32.503 18.117 176 H2' DT 16 H2' DT 16 30.614 32.336 20.349 177 H2'' DT 16 H2'' DT 16 32.137 33.151 20.813 178 H1' DT 16 H1' DT 16 31.188 35.189 20.851 179 H3 DT 16 H3 DT 16 27.668 35.379 23.624 180 H71 DT 16 H71 DT 16 26.154 32.479 19.267 181 H72 DT 16 H72 DT 16 25.611 31.975 20.887 182 H73 DT 16 H73 DT 16 24.956 33.443 20.163 183 H6 DT 16 H6 DT 16 28.368 33.190 19.393 184 H5' DG 17 H5' DG 17 34.513 32.348 20.952 185 H5'' DG 17 H5'' DG 17 35.562 31.067 20.341 186 H4' DG 17 H4' DG 17 35.692 31.051 22.695 187 H3' DG 17 H3' DG 17 35.011 28.744 21.294 188 H2' DG 17 H2' DG 17 32.772 28.667 21.816 189 H2'' DG 17 H2'' DG 17 33.336 27.874 23.299 190 H1' DG 17 H1' DG 17 33.095 29.788 24.599 191 H8 DG 17 H8 DG 17 31.156 30.111 21.226 192 H1 DG 17 H1 DG 17 27.951 32.106 26.478 193 H21 DG 17 H21 DG 17 29.271 31.896 28.240 194 H22 DG 17 H22 DG 17 30.913 31.271 28.042 195 H5' DT 18 H5' DT 18 36.031 29.148 25.655 196 H5'' DT 18 H5'' DT 18 36.976 27.856 26.398 197 H4' DT 18 H4' DT 18 35.460 29.035 27.951 198 H3' DT 18 H3' DT 18 35.742 26.226 27.766 199 H2' DT 18 H2' DT 18 33.575 25.817 27.013 200 H2'' DT 18 H2'' DT 18 33.212 25.930 28.769 201 H1' DT 18 H1' DT 18 32.666 28.230 28.626 202 H3 DT 18 H3 DT 18 28.474 28.683 27.029 203 H71 DT 18 H71 DT 18 31.473 26.290 23.151 204 H72 DT 18 H72 DT 18 29.718 26.034 23.244 205 H73 DT 18 H73 DT 18 30.345 27.583 22.680 206 H6 DT 18 H6 DT 18 32.484 26.715 25.203 207 H5' DA 19 H5' DA 19 34.516 26.766 32.611 208 H5'' DA 19 H5'' DA 19 34.882 25.168 33.242 209 H4' DA 19 H4' DA 19 32.478 26.121 33.238 210 H3' DA 19 H3' DA 19 33.329 23.329 32.899 211 H2' DA 19 H2' DA 19 31.795 22.942 31.234 212 H2'' DA 19 H2'' DA 19 30.529 23.167 32.475 213 H1' DA 19 H1' DA 19 30.270 25.465 31.986 214 H8 DA 19 H8 DA 19 32.077 23.917 28.901 215 H61 DA 19 H61 DA 19 26.954 25.780 25.856 216 H62 DA 19 H62 DA 19 28.485 24.929 25.660 217 H2 DA 19 H2 DA 19 26.279 26.497 30.072 218 H5' DC 20 H5' DC 20 29.458 24.516 34.889 219 H5'' DC 20 H5'' DC 20 29.021 23.602 36.334 220 H4' DC 20 H4' DC 20 27.077 23.958 34.955 221 H3' DC 20 H3' DC 20 27.876 21.350 35.735 222 H2' DC 20 H2' DC 20 28.354 20.671 33.539 223 H2'' DC 20 H2'' DC 20 26.605 20.293 33.539 224 H1' DC 20 H1' DC 20 26.042 22.492 32.718 225 H41 DC 20 H41 DC 20 27.903 22.212 26.687 226 H42 DC 20 H42 DC 20 29.513 21.679 27.132 227 H5 DC 20 H5 DC 20 30.153 21.139 29.387 228 H6 DC 20 H6 DC 20 29.437 21.231 31.720 229 H5' DA 21 H5' DA 21 23.576 21.321 34.014 230 H5'' DA 21 H5'' DA 21 22.553 20.174 34.877 231 H4' DA 21 H4' DA 21 22.276 19.692 32.595 232 H3' DA 21 H3' DA 21 23.495 17.661 34.215 233 H2' DA 21 H2' DA 21 25.538 17.925 32.998 234 H2'' DA 21 H2'' DA 21 24.712 16.645 32.049 235 H1' DA 21 H1' DA 21 23.584 18.391 30.676 236 H8 DA 21 H8 DA 21 27.314 18.025 31.447 237 H61 DA 21 H61 DA 21 27.929 19.388 25.370 238 H62 DA 21 H62 DA 21 28.781 18.715 26.759 239 H2 DA 21 H2 DA 21 23.845 20.234 26.471 240 H5' DT 22 H5' DT 22 19.746 18.219 31.765 241 H5'' DT 22 H5'' DT 22 18.288 17.264 32.048 242 H4' DT 22 H4' DT 22 18.493 17.871 29.713 243 H3' DT 22 H3' DT 22 18.016 15.242 30.410 244 H2' DT 22 H2' DT 22 20.249 14.529 30.145 245 H2'' DT 22 H2'' DT 22 19.651 14.192 28.503 246 H1' DT 22 H1' DT 22 20.360 16.292 27.658 247 H3 DT 22 H3 DT 22 24.740 16.088 26.683 248 H71 DT 22 H71 DT 22 24.105 14.294 31.793 249 H72 DT 22 H72 DT 22 25.008 13.240 30.688 250 H73 DT 22 H73 DT 22 25.706 14.777 31.190 251 H6 DT 22 H6 DT 22 22.245 15.049 30.670 252 H5' DC 23 H5' DC 23 18.525 16.012 25.837 253 H5'' DC 23 H5'' DC 23 17.332 15.131 24.878 254 H4' DC 23 H4' DC 23 19.468 15.055 23.788 255 H3' DC 23 H3' DC 23 18.033 12.707 24.265 256 H2' DC 23 H2' DC 23 19.470 12.132 26.137 257 H2'' DC 23 H2'' DC 23 20.214 11.206 24.794 258 H1' DC 23 H1' DC 23 21.581 13.095 24.176 259 H41 DC 23 H41 DC 23 26.255 11.803 27.966 260 H42 DC 23 H42 DC 23 25.237 11.410 29.356 261 H5 DC 23 H5 DC 23 22.812 11.721 29.262 262 H6 DC 23 H6 DC 23 20.964 12.391 27.804 263 H5' DG 24 H5' DG 24 22.157 11.883 22.422 264 H5'' DG 24 H5'' DG 24 22.098 10.776 21.052 265 H4' DG 24 H4' DG 24 23.953 10.231 22.516 266 H3' DG 24 H3' DG 24 22.125 8.303 21.643 267 HO3' DG 24 HO3' DG 24 23.845 6.845 22.118 268 H2' DG 24 H2' DG 24 20.991 8.196 23.746 269 H2'' DG 24 H2'' DG 24 22.197 6.883 23.950 270 H1' DG 24 H1' DG 24 23.782 8.388 24.972 271 H8 DG 24 H8 DG 24 20.021 9.199 25.652 272 H1 DG 24 H1 DG 24 23.681 8.084 30.840 273 H21 DG 24 H21 DG 24 25.760 7.566 30.149 274 H22 DG 24 H22 DG 24 26.147 7.614 28.438 275 H33 CWN 101 H33 PA6 25 29.396 28.042 31.221 276 H35 CWN 101 H35 PA6 25 32.745 29.117 33.771 277 H031 CWN 101 H031 PA6 25 20.481 16.602 21.123 278 H032 CWN 101 H032 PA6 25 21.688 17.714 20.454 279 H042 CWN 101 H042 PA6 25 22.478 18.249 22.764 280 H041 CWN 101 H041 PA6 25 21.197 17.249 23.449 281 H052 CWN 101 H052 PA6 25 19.466 18.725 22.484 282 H051 CWN 101 H051 PA6 25 20.697 19.648 21.599 283 HN02 CWN 101 HN02 PA6 25 21.636 20.400 23.758 284 HN01 CWN 101 HN01 PA6 25 23.428 16.350 21.651 285 H004 CWN 101 H004 PA6 25 21.767 14.943 19.551 286 H005 CWN 101 H005 PA6 25 23.492 14.640 19.900 287 H006 CWN 101 H006 PA6 25 22.989 16.205 19.216 288 H001 CWN 101 H001 PA6 25 21.978 15.211 23.254 289 H002 CWN 101 H002 PA6 25 22.849 14.038 22.232 290 H003 CWN 101 H003 PA6 25 21.135 14.410 21.897 291 HN03 CWN 101 HN03 PA6 25 22.350 20.502 28.493 292 H13 CWN 101 H13 PA6 25 23.109 21.661 30.008 293 HN1 CWN 101 HN1 PA6 25 24.077 23.413 31.727 294 H15 CWN 101 H15 PA6 25 20.518 22.830 33.287 295 H112 CWN 101 H112 PA6 25 18.181 21.600 30.946 296 H111 CWN 101 H111 PA6 25 18.438 21.735 32.703 297 H113 CWN 101 H113 PA6 25 18.674 20.164 31.891 298 HN2 CWN 101 HN2 PA6 25 27.866 26.536 32.171 299 HN3 CWN 101 HN3 PA6 25 31.418 29.444 30.111 300 H25 CWN 101 H25 PA6 25 26.086 27.095 35.570 301 H223 CWN 101 H223 PA6 25 23.579 24.862 36.481 302 H222 CWN 101 H222 PA6 25 22.670 26.160 35.642 303 H221 CWN 101 H221 PA6 25 24.041 26.572 36.705 304 HN4 CWN 101 HN4 PA6 25 32.250 32.071 26.370 305 H23 CWN 101 H23 PA6 25 25.718 24.845 31.883 306 HN9 CWN 101 HN9 PA6 25 31.165 34.739 27.334 307 HN5 CWN 101 HN5 PA6 25 29.540 32.221 30.874 308 H332 CWN 101 H332 PA6 25 32.246 27.901 35.784 309 H331 CWN 101 H331 PA6 25 31.018 26.613 35.694 310 H333 CWN 101 H333 PA6 25 30.548 28.262 36.214 311 HN6 CWN 101 HN6 PA6 25 25.726 29.200 31.935 312 HN7 CWN 101 HN7 PA6 25 22.237 25.948 30.517 313 H44 CWN 101 H44 PA6 25 35.766 32.303 27.912 314 H443 CWN 101 H443 PA6 25 36.955 31.417 29.869 315 H442 CWN 101 H442 PA6 25 36.243 29.970 30.629 316 H441 CWN 101 H441 PA6 25 35.910 31.596 31.304 317 H081 CWN 101 H081 PA6 25 21.929 19.179 26.578 318 H082 CWN 101 H082 PA6 25 20.287 18.875 27.167 319 H53 CWN 101 H53 PA6 25 30.454 33.760 28.948 320 H55 CWN 101 H55 PA6 25 33.107 33.061 32.306 321 H553 CWN 101 H553 PA6 25 34.739 35.733 30.742 322 H551 CWN 101 H551 PA6 25 35.346 34.325 29.817 323 H552 CWN 101 H552 PA6 25 35.134 34.206 31.583 324 H63 CWN 101 H63 PA6 25 27.974 30.660 31.269 325 H65 CWN 101 H65 PA6 25 27.083 30.019 35.465 326 H663 CWN 101 H663 PA6 25 30.432 30.827 35.712 327 H661 CWN 101 H661 PA6 25 28.893 31.175 36.554 328 H662 CWN 101 H662 PA6 25 29.692 32.455 35.609 329 H75 CWN 101 H75 PA6 25 20.517 27.538 33.649 330 H771 CWN 101 H771 PA6 25 20.885 29.305 35.212 331 H773 CWN 101 H773 PA6 25 22.154 30.486 34.802 332 H772 CWN 101 H772 PA6 25 22.510 29.146 35.935 333 H921 CWN 101 H921 PA6 25 33.436 33.474 23.691 334 H922 CWN 101 H922 PA6 25 32.016 33.417 24.727 335 H932 CWN 101 H932 PA6 25 32.943 35.747 23.859 336 H931 CWN 101 H931 PA6 25 34.199 35.559 25.066 337 H942 CWN 101 H942 PA6 25 31.229 36.020 25.417 338 H943 CWN 101 H943 PA6 25 32.587 36.918 26.096 339 H73 CWN 101 H73 PA6 25 24.264 27.448 31.451 340 H072 CWN 101 H072 PA6 25 19.692 21.277 26.443 341 H071 CWN 101 H071 PA6 25 21.284 21.385 25.682 342 H883 CWN 101 H883 PA6 25 17.571 24.240 31.649 343 H881 CWN 101 H881 PA6 25 16.652 24.241 30.140 344 H882 CWN 101 H882 PA6 25 17.393 25.740 30.707 345 H83 CWN 101 H83 PA6 25 20.964 23.150 27.451 Start of MODEL 5 1 H5 DCZ 1 H5 DC 1 29.569 9.957 24.366 2 H6 DCZ 1 H6 DC 1 31.863 10.029 23.519 3 HN41 DCZ 1 H41 DC 1 27.353 7.183 23.438 4 HN42 DCZ 1 H42 DC 1 27.495 8.720 24.297 5 H1' DCZ 1 H1' DC 1 33.241 7.338 21.292 6 H2'1 DCZ 1 H2' DC 1 32.376 10.033 20.789 7 H2'2 DCZ 1 H2'' DC 1 33.697 9.119 20.017 8 H3' DCZ 1 H3' DC 1 33.813 10.984 22.403 9 H4' DCZ 1 H4' DC 1 35.708 8.673 21.834 10 H5'1 DCZ 1 H5' DC 1 36.310 8.864 24.210 11 H5'2 DCZ 1 H5'' DC 1 36.684 10.339 23.320 12 HO5' DCZ 1 HO5' DC 1 34.974 11.393 24.311 13 H5' DG 2 H5' DG 2 33.457 11.227 18.698 14 H5'' DG 2 H5'' DG 2 33.911 12.764 17.959 15 H4' DG 2 H4' DG 2 31.596 12.083 17.437 16 H3' DG 2 H3' DG 2 32.342 14.660 18.026 17 H2' DG 2 H2' DG 2 31.809 14.455 20.372 18 H2'' DG 2 H2'' DG 2 30.351 15.244 19.754 19 H1' DG 2 H1' DG 2 29.229 13.132 19.427 20 H8 DG 2 H8 DG 2 31.902 12.839 22.256 21 H1 DG 2 H1 DG 2 25.722 12.424 24.106 22 H21 DG 2 H21 DG 2 24.455 12.731 22.347 23 H22 DG 2 H22 DG 2 25.152 13.015 20.739 24 H5' DA 3 H5' DA 3 27.509 14.330 19.065 25 H5'' DA 3 H5'' DA 3 27.631 14.048 17.337 26 H4' DA 3 H4' DA 3 25.592 14.906 17.191 27 H3' DA 3 H3' DA 3 27.093 17.108 16.743 28 H2' DA 3 H2' DA 3 27.409 17.875 18.923 29 H2'' DA 3 H2'' DA 3 25.872 18.697 18.639 30 H1' DA 3 H1' DA 3 24.711 17.294 20.006 31 H8 DA 3 H8 DA 3 28.511 16.547 20.362 32 H61 DA 3 H61 DA 3 26.964 15.323 26.319 33 H62 DA 3 H62 DA 3 28.348 15.467 25.237 34 H2 DA 3 H2 DA 3 23.336 16.226 24.195 35 H5' DT 4 H5' DT 4 22.791 17.930 17.691 36 H5'' DT 4 H5'' DT 4 22.011 19.228 16.781 37 H4' DT 4 H4' DT 4 21.370 19.365 19.088 38 H3' DT 4 H3' DT 4 22.802 21.546 17.791 39 H2' DT 4 H2' DT 4 24.320 21.807 19.450 40 H2'' DT 4 H2'' DT 4 23.002 22.501 20.403 41 H1' DT 4 H1' DT 4 22.472 20.449 21.455 42 H3 DT 4 H3 DT 4 25.546 19.570 24.695 43 H71 DT 4 H71 DT 4 28.213 20.306 19.988 44 H72 DT 4 H72 DT 4 28.920 20.919 21.500 45 H73 DT 4 H73 DT 4 28.856 19.179 21.206 46 H6 DT 4 H6 DT 4 25.923 20.505 19.980 47 H5' DG 5 H5' DG 5 19.967 21.486 21.343 48 H5'' DG 5 H5'' DG 5 18.631 22.475 20.756 49 H4' DG 5 H4' DG 5 18.410 22.490 23.062 50 H3' DG 5 H3' DG 5 18.804 24.869 21.702 51 H2' DG 5 H2' DG 5 21.015 25.251 22.335 52 H2'' DG 5 H2'' DG 5 20.230 25.998 23.750 53 H1' DG 5 H1' DG 5 20.585 24.128 25.110 54 H8 DG 5 H8 DG 5 22.904 23.964 21.971 55 H1 DG 5 H1 DG 5 25.660 22.453 27.612 56 H21 DG 5 H21 DG 5 24.270 22.951 29.229 57 H22 DG 5 H22 DG 5 22.669 23.587 28.868 58 H5' DT 6 H5' DT 6 17.115 25.096 26.043 59 H5'' DT 6 H5'' DT 6 16.137 26.519 26.432 60 H4' DT 6 H4' DT 6 17.794 25.989 28.204 61 H3' DT 6 H3' DT 6 18.138 28.576 26.662 62 H2' DT 6 H2' DT 6 20.159 28.956 27.731 63 H2'' DT 6 H2'' DT 6 19.605 28.097 29.208 64 H1' DT 6 H1' DT 6 20.492 26.237 28.669 65 H3 DT 6 H3 DT 6 24.795 26.126 27.572 66 H71 DT 6 H71 DT 6 23.700 28.310 23.433 67 H72 DT 6 H72 DT 6 23.263 26.657 22.997 68 H73 DT 6 H73 DT 6 21.987 27.877 23.223 69 H6 DT 6 H6 DT 6 20.850 27.663 25.248 70 H5' DA 7 H5' DA 7 18.260 29.225 31.227 71 H5'' DA 7 H5'' DA 7 18.039 30.919 31.664 72 H4' DA 7 H4' DA 7 20.236 29.809 32.363 73 H3' DA 7 H3' DA 7 20.311 32.352 30.719 74 H2' DA 7 H2' DA 7 22.670 32.199 30.722 75 H2'' DA 7 H2'' DA 7 22.692 31.196 32.193 76 H1' DA 7 H1' DA 7 22.792 29.372 31.051 77 H8 DA 7 H8 DA 7 21.231 31.008 27.932 78 H61 DA 7 H61 DA 7 26.550 28.930 25.380 79 H62 DA 7 H62 DA 7 25.036 29.745 24.993 80 H2 DA 7 H2 DA 7 26.986 28.658 29.664 81 H5' DC 8 H5' DC 8 23.001 31.971 34.116 82 H5'' DC 8 H5'' DC 8 23.309 33.419 35.055 83 H4' DC 8 H4' DC 8 25.371 32.228 34.338 84 H3' DC 8 H3' DC 8 24.864 35.006 34.230 85 H2' DC 8 H2' DC 8 24.911 35.138 31.916 86 H2'' DC 8 H2'' DC 8 26.659 35.291 32.200 87 H1' DC 8 H1' DC 8 27.021 32.931 31.906 88 H41 DC 8 H41 DC 8 25.899 32.458 25.623 89 H42 DC 8 H42 DC 8 24.306 33.145 25.830 90 H5 DC 8 H5 DC 8 23.422 33.896 27.904 91 H6 DC 8 H6 DC 8 23.855 34.101 30.294 92 H5' DA 9 H5' DA 9 29.297 34.249 33.666 93 H5'' DA 9 H5'' DA 9 30.325 35.514 34.346 94 H4' DA 9 H4' DA 9 30.863 35.178 32.020 95 H3' DA 9 H3' DA 9 29.774 37.768 32.880 96 H2' DA 9 H2' DA 9 28.493 38.025 31.039 97 H2'' DA 9 H2'' DA 9 29.982 38.123 30.073 98 H1' DA 9 H1' DA 9 30.007 35.826 29.573 99 H8 DA 9 H8 DA 9 26.422 37.063 30.547 100 H61 DA 9 H61 DA 9 25.261 35.844 24.516 101 H62 DA 9 H62 DA 9 24.536 36.541 25.973 102 H2 DA 9 H2 DA 9 29.235 34.460 25.368 103 H5' DT 10 H5' DT 10 32.951 37.426 29.644 104 H5'' DT 10 H5'' DT 10 34.051 38.800 29.498 105 H4' DT 10 H4' DT 10 33.309 38.047 27.315 106 H3' DT 10 H3' DT 10 32.074 40.712 28.086 107 H2' DT 10 H2' DT 10 31.229 40.766 25.857 108 H2'' DT 10 H2'' DT 10 32.414 39.566 25.286 109 H1' DT 10 H1' DT 10 30.950 37.943 25.662 110 H3 DT 10 H3 DT 10 26.825 39.235 24.483 111 H71 DT 10 H71 DT 10 27.560 40.202 29.813 112 H72 DT 10 H72 DT 10 26.496 41.297 28.898 113 H73 DT 10 H73 DT 10 25.989 39.633 29.213 114 H6 DT 10 H6 DT 10 29.405 39.636 28.540 115 H5' DC 11 H5' DC 11 34.237 40.650 24.263 116 H5'' DC 11 H5'' DC 11 35.207 42.099 23.994 117 H4' DC 11 H4' DC 11 33.865 41.481 22.016 118 H3' DC 11 H3' DC 11 34.128 44.072 22.965 119 H2' DC 11 H2' DC 11 32.038 44.029 24.120 120 H2'' DC 11 H2'' DC 11 31.538 44.770 22.577 121 H1' DC 11 H1' DC 11 31.034 42.648 21.587 122 H41 DC 11 H41 DC 11 25.971 42.885 25.809 123 H42 DC 11 H42 DC 11 25.423 42.479 24.177 124 H5 DC 11 H5 DC 11 28.373 43.018 26.316 125 H6 DC 11 H6 DC 11 30.603 42.906 25.318 126 H5' DG 12 H5' DG 12 30.950 44.411 19.635 127 H5'' DG 12 H5'' DG 12 31.268 45.803 18.596 128 H4' DG 12 H4' DG 12 28.957 45.811 19.280 129 H3' DG 12 H3' DG 12 30.605 48.070 19.678 130 HO3' DG 12 HO3' DG 12 28.544 49.184 19.633 131 H2' DG 12 H2' DG 12 30.672 47.763 22.041 132 H2'' DG 12 H2'' DG 12 29.238 48.835 21.899 133 H1' DG 12 H1' DG 12 27.746 46.920 21.739 134 H8 DG 12 H8 DG 12 30.899 46.394 23.992 135 H1 DG 12 H1 DG 12 25.188 46.155 26.972 136 H21 DG 12 H21 DG 12 23.571 46.546 25.455 137 H22 DG 12 H22 DG 12 23.995 46.765 23.767 138 H5 DCZ 13 H5 DC 13 20.440 47.696 18.182 139 H6 DCZ 13 H6 DC 13 18.823 45.861 18.072 140 HN41 DCZ 13 H41 DC 13 23.662 47.406 16.437 141 HN42 DCZ 13 H42 DC 13 22.652 48.403 17.486 142 H1' DCZ 13 H1' DC 13 19.355 42.801 16.026 143 H2'1 DCZ 13 H2' DC 13 19.391 43.420 18.999 144 H2'2 DCZ 13 H2'' DC 13 20.013 41.983 18.147 145 H3' DCZ 13 H3' DC 13 17.552 41.987 19.342 146 H4' DCZ 13 H4' DC 13 16.181 42.664 17.043 147 H5'1 DCZ 13 H5' DC 13 15.683 44.860 18.044 148 H5'2 DCZ 13 H5'' DC 13 15.493 43.514 19.166 149 HO5' DCZ 13 HO5' DC 13 16.568 45.330 20.145 150 H5' DG 14 H5' DG 14 19.954 40.530 15.997 151 H5'' DG 14 H5'' DG 14 19.265 38.945 15.663 152 H4' DG 14 H4' DG 14 21.557 39.235 14.809 153 H3' DG 14 H3' DG 14 20.567 36.930 15.885 154 H2' DG 14 H2' DG 14 21.279 37.291 18.084 155 H2'' DG 14 H2'' DG 14 22.666 36.370 17.501 156 H1' DG 14 H1' DG 14 23.994 38.274 17.161 157 H8 DG 14 H8 DG 14 21.067 38.773 19.682 158 H1 DG 14 H1 DG 14 26.713 41.279 21.525 159 H21 DG 14 H21 DG 14 28.172 41.019 19.924 160 H22 DG 14 H22 DG 14 27.762 40.173 18.423 161 H5' DA 15 H5' DA 15 25.034 37.544 14.815 162 H5'' DA 15 H5'' DA 15 25.457 36.256 13.691 163 H4' DA 15 H4' DA 15 27.439 37.097 14.688 164 H3' DA 15 H3' DA 15 26.890 34.408 14.630 165 H2' DA 15 H2' DA 15 26.161 34.164 16.832 166 H2'' DA 15 H2'' DA 15 27.890 33.902 17.138 167 H1' DA 15 H1' DA 15 28.243 36.081 17.915 168 H8 DA 15 H8 DA 15 24.460 35.150 17.896 169 H61 DA 15 H61 DA 15 24.521 37.800 23.568 170 H62 DA 15 H62 DA 15 23.461 36.975 22.424 171 H2 DA 15 H2 DA 15 28.522 37.995 22.003 172 H5' DT 16 H5' DT 16 31.035 35.360 16.636 173 H5'' DT 16 H5'' DT 16 32.234 34.109 16.272 174 H4' DT 16 H4' DT 16 32.292 34.603 18.640 175 H3' DT 16 H3' DT 16 31.051 31.946 17.929 176 H2' DT 16 H2' DT 16 30.331 31.642 20.040 177 H2'' DT 16 H2'' DT 16 31.827 32.292 20.768 178 H1' DT 16 H1' DT 16 31.041 34.416 20.884 179 H3 DT 16 H3 DT 16 27.451 34.741 23.566 180 H71 DT 16 H71 DT 16 25.297 31.525 20.577 181 H72 DT 16 H72 DT 16 24.727 33.090 19.998 182 H73 DT 16 H73 DT 16 25.886 32.164 19.023 183 H6 DT 16 H6 DT 16 28.152 32.636 19.286 184 H5' DG 17 H5' DG 17 34.543 31.880 20.922 185 H5'' DG 17 H5'' DG 17 35.611 30.547 20.468 186 H4' DG 17 H4' DG 17 35.453 30.660 22.850 187 H3' DG 17 H3' DG 17 34.839 28.288 21.425 188 H2' DG 17 H2' DG 17 32.622 28.150 21.972 189 H2'' DG 17 H2'' DG 17 33.199 27.512 23.526 190 H1' DG 17 H1' DG 17 32.923 29.555 24.635 191 H8 DG 17 H8 DG 17 30.986 29.587 21.241 192 H1 DG 17 H1 DG 17 27.644 31.706 26.367 193 H21 DG 17 H21 DG 17 28.934 31.595 28.154 194 H22 DG 17 H22 DG 17 30.578 30.964 28.014 195 H5' DT 18 H5' DT 18 35.652 28.872 25.768 196 H5'' DT 18 H5'' DT 18 36.700 27.681 26.540 197 H4' DT 18 H4' DT 18 35.092 28.682 28.087 198 H3' DT 18 H3' DT 18 35.441 25.857 27.749 199 H2' DT 18 H2' DT 18 33.225 25.407 27.241 200 H2'' DT 18 H2'' DT 18 32.969 25.615 29.002 201 H1' DT 18 H1' DT 18 32.391 27.894 28.776 202 H3 DT 18 H3 DT 18 28.186 28.357 27.211 203 H71 DT 18 H71 DT 18 31.179 25.952 23.326 204 H72 DT 18 H72 DT 18 29.437 25.619 23.440 205 H73 DT 18 H73 DT 18 29.990 27.197 22.873 206 H6 DT 18 H6 DT 18 32.159 26.301 25.396 207 H5' DA 19 H5' DA 19 33.773 26.991 31.952 208 H5'' DA 19 H5'' DA 19 34.392 25.919 33.211 209 H4' DA 19 H4' DA 19 31.976 26.156 33.327 210 H3' DA 19 H3' DA 19 33.198 23.522 32.994 211 H2' DA 19 H2' DA 19 31.754 22.901 31.325 212 H2'' DA 19 H2'' DA 19 30.509 22.811 32.595 213 H1' DA 19 H1' DA 19 29.757 25.041 32.186 214 H8 DA 19 H8 DA 19 31.677 23.663 29.081 215 H61 DA 19 H61 DA 19 26.572 25.455 25.972 216 H62 DA 19 H62 DA 19 28.111 24.613 25.794 217 H2 DA 19 H2 DA 19 25.820 26.138 30.179 218 H5' DC 20 H5' DC 20 29.316 24.421 34.998 219 H5'' DC 20 H5'' DC 20 28.921 23.523 36.466 220 H4' DC 20 H4' DC 20 26.948 23.817 35.106 221 H3' DC 20 H3' DC 20 27.838 21.250 35.939 222 H2' DC 20 H2' DC 20 28.270 20.520 33.760 223 H2'' DC 20 H2'' DC 20 26.535 20.104 33.807 224 H1' DC 20 H1' DC 20 25.903 22.268 32.939 225 H41 DC 20 H41 DC 20 27.617 21.758 26.875 226 H42 DC 20 H42 DC 20 29.239 21.244 27.304 227 H5 DC 20 H5 DC 20 29.939 20.816 29.559 228 H6 DC 20 H6 DC 20 29.286 21.014 31.902 229 H5' DA 21 H5' DA 21 23.605 21.073 34.268 230 H5'' DA 21 H5'' DA 21 22.572 19.966 35.176 231 H4' DA 21 H4' DA 21 22.298 19.366 32.931 232 H3' DA 21 H3' DA 21 23.572 17.430 34.619 233 H2' DA 21 H2' DA 21 25.586 17.641 33.333 234 H2'' DA 21 H2'' DA 21 24.738 16.322 32.450 235 H1' DA 21 H1' DA 21 23.570 18.025 31.045 236 H8 DA 21 H8 DA 21 27.315 17.728 31.763 237 H61 DA 21 H61 DA 21 27.803 18.778 25.616 238 H62 DA 21 H62 DA 21 28.690 18.181 27.023 239 H2 DA 21 H2 DA 21 23.752 19.698 26.752 240 H5' DT 22 H5' DT 22 19.767 17.451 32.735 241 H5'' DT 22 H5'' DT 22 18.468 16.259 32.697 242 H4' DT 22 H4' DT 22 18.759 17.433 30.554 243 H3' DT 22 H3' DT 22 18.367 14.696 30.793 244 H2' DT 22 H2' DT 22 20.675 14.178 30.421 245 H2'' DT 22 H2'' DT 22 20.027 14.042 28.761 246 H1' DT 22 H1' DT 22 20.506 16.358 28.291 247 H3 DT 22 H3 DT 22 24.640 15.891 26.593 248 H71 DT 22 H71 DT 22 26.191 14.859 31.088 249 H72 DT 22 H72 DT 22 24.744 14.034 31.725 250 H73 DT 22 H73 DT 22 25.739 13.268 30.471 251 H6 DT 22 H6 DT 22 22.770 14.950 30.940 252 H5' DC 23 H5' DC 23 19.058 16.061 26.252 253 H5'' DC 23 H5'' DC 23 17.537 15.618 25.475 254 H4' DC 23 H4' DC 23 19.193 15.286 23.855 255 H3' DC 23 H3' DC 23 17.610 13.138 24.549 256 H2' DC 23 H2' DC 23 19.285 12.183 26.013 257 H2'' DC 23 H2'' DC 23 19.570 11.276 24.502 258 H1' DC 23 H1' DC 23 21.161 12.851 23.724 259 H41 DC 23 H41 DC 23 26.215 11.818 27.177 260 H42 DC 23 H42 DC 23 25.350 11.748 28.718 261 H5 DC 23 H5 DC 23 22.925 12.073 28.814 262 H6 DC 23 H6 DC 23 20.939 12.519 27.451 263 H5' DG 24 H5' DG 24 20.694 11.415 21.607 264 H5'' DG 24 H5'' DG 24 19.917 10.357 20.423 265 H4' DG 24 H4' DG 24 21.777 9.192 21.400 266 H3' DG 24 H3' DG 24 19.200 8.067 21.463 267 HO3' DG 24 HO3' DG 24 20.368 6.083 21.629 268 H2' DG 24 H2' DG 24 18.916 8.505 23.786 269 H2'' DG 24 H2'' DG 24 19.601 6.846 23.853 270 H1' DG 24 H1' DG 24 21.864 7.717 24.021 271 H8 DG 24 H8 DG 24 18.869 9.223 25.928 272 H1 DG 24 H1 DG 24 24.354 8.754 29.289 273 H21 DG 24 H21 DG 24 26.009 8.146 27.883 274 H22 DG 24 H22 DG 24 25.648 7.886 26.186 275 H33 CWN 101 H33 PA6 25 29.059 27.672 31.352 276 H35 CWN 101 H35 PA6 25 32.185 29.257 33.919 277 H031 CWN 101 H031 PA6 25 20.155 16.414 21.070 278 H032 CWN 101 H032 PA6 25 21.294 17.595 20.404 279 H042 CWN 101 H042 PA6 25 22.279 17.960 22.646 280 H041 CWN 101 H041 PA6 25 21.130 16.839 23.374 281 H052 CWN 101 H052 PA6 25 19.240 18.298 22.776 282 H051 CWN 101 H051 PA6 25 20.298 19.350 21.816 283 HN02 CWN 101 HN02 PA6 25 21.529 19.871 23.976 284 HN01 CWN 101 HN01 PA6 25 23.117 16.089 21.401 285 H004 CWN 101 H004 PA6 25 22.721 16.337 18.994 286 H005 CWN 101 H005 PA6 25 21.397 15.141 19.097 287 H006 CWN 101 H006 PA6 25 23.087 14.642 19.392 288 H001 CWN 101 H001 PA6 25 20.811 14.148 21.349 289 H002 CWN 101 H002 PA6 25 21.679 14.714 22.805 290 H003 CWN 101 H003 PA6 25 22.529 13.719 21.595 291 HN03 CWN 101 HN03 PA6 25 22.208 20.142 28.674 292 H13 CWN 101 H13 PA6 25 22.918 21.320 30.175 293 HN1 CWN 101 HN1 PA6 25 23.819 23.073 31.912 294 H15 CWN 101 H15 PA6 25 20.334 22.239 33.538 295 H112 CWN 101 H112 PA6 25 18.469 20.694 33.139 296 H111 CWN 101 H111 PA6 25 18.706 19.381 31.958 297 H113 CWN 101 H113 PA6 25 18.002 20.938 31.430 298 HN2 CWN 101 HN2 PA6 25 27.513 26.292 32.338 299 HN3 CWN 101 HN3 PA6 25 31.031 29.129 30.203 300 H25 CWN 101 H25 PA6 25 25.669 26.885 35.694 301 H223 CWN 101 H223 PA6 25 22.271 25.845 35.732 302 H222 CWN 101 H222 PA6 25 23.605 26.361 36.794 303 H221 CWN 101 H221 PA6 25 23.220 24.623 36.638 304 HN4 CWN 101 HN4 PA6 25 31.961 31.684 26.383 305 H23 CWN 101 H23 PA6 25 25.422 24.528 32.064 306 HN9 CWN 101 HN9 PA6 25 30.998 34.361 27.334 307 HN5 CWN 101 HN5 PA6 25 29.297 31.965 30.947 308 H332 CWN 101 H332 PA6 25 30.647 26.966 36.084 309 H331 CWN 101 H331 PA6 25 29.740 28.499 36.299 310 H333 CWN 101 H333 PA6 25 31.508 28.530 36.084 311 HN6 CWN 101 HN6 PA6 25 25.452 29.019 32.128 312 HN7 CWN 101 HN7 PA6 25 21.981 25.728 30.747 313 H44 CWN 101 H44 PA6 25 35.433 31.937 27.996 314 H443 CWN 101 H443 PA6 25 35.432 31.294 31.455 315 H442 CWN 101 H442 PA6 25 36.543 31.238 30.061 316 H441 CWN 101 H441 PA6 25 35.905 29.719 30.746 317 H081 CWN 101 H081 PA6 25 21.815 18.833 26.723 318 H082 CWN 101 H082 PA6 25 20.176 18.491 27.295 319 H53 CWN 101 H53 PA6 25 30.270 33.389 28.955 320 H55 CWN 101 H55 PA6 25 32.847 32.832 32.399 321 H553 CWN 101 H553 PA6 25 34.509 35.437 30.750 322 H551 CWN 101 H551 PA6 25 35.152 33.985 29.923 323 H552 CWN 101 H552 PA6 25 34.885 33.962 31.685 324 H63 CWN 101 H63 PA6 25 27.712 30.428 31.420 325 H65 CWN 101 H65 PA6 25 26.780 30.013 35.637 326 H663 CWN 101 H663 PA6 25 28.415 31.496 36.636 327 H661 CWN 101 H661 PA6 25 29.361 32.567 35.578 328 H662 CWN 101 H662 PA6 25 29.992 30.945 35.995 329 H75 CWN 101 H75 PA6 25 20.270 27.317 33.881 330 H771 CWN 101 H771 PA6 25 22.161 28.862 36.167 331 H773 CWN 101 H773 PA6 25 20.603 29.185 35.357 332 H772 CWN 101 H772 PA6 25 21.977 30.276 35.082 333 H921 CWN 101 H921 PA6 25 33.241 33.025 23.687 334 H922 CWN 101 H922 PA6 25 31.803 33.011 24.702 335 H932 CWN 101 H932 PA6 25 32.847 35.307 23.863 336 H931 CWN 101 H931 PA6 25 34.068 35.057 25.094 337 H942 CWN 101 H942 PA6 25 31.106 35.623 25.401 338 H943 CWN 101 H943 PA6 25 32.484 36.485 26.080 339 H73 CWN 101 H73 PA6 25 24.000 27.266 31.654 340 H072 CWN 101 H072 PA6 25 19.597 20.943 26.665 341 H071 CWN 101 H071 PA6 25 21.172 21.030 25.865 342 H883 CWN 101 H883 PA6 25 17.672 23.606 32.235 343 H881 CWN 101 H881 PA6 25 16.605 23.349 30.853 344 H882 CWN 101 H882 PA6 25 17.104 24.991 31.274 345 H83 CWN 101 H83 PA6 25 20.740 22.871 27.734 Start of MODEL 6 1 H5 DCZ 1 H5 DC 1 28.316 10.248 24.165 2 H6 DCZ 1 H6 DC 1 30.711 9.990 23.741 3 HN41 DCZ 1 H41 DC 1 25.848 8.279 22.304 4 HN42 DCZ 1 H42 DC 1 26.127 9.542 23.494 5 H1' DCZ 1 H1' DC 1 32.036 7.378 21.404 6 H2'1 DCZ 1 H2' DC 1 31.716 10.133 20.901 7 H2'2 DCZ 1 H2'' DC 1 33.119 9.118 20.488 8 H3' DCZ 1 H3' DC 1 32.734 10.948 22.869 9 H4' DCZ 1 H4' DC 1 34.582 8.554 22.914 10 H5'1 DCZ 1 H5' DC 1 34.215 8.618 25.332 11 H5'2 DCZ 1 H5'' DC 1 34.770 10.193 24.750 12 HO5' DCZ 1 HO5' DC 1 32.978 10.318 26.280 13 H5' DG 2 H5' DG 2 33.507 11.326 19.254 14 H5'' DG 2 H5'' DG 2 34.086 12.893 18.692 15 H4' DG 2 H4' DG 2 31.862 12.161 17.783 16 H3' DG 2 H3' DG 2 32.538 14.743 18.310 17 H2' DG 2 H2' DG 2 31.769 14.726 20.580 18 H2'' DG 2 H2'' DG 2 30.368 15.442 19.759 19 H1' DG 2 H1' DG 2 29.233 13.374 19.598 20 H8 DG 2 H8 DG 2 31.848 13.226 22.507 21 H1 DG 2 H1 DG 2 25.629 12.837 24.203 22 H21 DG 2 H21 DG 2 24.424 12.973 22.408 23 H22 DG 2 H22 DG 2 25.154 13.086 20.786 24 H5' DA 3 H5' DA 3 27.657 14.193 18.379 25 H5'' DA 3 H5'' DA 3 27.780 14.352 16.632 26 H4' DA 3 H4' DA 3 25.636 14.961 16.935 27 H3' DA 3 H3' DA 3 27.115 17.081 16.127 28 H2' DA 3 H2' DA 3 27.630 18.026 18.210 29 H2'' DA 3 H2'' DA 3 26.107 18.876 17.956 30 H1' DA 3 H1' DA 3 24.959 17.583 19.472 31 H8 DA 3 H8 DA 3 28.790 17.055 19.814 32 H61 DA 3 H61 DA 3 27.342 15.713 25.766 33 H62 DA 3 H62 DA 3 28.725 15.895 24.682 34 H2 DA 3 H2 DA 3 23.696 16.629 23.727 35 H5' DT 4 H5' DT 4 22.802 17.890 17.438 36 H5'' DT 4 H5'' DT 4 21.936 19.085 16.468 37 H4' DT 4 H4' DT 4 21.350 19.375 18.760 38 H3' DT 4 H3' DT 4 22.595 21.523 17.310 39 H2' DT 4 H2' DT 4 24.337 21.768 18.761 40 H2'' DT 4 H2'' DT 4 23.172 22.622 19.787 41 H1' DT 4 H1' DT 4 22.599 20.673 21.017 42 H3 DT 4 H3 DT 4 25.776 19.922 24.159 43 H71 DT 4 H71 DT 4 28.935 21.445 20.756 44 H72 DT 4 H72 DT 4 29.069 19.686 20.683 45 H73 DT 4 H73 DT 4 28.281 20.565 19.356 46 H6 DT 4 H6 DT 4 25.991 20.670 19.405 47 H5' DG 5 H5' DG 5 19.795 21.637 21.060 48 H5'' DG 5 H5'' DG 5 18.518 22.673 20.430 49 H4' DG 5 H4' DG 5 18.260 22.699 22.734 50 H3' DG 5 H3' DG 5 18.666 25.075 21.402 51 H2' DG 5 H2' DG 5 20.921 25.374 21.956 52 H2'' DG 5 H2'' DG 5 20.200 26.173 23.373 53 H1' DG 5 H1' DG 5 20.543 24.329 24.767 54 H8 DG 5 H8 DG 5 22.702 23.906 21.538 55 H1 DG 5 H1 DG 5 25.723 22.794 27.141 56 H21 DG 5 H21 DG 5 24.359 23.282 28.788 57 H22 DG 5 H22 DG 5 22.743 23.903 28.457 58 H5' DT 6 H5' DT 6 17.417 25.301 25.940 59 H5'' DT 6 H5'' DT 6 16.468 26.736 26.343 60 H4' DT 6 H4' DT 6 18.088 26.125 28.087 61 H3' DT 6 H3' DT 6 17.781 28.755 27.094 62 H2' DT 6 H2' DT 6 19.862 28.753 26.028 63 H2'' DT 6 H2'' DT 6 20.359 29.322 27.639 64 H1' DT 6 H1' DT 6 20.814 27.062 28.402 65 H3 DT 6 H3 DT 6 25.111 26.316 27.115 66 H71 DT 6 H71 DT 6 23.903 28.223 22.860 67 H72 DT 6 H72 DT 6 23.525 26.532 22.527 68 H73 DT 6 H73 DT 6 22.209 27.715 22.706 69 H6 DT 6 H6 DT 6 21.126 27.612 24.726 70 H5' DA 7 H5' DA 7 18.334 31.557 31.455 71 H5'' DA 7 H5'' DA 7 19.072 32.529 30.190 72 H4' DA 7 H4' DA 7 20.155 30.021 31.507 73 H3' DA 7 H3' DA 7 21.153 32.833 30.925 74 H2' DA 7 H2' DA 7 23.301 32.035 30.729 75 H2'' DA 7 H2'' DA 7 23.050 30.738 31.914 76 H1' DA 7 H1' DA 7 22.433 29.247 30.350 77 H8 DA 7 H8 DA 7 21.625 31.159 27.328 78 H61 DA 7 H61 DA 7 27.008 28.928 25.193 79 H62 DA 7 H62 DA 7 25.503 29.715 24.744 80 H2 DA 7 H2 DA 7 27.225 28.839 29.550 81 H5' DC 8 H5' DC 8 23.676 31.636 33.889 82 H5'' DC 8 H5'' DC 8 23.925 32.861 35.133 83 H4' DC 8 H4' DC 8 26.057 32.209 34.191 84 H3' DC 8 H3' DC 8 25.112 34.909 34.219 85 H2' DC 8 H2' DC 8 25.141 35.166 31.937 86 H2'' DC 8 H2'' DC 8 26.872 35.471 32.188 87 H1' DC 8 H1' DC 8 27.457 33.177 31.769 88 H41 DC 8 H41 DC 8 26.097 32.620 25.553 89 H42 DC 8 H42 DC 8 24.487 33.249 25.812 90 H5 DC 8 H5 DC 8 23.656 33.981 27.917 91 H6 DC 8 H6 DC 8 24.165 34.199 30.287 92 H5' DA 9 H5' DA 9 29.603 34.485 33.687 93 H5'' DA 9 H5'' DA 9 30.572 35.831 34.304 94 H4' DA 9 H4' DA 9 31.129 35.326 31.991 95 H3' DA 9 H3' DA 9 30.140 37.955 32.790 96 H2' DA 9 H2' DA 9 28.733 38.153 31.024 97 H2'' DA 9 H2'' DA 9 30.180 38.296 29.996 98 H1' DA 9 H1' DA 9 30.233 35.979 29.507 99 H8 DA 9 H8 DA 9 26.659 37.180 30.559 100 H61 DA 9 H61 DA 9 25.514 36.284 24.474 101 H62 DA 9 H62 DA 9 24.797 36.920 25.962 102 H2 DA 9 H2 DA 9 29.372 34.603 25.314 103 H5' DT 10 H5' DT 10 33.129 37.710 29.393 104 H5'' DT 10 H5'' DT 10 34.212 39.097 29.244 105 H4' DT 10 H4' DT 10 33.293 38.524 27.097 106 H3' DT 10 H3' DT 10 32.132 41.091 28.191 107 H2' DT 10 H2' DT 10 30.885 41.266 26.224 108 H2'' DT 10 H2'' DT 10 32.054 40.307 25.277 109 H1' DT 10 H1' DT 10 30.985 38.428 25.622 110 H3 DT 10 H3 DT 10 26.634 38.999 24.672 111 H71 DT 10 H71 DT 10 26.286 41.301 28.977 112 H72 DT 10 H72 DT 10 25.930 39.618 29.374 113 H73 DT 10 H73 DT 10 27.466 40.337 29.896 114 H6 DT 10 H6 DT 10 29.321 39.948 28.564 115 H5' DC 11 H5' DC 11 34.140 40.774 24.261 116 H5'' DC 11 H5'' DC 11 35.020 42.199 23.707 117 H4' DC 11 H4' DC 11 33.648 41.170 21.939 118 H3' DC 11 H3' DC 11 33.763 43.920 22.468 119 H2' DC 11 H2' DC 11 31.635 44.008 23.469 120 H2'' DC 11 H2'' DC 11 31.157 44.335 21.782 121 H1' DC 11 H1' DC 11 30.774 42.013 21.327 122 H41 DC 11 H41 DC 11 25.682 42.545 25.505 123 H42 DC 11 H42 DC 11 25.214 41.701 24.019 124 H5 DC 11 H5 DC 11 28.053 43.122 25.918 125 H6 DC 11 H6 DC 11 30.281 43.113 24.903 126 H5' DG 12 H5' DG 12 31.184 42.428 18.960 127 H5'' DG 12 H5'' DG 12 31.491 43.352 17.486 128 H4' DG 12 H4' DG 12 29.161 42.832 17.565 129 H3' DG 12 H3' DG 12 30.039 45.539 17.433 130 HO3' DG 12 HO3' DG 12 28.018 45.798 16.321 131 H2' DG 12 H2' DG 12 29.241 45.985 19.642 132 H2'' DG 12 H2'' DG 12 27.781 46.409 18.677 133 H1' DG 12 H1' DG 12 26.984 44.088 18.824 134 H8 DG 12 H8 DG 12 28.794 45.439 22.023 135 H1 DG 12 H1 DG 12 22.512 44.062 22.572 136 H21 DG 12 H21 DG 12 21.776 43.290 20.580 137 H22 DG 12 H22 DG 12 22.898 43.149 19.239 138 H5 DCZ 13 H5 DC 13 16.300 47.318 17.049 139 H6 DCZ 13 H6 DC 13 15.826 44.926 17.225 140 HN41 DCZ 13 H41 DC 13 18.953 48.501 14.797 141 HN42 DCZ 13 H42 DC 13 17.703 48.961 15.958 142 H1' DCZ 13 H1' DC 13 17.515 42.371 15.103 143 H2'1 DCZ 13 H2' DC 13 17.423 43.020 18.064 144 H2'2 DCZ 13 H2'' DC 13 18.530 41.937 17.186 145 H3' DCZ 13 H3' DC 13 16.362 40.941 18.514 146 H4' DCZ 13 H4' DC 13 14.668 40.973 16.366 147 H5'1 DCZ 13 H5' DC 13 13.539 43.015 17.303 148 H5'2 DCZ 13 H5'' DC 13 13.715 41.640 18.386 149 HO5' DCZ 13 HO5' DC 13 15.180 42.753 19.609 150 H5' DG 14 H5' DG 14 19.460 40.664 15.352 151 H5'' DG 14 H5'' DG 14 19.027 39.023 14.888 152 H4' DG 14 H4' DG 14 21.320 39.680 14.235 153 H3' DG 14 H3' DG 14 20.563 37.191 15.073 154 H2' DG 14 H2' DG 14 21.033 37.533 17.365 155 H2'' DG 14 H2'' DG 14 22.542 36.772 16.853 156 H1' DG 14 H1' DG 14 23.674 38.826 16.613 157 H8 DG 14 H8 DG 14 20.654 38.972 19.091 158 H1 DG 14 H1 DG 14 26.338 41.014 21.362 159 H21 DG 14 H21 DG 14 27.809 40.936 19.731 160 H22 DG 14 H22 DG 14 27.333 40.446 18.096 161 H5' DA 15 H5' DA 15 25.032 38.431 14.716 162 H5'' DA 15 H5'' DA 15 25.710 37.333 13.517 163 H4' DA 15 H4' DA 15 27.489 38.166 14.828 164 H3' DA 15 H3' DA 15 27.073 35.453 14.490 165 H2' DA 15 H2' DA 15 26.280 34.931 16.590 166 H2'' DA 15 H2'' DA 15 28.001 34.849 17.018 167 H1' DA 15 H1' DA 15 28.012 36.950 18.027 168 H8 DA 15 H8 DA 15 24.352 35.763 17.428 169 H61 DA 15 H61 DA 15 23.606 37.269 23.458 170 H62 DA 15 H62 DA 15 22.769 36.575 22.072 171 H2 DA 15 H2 DA 15 27.702 38.130 22.391 172 H5' DT 16 H5' DT 16 31.241 36.393 16.629 173 H5'' DT 16 H5'' DT 16 32.424 35.146 16.204 174 H4' DT 16 H4' DT 16 32.488 35.538 18.597 175 H3' DT 16 H3' DT 16 31.191 32.918 17.802 176 H2' DT 16 H2' DT 16 30.673 32.491 19.975 177 H2'' DT 16 H2'' DT 16 32.148 33.272 20.615 178 H1' DT 16 H1' DT 16 31.147 35.275 20.862 179 H3 DT 16 H3 DT 16 27.535 34.894 23.521 180 H71 DT 16 H71 DT 16 26.188 32.971 18.599 181 H72 DT 16 H72 DT 16 25.690 32.005 20.010 182 H73 DT 16 H73 DT 16 24.958 33.582 19.724 183 H6 DT 16 H6 DT 16 28.425 33.539 18.977 184 H5' DG 17 H5' DG 17 34.731 32.732 20.657 185 H5'' DG 17 H5'' DG 17 35.793 31.400 20.201 186 H4' DG 17 H4' DG 17 35.590 31.601 22.616 187 H3' DG 17 H3' DG 17 35.273 29.164 21.249 188 H2' DG 17 H2' DG 17 32.969 28.969 21.606 189 H2'' DG 17 H2'' DG 17 33.515 28.252 23.150 190 H1' DG 17 H1' DG 17 33.219 30.280 24.341 191 H8 DG 17 H8 DG 17 31.164 30.442 21.021 192 H1 DG 17 H1 DG 17 27.900 31.944 26.401 193 H21 DG 17 H21 DG 17 29.240 31.721 28.133 194 H22 DG 17 H22 DG 17 30.883 31.109 27.907 195 H5' DT 18 H5' DT 18 36.022 29.475 25.855 196 H5'' DT 18 H5'' DT 18 37.126 28.219 26.429 197 H4' DT 18 H4' DT 18 35.473 28.827 28.122 198 H3' DT 18 H3' DT 18 35.889 26.127 27.226 199 H2' DT 18 H2' DT 18 33.704 25.707 26.648 200 H2'' DT 18 H2'' DT 18 33.416 25.615 28.408 201 H1' DT 18 H1' DT 18 32.738 27.864 28.559 202 H3 DT 18 H3 DT 18 28.577 28.438 26.871 203 H71 DT 18 H71 DT 18 31.789 26.601 22.841 204 H72 DT 18 H72 DT 18 30.067 26.164 22.874 205 H73 DT 18 H73 DT 18 30.541 27.817 22.487 206 H6 DT 18 H6 DT 18 32.712 26.828 24.960 207 H5' DA 19 H5' DA 19 34.496 26.362 31.786 208 H5'' DA 19 H5'' DA 19 34.899 24.885 32.668 209 H4' DA 19 H4' DA 19 32.518 25.624 32.756 210 H3' DA 19 H3' DA 19 33.338 22.875 32.090 211 H2' DA 19 H2' DA 19 31.644 22.580 30.594 212 H2'' DA 19 H2'' DA 19 30.482 22.838 31.922 213 H1' DA 19 H1' DA 19 30.225 25.112 31.476 214 H8 DA 19 H8 DA 19 32.064 23.713 28.341 215 H61 DA 19 H61 DA 19 26.918 25.575 25.351 216 H62 DA 19 H62 DA 19 28.471 24.773 25.130 217 H2 DA 19 H2 DA 19 26.244 26.213 29.580 218 H5' DC 20 H5' DC 20 29.740 24.068 34.373 219 H5'' DC 20 H5'' DC 20 29.361 23.162 35.838 220 H4' DC 20 H4' DC 20 27.328 23.739 34.682 221 H3' DC 20 H3' DC 20 27.925 21.077 35.359 222 H2' DC 20 H2' DC 20 28.322 20.430 33.127 223 H2'' DC 20 H2'' DC 20 26.573 20.092 33.197 224 H1' DC 20 H1' DC 20 26.018 22.311 32.416 225 H41 DC 20 H41 DC 20 27.681 22.067 26.327 226 H42 DC 20 H42 DC 20 29.294 21.487 26.710 227 H5 DC 20 H5 DC 20 29.983 20.893 28.938 228 H6 DC 20 H6 DC 20 29.333 20.955 31.287 229 H5' DA 21 H5' DA 21 23.741 21.310 33.608 230 H5'' DA 21 H5'' DA 21 22.582 20.294 34.464 231 H4' DA 21 H4' DA 21 22.290 19.753 32.216 232 H3' DA 21 H3' DA 21 23.316 17.671 33.851 233 H2' DA 21 H2' DA 21 25.463 17.899 32.731 234 H2'' DA 21 H2'' DA 21 24.657 16.588 31.814 235 H1' DA 21 H1' DA 21 23.583 18.311 30.337 236 H8 DA 21 H8 DA 21 27.297 17.854 31.121 237 H61 DA 21 H61 DA 21 27.926 19.178 25.025 238 H62 DA 21 H62 DA 21 28.785 18.500 26.408 239 H2 DA 21 H2 DA 21 23.846 20.011 26.108 240 H5' DT 22 H5' DT 22 19.634 18.027 31.334 241 H5'' DT 22 H5'' DT 22 18.278 16.912 31.517 242 H4' DT 22 H4' DT 22 18.451 17.822 29.257 243 H3' DT 22 H3' DT 22 18.096 15.106 29.689 244 H2' DT 22 H2' DT 22 20.304 14.474 29.194 245 H2'' DT 22 H2'' DT 22 19.646 14.423 27.537 246 H1' DT 22 H1' DT 22 20.357 16.603 27.017 247 H3 DT 22 H3 DT 22 24.732 16.134 25.972 248 H71 DT 22 H71 DT 22 24.057 14.504 31.136 249 H72 DT 22 H72 DT 22 25.009 13.460 30.076 250 H73 DT 22 H73 DT 22 25.664 15.018 30.551 251 H6 DT 22 H6 DT 22 22.215 15.268 29.992 252 H5' DC 23 H5' DC 23 18.346 16.069 25.162 253 H5'' DC 23 H5'' DC 23 17.066 15.258 24.254 254 H4' DC 23 H4' DC 23 19.124 15.047 23.053 255 H3' DC 23 H3' DC 23 17.646 12.769 23.635 256 H2' DC 23 H2' DC 23 19.084 12.199 25.507 257 H2'' DC 23 H2'' DC 23 19.762 11.198 24.186 258 H1' DC 23 H1' DC 23 21.231 12.956 23.497 259 H41 DC 23 H41 DC 23 25.877 12.128 27.445 260 H42 DC 23 H42 DC 23 24.858 11.775 28.844 261 H5 DC 23 H5 DC 23 22.413 11.965 28.688 262 H6 DC 23 H6 DC 23 20.570 12.416 27.144 263 H5' DG 24 H5' DG 24 21.759 11.941 21.527 264 H5'' DG 24 H5'' DG 24 21.612 10.749 20.236 265 H4' DG 24 H4' DG 24 23.650 10.421 21.575 266 H3' DG 24 H3' DG 24 21.965 8.352 20.811 267 HO3' DG 24 HO3' DG 24 23.775 7.043 21.185 268 H2' DG 24 H2' DG 24 20.867 8.226 22.934 269 H2'' DG 24 H2'' DG 24 22.146 6.986 23.141 270 H1' DG 24 H1' DG 24 23.657 8.579 24.122 271 H8 DG 24 H8 DG 24 19.855 9.081 24.825 272 H1 DG 24 H1 DG 24 23.700 8.842 29.996 273 H21 DG 24 H21 DG 24 25.823 8.542 29.296 274 H22 DG 24 H22 DG 24 26.168 8.483 27.578 275 H33 CWN 101 H33 PA6 25 29.398 27.826 30.988 276 H35 CWN 101 H35 PA6 25 32.900 28.495 33.473 277 H031 CWN 101 H031 PA6 25 20.315 16.477 20.662 278 H032 CWN 101 H032 PA6 25 21.456 17.717 20.117 279 H042 CWN 101 H042 PA6 25 22.169 17.920 22.607 280 H041 CWN 101 H041 PA6 25 20.687 17.056 23.006 281 H052 CWN 101 H052 PA6 25 19.301 18.838 22.092 282 H051 CWN 101 H051 PA6 25 20.682 19.564 21.244 283 HN02 CWN 101 HN02 PA6 25 21.673 20.167 23.421 284 HN01 CWN 101 HN01 PA6 25 23.288 16.437 21.173 285 H004 CWN 101 H004 PA6 25 22.786 16.241 18.768 286 H005 CWN 101 H005 PA6 25 21.680 14.889 19.145 287 H006 CWN 101 H006 PA6 25 23.432 14.730 19.451 288 H001 CWN 101 H001 PA6 25 21.162 14.324 21.519 289 H002 CWN 101 H002 PA6 25 21.983 15.208 22.839 290 H003 CWN 101 H003 PA6 25 22.914 14.107 21.795 291 HN03 CWN 101 HN03 PA6 25 22.244 20.456 28.143 292 H13 CWN 101 H13 PA6 25 22.989 21.598 29.637 293 HN1 CWN 101 HN1 PA6 25 23.965 23.317 31.359 294 H15 CWN 101 H15 PA6 25 20.417 22.705 32.951 295 H112 CWN 101 H112 PA6 25 18.031 21.588 30.914 296 H111 CWN 101 H111 PA6 25 18.516 21.155 32.579 297 H113 CWN 101 H113 PA6 25 18.616 19.942 31.281 298 HN2 CWN 101 HN2 PA6 25 27.848 26.317 31.829 299 HN3 CWN 101 HN3 PA6 25 31.409 29.254 29.934 300 H25 CWN 101 H25 PA6 25 26.228 26.655 35.331 301 H223 CWN 101 H223 PA6 25 23.676 24.359 36.097 302 H222 CWN 101 H222 PA6 25 22.820 25.842 35.574 303 H221 CWN 101 H221 PA6 25 24.293 25.963 36.573 304 HN4 CWN 101 HN4 PA6 25 32.092 32.090 26.339 305 H23 CWN 101 H23 PA6 25 25.596 24.766 31.479 306 HN9 CWN 101 HN9 PA6 25 31.111 34.736 27.381 307 HN5 CWN 101 HN5 PA6 25 29.661 32.033 30.839 308 H332 CWN 101 H332 PA6 25 31.172 25.810 35.149 309 H331 CWN 101 H331 PA6 25 30.793 27.386 35.911 310 H333 CWN 101 H333 PA6 25 32.449 27.033 35.345 311 HN6 CWN 101 HN6 PA6 25 25.771 29.171 31.794 312 HN7 CWN 101 HN7 PA6 25 22.123 26.103 30.300 313 H44 CWN 101 H44 PA6 25 35.592 32.429 27.869 314 H443 CWN 101 H443 PA6 25 36.761 31.736 29.911 315 H442 CWN 101 H442 PA6 25 36.315 30.089 30.434 316 H441 CWN 101 H441 PA6 25 35.663 31.518 31.298 317 H081 CWN 101 H081 PA6 25 21.816 19.097 26.237 318 H082 CWN 101 H082 PA6 25 20.131 18.919 26.748 319 H53 CWN 101 H53 PA6 25 30.528 33.565 28.910 320 H55 CWN 101 H55 PA6 25 33.196 33.012 32.285 321 H553 CWN 101 H553 PA6 25 34.664 35.801 30.650 322 H551 CWN 101 H551 PA6 25 35.396 34.366 29.869 323 H552 CWN 101 H552 PA6 25 35.112 34.378 31.630 324 H63 CWN 101 H63 PA6 25 28.029 30.641 31.194 325 H65 CWN 101 H65 PA6 25 27.441 29.341 35.285 326 H663 CWN 101 H663 PA6 25 29.444 30.098 36.368 327 H661 CWN 101 H661 PA6 25 30.144 31.583 35.672 328 H662 CWN 101 H662 PA6 25 30.875 29.990 35.308 329 H75 CWN 101 H75 PA6 25 20.678 27.379 33.705 330 H771 CWN 101 H771 PA6 25 22.434 30.036 35.208 331 H773 CWN 101 H773 PA6 25 23.017 28.535 35.994 332 H772 CWN 101 H772 PA6 25 21.295 28.712 35.575 333 H921 CWN 101 H921 PA6 25 33.181 33.560 23.646 334 H922 CWN 101 H922 PA6 25 31.808 33.483 24.738 335 H932 CWN 101 H932 PA6 25 32.737 35.806 23.867 336 H931 CWN 101 H931 PA6 25 34.047 35.574 25.011 337 H942 CWN 101 H942 PA6 25 31.103 36.081 25.509 338 H943 CWN 101 H943 PA6 25 32.515 36.922 26.138 339 H73 CWN 101 H73 PA6 25 24.208 27.581 31.175 340 H072 CWN 101 H072 PA6 25 19.801 21.400 26.040 341 H071 CWN 101 H071 PA6 25 21.397 21.304 25.287 342 H883 CWN 101 H883 PA6 25 17.698 24.196 31.809 343 H881 CWN 101 H881 PA6 25 16.646 23.993 30.405 344 H882 CWN 101 H882 PA6 25 17.256 25.603 30.811 345 H83 CWN 101 H83 PA6 25 20.790 23.203 27.368 Start of MODEL 7 1 H5 DCZ 1 H5 DC 1 29.061 9.874 23.674 2 H6 DCZ 1 H6 DC 1 31.328 9.532 22.813 3 HN41 DCZ 1 H41 DC 1 26.161 9.064 21.559 4 HN42 DCZ 1 H42 DC 1 26.711 9.676 23.129 5 H1' DCZ 1 H1' DC 1 31.959 8.342 19.311 6 H2'1 DCZ 1 H2' DC 1 32.002 10.924 20.547 7 H2'2 DCZ 1 H2'' DC 1 33.027 10.287 19.228 8 H3' DCZ 1 H3' DC 1 33.547 10.325 22.227 9 H4' DCZ 1 H4' DC 1 34.696 8.360 20.208 10 H5'1 DCZ 1 H5' DC 1 35.268 6.997 22.117 11 H5'2 DCZ 1 H5'' DC 1 35.916 8.618 22.387 12 HO5' DCZ 1 HO5' DC 1 33.483 7.566 23.497 13 H5' DG 2 H5' DG 2 34.007 12.154 18.517 14 H5'' DG 2 H5'' DG 2 34.396 13.867 18.490 15 H4' DG 2 H4' DG 2 32.241 13.013 17.334 16 H3' DG 2 H3' DG 2 32.798 15.532 18.144 17 H2' DG 2 H2' DG 2 32.091 15.204 20.411 18 H2'' DG 2 H2'' DG 2 30.655 15.982 19.701 19 H1' DG 2 H1' DG 2 29.548 13.933 19.344 20 H8 DG 2 H8 DG 2 32.266 13.533 22.142 21 H1 DG 2 H1 DG 2 26.135 12.739 23.969 22 H21 DG 2 H21 DG 2 24.868 13.116 22.274 23 H22 DG 2 H22 DG 2 25.525 13.388 20.638 24 H5' DA 3 H5' DA 3 27.903 14.656 17.629 25 H5'' DA 3 H5'' DA 3 27.998 15.357 16.015 26 H4' DA 3 H4' DA 3 25.795 15.632 16.584 27 H3' DA 3 H3' DA 3 27.198 17.908 16.075 28 H2' DA 3 H2' DA 3 27.686 18.569 18.269 29 H2'' DA 3 H2'' DA 3 26.111 19.366 18.137 30 H1' DA 3 H1' DA 3 25.035 17.793 19.415 31 H8 DA 3 H8 DA 3 28.887 17.265 19.722 32 H61 DA 3 H61 DA 3 27.395 15.704 25.625 33 H62 DA 3 H62 DA 3 28.785 15.840 24.542 34 H2 DA 3 H2 DA 3 23.813 16.944 23.662 35 H5' DT 4 H5' DT 4 22.804 18.527 17.388 36 H5'' DT 4 H5'' DT 4 21.992 19.805 16.472 37 H4' DT 4 H4' DT 4 21.327 19.922 18.775 38 H3' DT 4 H3' DT 4 22.663 22.143 17.470 39 H2' DT 4 H2' DT 4 24.242 22.428 19.057 40 H2'' DT 4 H2'' DT 4 22.965 23.104 20.068 41 H1' DT 4 H1' DT 4 22.516 21.064 21.159 42 H3 DT 4 H3 DT 4 25.752 20.104 24.200 43 H71 DT 4 H71 DT 4 28.953 21.630 20.932 44 H72 DT 4 H72 DT 4 28.887 19.914 20.517 45 H73 DT 4 H73 DT 4 28.177 21.119 19.416 46 H6 DT 4 H6 DT 4 25.886 21.189 19.505 47 H5' DG 5 H5' DG 5 19.963 21.845 21.086 48 H5'' DG 5 H5'' DG 5 18.579 22.800 20.562 49 H4' DG 5 H4' DG 5 18.354 22.650 22.857 50 H3' DG 5 H3' DG 5 18.636 25.130 21.652 51 H2' DG 5 H2' DG 5 20.798 25.618 22.345 52 H2'' DG 5 H2'' DG 5 19.966 26.188 23.815 53 H1' DG 5 H1' DG 5 20.482 24.261 25.022 54 H8 DG 5 H8 DG 5 22.685 24.337 21.800 55 H1 DG 5 H1 DG 5 25.729 22.806 27.286 56 H21 DG 5 H21 DG 5 24.395 23.225 28.967 57 H22 DG 5 H22 DG 5 22.757 23.806 28.687 58 H5' DT 6 H5' DT 6 17.155 25.300 26.135 59 H5'' DT 6 H5'' DT 6 16.166 26.736 26.451 60 H4' DT 6 H4' DT 6 17.816 26.478 28.209 61 H3' DT 6 H3' DT 6 18.531 28.742 26.290 62 H2' DT 6 H2' DT 6 20.364 29.144 27.706 63 H2'' DT 6 H2'' DT 6 19.558 28.321 29.083 64 H1' DT 6 H1' DT 6 20.558 26.487 28.677 65 H3 DT 6 H3 DT 6 24.865 26.346 27.514 66 H71 DT 6 H71 DT 6 23.361 26.884 22.946 67 H72 DT 6 H72 DT 6 21.969 27.969 23.171 68 H73 DT 6 H73 DT 6 23.628 28.569 23.398 69 H6 DT 6 H6 DT 6 20.873 27.791 25.207 70 H5' DA 7 H5' DA 7 18.366 29.596 30.673 71 H5'' DA 7 H5'' DA 7 18.263 31.292 31.155 72 H4' DA 7 H4' DA 7 20.205 30.042 32.150 73 H3' DA 7 H3' DA 7 20.812 32.417 30.362 74 H2' DA 7 H2' DA 7 23.127 32.033 30.838 75 H2'' DA 7 H2'' DA 7 22.745 31.005 32.247 76 H1' DA 7 H1' DA 7 23.010 29.276 30.920 77 H8 DA 7 H8 DA 7 21.419 31.071 27.921 78 H61 DA 7 H61 DA 7 26.678 29.076 25.193 79 H62 DA 7 H62 DA 7 25.148 29.882 24.862 80 H2 DA 7 H2 DA 7 27.236 28.734 29.456 81 H5' DC 8 H5' DC 8 23.122 32.189 33.906 82 H5'' DC 8 H5'' DC 8 23.418 33.697 34.750 83 H4' DC 8 H4' DC 8 25.499 32.424 34.220 84 H3' DC 8 H3' DC 8 25.009 35.184 33.935 85 H2' DC 8 H2' DC 8 25.072 35.205 31.623 86 H2'' DC 8 H2'' DC 8 26.815 35.379 31.909 87 H1' DC 8 H1' DC 8 27.214 33.032 31.694 88 H41 DC 8 H41 DC 8 26.056 32.496 25.442 89 H42 DC 8 H42 DC 8 24.427 33.107 25.650 90 H5 DC 8 H5 DC 8 23.529 33.829 27.734 91 H6 DC 8 H6 DC 8 23.969 34.039 30.122 92 H5' DA 9 H5' DA 9 29.365 34.369 33.342 93 H5'' DA 9 H5'' DA 9 30.444 35.613 33.983 94 H4' DA 9 H4' DA 9 30.989 35.211 31.693 95 H3' DA 9 H3' DA 9 29.923 37.840 32.445 96 H2' DA 9 H2' DA 9 28.639 38.031 30.604 97 H2'' DA 9 H2'' DA 9 30.125 38.087 29.635 98 H1' DA 9 H1' DA 9 30.114 35.784 29.182 99 H8 DA 9 H8 DA 9 26.549 37.008 30.241 100 H61 DA 9 H61 DA 9 25.267 35.983 24.211 101 H62 DA 9 H62 DA 9 24.583 36.634 25.709 102 H2 DA 9 H2 DA 9 29.222 34.482 24.949 103 H5' DT 10 H5' DT 10 32.958 37.309 29.212 104 H5'' DT 10 H5'' DT 10 34.129 38.608 28.969 105 H4' DT 10 H4' DT 10 33.251 37.836 26.844 106 H3' DT 10 H3' DT 10 32.285 40.595 27.639 107 H2' DT 10 H2' DT 10 31.070 40.684 25.655 108 H2'' DT 10 H2'' DT 10 32.171 39.561 24.809 109 H1' DT 10 H1' DT 10 30.943 37.809 25.290 110 H3 DT 10 H3 DT 10 26.692 38.724 24.178 111 H71 DT 10 H71 DT 10 27.512 40.166 29.382 112 H72 DT 10 H72 DT 10 26.388 41.150 28.409 113 H73 DT 10 H73 DT 10 25.950 39.498 28.859 114 H6 DT 10 H6 DT 10 29.355 39.589 28.108 115 H5' DC 11 H5' DC 11 34.244 39.825 23.785 116 H5'' DC 11 H5'' DC 11 35.257 41.117 23.139 117 H4' DC 11 H4' DC 11 33.770 40.130 21.447 118 H3' DC 11 H3' DC 11 34.078 42.921 21.890 119 H2' DC 11 H2' DC 11 31.905 43.264 22.621 120 H2'' DC 11 H2'' DC 11 31.561 43.362 20.878 121 H1' DC 11 H1' DC 11 31.005 41.047 20.727 122 H41 DC 11 H41 DC 11 26.012 42.455 24.849 123 H42 DC 11 H42 DC 11 25.431 41.586 23.416 124 H5 DC 11 H5 DC 11 28.422 42.787 25.214 125 H6 DC 11 H6 DC 11 30.629 42.460 24.203 126 H5' DG 12 H5' DG 12 31.903 41.177 18.315 127 H5'' DG 12 H5'' DG 12 32.328 41.923 16.769 128 H4' DG 12 H4' DG 12 29.997 41.293 16.781 129 H3' DG 12 H3' DG 12 30.852 43.914 16.144 130 HO3' DG 12 HO3' DG 12 28.871 43.853 14.892 131 H2' DG 12 H2' DG 12 29.944 44.825 18.158 132 H2'' DG 12 H2'' DG 12 28.536 45.010 17.055 133 H1' DG 12 H1' DG 12 27.694 42.812 17.697 134 H8 DG 12 H8 DG 12 29.569 44.598 20.645 135 H1 DG 12 H1 DG 12 23.191 43.834 21.276 136 H21 DG 12 H21 DG 12 22.415 42.800 19.419 137 H22 DG 12 H22 DG 12 23.541 42.350 18.149 138 H5 DCZ 13 H5 DC 13 19.287 46.605 14.953 139 H6 DCZ 13 H6 DC 13 18.042 44.759 15.978 140 HN41 DCZ 13 H41 DC 13 21.527 45.951 12.116 141 HN42 DCZ 13 H42 DC 13 20.861 47.170 13.203 142 H1' DCZ 13 H1' DC 13 18.160 41.274 14.658 143 H2'1 DCZ 13 H2' DC 13 18.906 42.714 17.233 144 H2'2 DCZ 13 H2'' DC 13 19.445 41.117 16.650 145 H3' DCZ 13 H3' DC 13 17.370 41.328 18.409 146 H4' DCZ 13 H4' DC 13 15.406 41.361 16.476 147 H5'1 DCZ 13 H5' DC 13 14.959 43.720 16.977 148 H5'2 DCZ 13 H5'' DC 13 15.177 42.730 18.416 149 HO5' DCZ 13 HO5' DC 13 17.145 43.719 18.820 150 H5' DG 14 H5' DG 14 19.172 39.232 15.256 151 H5'' DG 14 H5'' DG 14 18.739 37.529 15.360 152 H4' DG 14 H4' DG 14 20.935 38.110 14.231 153 H3' DG 14 H3' DG 14 20.274 35.806 15.529 154 H2' DG 14 H2' DG 14 20.959 36.499 17.671 155 H2'' DG 14 H2'' DG 14 22.410 35.640 17.151 156 H1' DG 14 H1' DG 14 23.541 37.616 16.536 157 H8 DG 14 H8 DG 14 20.695 38.165 19.144 158 H1 DG 14 H1 DG 14 26.461 40.551 20.747 159 H21 DG 14 H21 DG 14 27.860 40.183 19.107 160 H22 DG 14 H22 DG 14 27.320 39.462 17.584 161 H5' DA 15 H5' DA 15 24.595 37.024 14.647 162 H5'' DA 15 H5'' DA 15 25.172 35.825 13.493 163 H4' DA 15 H4' DA 15 27.060 36.821 14.473 164 H3' DA 15 H3' DA 15 26.701 34.090 14.510 165 H2' DA 15 H2' DA 15 26.146 33.787 16.728 166 H2'' DA 15 H2'' DA 15 27.901 33.814 16.984 167 H1' DA 15 H1' DA 15 27.916 35.988 17.782 168 H8 DA 15 H8 DA 15 24.269 34.630 17.624 169 H61 DA 15 H61 DA 15 23.765 37.344 23.239 170 H62 DA 15 H62 DA 15 22.881 36.347 22.086 171 H2 DA 15 H2 DA 15 27.802 37.950 21.863 172 H5' DT 16 H5' DT 16 30.956 35.169 16.199 173 H5'' DT 16 H5'' DT 16 32.112 33.867 15.887 174 H4' DT 16 H4' DT 16 32.189 34.419 18.230 175 H3' DT 16 H3' DT 16 30.688 31.835 17.697 176 H2' DT 16 H2' DT 16 30.279 31.640 19.922 177 H2'' DT 16 H2'' DT 16 31.807 32.423 20.416 178 H1' DT 16 H1' DT 16 30.901 34.470 20.488 179 H3 DT 16 H3 DT 16 27.347 34.711 23.227 180 H71 DT 16 H71 DT 16 25.390 31.208 20.403 181 H72 DT 16 H72 DT 16 24.635 32.701 19.842 182 H73 DT 16 H73 DT 16 25.833 31.887 18.814 183 H6 DT 16 H6 DT 16 28.075 32.503 19.001 184 H5' DG 17 H5' DG 17 34.231 31.782 20.519 185 H5'' DG 17 H5'' DG 17 35.292 30.499 19.933 186 H4' DG 17 H4' DG 17 35.492 30.553 22.271 187 H3' DG 17 H3' DG 17 34.720 28.198 20.989 188 H2' DG 17 H2' DG 17 32.514 28.164 21.640 189 H2'' DG 17 H2'' DG 17 33.152 27.430 23.122 190 H1' DG 17 H1' DG 17 33.006 29.412 24.347 191 H8 DG 17 H8 DG 17 30.917 29.639 21.060 192 H1 DG 17 H1 DG 17 27.924 31.819 26.360 193 H21 DG 17 H21 DG 17 29.243 31.569 28.084 194 H22 DG 17 H22 DG 17 30.874 30.911 27.873 195 H5' DT 18 H5' DT 18 35.814 28.749 25.293 196 H5'' DT 18 H5'' DT 18 36.828 27.502 26.024 197 H4' DT 18 H4' DT 18 35.336 28.601 27.630 198 H3' DT 18 H3' DT 18 35.589 25.776 27.334 199 H2' DT 18 H2' DT 18 33.361 25.396 26.789 200 H2'' DT 18 H2'' DT 18 33.121 25.556 28.559 201 H1' DT 18 H1' DT 18 32.605 27.863 28.407 202 H3 DT 18 H3 DT 18 28.370 28.441 26.981 203 H71 DT 18 H71 DT 18 31.133 25.894 23.021 204 H72 DT 18 H72 DT 18 29.374 25.702 23.173 205 H73 DT 18 H73 DT 18 30.037 27.222 22.568 206 H6 DT 18 H6 DT 18 32.225 26.295 25.023 207 H5' DA 19 H5' DA 19 34.070 26.965 31.660 208 H5'' DA 19 H5'' DA 19 34.697 25.840 32.867 209 H4' DA 19 H4' DA 19 32.305 26.257 33.075 210 H3' DA 19 H3' DA 19 33.346 23.570 32.912 211 H2' DA 19 H2' DA 19 31.964 22.995 31.130 212 H2'' DA 19 H2'' DA 19 30.697 22.878 32.383 213 H1' DA 19 H1' DA 19 29.990 25.151 32.030 214 H8 DA 19 H8 DA 19 31.779 23.726 28.869 215 H61 DA 19 H61 DA 19 26.637 25.684 25.918 216 H62 DA 19 H62 DA 19 28.149 24.807 25.688 217 H2 DA 19 H2 DA 19 26.016 26.336 30.144 218 H5' DC 20 H5' DC 20 29.302 24.466 34.766 219 H5'' DC 20 H5'' DC 20 28.896 23.539 36.212 220 H4' DC 20 H4' DC 20 26.987 23.672 34.778 221 H3' DC 20 H3' DC 20 28.035 21.125 35.528 222 H2' DC 20 H2' DC 20 28.516 20.542 33.313 223 H2'' DC 20 H2'' DC 20 26.802 20.038 33.318 224 H1' DC 20 H1' DC 20 26.077 22.244 32.604 225 H41 DC 20 H41 DC 20 27.629 22.099 26.488 226 H42 DC 20 H42 DC 20 29.241 21.500 26.836 227 H5 DC 20 H5 DC 20 30.000 20.936 29.045 228 H6 DC 20 H6 DC 20 29.430 21.042 31.413 229 H5' DA 21 H5' DA 21 23.853 20.964 33.730 230 H5'' DA 21 H5'' DA 21 22.781 19.840 34.565 231 H4' DA 21 H4' DA 21 22.492 19.389 32.293 232 H3' DA 21 H3' DA 21 23.664 17.298 33.840 233 H2' DA 21 H2' DA 21 25.740 17.601 32.641 234 H2'' DA 21 H2'' DA 21 24.915 16.331 31.672 235 H1' DA 21 H1' DA 21 23.773 18.112 30.337 236 H8 DA 21 H8 DA 21 27.508 17.695 31.021 237 H61 DA 21 H61 DA 21 27.973 19.257 24.970 238 H62 DA 21 H62 DA 21 28.870 18.526 26.305 239 H2 DA 21 H2 DA 21 23.941 20.095 26.205 240 H5' DT 22 H5' DT 22 19.936 17.633 31.506 241 H5'' DT 22 H5'' DT 22 18.589 16.499 31.613 242 H4' DT 22 H4' DT 22 18.783 17.492 29.392 243 H3' DT 22 H3' DT 22 18.465 14.757 29.734 244 H2' DT 22 H2' DT 22 20.746 14.241 29.338 245 H2'' DT 22 H2'' DT 22 20.120 14.093 27.675 246 H1' DT 22 H1' DT 22 20.637 16.358 27.146 247 H3 DT 22 H3 DT 22 24.936 16.187 25.835 248 H71 DT 22 H71 DT 22 24.653 14.127 30.875 249 H72 DT 22 H72 DT 22 25.688 13.326 29.676 250 H73 DT 22 H73 DT 22 26.161 14.896 30.315 251 H6 DT 22 H6 DT 22 22.731 14.973 29.941 252 H5' DC 23 H5' DC 23 18.901 15.952 25.267 253 H5'' DC 23 H5'' DC 23 17.651 15.194 24.276 254 H4' DC 23 H4' DC 23 19.748 15.129 23.118 255 H3' DC 23 H3' DC 23 18.261 12.800 23.428 256 H2' DC 23 H2' DC 23 19.660 12.040 25.255 257 H2'' DC 23 H2'' DC 23 20.377 11.183 23.854 258 H1' DC 23 H1' DC 23 21.848 13.028 23.390 259 H41 DC 23 H41 DC 23 26.389 11.624 27.309 260 H42 DC 23 H42 DC 23 25.320 11.143 28.632 261 H5 DC 23 H5 DC 23 22.897 11.378 28.437 262 H6 DC 23 H6 DC 23 21.096 12.078 26.938 263 H5' DG 24 H5' DG 24 22.448 12.269 21.331 264 H5'' DG 24 H5'' DG 24 22.290 11.298 19.868 265 H4' DG 24 H4' DG 24 24.350 10.780 21.066 266 H3' DG 24 H3' DG 24 22.630 8.824 20.100 267 HO3' DG 24 HO3' DG 24 24.491 7.528 20.171 268 H2' DG 24 H2' DG 24 21.663 8.359 22.231 269 H2'' DG 24 H2'' DG 24 22.982 7.145 22.198 270 H1' DG 24 H1' DG 24 24.493 8.618 23.342 271 H8 DG 24 H8 DG 24 20.720 9.015 24.223 272 H1 DG 24 H1 DG 24 24.682 7.817 29.168 273 H21 DG 24 H21 DG 24 26.787 7.707 28.395 274 H22 DG 24 H22 DG 24 27.107 7.986 26.692 275 H33 CWN 101 H33 PA6 25 29.273 27.815 31.130 276 H35 CWN 101 H35 PA6 25 32.535 29.240 33.617 277 H031 CWN 101 H031 PA6 25 20.511 16.772 20.683 278 H032 CWN 101 H032 PA6 25 21.591 18.033 20.067 279 H042 CWN 101 H042 PA6 25 22.493 18.376 22.378 280 H041 CWN 101 H041 PA6 25 21.301 17.251 23.023 281 H052 CWN 101 H052 PA6 25 19.454 18.723 22.331 282 H051 CWN 101 H051 PA6 25 20.569 19.763 21.422 283 HN02 CWN 101 HN02 PA6 25 21.665 20.374 23.579 284 HN01 CWN 101 HN01 PA6 25 23.499 16.705 21.007 285 H004 CWN 101 H004 PA6 25 22.949 16.726 18.608 286 H005 CWN 101 H005 PA6 25 21.804 15.381 18.885 287 H006 CWN 101 H006 PA6 25 23.558 15.133 19.122 288 H001 CWN 101 H001 PA6 25 21.408 14.547 21.206 289 H002 CWN 101 H002 PA6 25 22.230 15.323 22.592 290 H003 CWN 101 H003 PA6 25 23.166 14.335 21.442 291 HN03 CWN 101 HN03 PA6 25 22.402 20.461 28.328 292 H13 CWN 101 H13 PA6 25 23.148 21.543 29.893 293 HN1 CWN 101 HN1 PA6 25 24.078 23.223 31.692 294 H15 CWN 101 H15 PA6 25 20.597 22.363 33.305 295 H112 CWN 101 H112 PA6 25 18.901 19.631 31.668 296 H111 CWN 101 H111 PA6 25 18.241 21.180 31.069 297 H113 CWN 101 H113 PA6 25 18.645 20.987 32.797 298 HN2 CWN 101 HN2 PA6 25 27.759 26.394 32.173 299 HN3 CWN 101 HN3 PA6 25 31.296 29.181 29.926 300 H25 CWN 101 H25 PA6 25 26.028 26.811 35.637 301 H223 CWN 101 H223 PA6 25 24.061 26.127 36.813 302 H222 CWN 101 H222 PA6 25 23.665 24.412 36.516 303 H221 CWN 101 H221 PA6 25 22.672 25.711 35.779 304 HN4 CWN 101 HN4 PA6 25 32.296 31.646 26.063 305 H23 CWN 101 H23 PA6 25 25.670 24.674 31.881 306 HN9 CWN 101 HN9 PA6 25 31.133 34.173 26.977 307 HN5 CWN 101 HN5 PA6 25 29.487 32.013 30.725 308 H332 CWN 101 H332 PA6 25 32.041 28.239 35.725 309 H331 CWN 101 H331 PA6 25 30.939 26.835 35.711 310 H333 CWN 101 H333 PA6 25 30.309 28.469 36.101 311 HN6 CWN 101 HN6 PA6 25 25.667 29.081 32.022 312 HN7 CWN 101 HN7 PA6 25 22.150 25.860 30.707 313 H44 CWN 101 H44 PA6 25 35.789 31.802 27.660 314 H443 CWN 101 H443 PA6 25 36.920 30.935 29.640 315 H442 CWN 101 H442 PA6 25 36.164 29.496 30.368 316 H441 CWN 101 H441 PA6 25 35.887 31.116 31.082 317 H081 CWN 101 H081 PA6 25 22.005 19.134 26.398 318 H082 CWN 101 H082 PA6 25 20.365 18.810 26.969 319 H53 CWN 101 H53 PA6 25 30.404 33.387 28.682 320 H55 CWN 101 H55 PA6 25 33.061 32.960 32.079 321 H553 CWN 101 H553 PA6 25 34.598 35.580 30.227 322 H551 CWN 101 H551 PA6 25 35.318 34.054 29.621 323 H552 CWN 101 H552 PA6 25 34.983 34.261 31.365 324 H63 CWN 101 H63 PA6 25 27.883 30.553 31.241 325 H65 CWN 101 H65 PA6 25 27.141 29.998 35.476 326 H663 CWN 101 H663 PA6 25 29.652 32.443 35.565 327 H661 CWN 101 H661 PA6 25 30.535 30.885 35.519 328 H662 CWN 101 H662 PA6 25 29.042 31.040 36.482 329 H75 CWN 101 H75 PA6 25 20.641 27.197 34.061 330 H771 CWN 101 H771 PA6 25 22.140 30.058 35.347 331 H773 CWN 101 H773 PA6 25 22.928 28.730 36.256 332 H772 CWN 101 H772 PA6 25 21.193 28.638 35.867 333 H921 CWN 101 H921 PA6 25 33.725 32.996 23.370 334 H922 CWN 101 H922 PA6 25 32.205 32.824 24.246 335 H932 CWN 101 H932 PA6 25 33.092 35.219 23.527 336 H931 CWN 101 H931 PA6 25 34.222 35.070 24.857 337 H942 CWN 101 H942 PA6 25 31.181 35.243 24.931 338 H943 CWN 101 H943 PA6 25 32.362 36.352 25.621 339 H73 CWN 101 H73 PA6 25 24.189 27.385 31.562 340 H072 CWN 101 H072 PA6 25 19.780 21.246 26.311 341 H071 CWN 101 H071 PA6 25 21.361 21.336 25.527 342 H883 CWN 101 H883 PA6 25 17.797 23.739 32.169 343 H881 CWN 101 H881 PA6 25 16.699 23.677 30.789 344 H882 CWN 101 H882 PA6 25 17.303 25.239 31.352 345 H83 CWN 101 H83 PA6 25 20.764 23.184 27.590 Start of MODEL 8 1 H5 DCZ 1 H5 DC 1 28.645 9.445 25.751 2 H6 DCZ 1 H6 DC 1 30.661 8.884 24.493 3 HN41 DCZ 1 H41 DC 1 25.333 8.805 24.304 4 HN42 DCZ 1 H42 DC 1 26.229 9.485 25.660 5 H1' DCZ 1 H1' DC 1 30.499 7.419 21.033 6 H2'1 DCZ 1 H2' DC 1 31.131 10.002 21.997 7 H2'2 DCZ 1 H2'' DC 1 31.953 9.085 20.705 8 H3' DCZ 1 H3' DC 1 32.680 9.242 23.662 9 H4' DCZ 1 H4' DC 1 33.435 7.041 21.708 10 H5'1 DCZ 1 H5' DC 1 33.878 5.704 23.675 11 H5'2 DCZ 1 H5'' DC 1 34.764 7.223 23.823 12 HO5' DCZ 1 HO5' DC 1 32.264 6.585 25.091 13 H5' DG 2 H5' DG 2 33.297 10.620 19.782 14 H5'' DG 2 H5'' DG 2 34.103 12.163 19.558 15 H4' DG 2 H4' DG 2 31.874 11.796 18.382 16 H3' DG 2 H3' DG 2 32.932 14.171 19.174 17 H2' DG 2 H2' DG 2 31.980 14.176 21.349 18 H2'' DG 2 H2'' DG 2 30.768 15.136 20.465 19 H1' DG 2 H1' DG 2 29.322 13.311 20.169 20 H8 DG 2 H8 DG 2 31.748 12.827 23.196 21 H1 DG 2 H1 DG 2 25.454 12.104 24.451 22 H21 DG 2 H21 DG 2 24.362 12.163 22.580 23 H22 DG 2 H22 DG 2 25.193 12.360 21.019 24 H5' DA 3 H5' DA 3 28.404 14.127 17.690 25 H5'' DA 3 H5'' DA 3 28.584 15.028 16.188 26 H4' DA 3 H4' DA 3 26.322 15.127 16.814 27 H3' DA 3 H3' DA 3 27.721 17.403 16.248 28 H2' DA 3 H2' DA 3 28.143 18.160 18.404 29 H2'' DA 3 H2'' DA 3 26.534 18.890 18.232 30 H1' DA 3 H1' DA 3 25.504 17.318 19.561 31 H8 DA 3 H8 DA 3 29.372 17.109 19.935 32 H61 DA 3 H61 DA 3 28.059 15.438 25.825 33 H62 DA 3 H62 DA 3 29.394 15.691 24.701 34 H2 DA 3 H2 DA 3 24.329 16.295 23.875 35 H5' DT 4 H5' DT 4 23.308 18.115 17.376 36 H5'' DT 4 H5'' DT 4 22.526 19.356 16.393 37 H4' DT 4 H4' DT 4 21.896 19.621 18.699 38 H3' DT 4 H3' DT 4 23.268 21.750 17.274 39 H2' DT 4 H2' DT 4 24.882 22.054 18.817 40 H2'' DT 4 H2'' DT 4 23.651 22.816 19.829 41 H1' DT 4 H1' DT 4 23.143 20.835 21.000 42 H3 DT 4 H3 DT 4 26.363 19.934 24.063 43 H71 DT 4 H71 DT 4 29.543 21.425 20.714 44 H72 DT 4 H72 DT 4 29.542 19.680 20.442 45 H73 DT 4 H73 DT 4 28.795 20.761 19.244 46 H6 DT 4 H6 DT 4 26.509 20.857 19.338 47 H5' DG 5 H5' DG 5 20.537 21.566 20.884 48 H5'' DG 5 H5'' DG 5 19.188 22.565 20.369 49 H4' DG 5 H4' DG 5 18.979 22.322 22.678 50 H3' DG 5 H3' DG 5 19.170 24.833 21.530 51 H2' DG 5 H2' DG 5 21.345 25.347 22.204 52 H2'' DG 5 H2'' DG 5 20.506 25.885 23.690 53 H1' DG 5 H1' DG 5 21.049 23.935 24.860 54 H8 DG 5 H8 DG 5 23.272 24.042 21.648 55 H1 DG 5 H1 DG 5 26.315 22.627 27.175 56 H21 DG 5 H21 DG 5 24.933 22.952 28.849 57 H22 DG 5 H22 DG 5 23.286 23.510 28.546 58 H5' DT 6 H5' DT 6 17.793 24.925 26.044 59 H5'' DT 6 H5'' DT 6 16.731 26.291 26.408 60 H4' DT 6 H4' DT 6 18.509 26.103 28.076 61 H3' DT 6 H3' DT 6 18.658 28.496 26.241 62 H2' DT 6 H2' DT 6 20.796 28.941 26.886 63 H2'' DT 6 H2'' DT 6 20.441 28.508 28.583 64 H1' DT 6 H1' DT 6 21.102 26.436 28.448 65 H3 DT 6 H3 DT 6 25.462 26.153 27.315 66 H71 DT 6 H71 DT 6 24.277 28.312 23.143 67 H72 DT 6 H72 DT 6 24.013 26.622 22.713 68 H73 DT 6 H73 DT 6 22.622 27.708 22.909 69 H6 DT 6 H6 DT 6 21.501 27.536 24.922 70 H5' DA 7 H5' DA 7 18.971 29.061 30.849 71 H5'' DA 7 H5'' DA 7 18.777 30.723 31.419 72 H4' DA 7 H4' DA 7 20.828 29.609 32.276 73 H3' DA 7 H3' DA 7 21.258 32.016 30.478 74 H2' DA 7 H2' DA 7 23.610 31.720 30.851 75 H2'' DA 7 H2'' DA 7 23.328 30.658 32.261 76 H1' DA 7 H1' DA 7 23.614 28.964 30.888 77 H8 DA 7 H8 DA 7 21.798 30.767 28.011 78 H61 DA 7 H61 DA 7 27.048 29.110 25.010 79 H62 DA 7 H62 DA 7 25.477 29.875 24.758 80 H2 DA 7 H2 DA 7 27.726 28.522 29.218 81 H5' DC 8 H5' DC 8 23.637 31.720 34.035 82 H5'' DC 8 H5'' DC 8 23.951 33.196 34.923 83 H4' DC 8 H4' DC 8 26.000 31.847 34.361 84 H3' DC 8 H3' DC 8 25.684 34.613 34.346 85 H2' DC 8 H2' DC 8 25.545 34.800 32.010 86 H2'' DC 8 H2'' DC 8 27.302 35.003 32.223 87 H1' DC 8 H1' DC 8 27.726 32.670 31.841 88 H41 DC 8 H41 DC 8 26.456 32.443 25.599 89 H42 DC 8 H42 DC 8 24.848 33.090 25.858 90 H5 DC 8 H5 DC 8 23.982 33.700 27.992 91 H6 DC 8 H6 DC 8 24.462 33.793 30.384 92 H5' DA 9 H5' DA 9 30.202 34.040 33.474 93 H5'' DA 9 H5'' DA 9 31.131 35.396 34.119 94 H4' DA 9 H4' DA 9 31.487 35.203 31.731 95 H3' DA 9 H3' DA 9 30.045 37.613 32.717 96 H2' DA 9 H2' DA 9 28.844 37.865 30.841 97 H2'' DA 9 H2'' DA 9 30.323 37.896 29.847 98 H1' DA 9 H1' DA 9 30.357 35.666 29.409 99 H8 DA 9 H8 DA 9 26.785 36.714 30.633 100 H61 DA 9 H61 DA 9 25.775 36.452 24.492 101 H62 DA 9 H62 DA 9 24.983 36.885 26.023 102 H2 DA 9 H2 DA 9 29.524 34.539 25.229 103 H5' DT 10 H5' DT 10 32.898 37.890 29.308 104 H5'' DT 10 H5'' DT 10 33.858 39.367 29.215 105 H4' DT 10 H4' DT 10 33.094 38.766 27.025 106 H3' DT 10 H3' DT 10 31.546 41.150 28.068 107 H2' DT 10 H2' DT 10 30.687 41.300 25.831 108 H2'' DT 10 H2'' DT 10 31.984 40.269 25.182 109 H1' DT 10 H1' DT 10 30.645 38.497 25.421 110 H3 DT 10 H3 DT 10 26.363 39.871 24.599 111 H71 DT 10 H71 DT 10 25.701 39.242 29.314 112 H72 DT 10 H72 DT 10 27.289 39.690 29.978 113 H73 DT 10 H73 DT 10 26.186 40.941 29.351 114 H6 DT 10 H6 DT 10 29.105 39.509 28.561 115 H5' DC 11 H5' DC 11 33.617 41.624 24.309 116 H5'' DC 11 H5'' DC 11 34.459 43.162 24.125 117 H4' DC 11 H4' DC 11 33.152 42.538 22.124 118 H3' DC 11 H3' DC 11 33.247 45.088 23.204 119 H2' DC 11 H2' DC 11 31.160 44.827 24.372 120 H2'' DC 11 H2'' DC 11 30.618 45.642 22.880 121 H1' DC 11 H1' DC 11 30.262 43.551 21.750 122 H41 DC 11 H41 DC 11 25.227 42.862 25.969 123 H42 DC 11 H42 DC 11 24.680 42.709 24.304 124 H5 DC 11 H5 DC 11 27.587 43.224 26.486 125 H6 DC 11 H6 DC 11 29.816 43.431 25.488 126 H5' DG 12 H5' DG 12 30.068 45.012 19.927 127 H5'' DG 12 H5'' DG 12 30.226 46.360 18.795 128 H4' DG 12 H4' DG 12 27.920 46.129 19.429 129 H3' DG 12 H3' DG 12 29.288 48.589 19.783 130 HO3' DG 12 HO3' DG 12 27.444 49.063 18.776 131 H2' DG 12 H2' DG 12 29.266 48.392 22.159 132 H2'' DG 12 H2'' DG 12 27.719 49.271 21.892 133 H1' DG 12 H1' DG 12 26.488 47.179 21.741 134 H8 DG 12 H8 DG 12 29.514 47.147 24.222 135 H1 DG 12 H1 DG 12 23.716 45.846 26.742 136 H21 DG 12 H21 DG 12 22.177 45.986 25.098 137 H22 DG 12 H22 DG 12 22.687 46.343 23.458 138 H5 DCZ 13 H5 DC 13 20.653 47.677 18.536 139 H6 DCZ 13 H6 DC 13 19.058 45.830 18.693 140 HN41 DCZ 13 H41 DC 13 23.435 47.503 16.142 141 HN42 DCZ 13 H42 DC 13 22.664 48.440 17.425 142 H1' DCZ 13 H1' DC 13 19.052 42.946 16.386 143 H2'1 DCZ 13 H2' DC 13 20.106 43.166 19.224 144 H2'2 DCZ 13 H2'' DC 13 20.350 41.858 18.029 145 H3' DCZ 13 H3' DC 13 18.453 41.638 19.983 146 H4' DCZ 13 H4' DC 13 16.381 42.639 18.499 147 H5'1 DCZ 13 H5' DC 13 16.431 44.711 19.824 148 H5'2 DCZ 13 H5'' DC 13 16.609 43.249 20.789 149 HO5' DCZ 13 HO5' DC 13 18.062 44.934 21.463 150 H5' DG 14 H5' DG 14 19.826 40.442 16.153 151 H5'' DG 14 H5'' DG 14 19.462 38.757 15.798 152 H4' DG 14 H4' DG 14 21.677 39.632 14.958 153 H3' DG 14 H3' DG 14 21.139 37.067 15.678 154 H2' DG 14 H2' DG 14 21.653 37.364 17.990 155 H2'' DG 14 H2'' DG 14 23.168 36.671 17.384 156 H1' DG 14 H1' DG 14 24.208 38.779 17.149 157 H8 DG 14 H8 DG 14 21.319 38.811 19.791 158 H1 DG 14 H1 DG 14 27.098 40.782 21.833 159 H21 DG 14 H21 DG 14 28.506 40.785 20.099 160 H22 DG 14 H22 DG 14 27.965 40.210 18.526 161 H5' DA 15 H5' DA 15 25.623 38.455 15.110 162 H5'' DA 15 H5'' DA 15 26.290 37.387 13.880 163 H4' DA 15 H4' DA 15 28.052 38.298 15.191 164 H3' DA 15 H3' DA 15 27.856 35.605 14.689 165 H2' DA 15 H2' DA 15 27.084 34.881 16.749 166 H2'' DA 15 H2'' DA 15 28.807 34.887 17.179 167 H1' DA 15 H1' DA 15 28.670 36.883 18.355 168 H8 DA 15 H8 DA 15 25.088 35.543 17.584 169 H61 DA 15 H61 DA 15 24.028 36.941 23.578 170 H62 DA 15 H62 DA 15 23.276 36.276 22.141 171 H2 DA 15 H2 DA 15 28.202 37.737 22.773 172 H5' DT 16 H5' DT 16 31.848 36.594 17.047 173 H5'' DT 16 H5'' DT 16 33.140 35.477 16.587 174 H4' DT 16 H4' DT 16 33.008 35.578 18.997 175 H3' DT 16 H3' DT 16 31.880 33.014 17.846 176 H2' DT 16 H2' DT 16 31.217 32.354 19.914 177 H2'' DT 16 H2'' DT 16 32.618 33.095 20.742 178 H1' DT 16 H1' DT 16 31.581 35.052 21.099 179 H3 DT 16 H3 DT 16 27.782 34.638 23.470 180 H71 DT 16 H71 DT 16 25.586 33.188 19.446 181 H72 DT 16 H72 DT 16 26.921 32.444 18.542 182 H73 DT 16 H73 DT 16 26.228 31.633 19.966 183 H6 DT 16 H6 DT 16 29.042 33.241 19.024 184 H5' DG 17 H5' DG 17 35.111 32.731 21.063 185 H5'' DG 17 H5'' DG 17 36.297 31.552 20.500 186 H4' DG 17 H4' DG 17 36.069 31.270 22.833 187 H3' DG 17 H3' DG 17 35.528 29.120 21.072 188 H2' DG 17 H2' DG 17 33.284 28.943 21.506 189 H2'' DG 17 H2'' DG 17 33.809 28.028 22.940 190 H1' DG 17 H1' DG 17 33.552 29.871 24.385 191 H8 DG 17 H8 DG 17 31.585 30.364 21.051 192 H1 DG 17 H1 DG 17 28.271 31.757 26.432 193 H21 DG 17 H21 DG 17 29.589 31.507 28.166 194 H22 DG 17 H22 DG 17 31.252 30.947 27.935 195 H5' DT 18 H5' DT 18 36.361 29.094 25.461 196 H5'' DT 18 H5'' DT 18 37.337 27.770 26.085 197 H4' DT 18 H4' DT 18 35.755 28.683 27.720 198 H3' DT 18 H3' DT 18 36.057 25.908 27.115 199 H2' DT 18 H2' DT 18 33.850 25.559 26.491 200 H2'' DT 18 H2'' DT 18 33.559 25.561 28.265 201 H1' DT 18 H1' DT 18 33.008 27.859 28.295 202 H3 DT 18 H3 DT 18 28.779 28.355 26.803 203 H71 DT 18 H71 DT 18 31.827 26.549 22.647 204 H72 DT 18 H72 DT 18 30.102 26.128 22.733 205 H73 DT 18 H73 DT 18 30.579 27.783 22.349 206 H6 DT 18 H6 DT 18 32.821 26.715 24.737 207 H5' DA 19 H5' DA 19 34.666 26.684 31.613 208 H5'' DA 19 H5'' DA 19 35.307 25.438 32.687 209 H4' DA 19 H4' DA 19 32.910 25.877 32.967 210 H3' DA 19 H3' DA 19 33.965 23.207 32.585 211 H2' DA 19 H2' DA 19 32.499 22.703 30.865 212 H2'' DA 19 H2'' DA 19 31.265 22.583 32.161 213 H1' DA 19 H1' DA 19 30.555 24.845 31.858 214 H8 DA 19 H8 DA 19 32.416 23.603 28.662 215 H61 DA 19 H61 DA 19 27.289 25.588 25.709 216 H62 DA 19 H62 DA 19 28.837 24.783 25.478 217 H2 DA 19 H2 DA 19 26.573 26.021 29.962 218 H5' DC 20 H5' DC 20 30.037 24.074 34.630 219 H5'' DC 20 H5'' DC 20 29.672 23.116 36.066 220 H4' DC 20 H4' DC 20 27.694 23.324 34.733 221 H3' DC 20 H3' DC 20 28.767 20.753 35.356 222 H2' DC 20 H2' DC 20 29.135 20.213 33.118 223 H2'' DC 20 H2'' DC 20 27.421 19.726 33.185 224 H1' DC 20 H1' DC 20 26.681 21.938 32.512 225 H41 DC 20 H41 DC 20 28.212 21.969 26.369 226 H42 DC 20 H42 DC 20 29.845 21.428 26.707 227 H5 DC 20 H5 DC 20 30.620 20.836 28.895 228 H6 DC 20 H6 DC 20 30.044 20.837 31.264 229 H5' DA 21 H5' DA 21 24.506 20.691 33.816 230 H5'' DA 21 H5'' DA 21 23.481 19.499 34.617 231 H4' DA 21 H4' DA 21 23.133 19.186 32.321 232 H3' DA 21 H3' DA 21 24.437 17.034 33.741 233 H2' DA 21 H2' DA 21 26.382 17.324 32.408 234 H2'' DA 21 H2'' DA 21 25.451 16.167 31.394 235 H1' DA 21 H1' DA 21 24.314 18.054 30.256 236 H8 DA 21 H8 DA 21 28.082 17.621 30.881 237 H61 DA 21 H61 DA 21 28.490 19.156 24.835 238 H62 DA 21 H62 DA 21 29.383 18.437 26.177 239 H2 DA 21 H2 DA 21 24.434 19.950 26.092 240 H5' DT 22 H5' DT 22 20.657 17.984 31.791 241 H5'' DT 22 H5'' DT 22 19.123 17.120 31.899 242 H4' DT 22 H4' DT 22 19.504 18.084 29.718 243 H3' DT 22 H3' DT 22 18.614 15.499 30.005 244 H2' DT 22 H2' DT 22 20.665 14.466 29.481 245 H2'' DT 22 H2'' DT 22 20.008 14.611 27.829 246 H1' DT 22 H1' DT 22 21.138 16.621 27.384 247 H3 DT 22 H3 DT 22 25.422 15.567 26.357 248 H71 DT 22 H71 DT 22 26.022 14.039 30.899 249 H72 DT 22 H72 DT 22 24.348 13.687 31.382 250 H73 DT 22 H73 DT 22 25.223 12.598 30.282 251 H6 DT 22 H6 DT 22 22.686 14.776 30.253 252 H5' DC 23 H5' DC 23 19.264 16.623 25.669 253 H5'' DC 23 H5'' DC 23 17.826 16.357 24.681 254 H4' DC 23 H4' DC 23 19.700 15.608 23.432 255 H3' DC 23 H3' DC 23 17.605 13.855 23.931 256 H2' DC 23 H2' DC 23 18.834 12.719 25.682 257 H2'' DC 23 H2'' DC 23 19.155 11.662 24.276 258 H1' DC 23 H1' DC 23 21.098 12.953 23.660 259 H41 DC 23 H41 DC 23 25.421 11.065 27.714 260 H42 DC 23 H42 DC 23 24.315 10.989 29.083 261 H5 DC 23 H5 DC 23 21.991 11.652 28.870 262 H6 DC 23 H6 DC 23 20.304 12.463 27.296 263 H5' DG 24 H5' DG 24 20.816 11.529 21.717 264 H5'' DG 24 H5'' DG 24 20.147 10.564 20.397 265 H4' DG 24 H4' DG 24 21.543 9.131 21.695 266 H3' DG 24 H3' DG 24 18.806 8.493 21.373 267 HO3' DG 24 HO3' DG 24 19.574 6.343 21.666 268 H2' DG 24 H2' DG 24 18.301 9.014 23.645 269 H2'' DG 24 H2'' DG 24 18.675 7.261 23.791 270 H1' DG 24 H1' DG 24 21.026 7.749 24.220 271 H8 DG 24 H8 DG 24 18.157 9.812 25.799 272 H1 DG 24 H1 DG 24 22.931 8.088 29.784 273 H21 DG 24 H21 DG 24 24.577 7.145 28.563 274 H22 DG 24 H22 DG 24 24.402 7.016 26.821 275 H33 CWN 101 H33 PA6 25 29.735 27.546 31.042 276 H35 CWN 101 H35 PA6 25 33.084 28.808 33.502 277 H031 CWN 101 H031 PA6 25 21.134 16.497 20.550 278 H032 CWN 101 H032 PA6 25 22.492 17.536 20.067 279 H042 CWN 101 H042 PA6 25 23.055 17.956 22.451 280 H041 CWN 101 H041 PA6 25 21.679 16.981 22.984 281 H052 CWN 101 H052 PA6 25 20.080 18.555 22.003 282 H051 CWN 101 H051 PA6 25 21.378 19.436 21.169 283 HN02 CWN 101 HN02 PA6 25 22.267 20.156 23.348 284 HN01 CWN 101 HN01 PA6 25 24.002 16.014 21.331 285 H004 CWN 101 H004 PA6 25 22.414 14.726 19.106 286 H005 CWN 101 H005 PA6 25 24.091 14.322 19.587 287 H006 CWN 101 H006 PA6 25 23.729 15.918 18.880 288 H001 CWN 101 H001 PA6 25 23.203 13.740 21.864 289 H002 CWN 101 H002 PA6 25 21.543 14.237 21.392 290 H003 CWN 101 H003 PA6 25 22.336 14.973 22.824 291 HN03 CWN 101 HN03 PA6 25 22.932 20.184 28.118 292 H13 CWN 101 H13 PA6 25 23.685 21.229 29.745 293 HN1 CWN 101 HN1 PA6 25 24.629 22.835 31.594 294 H15 CWN 101 H15 PA6 25 21.038 22.214 33.041 295 H112 CWN 101 H112 PA6 25 18.973 21.112 32.369 296 H111 CWN 101 H111 PA6 25 19.157 19.722 31.270 297 H113 CWN 101 H113 PA6 25 18.703 21.317 30.617 298 HN2 CWN 101 HN2 PA6 25 28.262 26.029 32.062 299 HN3 CWN 101 HN3 PA6 25 31.701 29.044 29.872 300 H25 CWN 101 H25 PA6 25 26.634 26.301 35.596 301 H223 CWN 101 H223 PA6 25 24.722 25.515 36.821 302 H222 CWN 101 H222 PA6 25 24.258 23.842 36.407 303 H221 CWN 101 H221 PA6 25 23.292 25.223 35.796 304 HN4 CWN 101 HN4 PA6 25 32.501 31.954 26.283 305 H23 CWN 101 H23 PA6 25 26.165 24.335 31.763 306 HN9 CWN 101 HN9 PA6 25 31.341 34.548 27.365 307 HN5 CWN 101 HN5 PA6 25 29.964 31.794 30.840 308 H332 CWN 101 H332 PA6 25 31.524 26.233 35.472 309 H331 CWN 101 H331 PA6 25 31.014 27.865 36.012 310 H333 CWN 101 H333 PA6 25 32.707 27.563 35.521 311 HN6 CWN 101 HN6 PA6 25 26.251 28.721 31.985 312 HN7 CWN 101 HN7 PA6 25 22.723 25.572 30.482 313 H44 CWN 101 H44 PA6 25 36.058 32.038 27.752 314 H443 CWN 101 H443 PA6 25 36.272 30.965 31.076 315 H442 CWN 101 H442 PA6 25 37.282 30.982 29.600 316 H441 CWN 101 H441 PA6 25 36.590 29.440 30.181 317 H081 CWN 101 H081 PA6 25 22.513 18.966 26.140 318 H082 CWN 101 H082 PA6 25 20.864 18.676 26.717 319 H53 CWN 101 H53 PA6 25 30.758 33.417 28.935 320 H55 CWN 101 H55 PA6 25 33.594 32.614 32.119 321 H553 CWN 101 H553 PA6 25 35.599 33.730 31.276 322 H551 CWN 101 H551 PA6 25 35.137 35.344 30.658 323 H552 CWN 101 H552 PA6 25 35.653 34.059 29.523 324 H63 CWN 101 H63 PA6 25 28.429 30.241 31.272 325 H65 CWN 101 H65 PA6 25 27.754 29.446 35.481 326 H663 CWN 101 H663 PA6 25 29.623 30.550 36.521 327 H661 CWN 101 H661 PA6 25 30.340 31.902 35.602 328 H662 CWN 101 H662 PA6 25 31.112 30.286 35.566 329 H75 CWN 101 H75 PA6 25 21.169 26.872 33.823 330 H771 CWN 101 H771 PA6 25 22.832 29.744 35.115 331 H773 CWN 101 H773 PA6 25 23.239 28.322 36.131 332 H772 CWN 101 H772 PA6 25 21.584 28.527 35.486 333 H921 CWN 101 H921 PA6 25 33.612 33.538 23.701 334 H922 CWN 101 H922 PA6 25 32.201 33.382 24.737 335 H932 CWN 101 H932 PA6 25 33.005 35.772 23.927 336 H931 CWN 101 H931 PA6 25 34.283 35.618 25.114 337 H942 CWN 101 H942 PA6 25 31.295 35.931 25.515 338 H943 CWN 101 H943 PA6 25 32.614 36.869 26.209 339 H73 CWN 101 H73 PA6 25 24.812 26.978 31.463 340 H072 CWN 101 H072 PA6 25 20.289 21.080 25.997 341 H071 CWN 101 H071 PA6 25 21.888 21.173 25.249 342 H883 CWN 101 H883 PA6 25 18.167 23.710 31.769 343 H881 CWN 101 H881 PA6 25 17.122 23.855 30.347 344 H882 CWN 101 H882 PA6 25 17.897 25.301 31.011 345 H83 CWN 101 H83 PA6 25 21.219 23.076 27.241 Start of MODEL 9 1 H5 DCZ 1 H5 DC 1 29.106 9.718 26.385 2 H6 DCZ 1 H6 DC 1 31.101 9.262 25.048 3 HN41 DCZ 1 H41 DC 1 25.771 9.069 25.015 4 HN42 DCZ 1 H42 DC 1 26.708 9.643 26.388 5 H1' DCZ 1 H1' DC 1 30.901 7.873 21.573 6 H2'1 DCZ 1 H2' DC 1 31.435 10.495 22.481 7 H2'2 DCZ 1 H2'' DC 1 32.274 9.603 21.187 8 H3' DCZ 1 H3' DC 1 33.049 9.882 24.115 9 H4' DCZ 1 H4' DC 1 33.886 7.622 22.271 10 H5'1 DCZ 1 H5' DC 1 34.346 6.399 24.315 11 H5'2 DCZ 1 H5'' DC 1 35.177 7.954 24.388 12 HO5' DCZ 1 HO5' DC 1 32.720 7.253 25.703 13 H5' DG 2 H5' DG 2 33.707 10.958 20.059 14 H5'' DG 2 H5'' DG 2 34.372 12.548 19.709 15 H4' DG 2 H4' DG 2 32.235 11.872 18.507 16 H3' DG 2 H3' DG 2 32.979 14.408 19.105 17 H2' DG 2 H2' DG 2 32.029 14.455 21.286 18 H2'' DG 2 H2'' DG 2 30.731 15.222 20.346 19 H1' DG 2 H1' DG 2 29.487 13.242 20.156 20 H8 DG 2 H8 DG 2 31.906 13.255 23.228 21 H1 DG 2 H1 DG 2 25.674 12.139 24.472 22 H21 DG 2 H21 DG 2 24.621 11.898 22.608 23 H22 DG 2 H22 DG 2 25.444 12.002 21.037 24 H5' DA 3 H5' DA 3 28.300 13.735 18.080 25 H5'' DA 3 H5'' DA 3 28.380 14.431 16.465 26 H4' DA 3 H4' DA 3 26.148 14.555 17.079 27 H3' DA 3 H3' DA 3 27.399 16.867 16.370 28 H2' DA 3 H2' DA 3 27.881 17.704 18.503 29 H2'' DA 3 H2'' DA 3 26.266 18.407 18.335 30 H1' DA 3 H1' DA 3 25.272 16.853 19.722 31 H8 DA 3 H8 DA 3 29.135 16.842 20.101 32 H61 DA 3 H61 DA 3 27.890 15.327 26.043 33 H62 DA 3 H62 DA 3 29.215 15.672 24.936 34 H2 DA 3 H2 DA 3 24.120 15.862 24.031 35 H5' DT 4 H5' DT 4 22.815 17.424 17.492 36 H5'' DT 4 H5'' DT 4 22.084 18.816 16.684 37 H4' DT 4 H4' DT 4 21.558 18.797 19.076 38 H3' DT 4 H3' DT 4 23.268 21.022 18.002 39 H2' DT 4 H2' DT 4 23.871 21.723 20.086 40 H2'' DT 4 H2'' DT 4 22.261 21.395 20.772 41 H1' DT 4 H1' DT 4 22.743 19.399 21.501 42 H3 DT 4 H3 DT 4 26.158 19.471 24.391 43 H71 DT 4 H71 DT 4 28.897 21.243 20.814 44 H72 DT 4 H72 DT 4 29.135 19.505 20.583 45 H73 DT 4 H73 DT 4 28.173 20.431 19.407 46 H6 DT 4 H6 DT 4 25.879 20.214 19.643 47 H5' DG 5 H5' DG 5 19.773 21.268 20.760 48 H5'' DG 5 H5'' DG 5 18.610 22.500 20.258 49 H4' DG 5 H4' DG 5 18.526 22.351 22.622 50 H3' DG 5 H3' DG 5 19.149 24.765 21.317 51 H2' DG 5 H2' DG 5 21.312 24.986 22.085 52 H2'' DG 5 H2'' DG 5 20.514 25.631 23.544 53 H1' DG 5 H1' DG 5 20.702 23.591 24.710 54 H8 DG 5 H8 DG 5 23.035 23.419 21.597 55 H1 DG 5 H1 DG 5 25.943 22.342 27.256 56 H21 DG 5 H21 DG 5 24.589 22.839 28.878 57 H22 DG 5 H22 DG 5 22.971 23.444 28.556 58 H5' DT 6 H5' DT 6 17.406 25.160 25.719 59 H5'' DT 6 H5'' DT 6 16.601 26.717 25.983 60 H4' DT 6 H4' DT 6 18.126 26.112 27.843 61 H3' DT 6 H3' DT 6 18.687 28.553 26.161 62 H2' DT 6 H2' DT 6 20.759 28.805 27.084 63 H2'' DT 6 H2'' DT 6 20.181 28.202 28.669 64 H1' DT 6 H1' DT 6 20.863 26.215 28.390 65 H3 DT 6 H3 DT 6 25.210 25.843 27.313 66 H71 DT 6 H71 DT 6 24.144 27.806 23.053 67 H72 DT 6 H72 DT 6 23.659 26.146 22.684 68 H73 DT 6 H73 DT 6 22.421 27.410 22.880 69 H6 DT 6 H6 DT 6 21.290 27.279 24.882 70 H5' DA 7 H5' DA 7 18.970 28.934 30.689 71 H5'' DA 7 H5'' DA 7 18.777 30.571 31.328 72 H4' DA 7 H4' DA 7 20.890 29.473 32.075 73 H3' DA 7 H3' DA 7 21.160 31.921 30.313 74 H2' DA 7 H2' DA 7 23.501 31.688 30.425 75 H2'' DA 7 H2'' DA 7 23.435 30.723 31.923 76 H1' DA 7 H1' DA 7 23.542 28.894 30.727 77 H8 DA 7 H8 DA 7 21.926 30.543 27.644 78 H61 DA 7 H61 DA 7 27.205 28.351 25.083 79 H62 DA 7 H62 DA 7 25.665 29.106 24.688 80 H2 DA 7 H2 DA 7 27.716 28.301 29.372 81 H5' DC 8 H5' DC 8 23.610 31.744 33.838 82 H5'' DC 8 H5'' DC 8 23.956 33.246 34.686 83 H4' DC 8 H4' DC 8 25.995 31.935 34.017 84 H3' DC 8 H3' DC 8 25.563 34.718 33.859 85 H2' DC 8 H2' DC 8 25.526 34.807 31.532 86 H2'' DC 8 H2'' DC 8 27.287 34.944 31.759 87 H1' DC 8 H1' DC 8 27.611 32.585 31.524 88 H41 DC 8 H41 DC 8 26.424 31.926 25.297 89 H42 DC 8 H42 DC 8 24.842 32.643 25.476 90 H5 DC 8 H5 DC 8 23.962 33.454 27.542 91 H6 DC 8 H6 DC 8 24.418 33.744 29.924 92 H5' DA 9 H5' DA 9 30.043 33.968 33.177 93 H5'' DA 9 H5'' DA 9 31.012 35.297 33.824 94 H4' DA 9 H4' DA 9 31.524 34.966 31.494 95 H3' DA 9 H3' DA 9 30.414 37.496 32.416 96 H2' DA 9 H2' DA 9 28.909 37.662 30.721 97 H2'' DA 9 H2'' DA 9 30.288 37.955 29.642 98 H1' DA 9 H1' DA 9 30.519 35.664 29.065 99 H8 DA 9 H8 DA 9 26.932 36.763 30.145 100 H61 DA 9 H61 DA 9 25.801 35.669 24.118 101 H62 DA 9 H62 DA 9 25.039 36.266 25.606 102 H2 DA 9 H2 DA 9 29.620 33.933 25.025 103 H5' DT 10 H5' DT 10 33.347 37.317 28.849 104 H5'' DT 10 H5'' DT 10 34.335 38.772 28.664 105 H4' DT 10 H4' DT 10 33.492 38.033 26.514 106 H3' DT 10 H3' DT 10 32.159 40.572 27.499 107 H2' DT 10 H2' DT 10 31.084 40.668 25.407 108 H2'' DT 10 H2'' DT 10 32.316 39.666 24.607 109 H1' DT 10 H1' DT 10 31.139 37.819 24.997 110 H3 DT 10 H3 DT 10 26.892 39.053 23.925 111 H71 DT 10 H71 DT 10 26.096 38.986 28.706 112 H72 DT 10 H72 DT 10 27.637 39.640 29.306 113 H73 DT 10 H73 DT 10 26.485 40.681 28.439 114 H6 DT 10 H6 DT 10 29.483 39.145 27.990 115 H5' DC 11 H5' DC 11 33.656 41.224 23.396 116 H5'' DC 11 H5'' DC 11 34.671 42.669 23.439 117 H4' DC 11 H4' DC 11 33.235 42.832 21.530 118 H3' DC 11 H3' DC 11 33.362 44.868 23.430 119 H2' DC 11 H2' DC 11 31.280 44.175 24.431 120 H2'' DC 11 H2'' DC 11 30.733 45.469 23.342 121 H1' DC 11 H1' DC 11 30.425 43.890 21.511 122 H41 DC 11 H41 DC 11 25.334 41.650 25.091 123 H42 DC 11 H42 DC 11 24.748 42.394 23.610 124 H5 DC 11 H5 DC 11 27.676 41.892 25.771 125 H6 DC 11 H6 DC 11 29.905 42.430 24.919 126 H5' DG 12 H5' DG 12 30.064 46.374 20.759 127 H5'' DG 12 H5'' DG 12 30.274 48.087 20.381 128 H4' DG 12 H4' DG 12 28.092 47.857 21.257 129 H3' DG 12 H3' DG 12 29.907 49.521 22.641 130 HO3' DG 12 HO3' DG 12 27.965 50.584 23.306 131 H2' DG 12 H2' DG 12 30.093 47.986 24.460 132 H2'' DG 12 H2'' DG 12 28.743 49.020 25.043 133 H1' DG 12 H1' DG 12 27.103 47.548 24.001 134 H8 DG 12 H8 DG 12 30.265 46.016 25.690 135 H1 DG 12 H1 DG 12 24.560 43.845 27.777 136 H21 DG 12 H21 DG 12 22.929 44.802 26.537 137 H22 DG 12 H22 DG 12 23.356 45.924 25.260 138 H5 DCZ 13 H5 DC 13 21.587 47.068 19.241 139 H6 DCZ 13 H6 DC 13 19.927 45.435 18.493 140 HN41 DCZ 13 H41 DC 13 25.104 46.694 18.255 141 HN42 DCZ 13 H42 DC 13 23.933 47.639 19.175 142 H1' DCZ 13 H1' DC 13 20.685 42.681 16.141 143 H2'1 DCZ 13 H2' DC 13 20.145 42.810 19.126 144 H2'2 DCZ 13 H2'' DC 13 20.817 41.462 18.171 145 H3' DCZ 13 H3' DC 13 18.168 41.527 18.821 146 H4' DCZ 13 H4' DC 13 17.365 42.772 16.496 147 H5'1 DCZ 13 H5' DC 13 16.836 44.791 17.793 148 H5'2 DCZ 13 H5'' DC 13 16.321 43.301 18.573 149 HO5' DCZ 13 HO5' DC 13 17.938 43.529 20.114 150 H5' DG 14 H5' DG 14 20.908 40.442 15.465 151 H5'' DG 14 H5'' DG 14 20.197 38.950 14.854 152 H4' DG 14 H4' DG 14 22.541 39.107 14.268 153 H3' DG 14 H3' DG 14 21.365 36.817 15.259 154 H2' DG 14 H2' DG 14 22.040 37.159 17.488 155 H2'' DG 14 H2'' DG 14 23.367 36.139 16.931 156 H1' DG 14 H1' DG 14 24.793 37.991 16.495 157 H8 DG 14 H8 DG 14 22.071 38.549 19.226 158 H1 DG 14 H1 DG 14 28.131 39.931 20.966 159 H21 DG 14 H21 DG 14 29.462 39.714 19.153 160 H22 DG 14 H22 DG 14 28.749 39.278 17.609 161 H5' DA 15 H5' DA 15 25.798 37.346 14.630 162 H5'' DA 15 H5'' DA 15 26.333 36.152 13.454 163 H4' DA 15 H4' DA 15 28.198 36.939 14.694 164 H3' DA 15 H3' DA 15 27.682 34.258 14.354 165 H2' DA 15 H2' DA 15 26.889 33.735 16.465 166 H2'' DA 15 H2'' DA 15 28.605 33.589 16.880 167 H1' DA 15 H1' DA 15 28.689 35.649 17.940 168 H8 DA 15 H8 DA 15 24.987 34.608 17.280 169 H61 DA 15 H61 DA 15 24.137 36.572 23.152 170 H62 DA 15 H62 DA 15 23.301 35.826 21.802 171 H2 DA 15 H2 DA 15 28.341 36.904 22.267 172 H5' DT 16 H5' DT 16 31.696 35.050 16.562 173 H5'' DT 16 H5'' DT 16 32.915 33.811 16.237 174 H4' DT 16 H4' DT 16 32.775 34.120 18.608 175 H3' DT 16 H3' DT 16 31.394 31.583 17.695 176 H2' DT 16 H2' DT 16 30.772 31.156 19.842 177 H2'' DT 16 H2'' DT 16 32.247 31.867 20.551 178 H1' DT 16 H1' DT 16 31.354 33.919 20.745 179 H3 DT 16 H3 DT 16 27.636 33.901 23.264 180 H71 DT 16 H71 DT 16 25.743 30.806 20.017 181 H72 DT 16 H72 DT 16 25.213 32.365 19.383 182 H73 DT 16 H73 DT 16 26.467 31.445 18.524 183 H6 DT 16 H6 DT 16 28.640 32.135 18.888 184 H5' DG 17 H5' DG 17 34.703 31.513 20.721 185 H5'' DG 17 H5'' DG 17 35.871 30.293 20.207 186 H4' DG 17 H4' DG 17 35.861 30.311 22.564 187 H3' DG 17 H3' DG 17 35.294 27.951 21.153 188 H2' DG 17 H2' DG 17 33.068 27.773 21.685 189 H2'' DG 17 H2'' DG 17 33.666 27.057 23.194 190 H1' DG 17 H1' DG 17 33.359 29.025 24.424 191 H8 DG 17 H8 DG 17 31.378 29.083 21.055 192 H1 DG 17 H1 DG 17 28.142 31.262 26.212 193 H21 DG 17 H21 DG 17 29.422 31.135 27.978 194 H22 DG 17 H22 DG 17 31.061 30.492 27.845 195 H5' DT 18 H5' DT 18 36.339 28.467 25.492 196 H5'' DT 18 H5'' DT 18 37.346 27.218 26.230 197 H4' DT 18 H4' DT 18 35.801 28.290 27.817 198 H3' DT 18 H3' DT 18 36.123 25.479 27.471 199 H2' DT 18 H2' DT 18 33.930 25.029 26.894 200 H2'' DT 18 H2'' DT 18 33.638 25.181 28.653 201 H1' DT 18 H1' DT 18 33.023 27.450 28.491 202 H3 DT 18 H3 DT 18 28.820 27.801 26.883 203 H71 DT 18 H71 DT 18 30.685 26.576 22.550 204 H72 DT 18 H72 DT 18 31.872 25.356 23.070 205 H73 DT 18 H73 DT 18 30.132 25.025 23.189 206 H6 DT 18 H6 DT 18 32.869 25.882 25.089 207 H5' DA 19 H5' DA 19 34.370 26.526 31.697 208 H5'' DA 19 H5'' DA 19 35.009 25.413 32.908 209 H4' DA 19 H4' DA 19 32.613 25.624 33.104 210 H3' DA 19 H3' DA 19 33.751 22.995 32.563 211 H2' DA 19 H2' DA 19 32.255 22.523 30.883 212 H2'' DA 19 H2'' DA 19 31.025 22.397 32.161 213 H1' DA 19 H1' DA 19 30.343 24.670 31.919 214 H8 DA 19 H8 DA 19 32.197 23.514 28.689 215 H61 DA 19 H61 DA 19 26.917 25.128 25.818 216 H62 DA 19 H62 DA 19 28.479 24.361 25.595 217 H2 DA 19 H2 DA 19 26.308 25.761 30.074 218 H5' DC 20 H5' DC 20 29.835 23.813 34.731 219 H5'' DC 20 H5'' DC 20 29.463 22.760 36.097 220 H4' DC 20 H4' DC 20 27.468 23.278 34.816 221 H3' DC 20 H3' DC 20 28.242 20.620 35.438 222 H2' DC 20 H2' DC 20 28.610 20.030 33.192 223 H2'' DC 20 H2'' DC 20 26.857 19.694 33.246 224 H1' DC 20 H1' DC 20 26.309 21.943 32.569 225 H41 DC 20 H41 DC 20 27.851 21.660 26.469 226 H42 DC 20 H42 DC 20 29.469 21.075 26.798 227 H5 DC 20 H5 DC 20 30.293 20.703 29.052 228 H6 DC 20 H6 DC 20 29.672 20.769 31.415 229 H5' DA 21 H5' DA 21 23.889 20.719 33.858 230 H5'' DA 21 H5'' DA 21 22.886 19.549 34.716 231 H4' DA 21 H4' DA 21 22.512 19.211 32.399 232 H3' DA 21 H3' DA 21 23.596 17.061 33.929 233 H2' DA 21 H2' DA 21 25.695 17.287 32.770 234 H2'' DA 21 H2'' DA 21 24.841 16.065 31.776 235 H1' DA 21 H1' DA 21 23.806 17.861 30.422 236 H8 DA 21 H8 DA 21 27.540 17.483 31.283 237 H61 DA 21 H61 DA 21 28.223 18.950 25.212 238 H62 DA 21 H62 DA 21 29.087 18.234 26.572 239 H2 DA 21 H2 DA 21 24.106 19.606 26.255 240 H5' DT 22 H5' DT 22 20.005 17.880 31.333 241 H5'' DT 22 H5'' DT 22 18.489 16.989 31.474 242 H4' DT 22 H4' DT 22 18.917 17.684 29.195 243 H3' DT 22 H3' DT 22 18.209 15.068 29.752 244 H2' DT 22 H2' DT 22 20.356 14.158 29.462 245 H2'' DT 22 H2'' DT 22 19.798 14.049 27.775 246 H1' DT 22 H1' DT 22 20.774 16.117 27.153 247 H3 DT 22 H3 DT 22 25.205 15.388 26.501 248 H71 DT 22 H71 DT 22 25.597 14.119 31.133 249 H72 DT 22 H72 DT 22 23.906 13.794 31.565 250 H73 DT 22 H73 DT 22 24.837 12.621 30.613 251 H6 DT 22 H6 DT 22 22.270 14.673 30.262 252 H5' DC 23 H5' DC 23 18.926 15.840 25.242 253 H5'' DC 23 H5'' DC 23 17.555 15.264 24.286 254 H4' DC 23 H4' DC 23 19.559 14.734 23.122 255 H3' DC 23 H3' DC 23 17.735 12.719 23.644 256 H2' DC 23 H2' DC 23 19.027 11.883 25.520 257 H2'' DC 23 H2'' DC 23 19.574 10.809 24.196 258 H1' DC 23 H1' DC 23 21.329 12.323 23.582 259 H41 DC 23 H41 DC 23 25.632 11.188 27.920 260 H42 DC 23 H42 DC 23 24.464 10.960 29.222 261 H5 DC 23 H5 DC 23 22.095 11.372 28.875 262 H6 DC 23 H6 DC 23 20.415 11.940 27.196 263 H5' DG 24 H5' DG 24 21.428 10.797 21.613 264 H5'' DG 24 H5'' DG 24 20.900 9.719 20.312 265 H4' DG 24 H4' DG 24 22.434 8.511 21.695 266 H3' DG 24 H3' DG 24 19.815 7.543 21.245 267 HO3' DG 24 HO3' DG 24 20.830 5.499 21.627 268 H2' DG 24 H2' DG 24 19.126 8.013 23.472 269 H2'' DG 24 H2'' DG 24 19.697 6.321 23.667 270 H1' DG 24 H1' DG 24 21.941 7.092 24.232 271 H8 DG 24 H8 DG 24 18.722 8.750 25.567 272 H1 DG 24 H1 DG 24 23.453 7.964 29.880 273 H21 DG 24 H21 DG 24 25.303 7.258 28.796 274 H22 DG 24 H22 DG 24 25.255 7.034 27.056 275 H33 CWN 101 H33 PA6 25 29.647 27.375 31.049 276 H35 CWN 101 H35 PA6 25 32.978 28.712 33.497 277 H031 CWN 101 H031 PA6 25 20.731 15.766 21.007 278 H032 CWN 101 H032 PA6 25 21.741 17.072 20.370 279 H042 CWN 101 H042 PA6 25 22.698 17.418 22.672 280 H041 CWN 101 H041 PA6 25 21.546 16.269 23.329 281 H052 CWN 101 H052 PA6 25 19.658 17.685 22.829 282 H051 CWN 101 H051 PA6 25 20.601 18.703 21.720 283 HN02 CWN 101 HN02 PA6 25 22.007 19.159 23.952 284 HN01 CWN 101 HN01 PA6 25 23.723 15.786 21.342 285 H004 CWN 101 H004 PA6 25 22.134 14.526 19.101 286 H005 CWN 101 H005 PA6 25 23.885 14.328 19.386 287 H006 CWN 101 H006 PA6 25 23.239 15.923 18.933 288 H001 CWN 101 H001 PA6 25 23.413 13.384 21.631 289 H002 CWN 101 H002 PA6 25 21.655 13.591 21.376 290 H003 CWN 101 H003 PA6 25 22.444 14.303 22.812 291 HN03 CWN 101 HN03 PA6 25 22.554 20.002 28.345 292 H13 CWN 101 H13 PA6 25 23.363 21.197 29.896 293 HN1 CWN 101 HN1 PA6 25 24.375 22.882 31.684 294 H15 CWN 101 H15 PA6 25 20.781 22.446 33.155 295 H112 CWN 101 H112 PA6 25 18.398 21.381 30.847 296 H111 CWN 101 H111 PA6 25 18.710 21.340 32.603 297 H113 CWN 101 H113 PA6 25 18.880 19.850 31.638 298 HN2 CWN 101 HN2 PA6 25 28.147 25.915 32.081 299 HN3 CWN 101 HN3 PA6 25 31.650 28.775 29.841 300 H25 CWN 101 H25 PA6 25 26.554 26.322 35.603 301 H223 CWN 101 H223 PA6 25 23.146 25.530 35.792 302 H222 CWN 101 H222 PA6 25 24.589 25.753 36.815 303 H221 CWN 101 H221 PA6 25 23.988 24.104 36.482 304 HN4 CWN 101 HN4 PA6 25 32.428 31.243 26.034 305 H23 CWN 101 H23 PA6 25 25.958 24.294 31.819 306 HN9 CWN 101 HN9 PA6 25 31.310 34.236 26.931 307 HN5 CWN 101 HN5 PA6 25 29.838 31.708 30.542 308 H332 CWN 101 H332 PA6 25 31.425 26.359 35.633 309 H331 CWN 101 H331 PA6 25 30.757 27.988 35.986 310 H333 CWN 101 H333 PA6 25 32.490 27.789 35.602 311 HN6 CWN 101 HN6 PA6 25 26.062 28.739 31.850 312 HN7 CWN 101 HN7 PA6 25 22.459 25.646 30.506 313 H44 CWN 101 H44 PA6 25 35.960 31.594 27.514 314 H443 CWN 101 H443 PA6 25 36.067 30.998 30.998 315 H442 CWN 101 H442 PA6 25 37.133 30.948 29.569 316 H441 CWN 101 H441 PA6 25 36.535 29.424 30.277 317 H081 CWN 101 H081 PA6 25 22.028 18.705 26.443 318 H082 CWN 101 H082 PA6 25 20.360 18.584 27.013 319 H53 CWN 101 H53 PA6 25 30.704 33.148 28.520 320 H55 CWN 101 H55 PA6 25 33.456 32.552 31.817 321 H553 CWN 101 H553 PA6 25 34.960 35.261 30.131 322 H551 CWN 101 H551 PA6 25 35.626 33.807 29.322 323 H552 CWN 101 H552 PA6 25 35.388 33.817 31.092 324 H63 CWN 101 H63 PA6 25 28.268 30.176 31.049 325 H65 CWN 101 H65 PA6 25 27.652 29.527 35.290 326 H663 CWN 101 H663 PA6 25 29.544 30.625 36.265 327 H661 CWN 101 H661 PA6 25 30.159 32.005 35.315 328 H662 CWN 101 H662 PA6 25 31.024 30.437 35.287 329 H75 CWN 101 H75 PA6 25 20.979 27.078 33.834 330 H771 CWN 101 H771 PA6 25 23.166 28.526 36.080 331 H773 CWN 101 H773 PA6 25 21.491 28.706 35.494 332 H772 CWN 101 H772 PA6 25 22.717 29.915 35.040 333 H921 CWN 101 H921 PA6 25 33.309 32.589 23.375 334 H922 CWN 101 H922 PA6 25 32.022 32.691 24.562 335 H932 CWN 101 H932 PA6 25 32.893 34.877 23.330 336 H931 CWN 101 H931 PA6 25 34.246 34.806 24.437 337 H942 CWN 101 H942 PA6 25 31.341 35.427 24.961 338 H943 CWN 101 H943 PA6 25 32.782 36.276 25.513 339 H73 CWN 101 H73 PA6 25 24.600 27.003 31.434 340 H072 CWN 101 H072 PA6 25 19.994 21.006 26.208 341 H071 CWN 101 H071 PA6 25 21.594 20.932 25.456 342 H883 CWN 101 H883 PA6 25 17.796 24.109 31.805 343 H881 CWN 101 H881 PA6 25 16.808 24.117 30.342 344 H882 CWN 101 H882 PA6 25 17.596 25.608 30.867 345 H83 CWN 101 H83 PA6 25 20.968 22.919 27.465 Start of MODEL 10 1 H5 DCZ 1 H5 DC 1 29.346 9.468 24.936 2 H6 DCZ 1 H6 DC 1 31.167 8.779 23.464 3 HN41 DCZ 1 H41 DC 1 25.883 8.580 24.112 4 HN42 DCZ 1 H42 DC 1 26.946 9.535 25.149 5 H1' DCZ 1 H1' DC 1 30.506 6.929 20.256 6 H2'1 DCZ 1 H2' DC 1 31.191 9.608 20.934 7 H2'2 DCZ 1 H2'' DC 1 31.761 8.642 19.550 8 H3' DCZ 1 H3' DC 1 33.066 8.929 22.296 9 H4' DCZ 1 H4' DC 1 33.410 6.705 20.251 10 H5'1 DCZ 1 H5' DC 1 34.412 5.437 22.060 11 H5'2 DCZ 1 H5'' DC 1 35.280 6.961 21.866 12 HO5' DCZ 1 HO5' DC 1 33.295 6.384 23.864 13 H5' DG 2 H5' DG 2 32.755 10.437 18.470 14 H5'' DG 2 H5'' DG 2 33.704 11.879 18.124 15 H4' DG 2 H4' DG 2 31.332 11.922 17.342 16 H3' DG 2 H3' DG 2 32.729 14.095 18.268 17 H2' DG 2 H2' DG 2 32.005 13.921 20.513 18 H2'' DG 2 H2'' DG 2 30.785 15.066 19.904 19 H1' DG 2 H1' DG 2 29.186 13.384 19.530 20 H8 DG 2 H8 DG 2 31.831 12.394 22.242 21 H1 DG 2 H1 DG 2 25.625 12.103 24.009 22 H21 DG 2 H21 DG 2 24.402 12.486 22.244 23 H22 DG 2 H22 DG 2 25.129 12.889 20.671 24 H5' DA 3 H5' DA 3 27.998 14.076 17.670 25 H5'' DA 3 H5'' DA 3 28.126 14.929 16.137 26 H4' DA 3 H4' DA 3 25.900 15.093 16.719 27 H3' DA 3 H3' DA 3 27.320 17.381 16.298 28 H2' DA 3 H2' DA 3 27.740 18.001 18.506 29 H2'' DA 3 H2'' DA 3 26.148 18.775 18.350 30 H1' DA 3 H1' DA 3 25.068 17.155 19.564 31 H8 DA 3 H8 DA 3 28.930 16.719 19.969 32 H61 DA 3 H61 DA 3 27.330 15.102 25.824 33 H62 DA 3 H62 DA 3 28.741 15.339 24.787 34 H2 DA 3 H2 DA 3 23.746 16.186 23.765 35 H5' DT 4 H5' DT 4 22.848 18.199 17.343 36 H5'' DT 4 H5'' DT 4 22.171 19.498 16.353 37 H4' DT 4 H4' DT 4 21.418 19.693 18.641 38 H3' DT 4 H3' DT 4 22.825 21.843 17.322 39 H2' DT 4 H2' DT 4 24.457 22.054 18.859 40 H2'' DT 4 H2'' DT 4 23.261 22.839 19.884 41 H1' DT 4 H1' DT 4 22.702 20.862 21.049 42 H3 DT 4 H3 DT 4 25.969 19.752 24.018 43 H71 DT 4 H71 DT 4 28.302 20.658 19.166 44 H72 DT 4 H72 DT 4 29.118 21.223 20.639 45 H73 DT 4 H73 DT 4 29.032 19.490 20.292 46 H6 DT 4 H6 DT 4 26.030 20.801 19.317 47 H5' DG 5 H5' DG 5 20.133 21.509 20.925 48 H5'' DG 5 H5'' DG 5 18.772 22.530 20.485 49 H4' DG 5 H4' DG 5 18.581 22.108 22.771 50 H3' DG 5 H3' DG 5 18.661 24.686 21.809 51 H2' DG 5 H2' DG 5 20.838 25.231 22.453 52 H2'' DG 5 H2'' DG 5 20.027 25.654 23.984 53 H1' DG 5 H1' DG 5 20.687 23.678 25.036 54 H8 DG 5 H8 DG 5 22.722 23.913 21.715 55 H1 DG 5 H1 DG 5 26.128 22.550 27.027 56 H21 DG 5 H21 DG 5 24.861 22.873 28.779 57 H22 DG 5 H22 DG 5 23.186 23.386 28.593 58 H5' DT 6 H5' DT 6 17.480 24.542 26.396 59 H5'' DT 6 H5'' DT 6 16.384 25.858 26.840 60 H4' DT 6 H4' DT 6 18.230 25.707 28.425 61 H3' DT 6 H3' DT 6 18.361 28.145 26.616 62 H2' DT 6 H2' DT 6 20.416 28.669 27.569 63 H2'' DT 6 H2'' DT 6 19.943 27.858 29.103 64 H1' DT 6 H1' DT 6 20.896 26.040 28.662 65 H3 DT 6 H3 DT 6 25.138 26.071 27.290 66 H71 DT 6 H71 DT 6 23.626 28.256 23.258 67 H72 DT 6 H72 DT 6 23.362 26.567 22.813 68 H73 DT 6 H73 DT 6 21.967 27.629 23.118 69 H6 DT 6 H6 DT 6 20.979 27.370 25.197 70 H5' DA 7 H5' DA 7 18.786 28.620 31.111 71 H5'' DA 7 H5'' DA 7 18.622 30.240 31.793 72 H4' DA 7 H4' DA 7 20.789 28.996 32.309 73 H3' DA 7 H3' DA 7 20.929 31.708 30.954 74 H2' DA 7 H2' DA 7 23.298 31.480 30.971 75 H2'' DA 7 H2'' DA 7 23.261 30.282 32.283 76 H1' DA 7 H1' DA 7 23.349 28.664 30.810 77 H8 DA 7 H8 DA 7 21.539 30.484 27.993 78 H61 DA 7 H61 DA 7 26.791 28.927 24.976 79 H62 DA 7 H62 DA 7 25.188 29.615 24.735 80 H2 DA 7 H2 DA 7 27.585 28.594 29.210 81 H5' DC 8 H5' DC 8 23.786 31.126 34.171 82 H5'' DC 8 H5'' DC 8 24.004 32.527 35.210 83 H4' DC 8 H4' DC 8 26.148 31.665 34.303 84 H3' DC 8 H3' DC 8 25.303 34.336 34.449 85 H2' DC 8 H2' DC 8 24.980 34.588 32.160 86 H2'' DC 8 H2'' DC 8 26.690 35.056 32.238 87 H1' DC 8 H1' DC 8 27.437 32.818 31.735 88 H41 DC 8 H41 DC 8 25.643 32.390 25.626 89 H42 DC 8 H42 DC 8 24.011 32.866 26.042 90 H5 DC 8 H5 DC 8 23.288 33.417 28.230 91 H6 DC 8 H6 DC 8 23.963 33.581 30.561 92 H5' DA 9 H5' DA 9 29.761 34.326 33.288 93 H5'' DA 9 H5'' DA 9 30.620 35.779 33.814 94 H4' DA 9 H4' DA 9 30.816 35.468 31.412 95 H3' DA 9 H3' DA 9 29.230 37.842 32.325 96 H2' DA 9 H2' DA 9 28.261 38.086 30.302 97 H2'' DA 9 H2'' DA 9 29.796 37.853 29.435 98 H1' DA 9 H1' DA 9 29.580 35.653 29.161 99 H8 DA 9 H8 DA 9 26.055 36.646 30.563 100 H61 DA 9 H61 DA 9 24.475 35.710 24.559 101 H62 DA 9 H62 DA 9 23.791 36.216 26.113 102 H2 DA 9 H2 DA 9 28.606 34.685 24.998 103 H5' DT 10 H5' DT 10 32.201 37.852 29.159 104 H5'' DT 10 H5'' DT 10 33.291 39.236 29.060 105 H4' DT 10 H4' DT 10 32.640 38.498 26.843 106 H3' DT 10 H3' DT 10 31.368 41.142 27.633 107 H2' DT 10 H2' DT 10 30.724 41.274 25.320 108 H2'' DT 10 H2'' DT 10 31.909 40.036 24.842 109 H1' DT 10 H1' DT 10 30.315 38.484 25.053 110 H3 DT 10 H3 DT 10 26.349 40.490 23.851 111 H71 DT 10 H71 DT 10 25.519 40.662 28.590 112 H72 DT 10 H72 DT 10 25.067 38.998 28.220 113 H73 DT 10 H73 DT 10 26.539 39.323 29.163 114 H6 DT 10 H6 DT 10 28.523 39.288 27.984 115 H5' DC 11 H5' DC 11 33.762 41.398 24.125 116 H5'' DC 11 H5'' DC 11 34.882 42.764 24.122 117 H4' DC 11 H4' DC 11 33.660 42.578 22.003 118 H3' DC 11 H3' DC 11 34.055 44.957 23.332 119 H2' DC 11 H2' DC 11 31.943 44.967 24.413 120 H2'' DC 11 H2'' DC 11 31.547 45.941 22.988 121 H1' DC 11 H1' DC 11 30.778 44.074 21.741 122 H41 DC 11 H41 DC 11 26.049 43.307 26.291 123 H42 DC 11 H42 DC 11 25.354 43.176 24.673 124 H5 DC 11 H5 DC 11 28.436 43.537 26.626 125 H6 DC 11 H6 DC 11 30.582 43.725 25.482 126 H5' DG 12 H5' DG 12 31.146 45.550 19.937 127 H5'' DG 12 H5'' DG 12 31.397 47.010 18.976 128 H4' DG 12 H4' DG 12 29.066 46.811 19.535 129 H3' DG 12 H3' DG 12 30.550 49.142 20.179 130 HO3' DG 12 HO3' DG 12 28.450 50.120 19.934 131 H2' DG 12 H2' DG 12 30.425 48.707 22.519 132 H2'' DG 12 H2'' DG 12 28.936 49.691 22.297 133 H1' DG 12 H1' DG 12 27.619 47.681 21.869 134 H8 DG 12 H8 DG 12 30.484 47.390 24.517 135 H1 DG 12 H1 DG 12 24.471 46.351 26.611 136 H21 DG 12 H21 DG 12 23.069 46.463 24.842 137 H22 DG 12 H22 DG 12 23.720 46.761 23.240 138 H5 DCZ 13 H5 DC 13 20.054 48.299 19.517 139 H6 DCZ 13 H6 DC 13 18.686 46.322 19.054 140 HN41 DCZ 13 H41 DC 13 23.317 48.693 17.878 141 HN42 DCZ 13 H42 DC 13 22.145 49.391 19.001 142 H1' DCZ 13 H1' DC 13 19.657 43.729 16.573 143 H2'1 DCZ 13 H2' DC 13 19.442 43.838 19.599 144 H2'2 DCZ 13 H2'' DC 13 20.229 42.611 18.570 145 H3' DCZ 13 H3' DC 13 17.709 42.245 19.569 146 H4' DCZ 13 H4' DC 13 16.447 43.170 17.292 147 H5'1 DCZ 13 H5' DC 13 15.673 45.133 18.551 148 H5'2 DCZ 13 H5'' DC 13 15.506 43.605 19.417 149 HO5' DCZ 13 HO5' DC 13 16.286 45.295 20.791 150 H5' DG 14 H5' DG 14 20.151 41.582 15.989 151 H5'' DG 14 H5'' DG 14 19.698 39.979 15.417 152 H4' DG 14 H4' DG 14 21.902 40.842 14.600 153 H3' DG 14 H3' DG 14 21.274 38.243 15.062 154 H2' DG 14 H2' DG 14 21.901 38.201 17.337 155 H2'' DG 14 H2'' DG 14 23.388 37.586 16.598 156 H1' DG 14 H1' DG 14 24.485 39.656 16.683 157 H8 DG 14 H8 DG 14 21.697 39.074 19.311 158 H1 DG 14 H1 DG 14 26.860 42.261 21.487 159 H21 DG 14 H21 DG 14 28.148 42.749 19.850 160 H22 DG 14 H22 DG 14 27.790 42.259 18.182 161 H5' DA 15 H5' DA 15 25.761 39.212 14.736 162 H5'' DA 15 H5'' DA 15 26.566 38.156 13.568 163 H4' DA 15 H4' DA 15 28.074 38.646 15.379 164 H3' DA 15 H3' DA 15 27.354 35.972 14.665 165 H2' DA 15 H2' DA 15 26.515 35.317 16.686 166 H2'' DA 15 H2'' DA 15 28.212 35.248 17.222 167 H1' DA 15 H1' DA 15 28.144 37.348 18.240 168 H8 DA 15 H8 DA 15 24.514 36.037 17.581 169 H61 DA 15 H61 DA 15 23.779 37.538 23.637 170 H62 DA 15 H62 DA 15 22.885 36.882 22.264 171 H2 DA 15 H2 DA 15 27.862 38.245 22.609 172 H5' DT 16 H5' DT 16 31.208 36.722 17.029 173 H5'' DT 16 H5'' DT 16 32.548 35.622 16.677 174 H4' DT 16 H4' DT 16 32.310 35.992 19.081 175 H3' DT 16 H3' DT 16 31.864 33.269 17.960 176 H2' DT 16 H2' DT 16 30.482 32.620 19.619 177 H2'' DT 16 H2'' DT 16 31.707 33.049 20.840 178 H1' DT 16 H1' DT 16 30.878 35.189 21.155 179 H3 DT 16 H3 DT 16 26.915 34.889 23.298 180 H71 DT 16 H71 DT 16 24.917 33.576 19.128 181 H72 DT 16 H72 DT 16 26.283 32.795 18.296 182 H73 DT 16 H73 DT 16 25.474 31.985 19.659 183 H6 DT 16 H6 DT 16 28.389 33.498 18.919 184 H5' DG 17 H5' DG 17 34.745 32.730 21.649 185 H5'' DG 17 H5'' DG 17 35.892 31.494 21.123 186 H4' DG 17 H4' DG 17 34.967 30.795 23.210 187 H3' DG 17 H3' DG 17 34.745 29.094 20.980 188 H2' DG 17 H2' DG 17 32.429 29.675 20.657 189 H2'' DG 17 H2'' DG 17 32.323 28.174 21.633 190 H1' DG 17 H1' DG 17 32.329 29.486 23.720 191 H8 DG 17 H8 DG 17 30.203 30.283 20.629 192 H1 DG 17 H1 DG 17 27.583 32.033 26.279 193 H21 DG 17 H21 DG 17 29.032 31.689 27.880 194 H22 DG 17 H22 DG 17 30.658 31.108 27.505 195 H5' DT 18 H5' DT 18 36.124 29.562 25.151 196 H5'' DT 18 H5'' DT 18 37.198 28.540 26.107 197 H4' DT 18 H4' DT 18 35.359 29.355 27.444 198 H3' DT 18 H3' DT 18 35.980 26.601 27.303 199 H2' DT 18 H2' DT 18 33.986 26.087 26.104 200 H2'' DT 18 H2'' DT 18 33.416 25.907 27.799 201 H1' DT 18 H1' DT 18 32.798 28.248 27.901 202 H3 DT 18 H3 DT 18 28.519 28.389 26.589 203 H71 DT 18 H71 DT 18 31.408 26.195 22.522 204 H72 DT 18 H72 DT 18 29.697 25.797 22.769 205 H73 DT 18 H73 DT 18 30.133 27.369 22.094 206 H6 DT 18 H6 DT 18 32.549 26.817 24.442 207 H5' DA 19 H5' DA 19 35.876 24.309 31.582 208 H5'' DA 19 H5'' DA 19 35.176 23.350 30.283 209 H4' DA 19 H4' DA 19 33.868 25.483 31.978 210 H3' DA 19 H3' DA 19 33.837 22.596 31.840 211 H2' DA 19 H2' DA 19 32.164 22.501 30.257 212 H2'' DA 19 H2'' DA 19 31.089 22.833 31.649 213 H1' DA 19 H1' DA 19 31.089 25.184 31.221 214 H8 DA 19 H8 DA 19 32.356 23.754 27.860 215 H61 DA 19 H61 DA 19 26.843 25.589 25.631 216 H62 DA 19 H62 DA 19 28.376 24.842 25.214 217 H2 DA 19 H2 DA 19 26.673 25.990 29.961 218 H5' DC 20 H5' DC 20 30.341 24.020 34.175 219 H5'' DC 20 H5'' DC 20 30.054 23.102 35.656 220 H4' DC 20 H4' DC 20 28.005 23.332 34.471 221 H3' DC 20 H3' DC 20 29.014 20.735 35.034 222 H2' DC 20 H2' DC 20 29.218 20.164 32.775 223 H2'' DC 20 H2'' DC 20 27.490 19.753 32.959 224 H1' DC 20 H1' DC 20 26.798 21.975 32.308 225 H41 DC 20 H41 DC 20 27.992 21.929 26.090 226 H42 DC 20 H42 DC 20 29.624 21.336 26.341 227 H5 DC 20 H5 DC 20 30.525 20.799 28.493 228 H6 DC 20 H6 DC 20 30.074 20.813 30.888 229 H5' DA 21 H5' DA 21 24.593 20.693 33.810 230 H5'' DA 21 H5'' DA 21 23.656 19.490 34.704 231 H4' DA 21 H4' DA 21 23.177 19.119 32.436 232 H3' DA 21 H3' DA 21 24.577 17.045 33.849 233 H2' DA 21 H2' DA 21 26.471 17.346 32.440 234 H2'' DA 21 H2'' DA 21 25.538 16.121 31.514 235 H1' DA 21 H1' DA 21 24.306 17.929 30.343 236 H8 DA 21 H8 DA 21 28.097 17.588 30.814 237 H61 DA 21 H61 DA 21 28.188 18.941 24.715 238 H62 DA 21 H62 DA 21 29.150 18.247 26.024 239 H2 DA 21 H2 DA 21 24.217 19.809 26.157 240 H5' DT 22 H5' DT 22 20.694 17.650 31.910 241 H5'' DT 22 H5'' DT 22 19.235 16.723 32.268 242 H4' DT 22 H4' DT 22 19.262 17.452 29.962 243 H3' DT 22 H3' DT 22 18.731 14.815 30.573 244 H2' DT 22 H2' DT 22 20.937 14.067 30.077 245 H2'' DT 22 H2'' DT 22 20.139 13.783 28.511 246 H1' DT 22 H1' DT 22 20.772 15.933 27.664 247 H3 DT 22 H3 DT 22 24.946 15.533 26.044 248 H71 DT 22 H71 DT 22 26.492 14.344 30.441 249 H72 DT 22 H72 DT 22 24.995 13.733 31.193 250 H73 DT 22 H73 DT 22 25.838 12.785 29.948 251 H6 DT 22 H6 DT 22 23.021 14.582 30.357 252 H5' DC 23 H5' DC 23 19.077 15.950 26.020 253 H5'' DC 23 H5'' DC 23 17.610 15.406 25.206 254 H4' DC 23 H4' DC 23 19.474 15.237 23.703 255 H3' DC 23 H3' DC 23 17.744 13.121 24.070 256 H2' DC 23 H2' DC 23 19.232 12.021 25.659 257 H2'' DC 23 H2'' DC 23 19.610 11.169 24.133 258 H1' DC 23 H1' DC 23 21.309 12.753 23.565 259 H41 DC 23 H41 DC 23 26.060 11.207 27.224 260 H42 DC 23 H42 DC 23 25.100 11.116 28.706 261 H5 DC 23 H5 DC 23 22.705 11.549 28.687 262 H6 DC 23 H6 DC 23 20.826 12.185 27.241 263 H5' DG 24 H5' DG 24 21.191 11.457 21.457 264 H5'' DG 24 H5'' DG 24 20.549 10.512 20.107 265 H4' DG 24 H4' DG 24 22.225 9.202 21.205 266 H3' DG 24 H3' DG 24 19.622 8.189 20.902 267 HO3' DG 24 HO3' DG 24 20.690 6.146 21.083 268 H2' DG 24 H2' DG 24 19.082 8.497 23.200 269 H2'' DG 24 H2'' DG 24 19.689 6.808 23.236 270 H1' DG 24 H1' DG 24 21.945 7.557 23.726 271 H8 DG 24 H8 DG 24 18.817 9.144 25.344 272 H1 DG 24 H1 DG 24 23.794 8.139 29.318 273 H21 DG 24 H21 DG 24 25.546 7.429 28.111 274 H22 DG 24 H22 DG 24 25.411 7.288 26.370 275 H33 CWN 101 H33 PA6 25 29.566 27.791 30.829 276 H35 CWN 101 H35 PA6 25 33.439 28.275 32.736 277 H031 CWN 101 H031 PA6 25 20.538 16.478 20.649 278 H032 CWN 101 H032 PA6 25 21.779 17.590 20.041 279 H042 CWN 101 H042 PA6 25 22.633 17.943 22.340 280 H041 CWN 101 H041 PA6 25 21.390 16.876 23.001 281 H052 CWN 101 H052 PA6 25 19.602 18.413 22.283 282 H051 CWN 101 H051 PA6 25 20.772 19.427 21.412 283 HN02 CWN 101 HN02 PA6 25 21.791 20.071 23.529 284 HN01 CWN 101 HN01 PA6 25 23.474 16.034 21.101 285 H004 CWN 101 H004 PA6 25 21.728 14.941 18.893 286 H005 CWN 101 H005 PA6 25 23.435 14.502 19.185 287 H006 CWN 101 H006 PA6 25 23.017 16.158 18.669 288 H001 CWN 101 H001 PA6 25 21.102 14.166 21.137 289 H002 CWN 101 H002 PA6 25 21.941 14.796 22.583 290 H003 CWN 101 H003 PA6 25 22.796 13.710 21.457 291 HN03 CWN 101 HN03 PA6 25 22.827 19.999 28.288 292 H13 CWN 101 H13 PA6 25 23.644 21.145 29.810 293 HN1 CWN 101 HN1 PA6 25 24.657 22.826 31.553 294 H15 CWN 101 H15 PA6 25 21.242 22.023 33.316 295 H112 CWN 101 H112 PA6 25 19.338 19.379 31.534 296 H111 CWN 101 H111 PA6 25 18.763 21.061 31.389 297 H113 CWN 101 H113 PA6 25 19.354 20.442 32.960 298 HN2 CWN 101 HN2 PA6 25 28.315 26.003 31.795 299 HN3 CWN 101 HN3 PA6 25 31.470 29.215 29.509 300 H25 CWN 101 H25 PA6 25 27.031 26.116 35.476 301 H223 CWN 101 H223 PA6 25 24.737 23.520 36.310 302 H222 CWN 101 H222 PA6 25 23.799 25.028 36.068 303 H221 CWN 101 H221 PA6 25 25.388 25.076 36.885 304 HN4 CWN 101 HN4 PA6 25 31.882 31.956 25.723 305 H23 CWN 101 H23 PA6 25 26.152 24.369 31.604 306 HN9 CWN 101 HN9 PA6 25 30.735 34.533 26.969 307 HN5 CWN 101 HN5 PA6 25 29.651 31.966 30.633 308 H332 CWN 101 H332 PA6 25 33.229 26.777 34.637 309 H331 CWN 101 H331 PA6 25 31.820 25.696 34.743 310 H333 CWN 101 H333 PA6 25 31.736 27.339 35.444 311 HN6 CWN 101 HN6 PA6 25 26.126 28.748 31.902 312 HN7 CWN 101 HN7 PA6 25 22.638 25.463 30.624 313 H44 CWN 101 H44 PA6 25 35.322 32.690 27.269 314 H443 CWN 101 H443 PA6 25 36.617 32.050 29.232 315 H442 CWN 101 H442 PA6 25 36.146 30.510 29.997 316 H441 CWN 101 H441 PA6 25 35.569 32.067 30.676 317 H081 CWN 101 H081 PA6 25 22.326 18.673 26.401 318 H082 CWN 101 H082 PA6 25 20.723 18.350 27.074 319 H53 CWN 101 H53 PA6 25 30.270 33.511 28.620 320 H55 CWN 101 H55 PA6 25 33.157 33.290 31.846 321 H553 CWN 101 H553 PA6 25 34.279 36.162 30.013 322 H551 CWN 101 H551 PA6 25 35.115 34.729 29.342 323 H552 CWN 101 H552 PA6 25 34.855 34.874 31.103 324 H63 CWN 101 H63 PA6 25 28.140 30.481 31.131 325 H65 CWN 101 H65 PA6 25 28.107 28.995 35.204 326 H663 CWN 101 H663 PA6 25 31.530 29.987 34.710 327 H661 CWN 101 H661 PA6 25 30.322 29.578 35.955 328 H662 CWN 101 H662 PA6 25 30.616 31.292 35.535 329 H75 CWN 101 H75 PA6 25 21.387 26.518 34.178 330 H771 CWN 101 H771 PA6 25 23.090 29.260 35.597 331 H773 CWN 101 H773 PA6 25 23.791 27.774 36.322 332 H772 CWN 101 H772 PA6 25 22.038 27.878 36.008 333 H921 CWN 101 H921 PA6 25 32.855 33.621 23.106 334 H922 CWN 101 H922 PA6 25 31.470 33.393 24.171 335 H932 CWN 101 H932 PA6 25 32.152 35.832 23.398 336 H931 CWN 101 H931 PA6 25 33.468 35.705 24.547 337 H942 CWN 101 H942 PA6 25 30.473 35.803 25.066 338 H943 CWN 101 H943 PA6 25 31.733 36.883 25.649 339 H73 CWN 101 H73 PA6 25 24.707 26.992 31.412 340 H072 CWN 101 H072 PA6 25 20.046 20.731 26.343 341 H071 CWN 101 H071 PA6 25 21.602 20.856 25.520 342 H883 CWN 101 H883 PA6 25 17.167 23.394 30.863 343 H881 CWN 101 H881 PA6 25 17.799 24.982 31.317 344 H882 CWN 101 H882 PA6 25 18.282 23.529 32.225 345 H83 CWN 101 H83 PA6 25 21.169 22.731 27.609
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