NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
3304 | 1dgo | 4536 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H5* A 1 1H5' A 1 6.776 -8.726 -1.291 2 2H5* A 1 2H5' A 1 8.061 -9.196 -0.166 3 H4* A 1 H4* A 1 8.553 -7.016 -1.134 4 H3* A 1 H3* A 1 8.623 -7.508 1.614 5 H1* A 1 H1* A 1 7.365 -4.307 0.013 6 H8 A 1 H8 A 1 4.292 -6.557 0.976 7 1H6 A 1 1H6 A 1 1.152 -1.185 0.530 8 2H6 A 1 2H6 A 1 0.968 -2.897 0.937 9 H2 A 1 H2 A 1 5.280 -0.345 -0.396 10 H5* A 1 H5* A 1 5.985 -9.596 0.685 11 2H2* A 1 1H2' A 1 7.627 -5.056 2.306 12 1H2* A 1 2H2' A 1 6.545 -6.445 2.047 13 1H5* G 2 1H5' G 2 10.032 -2.973 0.510 14 2H5* G 2 2H5' G 2 11.435 -2.700 1.559 15 H4* G 2 H4* G 2 10.153 -0.702 1.484 16 H3* G 2 H3* G 2 10.692 -1.970 3.995 17 H1* G 2 H1* G 2 7.898 0.208 2.936 18 H8 G 2 H8 G 2 6.305 -3.325 3.430 19 H1 G 2 H1 G 2 2.169 1.615 3.167 20 1H2 G 2 1H2 G 2 5.156 3.388 2.934 21 2H2 G 2 2H2 G 2 3.390 3.515 3.041 22 2H2* G 2 1H2' G 2 8.373 -0.969 5.077 23 1H2* G 2 2H2' G 2 8.403 -2.532 4.239 24 1H5* G 3 1H5' G 3 9.277 2.621 3.649 25 2H5* G 3 2H5' G 3 10.304 3.487 4.805 26 H4* G 3 H4* G 3 8.206 4.625 4.544 27 H3* G 3 H3* G 3 9.218 3.899 7.095 28 H1* G 3 H1* G 3 5.679 4.212 5.982 29 H8 G 3 H8 G 3 6.317 0.322 6.089 30 H1 G 3 H1 G 3 0.164 2.201 6.555 31 1H2 G 3 1H2 G 3 1.655 5.341 6.407 32 2H2 G 3 2H2 G 3 0.124 4.454 6.553 33 2H2* G 3 1H2' G 3 6.706 3.613 8.138 34 1H2* G 3 2H2' G 3 7.557 2.235 7.396 35 1H5* A 4 1H5' A 4 5.438 6.925 6.761 36 2H5* A 4 2H5' A 4 5.917 8.247 7.839 37 H4* A 4 H4* A 4 3.546 8.105 7.829 38 H3* A 4 H3* A 4 5.022 7.973 10.249 39 H1* A 4 H1* A 4 1.734 6.288 9.441 40 H8 A 4 H8 A 4 4.598 3.613 9.353 41 1H6 A 4 1H6 A 4 -0.121 -0.414 9.961 42 2H6 A 4 2H6 A 4 1.636 -0.323 9.752 43 H2 A 4 H2 A 4 -1.819 3.549 9.827 44 2H2* A 4 1H2' A 4 3.124 6.409 11.446 45 1H2* A 4 2H2' A 4 4.512 5.694 10.595 46 1H5* T 5 1H5' T 5 0.320 8.657 10.271 47 2H5* T 5 2H5' T 5 0.022 9.947 11.451 48 H4* T 5 H4* T 5 -1.860 8.449 11.347 49 H3* T 5 H3* T 5 -0.526 9.065 13.805 50 1H2* T 5 2H2' T 5 0.187 6.845 14.153 51 2H2* T 5 1H2' T 5 -1.415 6.691 14.869 52 H1* T 5 H1* T 5 -2.406 5.995 12.762 53 H3 T 5 H3 T 5 -1.485 1.569 13.224 54 1H5M T 5 1H5M T 5 3.203 3.139 13.920 55 2H5M T 5 2H5M T 5 3.143 2.377 12.321 56 3H5M T 5 3H5M T 5 3.289 4.133 12.459 57 H6 T 5 H6 T 5 1.318 5.447 12.675 58 1H5* C 6 1H5' C 6 -4.820 6.963 13.985 59 2H5* C 6 2H5' C 6 -5.730 7.909 15.178 60 H4* C 6 H4* C 6 -6.411 5.635 15.360 61 H3* C 6 H3* C 6 -5.355 7.044 17.603 62 H1* C 6 H1* C 6 -5.272 3.439 16.806 63 1H4 C 6 1H4 C 6 1.003 1.234 16.064 64 2H4 C 6 2H4 C 6 -0.115 -0.057 16.560 65 H5 C 6 H5 C 6 0.149 3.566 15.959 66 H6 C 6 H6 C 6 -1.874 4.911 16.114 67 2H2* C 6 1H2' C 6 -4.399 4.742 18.710 68 1H2* C 6 2H2' C 6 -3.387 5.713 17.628 69 1H5* C 7 1H5' C 7 -7.919 2.889 18.493 70 2H5* C 7 2H5' C 7 -8.858 3.351 19.925 71 H4* C 7 H4* C 7 -8.293 1.017 20.076 72 H3* C 7 H3* C 7 -7.756 2.802 22.178 73 H1* C 7 H1* C 7 -5.846 -0.115 21.194 74 1H4 C 7 1H4 C 7 0.388 1.040 19.153 75 2H4 C 7 2H4 C 7 0.094 -0.652 19.632 76 H5 C 7 H5 C 7 -1.474 2.691 19.476 77 H6 C 7 H6 C 7 -3.840 2.846 20.037 78 2H2* C 7 1H2' C 7 -5.383 1.729 22.827 79 1H2* C 7 2H2' C 7 -5.443 2.914 21.524 80 1H5* T 8 1H5' T 8 -5.738 -1.423 23.248 81 2H5* T 8 2H5' T 8 -6.227 -1.769 24.914 82 H4* T 8 H4* T 8 -3.947 -2.280 24.778 83 H3* T 8 H3* T 8 -4.735 -0.105 26.551 84 1H2* T 8 2H2' T 8 -3.342 1.343 25.223 85 2H2* T 8 1H2' T 8 -2.139 0.868 26.361 86 H1* T 8 H1* T 8 -1.557 -1.088 24.899 87 H3 T 8 H3 T 8 1.457 2.399 24.694 88 1H5M T 8 1H5M T 8 -3.209 4.107 22.575 89 2H5M T 8 2H5M T 8 -1.883 5.208 22.953 90 3H5M T 8 3H5M T 8 -1.870 4.309 21.429 91 H6 T 8 H6 T 8 -2.981 1.782 23.129 92 1H5* U 9 1H5' U 9 -0.178 -0.870 29.883 93 2H5* U 9 2H5' U 9 -0.880 0.761 29.645 94 H4* U 9 H4* U 9 1.065 -0.432 27.652 95 H3* U 9 H3* U 9 1.911 1.068 30.158 96 H1* U 9 H1* U 9 1.926 1.475 26.363 97 H3 U 9 H3 U 9 -0.091 6.180 27.053 98 H5 U 9 H5 U 9 3.479 5.603 24.923 99 H6 U 9 H6 U 9 3.684 3.429 25.895 100 2H2* U 9 1H2' U 9 3.616 1.192 27.642 101 1H2* U 9 2H2' U 9 3.230 2.541 28.778 102 1H5* T 10 1H5' T 1 6.475 -2.832 28.932 103 2H5* T 10 2H5' T 1 6.514 -1.145 28.419 104 H4* T 10 H4* T 1 4.072 -2.954 27.999 105 H3* T 10 H3* T 1 6.520 -2.660 26.241 106 1H2* T 10 2H2' T 1 5.123 -2.488 24.327 107 2H2* T 10 1H2' T 1 3.867 -3.486 25.070 108 H1* T 10 H1* T 1 2.804 -1.731 26.069 109 H3 T 10 H3 T 1 5.572 2.485 24.552 110 1H5M T 10 1H5M T 1 2.172 0.467 21.085 111 2H5M T 10 2H5M T 1 1.017 0.996 22.341 112 3H5M T 10 3H5M T 1 2.037 2.189 21.516 113 H6 T 10 H6 T 1 2.654 -1.029 23.167 114 1H5* T 11 1H5' T 2 4.777 -7.283 27.136 115 2H5* T 11 2H5' T 2 5.916 -8.261 26.193 116 H4* T 11 H4* T 2 3.830 -9.417 26.286 117 H3* T 11 H3* T 2 5.016 -8.793 23.794 118 1H2* T 11 2H2' T 2 3.419 -7.071 23.376 119 2H2* T 11 1H2' T 2 2.616 -8.423 22.558 120 H1* T 11 H1* T 2 1.433 -9.033 24.635 121 H3 T 11 H3 T 2 -2.295 -6.572 23.888 122 1H5M T 11 1H5M T 2 0.992 -2.772 24.930 123 2H5M T 11 2H5M T 2 1.820 -3.177 23.400 124 3H5M T 11 3H5M T 2 0.151 -2.592 23.384 125 H6 T 11 H6 T 2 2.323 -5.367 24.482 126 1H5* G 12 1H5' G 3 1.081 -10.951 23.352 127 2H5* G 12 2H5' G 3 1.024 -12.183 22.087 128 H4* G 12 H4* G 3 -0.865 -10.569 22.110 129 H3* G 12 H3* G 3 0.574 -11.351 19.726 130 H1* G 12 H1* G 3 -1.366 -8.278 20.630 131 H8 G 12 H8 G 3 2.403 -7.235 20.105 132 H1 G 12 H1 G 3 -1.826 -2.390 20.530 133 1H2 G 12 1H2 G 3 -4.059 -5.063 20.740 134 2H2 G 12 2H2 G 3 -3.878 -3.296 20.732 135 2H2* G 12 1H2' G 3 -0.307 -9.013 18.536 136 1H2* G 12 2H2' G 3 1.280 -9.152 19.341 137 1H5* G 13 1H5' G 4 -3.849 -9.672 19.938 138 2H5* G 13 2H5' G 4 -4.797 -10.626 18.783 139 H4* G 13 H4* G 4 -5.778 -8.457 19.016 140 H3* G 13 H3* G 4 -5.045 -9.506 16.484 141 H1* G 13 H1* G 4 -5.122 -5.953 17.601 142 H8 G 13 H8 G 4 -1.314 -6.928 17.512 143 H1 G 13 H1 G 4 -2.631 -0.618 17.148 144 1H2 G 13 1H2 G 4 -5.893 -1.825 17.342 145 2H2 G 13 2H2 G 4 -4.875 -0.379 17.220 146 2H2* G 13 1H2' G 4 -4.518 -7.031 15.465 147 1H2* G 13 2H2' G 4 -3.235 -7.972 16.273 148 1H5* A 14 1H5' A 5 -8.017 -5.573 16.658 149 2H5* A 14 2H5' A 5 -9.258 -6.060 15.489 150 H4* A 14 H4* A 5 -9.098 -3.691 15.433 151 H3* A 14 H3* A 5 -8.787 -5.236 13.094 152 H1* A 14 H1* A 5 -7.057 -1.996 13.911 153 H8 A 14 H8 A 5 -4.496 -4.906 14.443 154 1H6 A 14 1H6 A 5 -0.281 -0.354 13.844 155 2H6 A 14 2H6 A 5 -0.451 -2.083 14.189 156 H2 A 14 H2 A 5 -4.195 1.451 13.508 157 2H2* A 14 1H2' A 5 -6.973 -3.520 11.988 158 1H2* A 14 2H2' A 5 -6.445 -4.870 13.021 159 1H5* T 15 1H5' T 6 -9.419 -0.432 12.679 160 2H5* T 15 2H5' T 6 -10.585 -0.296 11.350 161 H4* T 15 H4* T 6 -9.157 1.646 11.391 162 H3* T 15 H3* T 6 -9.560 0.107 9.057 163 1H2* T 15 2H2' T 6 -7.402 -0.842 9.158 164 2H2* T 15 1H2' T 6 -7.035 0.560 8.131 165 H1* T 15 H1* T 6 -6.493 1.935 10.089 166 H3 T 15 H3 T 6 -2.082 0.899 10.282 167 1H5M T 15 1H5M T 6 -3.323 -3.741 9.883 168 2H5M T 15 2H5M T 6 -3.441 -3.649 11.641 169 3H5M T 15 3H5M T 6 -4.906 -3.792 10.662 170 H6 T 15 H6 T 6 -6.072 -1.765 10.720 171 1H5* C 16 1H5' C 7 -7.708 4.603 8.710 172 2H5* C 16 2H5' C 7 -8.528 5.264 7.283 173 H4* C 16 H4* C 7 -6.353 6.292 7.590 174 H3* C 16 H3* C 7 -7.212 5.254 5.130 175 H1* C 16 H1* C 7 -3.729 5.155 6.487 176 1H4 C 16 1H4 C 7 -2.041 -1.265 7.390 177 2H4 C 16 2H4 C 7 -0.620 -0.251 7.059 178 H5 C 16 H5 C 7 -4.275 -0.231 7.415 179 H6 C 16 H6 C 7 -5.455 1.880 7.186 180 2H2* C 16 1H2' C 7 -4.741 4.355 4.416 181 1H2* C 16 2H2' C 7 -5.879 3.318 5.287 182 1H5* C 17 1H5' C 8 -3.115 7.856 5.296 183 2H5* C 17 2H5' C 8 -3.334 8.985 3.947 184 H4* C 17 H4* C 8 -0.987 8.599 4.326 185 H3* C 17 H3* C 8 -2.170 8.362 1.790 186 H1* C 17 H1* C 8 0.624 6.248 3.145 187 1H4 C 17 1H4 C 8 -1.627 0.015 4.031 188 2H4 C 17 2H4 C 8 0.124 0.034 3.737 189 H5 C 17 H5 C 8 -2.910 2.103 3.842 190 H6 C 17 H6 C 8 -2.680 4.518 3.582 191 2H2* C 17 1H2' C 8 -0.554 6.308 1.019 192 1H2* C 17 2H2' C 8 -2.121 6.007 1.802 193 1H5* T 18 1H5' T 9 2.570 7.953 2.174 194 2H5* T 18 2H5' T 9 3.208 9.061 0.945 195 H4* T 18 H4* T 9 4.746 7.233 1.248 196 H3* T 18 H3* T 9 3.761 7.958 -1.312 197 1H2* T 18 2H2' T 9 2.374 6.035 -1.475 198 2H2* T 18 1H2' T 9 3.873 5.403 -2.223 199 H1* T 18 H1* T 9 4.686 4.589 -0.071 200 H3 T 18 H3 T 9 2.759 0.493 0.032 201 1H5M T 18 1H5M T 9 -1.543 2.523 0.770 202 2H5M T 18 2H5M T 9 -1.293 4.181 0.204 203 3H5M T 18 3H5M T 9 -1.443 2.863 -0.963 204 H6 T 18 H6 T 9 0.933 4.947 -0.078 Start of MODEL 2 1 1H5* A 1 1H5' A 1 6.776 -8.726 -1.291 2 2H5* A 1 2H5' A 1 8.061 -9.196 -0.166 3 H4* A 1 H4* A 1 8.553 -7.016 -1.134 4 H3* A 1 H3* A 1 8.623 -7.508 1.614 5 H1* A 1 H1* A 1 7.365 -4.307 0.013 6 H8 A 1 H8 A 1 4.292 -6.557 0.976 7 1H6 A 1 1H6 A 1 1.152 -1.185 0.530 8 2H6 A 1 2H6 A 1 0.968 -2.897 0.937 9 H2 A 1 H2 A 1 5.280 -0.345 -0.396 10 H5* A 1 H5* A 1 5.985 -9.596 0.685 11 2H2* A 1 1H2' A 1 7.627 -5.056 2.306 12 1H2* A 1 2H2' A 1 6.545 -6.445 2.047 13 1H5* G 2 1H5' G 2 10.032 -2.973 0.510 14 2H5* G 2 2H5' G 2 11.435 -2.700 1.559 15 H4* G 2 H4* G 2 10.153 -0.702 1.484 16 H3* G 2 H3* G 2 10.692 -1.970 3.995 17 H1* G 2 H1* G 2 7.898 0.208 2.936 18 H8 G 2 H8 G 2 6.305 -3.325 3.430 19 H1 G 2 H1 G 2 2.169 1.615 3.167 20 1H2 G 2 1H2 G 2 5.156 3.388 2.934 21 2H2 G 2 2H2 G 2 3.390 3.515 3.041 22 2H2* G 2 1H2' G 2 8.373 -0.969 5.077 23 1H2* G 2 2H2' G 2 8.403 -2.532 4.239 24 1H5* G 3 1H5' G 3 9.277 2.621 3.649 25 2H5* G 3 2H5' G 3 10.304 3.487 4.805 26 H4* G 3 H4* G 3 8.206 4.625 4.544 27 H3* G 3 H3* G 3 9.218 3.899 7.095 28 H1* G 3 H1* G 3 5.679 4.212 5.982 29 H8 G 3 H8 G 3 6.317 0.322 6.089 30 H1 G 3 H1 G 3 0.164 2.201 6.555 31 1H2 G 3 1H2 G 3 1.655 5.341 6.407 32 2H2 G 3 2H2 G 3 0.124 4.454 6.553 33 2H2* G 3 1H2' G 3 6.706 3.613 8.138 34 1H2* G 3 2H2' G 3 7.557 2.235 7.396 35 1H5* A 4 1H5' A 4 5.438 6.925 6.761 36 2H5* A 4 2H5' A 4 5.917 8.247 7.839 37 H4* A 4 H4* A 4 3.546 8.105 7.829 38 H3* A 4 H3* A 4 5.022 7.973 10.249 39 H1* A 4 H1* A 4 1.734 6.288 9.441 40 H8 A 4 H8 A 4 4.598 3.613 9.353 41 1H6 A 4 1H6 A 4 -0.121 -0.414 9.961 42 2H6 A 4 2H6 A 4 1.636 -0.323 9.752 43 H2 A 4 H2 A 4 -1.819 3.549 9.827 44 2H2* A 4 1H2' A 4 3.124 6.409 11.446 45 1H2* A 4 2H2' A 4 4.512 5.694 10.595 46 1H5* T 5 1H5' T 5 0.320 8.657 10.271 47 2H5* T 5 2H5' T 5 0.022 9.947 11.451 48 H4* T 5 H4* T 5 -1.860 8.449 11.347 49 H3* T 5 H3* T 5 -0.526 9.065 13.805 50 1H2* T 5 2H2' T 5 0.187 6.845 14.153 51 2H2* T 5 1H2' T 5 -1.415 6.691 14.869 52 H1* T 5 H1* T 5 -2.406 5.995 12.762 53 H3 T 5 H3 T 5 -1.485 1.569 13.224 54 1H5M T 5 1H5M T 5 3.203 3.139 13.920 55 2H5M T 5 2H5M T 5 3.143 2.377 12.321 56 3H5M T 5 3H5M T 5 3.289 4.133 12.459 57 H6 T 5 H6 T 5 1.318 5.447 12.675 58 1H5* C 6 1H5' C 6 -4.820 6.963 13.985 59 2H5* C 6 2H5' C 6 -5.730 7.909 15.178 60 H4* C 6 H4* C 6 -6.411 5.635 15.360 61 H3* C 6 H3* C 6 -5.355 7.044 17.603 62 H1* C 6 H1* C 6 -5.272 3.439 16.806 63 1H4 C 6 1H4 C 6 1.003 1.234 16.064 64 2H4 C 6 2H4 C 6 -0.115 -0.057 16.560 65 H5 C 6 H5 C 6 0.149 3.566 15.959 66 H6 C 6 H6 C 6 -1.874 4.911 16.114 67 2H2* C 6 1H2' C 6 -4.399 4.742 18.710 68 1H2* C 6 2H2' C 6 -3.387 5.713 17.628 69 1H5* C 7 1H5' C 7 -7.919 2.889 18.493 70 2H5* C 7 2H5' C 7 -8.858 3.351 19.925 71 H4* C 7 H4* C 7 -8.293 1.017 20.076 72 H3* C 7 H3* C 7 -7.756 2.802 22.178 73 H1* C 7 H1* C 7 -5.846 -0.115 21.194 74 1H4 C 7 1H4 C 7 0.388 1.040 19.153 75 2H4 C 7 2H4 C 7 0.094 -0.652 19.632 76 H5 C 7 H5 C 7 -1.474 2.691 19.476 77 H6 C 7 H6 C 7 -3.840 2.846 20.037 78 2H2* C 7 1H2' C 7 -5.383 1.729 22.827 79 1H2* C 7 2H2' C 7 -5.443 2.914 21.524 80 1H5* T 8 1H5' T 8 -5.738 -1.423 23.248 81 2H5* T 8 2H5' T 8 -6.227 -1.769 24.914 82 H4* T 8 H4* T 8 -3.947 -2.280 24.778 83 H3* T 8 H3* T 8 -4.735 -0.105 26.551 84 1H2* T 8 2H2' T 8 -3.342 1.343 25.223 85 2H2* T 8 1H2' T 8 -2.139 0.868 26.361 86 H1* T 8 H1* T 8 -1.557 -1.088 24.899 87 H3 T 8 H3 T 8 1.457 2.399 24.694 88 1H5M T 8 1H5M T 8 -3.209 4.107 22.575 89 2H5M T 8 2H5M T 8 -1.883 5.208 22.953 90 3H5M T 8 3H5M T 8 -1.870 4.309 21.429 91 H6 T 8 H6 T 8 -2.981 1.782 23.129 92 1H5* U 9 1H5' U 9 -0.178 -0.870 29.883 93 2H5* U 9 2H5' U 9 -0.880 0.761 29.645 94 H4* U 9 H4* U 9 1.065 -0.432 27.652 95 H3* U 9 H3* U 9 1.911 1.068 30.158 96 H1* U 9 H1* U 9 1.926 1.475 26.363 97 H3 U 9 H3 U 9 -0.091 6.180 27.053 98 H5 U 9 H5 U 9 3.479 5.603 24.923 99 H6 U 9 H6 U 9 3.684 3.429 25.895 100 2H2* U 9 1H2' U 9 3.616 1.192 27.642 101 1H2* U 9 2H2' U 9 3.230 2.541 28.778 102 1H5* T 10 1H5' T 1 6.475 -2.832 28.932 103 2H5* T 10 2H5' T 1 6.514 -1.145 28.419 104 H4* T 10 H4* T 1 4.072 -2.954 27.999 105 H3* T 10 H3* T 1 6.520 -2.660 26.241 106 1H2* T 10 2H2' T 1 5.123 -2.488 24.327 107 2H2* T 10 1H2' T 1 3.867 -3.486 25.070 108 H1* T 10 H1* T 1 2.804 -1.731 26.069 109 H3 T 10 H3 T 1 5.572 2.485 24.552 110 1H5M T 10 1H5M T 1 2.172 0.467 21.085 111 2H5M T 10 2H5M T 1 1.017 0.996 22.341 112 3H5M T 10 3H5M T 1 2.037 2.189 21.516 113 H6 T 10 H6 T 1 2.654 -1.029 23.167 114 1H5* T 11 1H5' T 2 4.777 -7.283 27.136 115 2H5* T 11 2H5' T 2 5.916 -8.261 26.193 116 H4* T 11 H4* T 2 3.830 -9.417 26.286 117 H3* T 11 H3* T 2 5.016 -8.793 23.794 118 1H2* T 11 2H2' T 2 3.419 -7.071 23.376 119 2H2* T 11 1H2' T 2 2.616 -8.423 22.558 120 H1* T 11 H1* T 2 1.433 -9.033 24.635 121 H3 T 11 H3 T 2 -2.295 -6.572 23.888 122 1H5M T 11 1H5M T 2 0.992 -2.772 24.930 123 2H5M T 11 2H5M T 2 1.820 -3.177 23.400 124 3H5M T 11 3H5M T 2 0.151 -2.592 23.384 125 H6 T 11 H6 T 2 2.323 -5.367 24.482 126 1H5* G 12 1H5' G 3 1.081 -10.951 23.352 127 2H5* G 12 2H5' G 3 1.024 -12.183 22.087 128 H4* G 12 H4* G 3 -0.865 -10.569 22.110 129 H3* G 12 H3* G 3 0.574 -11.351 19.726 130 H1* G 12 H1* G 3 -1.366 -8.278 20.630 131 H8 G 12 H8 G 3 2.403 -7.235 20.105 132 H1 G 12 H1 G 3 -1.826 -2.390 20.530 133 1H2 G 12 1H2 G 3 -4.059 -5.063 20.740 134 2H2 G 12 2H2 G 3 -3.878 -3.296 20.732 135 2H2* G 12 1H2' G 3 -0.307 -9.013 18.536 136 1H2* G 12 2H2' G 3 1.280 -9.152 19.341 137 1H5* G 13 1H5' G 4 -3.849 -9.672 19.938 138 2H5* G 13 2H5' G 4 -4.797 -10.626 18.783 139 H4* G 13 H4* G 4 -5.778 -8.457 19.016 140 H3* G 13 H3* G 4 -5.045 -9.506 16.484 141 H1* G 13 H1* G 4 -5.122 -5.953 17.601 142 H8 G 13 H8 G 4 -1.314 -6.928 17.512 143 H1 G 13 H1 G 4 -2.631 -0.618 17.148 144 1H2 G 13 1H2 G 4 -5.893 -1.825 17.342 145 2H2 G 13 2H2 G 4 -4.875 -0.379 17.220 146 2H2* G 13 1H2' G 4 -4.518 -7.031 15.465 147 1H2* G 13 2H2' G 4 -3.235 -7.972 16.273 148 1H5* A 14 1H5' A 5 -8.017 -5.573 16.658 149 2H5* A 14 2H5' A 5 -9.258 -6.060 15.489 150 H4* A 14 H4* A 5 -9.098 -3.691 15.433 151 H3* A 14 H3* A 5 -8.787 -5.236 13.094 152 H1* A 14 H1* A 5 -7.057 -1.996 13.911 153 H8 A 14 H8 A 5 -4.496 -4.906 14.443 154 1H6 A 14 1H6 A 5 -0.281 -0.354 13.844 155 2H6 A 14 2H6 A 5 -0.451 -2.083 14.189 156 H2 A 14 H2 A 5 -4.195 1.451 13.508 157 2H2* A 14 1H2' A 5 -6.973 -3.520 11.988 158 1H2* A 14 2H2' A 5 -6.445 -4.870 13.021 159 1H5* T 15 1H5' T 6 -9.419 -0.432 12.679 160 2H5* T 15 2H5' T 6 -10.585 -0.296 11.350 161 H4* T 15 H4* T 6 -9.157 1.646 11.391 162 H3* T 15 H3* T 6 -9.560 0.107 9.057 163 1H2* T 15 2H2' T 6 -7.402 -0.842 9.158 164 2H2* T 15 1H2' T 6 -7.035 0.560 8.131 165 H1* T 15 H1* T 6 -6.493 1.935 10.089 166 H3 T 15 H3 T 6 -2.082 0.899 10.282 167 1H5M T 15 1H5M T 6 -3.323 -3.741 9.883 168 2H5M T 15 2H5M T 6 -3.441 -3.649 11.641 169 3H5M T 15 3H5M T 6 -4.906 -3.792 10.662 170 H6 T 15 H6 T 6 -6.072 -1.765 10.720 171 1H5* C 16 1H5' C 7 -7.708 4.603 8.710 172 2H5* C 16 2H5' C 7 -8.528 5.264 7.283 173 H4* C 16 H4* C 7 -6.353 6.292 7.590 174 H3* C 16 H3* C 7 -7.212 5.254 5.130 175 H1* C 16 H1* C 7 -3.729 5.155 6.487 176 1H4 C 16 1H4 C 7 -2.041 -1.265 7.390 177 2H4 C 16 2H4 C 7 -0.620 -0.251 7.059 178 H5 C 16 H5 C 7 -4.275 -0.231 7.415 179 H6 C 16 H6 C 7 -5.455 1.880 7.186 180 2H2* C 16 1H2' C 7 -4.741 4.355 4.416 181 1H2* C 16 2H2' C 7 -5.879 3.318 5.287 182 1H5* C 17 1H5' C 8 -3.115 7.856 5.296 183 2H5* C 17 2H5' C 8 -3.334 8.985 3.947 184 H4* C 17 H4* C 8 -0.987 8.599 4.326 185 H3* C 17 H3* C 8 -2.170 8.362 1.790 186 H1* C 17 H1* C 8 0.624 6.248 3.145 187 1H4 C 17 1H4 C 8 -1.627 0.015 4.031 188 2H4 C 17 2H4 C 8 0.124 0.034 3.737 189 H5 C 17 H5 C 8 -2.910 2.103 3.842 190 H6 C 17 H6 C 8 -2.680 4.518 3.582 191 2H2* C 17 1H2' C 8 -0.554 6.308 1.019 192 1H2* C 17 2H2' C 8 -2.121 6.007 1.802 193 1H5* T 18 1H5' T 9 2.570 7.953 2.174 194 2H5* T 18 2H5' T 9 3.208 9.061 0.945 195 H4* T 18 H4* T 9 4.746 7.233 1.248 196 H3* T 18 H3* T 9 3.761 7.958 -1.312 197 1H2* T 18 2H2' T 9 2.374 6.035 -1.475 198 2H2* T 18 1H2' T 9 3.873 5.403 -2.223 199 H1* T 18 H1* T 9 4.686 4.589 -0.071 200 H3 T 18 H3 T 9 2.759 0.493 0.032 201 1H5M T 18 1H5M T 9 -1.543 2.523 0.770 202 2H5M T 18 2H5M T 9 -1.293 4.181 0.204 203 3H5M T 18 3H5M T 9 -1.443 2.863 -0.963 204 H6 T 18 H6 T 9 0.933 4.947 -0.078 Start of MODEL 3 1 1H5* A 1 1H5' A 1 7.274 -8.489 -1.849 2 2H5* A 1 2H5' A 1 8.591 -8.887 -0.731 3 H4* A 1 H4* A 1 8.634 -6.506 -1.395 4 H3* A 1 H3* A 1 8.759 -7.417 1.306 5 H1* A 1 H1* A 1 7.322 -4.243 -0.085 6 H8 A 1 H8 A 1 4.311 -6.540 0.985 7 1H6 A 1 1H6 A 1 1.077 -1.225 0.566 8 2H6 A 1 2H6 A 1 0.930 -2.936 0.994 9 H2 A 1 H2 A 1 5.168 -0.326 -0.464 10 H5* A 1 H5* A 1 5.947 -8.242 0.048 11 2H2* A 1 1H2' A 1 7.605 -5.093 2.202 12 1H2* A 1 2H2' A 1 6.629 -6.538 1.837 13 1H5* G 2 1H5' G 2 10.033 -2.780 0.455 14 2H5* G 2 2H5' G 2 11.418 -2.520 1.532 15 H4* G 2 H4* G 2 10.130 -0.518 1.442 16 H3* G 2 H3* G 2 10.676 -1.789 3.943 17 H1* G 2 H1* G 2 7.840 0.352 2.911 18 H8 G 2 H8 G 2 6.326 -3.223 3.349 19 H1 G 2 H1 G 2 2.080 1.626 3.168 20 1H2 G 2 1H2 G 2 5.024 3.470 2.928 21 2H2 G 2 2H2 G 2 3.257 3.555 3.040 22 2H2* G 2 1H2' G 2 8.339 -0.843 5.034 23 1H2* G 2 2H2' G 2 8.400 -2.395 4.179 24 1H5* G 3 1H5' G 3 9.183 2.783 3.645 25 2H5* G 3 2H5' G 3 10.192 3.653 4.813 26 H4* G 3 H4* G 3 8.072 4.754 4.564 27 H3* G 3 H3* G 3 9.100 4.019 7.106 28 H1* G 3 H1* G 3 5.555 4.271 5.999 29 H8 G 3 H8 G 3 6.270 0.393 6.065 30 H1 G 3 H1 G 3 0.083 2.149 6.558 31 1H2 G 3 1H2 G 3 1.510 5.318 6.418 32 2H2 G 3 2H2 G 3 -0.002 4.400 6.565 33 2H2* G 3 1H2' G 3 6.596 3.669 8.147 34 1H2* G 3 2H2' G 3 7.475 2.318 7.387 35 1H5* A 4 1H5' A 4 5.276 6.985 6.801 36 2H5* A 4 2H5' A 4 5.718 8.300 7.903 37 H4* A 4 H4* A 4 3.347 8.102 7.858 38 H3* A 4 H3* A 4 4.796 7.994 10.295 39 H1* A 4 H1* A 4 1.565 6.229 9.440 40 H8 A 4 H8 A 4 4.493 3.624 9.354 41 1H6 A 4 1H6 A 4 -0.136 -0.505 9.986 42 2H6 A 4 2H6 A 4 1.619 -0.378 9.773 43 H2 A 4 H2 A 4 -1.921 3.417 9.825 44 2H2* A 4 1H2' A 4 2.929 6.370 11.460 45 1H2* A 4 2H2' A 4 4.344 5.698 10.620 46 1H5* T 5 1H5' T 5 0.076 8.519 10.252 47 2H5* T 5 2H5' T 5 -0.279 9.801 11.424 48 H4* T 5 H4* T 5 -2.115 8.249 11.293 49 H3* T 5 H3* T 5 -0.845 8.912 13.768 50 1H2* T 5 2H2' T 5 -0.054 6.716 14.124 51 2H2* T 5 1H2' T 5 -1.656 6.509 14.829 52 H1* T 5 H1* T 5 -2.608 5.784 12.711 53 H3 T 5 H3 T 5 -1.571 1.397 13.250 54 1H5M T 5 1H5M T 5 3.072 3.065 13.927 55 2H5M T 5 2H5M T 5 3.037 2.335 12.313 56 3H5M T 5 3H5M T 5 3.137 4.090 12.487 57 H6 T 5 H6 T 5 1.127 5.341 12.652 58 1H5* C 6 1H5' C 6 -5.064 6.603 13.962 59 2H5* C 6 2H5' C 6 -6.005 7.559 15.122 60 H4* C 6 H4* C 6 -6.614 5.284 15.413 61 H3* C 6 H3* C 6 -5.551 6.803 17.577 62 H1* C 6 H1* C 6 -5.383 3.171 16.916 63 1H4 C 6 1H4 C 6 0.918 1.114 16.018 64 2H4 C 6 2H4 C 6 -0.133 -0.197 16.596 65 H5 C 6 H5 C 6 0.005 3.416 15.908 66 H6 C 6 H6 C 6 -2.047 4.711 16.085 67 2H2* C 6 1H2' C 6 -4.502 4.574 18.748 68 1H2* C 6 2H2' C 6 -3.548 5.533 17.602 69 1H5* C 7 1H5' C 7 -8.004 2.635 18.737 70 2H5* C 7 2H5' C 7 -8.906 3.153 20.174 71 H4* C 7 H4* C 7 -8.280 0.843 20.427 72 H3* C 7 H3* C 7 -7.713 2.755 22.410 73 H1* C 7 H1* C 7 -5.774 -0.182 21.516 74 1H4 C 7 1H4 C 7 0.331 1.005 19.117 75 2H4 C 7 2H4 C 7 0.089 -0.679 19.646 76 H5 C 7 H5 C 7 -1.526 2.635 19.509 77 H6 C 7 H6 C 7 -3.869 2.774 20.173 78 2H2* C 7 1H2' C 7 -5.308 1.736 23.047 79 1H2* C 7 2H2' C 7 -5.425 2.866 21.697 80 1H5* T 8 1H5' T 8 -5.632 -1.384 23.698 81 2H5* T 8 2H5' T 8 -6.091 -1.621 25.392 82 H4* T 8 H4* T 8 -3.815 -2.127 25.258 83 H3* T 8 H3* T 8 -4.575 0.166 26.887 84 1H2* T 8 2H2' T 8 -3.222 1.522 25.418 85 2H2* T 8 1H2' T 8 -1.991 1.140 26.565 86 H1* T 8 H1* T 8 -1.439 -0.920 25.254 87 H3 T 8 H3 T 8 1.591 2.511 24.690 88 1H5M T 8 1H5M T 8 -3.126 4.073 22.538 89 2H5M T 8 2H5M T 8 -1.836 5.212 22.924 90 3H5M T 8 3H5M T 8 -1.761 4.280 21.423 91 H6 T 8 H6 T 8 -2.898 1.823 23.300 92 1H5* U 9 1H5' U 9 0.103 -0.393 30.125 93 2H5* U 9 2H5' U 9 -0.571 1.233 29.794 94 H4* U 9 H4* U 9 1.296 -0.145 27.844 95 H3* U 9 H3* U 9 2.236 1.541 30.197 96 H1* U 9 H1* U 9 2.147 1.667 26.374 97 H3 U 9 H3 U 9 0.203 6.431 26.871 98 H5 U 9 H5 U 9 3.667 5.682 24.624 99 H6 U 9 H6 U 9 3.897 3.571 25.717 100 2H2* U 9 1H2' U 9 3.852 1.411 27.621 101 1H2* U 9 2H2' U 9 3.554 2.856 28.661 102 1H5* T 10 1H5' T 1 6.857 -2.343 29.029 103 2H5* T 10 2H5' T 1 6.680 -0.720 28.366 104 H4* T 10 H4* T 1 4.459 -2.844 28.296 105 H3* T 10 H3* T 1 6.668 -2.324 26.285 106 1H2* T 10 2H2' T 1 5.073 -2.634 24.514 107 2H2* T 10 1H2' T 1 4.009 -3.589 25.563 108 H1* T 10 H1* T 1 2.871 -1.770 26.284 109 H3 T 10 H3 T 1 5.700 2.348 24.533 110 1H5M T 10 1H5M T 1 2.169 0.254 21.232 111 2H5M T 10 2H5M T 1 1.064 0.921 22.464 112 3H5M T 10 3H5M T 1 2.127 2.003 21.550 113 H6 T 10 H6 T 1 2.639 -1.130 23.380 114 1H5* T 11 1H5' T 2 4.805 -6.858 27.065 115 2H5* T 11 2H5' T 2 5.901 -7.912 26.152 116 H4* T 11 H4* T 2 3.731 -8.833 26.067 117 H3* T 11 H3* T 2 5.053 -8.104 23.598 118 1H2* T 11 2H2' T 2 3.338 -6.546 23.118 119 2H2* T 11 1H2' T 2 2.588 -7.982 22.388 120 H1* T 11 H1* T 2 1.555 -8.580 24.550 121 H3 T 11 H3 T 2 -2.463 -6.562 24.148 122 1H5M T 11 1H5M T 2 -0.568 -2.381 23.148 123 2H5M T 11 2H5M T 2 0.553 -2.421 24.515 124 3H5M T 11 3H5M T 2 1.129 -2.793 22.871 125 H6 T 11 H6 T 2 2.036 -4.881 23.929 126 1H5* G 12 1H5' G 3 1.298 -10.552 23.391 127 2H5* G 12 2H5' G 3 1.335 -11.906 22.257 128 H4* G 12 H4* G 3 -0.750 -10.600 22.194 129 H3* G 12 H3* G 3 0.693 -11.446 19.896 130 H1* G 12 H1* G 3 -1.339 -8.353 20.364 131 H8 G 12 H8 G 3 2.384 -7.253 19.784 132 H1 G 12 H1 G 3 -1.813 -2.441 20.581 133 1H2 G 12 1H2 G 3 -4.032 -5.109 20.917 134 2H2 G 12 2H2 G 3 -3.838 -3.345 20.939 135 2H2* G 12 1H2' G 3 -0.143 -9.230 18.448 136 1H2* G 12 2H2' G 3 1.400 -9.278 19.356 137 1H5* G 13 1H5' G 4 -3.746 -9.918 19.889 138 2H5* G 13 2H5' G 4 -4.674 -10.870 18.717 139 H4* G 13 H4* G 4 -5.594 -8.656 18.912 140 H3* G 13 H3* G 4 -4.833 -9.767 16.399 141 H1* G 13 H1* G 4 -4.914 -6.224 17.517 142 H8 G 13 H8 G 4 -1.083 -7.141 17.236 143 H1 G 13 H1 G 4 -2.532 -0.843 17.268 144 1H2 G 13 1H2 G 4 -5.755 -2.114 17.558 145 2H2 G 13 2H2 G 4 -4.766 -0.649 17.441 146 2H2* G 13 1H2' G 4 -4.305 -7.292 15.370 147 1H2* G 13 2H2' G 4 -3.026 -8.238 16.181 148 1H5* A 14 1H5' A 5 -7.942 -5.947 16.592 149 2H5* A 14 2H5' A 5 -9.148 -6.450 15.394 150 H4* A 14 H4* A 5 -9.084 -4.071 15.420 151 H3* A 14 H3* A 5 -8.709 -5.525 13.039 152 H1* A 14 H1* A 5 -7.071 -2.261 13.959 153 H8 A 14 H8 A 5 -4.452 -5.124 14.444 154 1H6 A 14 1H6 A 5 -0.330 -0.479 13.906 155 2H6 A 14 2H6 A 5 -0.463 -2.215 14.230 156 H2 A 14 H2 A 5 -4.281 1.251 13.615 157 2H2* A 14 1H2' A 5 -6.936 -3.729 11.998 158 1H2* A 14 2H2' A 5 -6.377 -5.092 12.994 159 1H5* T 15 1H5' T 6 -9.434 -0.718 12.726 160 2H5* T 15 2H5' T 6 -10.604 -0.587 11.401 161 H4* T 15 H4* T 6 -9.218 1.382 11.459 162 H3* T 15 H3* T 6 -9.584 -0.145 9.111 163 1H2* T 15 2H2' T 6 -7.407 -1.046 9.205 164 2H2* T 15 1H2' T 6 -7.070 0.372 8.192 165 H1* T 15 H1* T 6 -6.558 1.741 10.164 166 H3 T 15 H3 T 6 -2.126 0.786 10.334 167 1H5M T 15 1H5M T 6 -3.276 -3.871 9.919 168 2H5M T 15 2H5M T 6 -3.399 -3.795 11.677 169 3H5M T 15 3H5M T 6 -4.860 -3.958 10.693 170 H6 T 15 H6 T 6 -6.064 -1.952 10.766 171 1H5* C 16 1H5' C 7 -7.817 4.394 8.779 172 2H5* C 16 2H5' C 7 -8.663 5.039 7.361 173 H4* C 16 H4* C 7 -6.509 6.113 7.642 174 H3* C 16 H3* C 7 -7.369 5.050 5.193 175 H1* C 16 H1* C 7 -3.871 5.028 6.517 176 1H4 C 16 1H4 C 7 -2.045 -1.353 7.429 177 2H4 C 16 2H4 C 7 -0.648 -0.314 7.075 178 H5 C 16 H5 C 7 -4.297 -0.363 7.474 179 H6 C 16 H6 C 7 -5.523 1.723 7.243 180 2H2* C 16 1H2' C 7 -4.886 4.202 4.458 181 1H2* C 16 2H2' C 7 -5.993 3.143 5.343 182 1H5* C 17 1H5' C 8 -3.332 7.742 5.314 183 2H5* C 17 2H5' C 8 -3.583 8.861 3.962 184 H4* C 17 H4* C 8 -1.226 8.523 4.329 185 H3* C 17 H3* C 8 -2.420 8.256 1.800 186 H1* C 17 H1* C 8 0.424 6.204 3.142 187 1H4 C 17 1H4 C 8 -1.678 -0.077 4.057 188 2H4 C 17 2H4 C 8 0.070 -0.015 3.752 189 H5 C 17 H5 C 8 -3.012 1.983 3.873 190 H6 C 17 H6 C 8 -2.839 4.402 3.603 191 2H2* C 17 1H2' C 8 -0.770 6.232 1.024 192 1H2* C 17 2H2' C 8 -2.325 5.903 1.819 193 1H5* T 18 1H5' T 9 2.329 7.939 2.161 194 2H5* T 18 2H5' T 9 2.940 9.053 0.924 195 H4* T 18 H4* T 9 4.513 7.255 1.229 196 H3* T 18 H3* T 9 3.505 7.951 -1.330 197 1H2* T 18 2H2' T 9 2.154 6.003 -1.481 198 2H2* T 18 1H2' T 9 3.662 5.396 -2.232 199 H1* T 18 H1* T 9 4.497 4.605 -0.080 200 H3 T 18 H3 T 9 2.643 0.474 0.033 201 1H5M T 18 1H5M T 9 -1.690 2.430 0.792 202 2H5M T 18 2H5M T 9 -1.473 4.090 0.218 203 3H5M T 18 3H5M T 9 -1.604 2.765 -0.942 204 H6 T 18 H6 T 9 0.739 4.895 -0.071 Start of MODEL 4 1 1H5* A 1 1H5' A 1 7.364 -8.325 -1.976 2 2H5* A 1 2H5' A 1 8.693 -8.699 -0.864 3 H4* A 1 H4* A 1 8.685 -6.315 -1.519 4 H3* A 1 H3* A 1 8.836 -7.233 1.178 5 H1* A 1 H1* A 1 7.329 -4.085 -0.199 6 H8 A 1 H8 A 1 4.371 -6.448 0.874 7 1H6 A 1 1H6 A 1 1.024 -1.202 0.482 8 2H6 A 1 2H6 A 1 0.915 -2.916 0.905 9 H2 A 1 H2 A 1 5.091 -0.213 -0.559 10 H5* A 1 H5* A 1 6.038 -8.111 -0.075 11 2H2* A 1 1H2' A 1 7.638 -4.936 2.085 12 1H2* A 1 2H2' A 1 6.691 -6.400 1.718 13 1H5* G 2 1H5' G 2 10.013 -2.571 0.336 14 2H5* G 2 2H5' G 2 11.395 -2.283 1.409 15 H4* G 2 H4* G 2 10.065 -0.309 1.324 16 H3* G 2 H3* G 2 10.648 -1.569 3.822 17 H1* G 2 H1* G 2 7.761 0.509 2.804 18 H8 G 2 H8 G 2 6.328 -3.099 3.241 19 H1 G 2 H1 G 2 1.977 1.657 3.091 20 1H2 G 2 1H2 G 2 4.880 3.564 2.842 21 2H2 G 2 2H2 G 2 3.111 3.612 2.963 22 2H2* G 2 1H2' G 2 8.294 -0.678 4.923 23 1H2* G 2 2H2' G 2 8.386 -2.227 4.064 24 1H5* G 3 1H5' G 3 9.046 2.965 3.532 25 2H5* G 3 2H5' G 3 10.041 3.859 4.695 26 H4* G 3 H4* G 3 7.896 4.911 4.455 27 H3* G 3 H3* G 3 8.952 4.203 6.992 28 H1* G 3 H1* G 3 5.397 4.373 5.903 29 H8 G 3 H8 G 3 6.198 0.513 5.963 30 H1 G 3 H1 G 3 -0.023 2.130 6.497 31 1H2 G 3 1H2 G 3 1.334 5.329 6.360 32 2H2 G 3 2H2 G 3 -0.157 4.379 6.511 33 2H2* G 3 1H2' G 3 6.461 3.794 8.045 34 1H2* G 3 2H2' G 3 7.367 2.463 7.281 35 1H5* A 4 1H5' A 4 5.047 7.070 6.707 36 2H5* A 4 2H5' A 4 5.470 8.399 7.800 37 H4* A 4 H4* A 4 3.106 8.152 7.785 38 H3* A 4 H3* A 4 4.585 8.073 10.204 39 H1* A 4 H1* A 4 1.381 6.239 9.387 40 H8 A 4 H8 A 4 4.367 3.702 9.265 41 1H6 A 4 1H6 A 4 -0.156 -0.541 9.908 42 2H6 A 4 2H6 A 4 1.594 -0.369 9.683 43 H2 A 4 H2 A 4 -2.036 3.339 9.790 44 2H2* A 4 1H2' A 4 2.768 6.409 11.390 45 1H2* A 4 2H2' A 4 4.187 5.768 10.531 46 1H5* T 5 1H5' T 5 -0.146 8.520 10.228 47 2H5* T 5 2H5' T 5 -0.509 9.785 11.417 48 H4* T 5 H4* T 5 -2.313 8.194 11.298 49 H3* T 5 H3* T 5 -1.022 8.866 13.762 50 1H2* T 5 2H2' T 5 -0.191 6.684 14.097 51 2H2* T 5 1H2' T 5 -1.783 6.441 14.812 52 H1* T 5 H1* T 5 -2.739 5.712 12.697 53 H3 T 5 H3 T 5 -1.599 1.340 13.200 54 1H5M T 5 1H5M T 5 3.010 3.125 13.844 55 2H5M T 5 2H5M T 5 2.977 2.377 12.237 56 3H5M T 5 3H5M T 5 3.038 4.136 12.392 57 H6 T 5 H6 T 5 1.004 5.348 12.602 58 1H5* C 6 1H5' C 6 -5.149 6.467 13.955 59 2H5* C 6 2H5' C 6 -6.132 7.391 15.106 60 H4* C 6 H4* C 6 -6.680 5.094 15.359 61 H3* C 6 H3* C 6 -5.744 6.631 17.558 62 H1* C 6 H1* C 6 -5.397 3.022 16.915 63 1H4 C 6 1H4 C 6 0.906 1.098 15.861 64 2H4 C 6 2H4 C 6 -0.127 -0.220 16.462 65 H5 C 6 H5 C 6 -0.034 3.415 15.862 66 H6 C 6 H6 C 6 -2.107 4.674 16.127 67 2H2* C 6 1H2' C 6 -4.605 4.443 18.751 68 1H2* C 6 2H2' C 6 -3.677 5.453 17.621 69 1H5* C 7 1H5' C 7 -7.930 2.235 18.770 70 2H5* C 7 2H5' C 7 -8.923 2.818 20.118 71 H4* C 7 H4* C 7 -8.214 0.635 20.692 72 H3* C 7 H3* C 7 -7.730 2.765 22.418 73 H1* C 7 H1* C 7 -5.479 -0.032 21.909 74 1H4 C 7 1H4 C 7 0.386 1.070 19.073 75 2H4 C 7 2H4 C 7 0.078 -0.655 19.394 76 H5 C 7 H5 C 7 -1.458 2.704 19.513 77 H6 C 7 H6 C 7 -3.697 2.899 20.410 78 2H2* C 7 1H2' C 7 -5.238 2.074 23.119 79 1H2* C 7 2H2' C 7 -5.465 3.005 21.632 80 1H5* T 8 1H5' T 8 -5.550 -1.340 23.970 81 2H5* T 8 2H5' T 8 -5.976 -1.406 25.687 82 H4* T 8 H4* T 8 -3.733 -2.114 25.483 83 H3* T 8 H3* T 8 -4.370 0.196 27.107 84 1H2* T 8 2H2' T 8 -3.067 1.529 25.582 85 2H2* T 8 1H2' T 8 -1.799 1.164 26.694 86 H1* T 8 H1* T 8 -1.272 -0.908 25.398 87 H3 T 8 H3 T 8 1.696 2.541 24.663 88 1H5M T 8 1H5M T 8 -3.124 4.014 22.673 89 2H5M T 8 2H5M T 8 -1.861 5.179 23.071 90 3H5M T 8 3H5M T 8 -1.780 4.293 21.543 91 H6 T 8 H6 T 8 -2.837 1.778 23.455 92 1H5* U 9 1H5' U 9 0.380 -0.267 30.213 93 2H5* U 9 2H5' U 9 -0.335 1.335 29.852 94 H4* U 9 H4* U 9 1.505 -0.057 27.887 95 H3* U 9 H3* U 9 2.483 1.685 30.182 96 H1* U 9 H1* U 9 2.294 1.732 26.363 97 H3 U 9 H3 U 9 0.320 6.489 26.808 98 H5 U 9 H5 U 9 3.727 5.717 24.482 99 H6 U 9 H6 U 9 4.006 3.635 25.616 100 2H2* U 9 1H2' U 9 4.034 1.523 27.566 101 1H2* U 9 2H2' U 9 3.747 2.985 28.585 102 1H5* T 10 1H5' T 1 7.057 -2.233 28.992 103 2H5* T 10 2H5' T 1 6.916 -0.615 28.306 104 H4* T 10 H4* T 1 4.614 -2.650 28.314 105 H3* T 10 H3* T 1 6.832 -2.297 26.280 106 1H2* T 10 2H2' T 1 5.227 -2.547 24.522 107 2H2* T 10 1H2' T 1 4.133 -3.470 25.568 108 H1* T 10 H1* T 1 3.056 -1.623 26.324 109 H3 T 10 H3 T 1 5.793 2.441 24.356 110 1H5M T 10 1H5M T 1 2.174 0.222 21.232 111 2H5M T 10 2H5M T 1 1.107 0.910 22.485 112 3H5M T 10 3H5M T 1 2.127 1.978 21.510 113 H6 T 10 H6 T 1 2.745 -1.106 23.401 114 1H5* T 11 1H5' T 2 4.892 -6.801 27.288 115 2H5* T 11 2H5' T 2 6.017 -7.872 26.433 116 H4* T 11 H4* T 2 3.883 -8.872 26.366 117 H3* T 11 H3* T 2 5.216 -8.214 23.904 118 1H2* T 11 2H2' T 2 3.530 -6.618 23.387 119 2H2* T 11 1H2' T 2 2.803 -8.050 22.626 120 H1* T 11 H1* T 2 1.687 -8.641 24.759 121 H3 T 11 H3 T 2 -2.281 -6.636 23.985 122 1H5M T 11 1H5M T 2 -0.347 -2.437 23.218 123 2H5M T 11 2H5M T 2 0.799 -2.491 24.564 124 3H5M T 11 3H5M T 2 1.334 -2.892 22.909 125 H6 T 11 H6 T 2 2.206 -4.927 24.252 126 1H5* G 12 1H5' G 3 1.437 -10.634 23.537 127 2H5* G 12 2H5' G 3 1.469 -11.943 22.348 128 H4* G 12 H4* G 3 -0.547 -10.486 22.289 129 H3* G 12 H3* G 3 0.935 -11.315 19.961 130 H1* G 12 H1* G 3 -1.161 -8.263 20.630 131 H8 G 12 H8 G 3 2.582 -7.156 20.068 132 H1 G 12 H1 G 3 -1.728 -2.374 20.339 133 1H2 G 12 1H2 G 3 -3.927 -5.048 20.664 134 2H2 G 12 2H2 G 3 -3.756 -3.283 20.593 135 2H2* G 12 1H2' G 3 -0.032 -9.106 18.617 136 1H2* G 12 2H2' G 3 1.544 -9.118 19.451 137 1H5* G 13 1H5' G 4 -3.573 -9.873 19.991 138 2H5* G 13 2H5' G 4 -4.454 -10.904 18.850 139 H4* G 13 H4* G 4 -5.495 -8.747 18.971 140 H3* G 13 H3* G 4 -4.678 -9.886 16.498 141 H1* G 13 H1* G 4 -4.892 -6.300 17.473 142 H8 G 13 H8 G 4 -1.046 -7.134 17.415 143 H1 G 13 H1 G 4 -2.598 -0.876 17.147 144 1H2 G 13 1H2 G 4 -5.816 -2.205 17.285 145 2H2 G 13 2H2 G 4 -4.845 -0.722 17.228 146 2H2* G 13 1H2' G 4 -4.218 -7.433 15.389 147 1H2* G 13 2H2' G 4 -2.918 -8.302 16.251 148 1H5* A 14 1H5' A 5 -7.808 -6.114 16.570 149 2H5* A 14 2H5' A 5 -9.020 -6.644 15.390 150 H4* A 14 H4* A 5 -8.952 -4.266 15.363 151 H3* A 14 H3* A 5 -8.582 -5.775 13.008 152 H1* A 14 H1* A 5 -6.989 -2.476 13.862 153 H8 A 14 H8 A 5 -4.296 -5.280 14.333 154 1H6 A 14 1H6 A 5 -0.298 -0.526 13.812 155 2H6 A 14 2H6 A 5 -0.384 -2.271 14.102 156 H2 A 14 H2 A 5 -4.290 1.107 13.561 157 2H2* A 14 1H2' A 5 -6.848 -3.969 11.918 158 1H2* A 14 2H2' A 5 -6.259 -5.310 12.932 159 1H5* T 15 1H5' T 6 -9.438 -1.001 12.657 160 2H5* T 15 2H5' T 6 -10.611 -0.902 11.330 161 H4* T 15 H4* T 6 -9.276 1.105 11.398 162 H3* T 15 H3* T 6 -9.610 -0.418 9.044 163 1H2* T 15 2H2' T 6 -7.412 -1.270 9.131 164 2H2* T 15 1H2' T 6 -7.109 0.159 8.123 165 H1* T 15 H1* T 6 -6.626 1.533 10.098 166 H3 T 15 H3 T 6 -2.174 0.690 10.267 167 1H5M T 15 1H5M T 6 -3.219 -3.992 9.796 168 2H5M T 15 2H5M T 6 -3.314 -3.934 11.557 169 3H5M T 15 3H5M T 6 -4.787 -4.126 10.597 170 H6 T 15 H6 T 6 -6.040 -2.152 10.677 171 1H5* C 16 1H5' C 7 -7.970 4.172 8.736 172 2H5* C 16 2H5' C 7 -8.834 4.800 7.321 173 H4* C 16 H4* C 7 -6.712 5.936 7.612 174 H3* C 16 H3* C 7 -7.539 4.868 5.156 175 H1* C 16 H1* C 7 -4.040 4.924 6.480 176 1H4 C 16 1H4 C 7 -2.072 -1.421 7.347 177 2H4 C 16 2H4 C 7 -0.699 -0.349 7.001 178 H5 C 16 H5 C 7 -4.346 -0.481 7.404 179 H6 C 16 H6 C 7 -5.617 1.579 7.192 180 2H2* C 16 1H2' C 7 -5.036 4.087 4.417 181 1H2* C 16 2H2' C 7 -6.116 2.995 5.295 182 1H5* C 17 1H5' C 8 -3.557 7.647 5.289 183 2H5* C 17 2H5' C 8 -3.836 8.768 3.945 184 H4* C 17 H4* C 8 -1.471 8.476 4.300 185 H3* C 17 H3* C 8 -2.669 8.196 1.774 186 H1* C 17 H1* C 8 0.223 6.201 3.098 187 1H4 C 17 1H4 C 8 -1.739 -0.128 3.991 188 2H4 C 17 2H4 C 8 0.006 -0.028 3.679 189 H5 C 17 H5 C 8 -3.118 1.902 3.820 190 H6 C 17 H6 C 8 -2.998 4.326 3.562 191 2H2* C 17 1H2' C 8 -0.978 6.212 0.984 192 1H2* C 17 2H2' C 8 -2.523 5.845 1.782 193 1H5* T 18 1H5' T 9 2.087 7.977 2.114 194 2H5* T 18 2H5' T 9 2.669 9.110 0.881 195 H4* T 18 H4* T 9 4.282 7.345 1.169 196 H3* T 18 H3* T 9 3.247 8.033 -1.382 197 1H2* T 18 2H2' T 9 1.936 6.057 -1.537 198 2H2* T 18 1H2' T 9 3.453 5.487 -2.298 199 H1* T 18 H1* T 9 4.316 4.702 -0.154 200 H3 T 18 H3 T 9 2.551 0.532 -0.053 201 1H5M T 18 1H5M T 9 -1.819 2.393 0.738 202 2H5M T 18 2H5M T 9 -1.640 4.059 0.169 203 3H5M T 18 3H5M T 9 -1.749 2.736 -0.996 204 H6 T 18 H6 T 9 0.553 4.912 -0.126 Start of MODEL 5 1 1H5* A 1 1H5' A 1 7.595 -8.469 -1.113 2 2H5* A 1 2H5' A 1 8.943 -8.760 -0.003 3 H4* A 1 H4* A 1 9.127 -6.535 -0.983 4 H3* A 1 H3* A 1 9.250 -6.991 1.784 5 H1* A 1 H1* A 1 7.700 -3.996 0.077 6 H8 A 1 H8 A 1 4.811 -6.446 1.118 7 1H6 A 1 1H6 A 1 1.277 -1.332 0.590 8 2H6 A 1 2H6 A 1 1.222 -3.045 1.027 9 H2 A 1 H2 A 1 5.329 -0.204 -0.371 10 H5* A 1 H5* A 1 7.521 -8.290 1.723 11 2H2* A 1 1H2' A 1 8.017 -4.625 2.408 12 1H2* A 1 2H2' A 1 7.071 -6.118 2.197 13 1H5* G 2 1H5' G 2 10.266 -2.363 0.596 14 2H5* G 2 2H5' G 2 11.640 -1.970 1.647 15 H4* G 2 H4* G 2 10.217 -0.072 1.538 16 H3* G 2 H3* G 2 10.835 -1.264 4.066 17 H1* G 2 H1* G 2 7.889 0.684 2.973 18 H8 G 2 H8 G 2 6.567 -2.955 3.494 19 H1 G 2 H1 G 2 2.068 1.650 3.153 20 1H2 G 2 1H2 G 2 4.912 3.646 2.911 21 2H2 G 2 2H2 G 2 3.141 3.638 2.996 22 2H2* G 2 1H2' G 2 8.441 -0.432 5.128 23 1H2* G 2 2H2' G 2 8.594 -1.997 4.307 24 1H5* G 3 1H5' G 3 9.096 3.235 3.695 25 2H5* G 3 2H5' G 3 10.058 4.162 4.860 26 H4* G 3 H4* G 3 7.890 5.159 4.609 27 H3* G 3 H3* G 3 8.944 4.472 7.151 28 H1* G 3 H1* G 3 5.392 4.544 6.037 29 H8 G 3 H8 G 3 6.305 0.705 6.114 30 H1 G 3 H1 G 3 0.030 2.133 6.510 31 1H2 G 3 1H2 G 3 1.278 5.377 6.342 32 2H2 G 3 2H2 G 3 -0.180 4.374 6.477 33 2H2* G 3 1H2' G 3 6.460 3.991 8.184 34 1H2* G 3 2H2' G 3 7.410 2.690 7.426 35 1H5* A 4 1H5' A 4 5.017 7.344 6.868 36 2H5* A 4 2H5' A 4 5.407 8.638 8.014 37 H4* A 4 H4* A 4 3.042 8.360 7.925 38 H3* A 4 H3* A 4 4.456 8.256 10.381 39 H1* A 4 H1* A 4 1.307 6.378 9.446 40 H8 A 4 H8 A 4 4.353 3.918 9.323 41 1H6 A 4 1H6 A 4 -0.069 -0.425 9.903 42 2H6 A 4 2H6 A 4 1.677 -0.214 9.676 43 H2 A 4 H2 A 4 -2.042 3.407 9.798 44 2H2* A 4 1H2' A 4 2.625 6.542 11.486 45 1H2* A 4 2H2' A 4 4.081 5.938 10.668 46 1H5* T 5 1H5' T 5 -0.291 8.540 10.311 47 2H5* T 5 2H5' T 5 -0.707 9.792 11.496 48 H4* T 5 H4* T 5 -2.465 8.165 11.372 49 H3* T 5 H3* T 5 -1.170 8.816 13.848 50 1H2* T 5 2H2' T 5 -0.345 6.630 14.156 51 2H2* T 5 1H2' T 5 -1.942 6.373 14.854 52 H1* T 5 H1* T 5 -2.882 5.684 12.714 53 H3 T 5 H3 T 5 -1.757 1.302 13.213 54 1H5M T 5 1H5M T 5 2.851 2.986 13.862 55 2H5M T 5 2H5M T 5 2.823 2.398 12.191 56 3H5M T 5 3H5M T 5 2.891 4.132 12.515 57 H6 T 5 H6 T 5 0.857 5.310 12.636 58 1H5* C 6 1H5' C 6 -5.315 6.426 14.043 59 2H5* C 6 2H5' C 6 -6.282 7.356 15.204 60 H4* C 6 H4* C 6 -6.842 5.065 15.466 61 H3* C 6 H3* C 6 -5.865 6.596 17.653 62 H1* C 6 H1* C 6 -5.552 2.985 17.007 63 1H4 C 6 1H4 C 6 0.701 0.995 15.808 64 2H4 C 6 2H4 C 6 -0.332 -0.309 16.441 65 H5 C 6 H5 C 6 -0.205 3.331 15.864 66 H6 C 6 H6 C 6 -2.259 4.611 16.177 67 2H2* C 6 1H2' C 6 -4.728 4.399 18.831 68 1H2* C 6 2H2' C 6 -3.804 5.401 17.690 69 1H5* C 7 1H5' C 7 -8.077 2.225 18.901 70 2H5* C 7 2H5' C 7 -9.031 2.805 20.279 71 H4* C 7 H4* C 7 -8.313 0.613 20.816 72 H3* C 7 H3* C 7 -7.781 2.721 22.555 73 H1* C 7 H1* C 7 -5.561 -0.067 21.960 74 1H4 C 7 1H4 C 7 0.258 0.958 19.019 75 2H4 C 7 2H4 C 7 -0.064 -0.759 19.369 76 H5 C 7 H5 C 7 -1.552 2.625 19.511 77 H6 C 7 H6 C 7 -3.775 2.845 20.441 78 2H2* C 7 1H2' C 7 -5.268 2.045 23.168 79 1H2* C 7 2H2' C 7 -5.537 2.969 21.686 80 1H5* T 8 1H5' T 8 -5.517 -1.400 23.883 81 2H5* T 8 2H5' T 8 -5.824 -1.530 25.620 82 H4* T 8 H4* T 8 -3.587 -2.203 25.210 83 H3* T 8 H3* T 8 -4.155 0.003 27.001 84 1H2* T 8 2H2' T 8 -2.947 1.434 25.496 85 2H2* T 8 1H2' T 8 -1.616 1.010 26.504 86 H1* T 8 H1* T 8 -1.146 -0.969 25.039 87 H3 T 8 H3 T 8 1.715 2.592 24.401 88 1H5M T 8 1H5M T 8 -3.217 4.079 22.738 89 2H5M T 8 2H5M T 8 -1.929 5.243 23.050 90 3H5M T 8 3H5M T 8 -1.968 4.374 21.510 91 H6 T 8 H6 T 8 -2.851 1.797 23.367 92 1H5* U 9 1H5' U 9 0.741 -0.577 29.829 93 2H5* U 9 2H5' U 9 -0.035 1.024 29.618 94 H4* U 9 H4* U 9 1.720 -0.176 27.461 95 H3* U 9 H3* U 9 2.789 1.413 29.822 96 H1* U 9 H1* U 9 2.386 1.716 26.039 97 H3 U 9 H3 U 9 0.321 6.385 26.824 98 H5 U 9 H5 U 9 3.651 5.837 24.329 99 H6 U 9 H6 U 9 4.025 3.700 25.333 100 2H2* U 9 1H2' U 9 4.210 1.512 27.134 101 1H2* U 9 2H2' U 9 3.911 2.882 28.271 102 1H5* T 10 1H5' T 1 7.246 -2.463 28.225 103 2H5* T 10 2H5' T 1 7.241 -0.790 27.667 104 H4* T 10 H4* T 1 4.749 -2.572 27.554 105 H3* T 10 H3* T 1 7.015 -2.402 25.556 106 1H2* T 10 2H2' T 1 5.455 -2.217 23.786 107 2H2* T 10 1H2' T 1 4.260 -3.200 24.641 108 H1* T 10 H1* T 1 3.312 -1.433 25.739 109 H3 T 10 H3 T 1 5.779 2.785 23.801 110 1H5M T 10 1H5M T 1 2.083 0.564 20.788 111 2H5M T 10 2H5M T 1 1.059 1.107 22.147 112 3H5M T 10 3H5M T 1 1.948 2.296 21.179 113 H6 T 10 H6 T 1 2.843 -0.852 22.842 114 1H5* T 11 1H5' T 2 5.281 -6.878 26.878 115 2H5* T 11 2H5' T 2 6.323 -7.950 25.924 116 H4* T 11 H4* T 2 4.243 -9.062 26.309 117 H3* T 11 H3* T 2 5.211 -8.681 23.681 118 1H2* T 11 2H2' T 2 3.604 -6.968 23.249 119 2H2* T 11 1H2' T 2 2.717 -8.371 22.624 120 H1* T 11 H1* T 2 1.703 -8.769 24.837 121 H3 T 11 H3 T 2 -2.003 -6.302 23.985 122 1H5M T 11 1H5M T 2 1.447 -2.524 24.697 123 2H5M T 11 2H5M T 2 2.116 -3.028 23.119 124 3H5M T 11 3H5M T 2 0.471 -2.387 23.227 125 H6 T 11 H6 T 2 2.648 -5.143 24.392 126 1H5* G 12 1H5' G 3 1.210 -10.750 23.653 127 2H5* G 12 2H5' G 3 1.087 -12.103 22.520 128 H4* G 12 H4* G 3 -0.785 -10.505 22.412 129 H3* G 12 H3* G 3 0.660 -11.420 20.071 130 H1* G 12 H1* G 3 -1.341 -8.331 20.807 131 H8 G 12 H8 G 3 2.398 -7.273 20.141 132 H1 G 12 H1 G 3 -1.862 -2.445 20.415 133 1H2 G 12 1H2 G 3 -4.073 -5.098 20.841 134 2H2 G 12 2H2 G 3 -3.893 -3.336 20.721 135 2H2* G 12 1H2' G 3 -0.304 -9.191 18.746 136 1H2* G 12 2H2' G 3 1.299 -9.240 19.527 137 1H5* G 13 1H5' G 4 -3.805 -9.902 20.217 138 2H5* G 13 2H5' G 4 -4.745 -10.913 19.105 139 H4* G 13 H4* G 4 -5.735 -8.732 19.277 140 H3* G 13 H3* G 4 -5.053 -9.888 16.772 141 H1* G 13 H1* G 4 -5.143 -6.303 17.752 142 H8 G 13 H8 G 4 -1.316 -7.202 17.575 143 H1 G 13 H1 G 4 -2.797 -0.932 17.188 144 1H2 G 13 1H2 G 4 -6.024 -2.233 17.409 145 2H2 G 13 2H2 G 4 -5.047 -0.755 17.296 146 2H2* G 13 1H2' G 4 -4.579 -7.448 15.641 147 1H2* G 13 2H2' G 4 -3.265 -8.345 16.451 148 1H5* A 14 1H5' A 5 -8.015 -5.974 16.924 149 2H5* A 14 2H5' A 5 -9.296 -6.466 15.802 150 H4* A 14 H4* A 5 -9.112 -4.097 15.709 151 H3* A 14 H3* A 5 -8.892 -5.681 13.383 152 H1* A 14 H1* A 5 -7.149 -2.445 14.104 153 H8 A 14 H8 A 5 -4.488 -5.300 14.536 154 1H6 A 14 1H6 A 5 -0.449 -0.608 13.755 155 2H6 A 14 2H6 A 5 -0.542 -2.349 14.076 156 H2 A 14 H2 A 5 -4.419 1.075 13.638 157 2H2* A 14 1H2' A 5 -7.109 -3.992 12.190 158 1H2* A 14 2H2' A 5 -6.558 -5.331 13.238 159 1H5* T 15 1H5' T 6 -9.433 -0.856 12.842 160 2H5* T 15 2H5' T 6 -10.626 -0.748 11.535 161 H4* T 15 H4* T 6 -9.171 1.152 11.438 162 H3* T 15 H3* T 6 -9.560 -0.557 9.188 163 1H2* T 15 2H2' T 6 -7.357 -1.362 9.294 164 2H2* T 15 1H2' T 6 -7.063 0.023 8.223 165 H1* T 15 H1* T 6 -6.630 1.495 10.153 166 H3 T 15 H3 T 6 -2.143 0.821 10.333 167 1H5M T 15 1H5M T 6 -2.598 -3.816 10.961 168 2H5M T 15 2H5M T 6 -4.258 -3.963 11.543 169 3H5M T 15 3H5M T 6 -3.928 -3.995 9.804 170 H6 T 15 H6 T 6 -5.902 -2.160 10.772 171 1H5* C 16 1H5' C 7 -7.983 4.006 8.652 172 2H5* C 16 2H5' C 7 -8.851 4.567 7.211 173 H4* C 16 H4* C 7 -6.745 5.737 7.456 174 H3* C 16 H3* C 7 -7.549 4.537 5.047 175 H1* C 16 H1* C 7 -4.067 4.745 6.383 176 1H4 C 16 1H4 C 7 -1.874 -1.484 7.524 177 2H4 C 16 2H4 C 7 -0.548 -0.374 7.113 178 H5 C 16 H5 C 7 -4.189 -0.619 7.567 179 H6 C 16 H6 C 7 -5.531 1.382 7.231 180 2H2* C 16 1H2' C 7 -5.025 3.781 4.352 181 1H2* C 16 2H2' C 7 -6.081 2.706 5.280 182 1H5* C 17 1H5' C 8 -3.700 7.482 5.099 183 2H5* C 17 2H5' C 8 -4.013 8.539 3.711 184 H4* C 17 H4* C 8 -1.641 8.380 4.118 185 H3* C 17 H3* C 8 -2.776 7.972 1.586 186 H1* C 17 H1* C 8 0.170 6.120 3.005 187 1H4 C 17 1H4 C 8 -1.600 -0.241 4.073 188 2H4 C 17 2H4 C 8 0.144 -0.091 3.772 189 H5 C 17 H5 C 8 -3.043 1.744 3.845 190 H6 C 17 H6 C 8 -2.996 4.161 3.505 191 2H2* C 17 1H2' C 8 -1.005 6.027 0.882 192 1H2* C 17 2H2' C 8 -2.546 5.627 1.673 193 1H5* T 18 1H5' T 9 1.978 7.933 2.005 194 2H5* T 18 2H5' T 9 2.540 9.050 0.749 195 H4* T 18 H4* T 9 4.208 7.352 1.113 196 H3* T 18 H3* T 9 3.190 7.928 -1.473 197 1H2* T 18 2H2' T 9 1.954 5.901 -1.587 198 2H2* T 18 1H2' T 9 3.503 5.365 -2.309 199 H1* T 18 H1* T 9 4.359 4.677 -0.129 200 H3 T 18 H3 T 9 2.747 0.448 0.048 201 1H5M T 18 1H5M T 9 -1.697 2.161 0.744 202 2H5M T 18 2H5M T 9 -1.573 3.821 0.144 203 3H5M T 18 3H5M T 9 -1.620 2.472 -0.995 204 H6 T 18 H6 T 9 0.591 4.748 -0.154 Start of MODEL 6 1 1H5* A 1 1H5' A 1 7.595 -8.450 -1.673 2 2H5* A 1 2H5' A 1 8.902 -8.816 -0.533 3 H4* A 1 H4* A 1 8.918 -6.441 -1.221 4 H3* A 1 H3* A 1 9.020 -7.322 1.490 5 H1* A 1 H1* A 1 7.554 -4.186 0.045 6 H8 A 1 H8 A 1 4.562 -6.515 1.100 7 1H6 A 1 1H6 A 1 1.263 -1.247 0.591 8 2H6 A 1 2H6 A 1 1.133 -2.955 1.033 9 H2 A 1 H2 A 1 5.353 -0.305 -0.404 10 H5* A 1 H5* A 1 6.238 -8.204 0.202 11 2H2* A 1 1H2' A 1 7.817 -5.007 2.346 12 1H2* A 1 2H2' A 1 6.869 -6.472 1.982 13 1H5* G 2 1H5' G 2 10.236 -2.670 0.611 14 2H5* G 2 2H5' G 2 11.603 -2.384 1.704 15 H4* G 2 H4* G 2 10.296 -0.399 1.583 16 H3* G 2 H3* G 2 10.819 -1.646 4.100 17 H1* G 2 H1* G 2 7.974 0.454 3.014 18 H8 G 2 H8 G 2 6.492 -3.135 3.446 19 H1 G 2 H1 G 2 2.200 1.669 3.184 20 1H2 G 2 1H2 G 2 5.130 3.543 2.983 21 2H2 G 2 2H2 G 2 3.360 3.611 3.061 22 2H2* G 2 1H2' G 2 8.454 -0.726 5.151 23 1H2* G 2 2H2' G 2 8.545 -2.281 4.303 24 1H5* G 3 1H5' G 3 9.277 2.926 3.774 25 2H5* G 3 2H5' G 3 10.271 3.796 4.955 26 H4* G 3 H4* G 3 8.152 4.892 4.702 27 H3* G 3 H3* G 3 9.157 4.131 7.242 28 H1* G 3 H1* G 3 5.618 4.372 6.110 29 H8 G 3 H8 G 3 6.365 0.498 6.137 30 H1 G 3 H1 G 3 0.156 2.187 6.546 31 1H2 G 3 1H2 G 3 1.543 5.377 6.434 32 2H2 G 3 2H2 G 3 0.043 4.436 6.548 33 2H2* G 3 1H2' G 3 6.648 3.748 8.256 34 1H2* G 3 2H2' G 3 7.544 2.415 7.487 35 1H5* A 4 1H5' A 4 5.348 7.165 6.974 36 2H5* A 4 2H5' A 4 5.799 8.433 8.127 37 H4* A 4 H4* A 4 3.425 8.268 8.050 38 H3* A 4 H3* A 4 4.843 8.068 10.496 39 H1* A 4 H1* A 4 1.605 6.348 9.557 40 H8 A 4 H8 A 4 4.536 3.755 9.388 41 1H6 A 4 1H6 A 4 -0.075 -0.398 9.881 42 2H6 A 4 2H6 A 4 1.679 -0.258 9.659 43 H2 A 4 H2 A 4 -1.876 3.521 9.864 44 2H2* A 4 1H2' A 4 2.943 6.425 11.591 45 1H2* A 4 2H2' A 4 4.365 5.766 10.754 46 1H5* T 5 1H5' T 5 0.111 8.583 10.467 47 2H5* T 5 2H5' T 5 -0.234 9.835 11.674 48 H4* T 5 H4* T 5 -2.069 8.296 11.544 49 H3* T 5 H3* T 5 -0.722 8.847 14.017 50 1H2* T 5 2H2' T 5 0.003 6.621 14.283 51 2H2* T 5 1H2' T 5 -1.599 6.429 14.993 52 H1* T 5 H1* T 5 -2.587 5.813 12.854 53 H3 T 5 H3 T 5 -1.658 1.371 13.225 54 1H5M T 5 1H5M T 5 3.025 2.859 13.907 55 2H5M T 5 2H5M T 5 2.963 2.269 12.238 56 3H5M T 5 3H5M T 5 3.108 4.000 12.558 57 H6 T 5 H6 T 5 1.133 5.272 12.744 58 1H5* C 6 1H5' C 6 -4.972 6.693 14.156 59 2H5* C 6 2H5' C 6 -5.900 7.610 15.357 60 H4* C 6 H4* C 6 -6.553 5.323 15.489 61 H3* C 6 H3* C 6 -5.571 6.714 17.765 62 H1* C 6 H1* C 6 -5.380 3.132 16.946 63 1H4 C 6 1H4 C 6 0.838 0.950 15.890 64 2H4 C 6 2H4 C 6 -0.274 -0.332 16.432 65 H5 C 6 H5 C 6 0.007 3.316 15.963 66 H6 C 6 H6 C 6 -2.009 4.661 16.265 67 2H2* C 6 1H2' C 6 -4.542 4.420 18.859 68 1H2* C 6 2H2' C 6 -3.554 5.439 17.790 69 1H5* C 7 1H5' C 7 -7.959 2.347 18.762 70 2H5* C 7 2H5' C 7 -8.935 2.921 20.127 71 H4* C 7 H4* C 7 -8.330 0.689 20.620 72 H3* C 7 H3* C 7 -7.766 2.719 22.434 73 H1* C 7 H1* C 7 -5.639 -0.142 21.827 74 1H4 C 7 1H4 C 7 0.288 0.756 19.051 75 2H4 C 7 2H4 C 7 -0.093 -0.956 19.370 76 H5 C 7 H5 C 7 -1.481 2.471 19.537 77 H6 C 7 H6 C 7 -3.717 2.740 20.419 78 2H2* C 7 1H2' C 7 -5.304 1.922 23.101 79 1H2* C 7 2H2' C 7 -5.486 2.898 21.642 80 1H5* T 8 1H5' T 8 -5.623 -1.437 23.795 81 2H5* T 8 2H5' T 8 -5.984 -1.581 25.522 82 H4* T 8 H4* T 8 -3.733 -2.228 25.195 83 H3* T 8 H3* T 8 -4.349 0.017 26.933 84 1H2* T 8 2H2' T 8 -3.066 1.406 25.451 85 2H2* T 8 1H2' T 8 -1.774 0.971 26.506 86 H1* T 8 H1* T 8 -1.300 -1.036 25.080 87 H3 T 8 H3 T 8 1.667 2.441 24.481 88 1H5M T 8 1H5M T 8 -3.175 4.044 22.675 89 2H5M T 8 2H5M T 8 -1.855 5.173 22.980 90 3H5M T 8 3H5M T 8 -1.898 4.268 21.461 91 H6 T 8 H6 T 8 -2.889 1.755 23.327 92 1H5* U 9 1H5' U 9 0.452 -0.618 29.924 93 2H5* U 9 2H5' U 9 -0.279 0.999 29.672 94 H4* U 9 H4* U 9 1.503 -0.269 27.578 95 H3* U 9 H3* U 9 2.552 1.314 29.951 96 H1* U 9 H1* U 9 2.256 1.578 26.157 97 H3 U 9 H3 U 9 0.301 6.315 26.800 98 H5 U 9 H5 U 9 3.685 5.631 24.414 99 H6 U 9 H6 U 9 3.971 3.503 25.468 100 2H2* U 9 1H2' U 9 4.050 1.354 27.304 101 1H2* U 9 2H2' U 9 3.747 2.742 28.416 102 1H5* T 10 1H5' T 1 6.905 -2.735 28.535 103 2H5* T 10 2H5' T 1 7.014 -1.069 27.967 104 H4* T 10 H4* T 1 4.426 -2.695 27.776 105 H3* T 10 H3* T 1 6.775 -2.722 25.872 106 1H2* T 10 2H2' T 1 5.321 -2.416 24.042 107 2H2* T 10 1H2' T 1 4.031 -3.342 24.816 108 H1* T 10 H1* T 1 3.133 -1.537 25.922 109 H3 T 10 H3 T 1 5.736 2.576 23.956 110 1H5M T 10 1H5M T 1 2.069 0.367 20.895 111 2H5M T 10 2H5M T 1 1.029 0.950 22.225 112 3H5M T 10 3H5M T 1 1.958 2.107 21.256 113 H6 T 10 H6 T 1 2.758 -1.027 22.998 114 1H5* T 11 1H5' T 2 4.651 -6.945 27.264 115 2H5* T 11 2H5' T 2 5.759 -8.111 26.516 116 H4* T 11 H4* T 2 3.647 -9.170 26.822 117 H3* T 11 H3* T 2 4.854 -9.090 24.274 118 1H2* T 11 2H2' T 2 3.377 -7.352 23.543 119 2H2* T 11 1H2' T 2 2.514 -8.760 22.913 120 H1* T 11 H1* T 2 1.230 -8.964 25.002 121 H3 T 11 H3 T 2 -2.215 -6.355 23.600 122 1H5M T 11 1H5M T 2 1.412 -2.784 24.745 123 2H5M T 11 2H5M T 2 2.052 -3.262 23.146 124 3H5M T 11 3H5M T 2 0.451 -2.520 23.282 125 H6 T 11 H6 T 2 2.414 -5.422 24.524 126 1H5* G 12 1H5' G 3 1.522 -12.246 21.317 127 2H5* G 12 2H5' G 3 2.214 -10.633 21.026 128 H4* G 12 H4* G 3 -0.602 -11.117 22.078 129 H3* G 12 H3* G 3 0.242 -11.564 19.423 130 H1* G 12 H1* G 3 -1.610 -8.545 20.708 131 H8 G 12 H8 G 3 2.153 -7.561 20.273 132 H1 G 12 H1 G 3 -1.985 -2.616 20.311 133 1H2 G 12 1H2 G 3 -4.289 -5.208 20.590 134 2H2 G 12 2H2 G 3 -4.050 -3.448 20.520 135 2H2* G 12 1H2' G 3 -0.784 -9.211 18.495 136 1H2* G 12 2H2' G 3 0.889 -9.308 19.096 137 1H5* G 13 1H5' G 4 -4.137 -9.756 20.106 138 2H5* G 13 2H5' G 4 -5.187 -10.726 19.058 139 H4* G 13 H4* G 4 -6.065 -8.511 19.204 140 H3* G 13 H3* G 4 -5.491 -9.718 16.698 141 H1* G 13 H1* G 4 -5.391 -6.128 17.634 142 H8 G 13 H8 G 4 -1.610 -7.192 17.395 143 H1 G 13 H1 G 4 -2.823 -0.865 17.096 144 1H2 G 13 1H2 G 4 -6.104 -2.044 17.295 145 2H2 G 13 2H2 G 4 -5.076 -0.601 17.194 146 2H2* G 13 1H2' G 4 -4.916 -7.318 15.529 147 1H2* G 13 2H2' G 4 -3.632 -8.268 16.328 148 1H5* A 14 1H5' A 5 -8.240 -5.644 16.836 149 2H5* A 14 2H5' A 5 -9.550 -6.069 15.721 150 H4* A 14 H4* A 5 -9.222 -3.719 15.601 151 H3* A 14 H3* A 5 -9.087 -5.337 13.286 152 H1* A 14 H1* A 5 -7.198 -2.187 13.997 153 H8 A 14 H8 A 5 -4.650 -5.152 14.387 154 1H6 A 14 1H6 A 5 -0.431 -0.605 13.713 155 2H6 A 14 2H6 A 5 -0.593 -2.346 14.000 156 H2 A 14 H2 A 5 -4.332 1.232 13.610 157 2H2* A 14 1H2' A 5 -7.225 -3.740 12.084 158 1H2* A 14 2H2' A 5 -6.740 -5.100 13.138 159 1H5* T 15 1H5' T 6 -9.455 -0.498 12.761 160 2H5* T 15 2H5' T 6 -10.635 -0.338 11.447 161 H4* T 15 H4* T 6 -9.116 1.517 11.390 162 H3* T 15 H3* T 6 -9.557 -0.135 9.111 163 1H2* T 15 2H2' T 6 -7.390 -1.032 9.216 164 2H2* T 15 1H2' T 6 -7.034 0.354 8.165 165 H1* T 15 H1* T 6 -6.549 1.781 10.114 166 H3 T 15 H3 T 6 -2.096 0.922 10.323 167 1H5M T 15 1H5M T 6 -2.752 -3.701 10.893 168 2H5M T 15 2H5M T 6 -4.440 -3.799 11.397 169 3H5M T 15 3H5M T 6 -4.033 -3.804 9.674 170 H6 T 15 H6 T 6 -5.976 -1.911 10.679 171 1H5* C 16 1H5' C 7 -7.788 4.364 8.662 172 2H5* C 16 2H5' C 7 -8.618 4.986 7.225 173 H4* C 16 H4* C 7 -6.465 6.059 7.506 174 H3* C 16 H3* C 7 -7.299 4.937 5.070 175 H1* C 16 H1* C 7 -3.823 4.972 6.439 176 1H4 C 16 1H4 C 7 -1.907 -1.365 7.482 177 2H4 C 16 2H4 C 7 -0.532 -0.304 7.100 178 H5 C 16 H5 C 7 -4.184 -0.402 7.524 179 H6 C 16 H6 C 7 -5.437 1.660 7.217 180 2H2* C 16 1H2' C 7 -4.804 4.084 4.384 181 1H2* C 16 2H2' C 7 -5.913 3.040 5.285 182 1H5* C 17 1H5' C 8 -3.322 7.710 5.200 183 2H5* C 17 2H5' C 8 -3.580 8.801 3.827 184 H4* C 17 H4* C 8 -1.219 8.533 4.244 185 H3* C 17 H3* C 8 -2.356 8.214 1.700 186 H1* C 17 H1* C 8 0.497 6.212 3.105 187 1H4 C 17 1H4 C 8 -1.553 -0.081 4.062 188 2H4 C 17 2H4 C 8 0.198 -0.001 3.770 189 H5 C 17 H5 C 8 -2.907 1.968 3.858 190 H6 C 17 H6 C 8 -2.753 4.386 3.560 191 2H2* C 17 1H2' C 8 -0.670 6.202 0.974 192 1H2* C 17 2H2' C 8 -2.230 5.859 1.753 193 1H5* T 18 1H5' T 9 2.389 7.948 2.138 194 2H5* T 18 2H5' T 9 3.008 9.058 0.902 195 H4* T 18 H4* T 9 4.593 7.277 1.244 196 H3* T 18 H3* T 9 3.614 7.941 -1.336 197 1H2* T 18 2H2' T 9 2.285 5.976 -1.487 198 2H2* T 18 1H2' T 9 3.810 5.380 -2.211 199 H1* T 18 H1* T 9 4.624 4.617 -0.039 200 H3 T 18 H3 T 9 2.814 0.467 0.062 201 1H5M T 18 1H5M T 9 -1.547 2.380 0.776 202 2H5M T 18 2H5M T 9 -1.343 4.038 0.192 203 3H5M T 18 3H5M T 9 -1.449 2.704 -0.960 204 H6 T 18 H6 T 9 0.863 4.866 -0.077 Start of MODEL 7 1 1H5* A 1 1H5' A 1 6.541 -8.817 -1.486 2 2H5* A 1 2H5' A 1 7.861 -9.279 -0.401 3 H4* A 1 H4* A 1 8.263 -7.053 -1.311 4 H3* A 1 H3* A 1 8.361 -7.611 1.438 5 H1* A 1 H1* A 1 7.099 -4.418 -0.148 6 H8 A 1 H8 A 1 4.000 -6.615 0.851 7 1H6 A 1 1H6 A 1 0.955 -1.182 0.500 8 2H6 A 1 2H6 A 1 0.745 -2.895 0.893 9 H2 A 1 H2 A 1 5.087 -0.408 -0.469 10 H5* A 1 H5* A 1 6.508 -8.726 1.355 11 2H2* A 1 1H2' A 1 7.376 -5.157 2.153 12 1H2* A 1 2H2' A 1 6.285 -6.541 1.906 13 1H5* G 2 1H5' G 2 9.818 -3.087 0.367 14 2H5* G 2 2H5' G 2 11.231 -2.846 1.411 15 H4* G 2 H4* G 2 9.984 -0.822 1.347 16 H3* G 2 H3* G 2 10.527 -2.106 3.848 17 H1* G 2 H1* G 2 7.750 0.113 2.830 18 H8 G 2 H8 G 2 6.120 -3.405 3.313 19 H1 G 2 H1 G 2 2.043 1.588 3.138 20 1H2 G 2 1H2 G 2 5.050 3.324 2.882 21 2H2 G 2 2H2 G 2 3.288 3.474 3.010 22 2H2* G 2 1H2' G 2 8.230 -1.084 4.958 23 1H2* G 2 2H2' G 2 8.234 -2.642 4.110 24 1H5* G 3 1H5' G 3 9.156 2.497 3.528 25 2H5* G 3 2H5' G 3 10.207 3.350 4.672 26 H4* G 3 H4* G 3 8.122 4.515 4.435 27 H3* G 3 H3* G 3 9.157 3.778 6.973 28 H1* G 3 H1* G 3 5.607 4.133 5.908 29 H8 G 3 H8 G 3 6.202 0.237 5.997 30 H1 G 3 H1 G 3 0.078 2.183 6.558 31 1H2 G 3 1H2 G 3 1.603 5.307 6.411 32 2H2 G 3 2H2 G 3 0.064 4.437 6.571 33 2H2* G 3 1H2' G 3 6.655 3.521 8.049 34 1H2* G 3 2H2' G 3 7.479 2.133 7.295 35 1H5* A 4 1H5' A 4 5.395 6.837 6.688 36 2H5* A 4 2H5' A 4 5.913 8.159 7.748 37 H4* A 4 H4* A 4 3.543 8.056 7.793 38 H3* A 4 H3* A 4 5.069 7.902 10.178 39 H1* A 4 H1* A 4 1.739 6.260 9.450 40 H8 A 4 H8 A 4 4.569 3.553 9.297 41 1H6 A 4 1H6 A 4 -0.182 -0.431 9.936 42 2H6 A 4 2H6 A 4 1.573 -0.353 9.703 43 H2 A 4 H2 A 4 -1.841 3.553 9.877 44 2H2* A 4 1H2' A 4 3.182 6.363 11.420 45 1H2* A 4 2H2' A 4 4.539 5.631 10.534 46 1H5* T 5 1H5' T 5 0.376 8.671 10.329 47 2H5* T 5 2H5' T 5 0.136 9.959 11.524 48 H4* T 5 H4* T 5 -1.773 8.492 11.471 49 H3* T 5 H3* T 5 -0.353 9.072 13.891 50 1H2* T 5 2H2' T 5 0.333 6.841 14.205 51 2H2* T 5 1H2' T 5 -1.251 6.709 14.967 52 H1* T 5 H1* T 5 -2.312 6.035 12.889 53 H3 T 5 H3 T 5 -1.443 1.587 13.234 54 1H5M T 5 1H5M T 5 3.280 3.114 13.876 55 2H5M T 5 2H5M T 5 3.180 2.333 12.289 56 3H5M T 5 3H5M T 5 3.348 4.088 12.401 57 H6 T 5 H6 T 5 1.405 5.436 12.704 58 1H5* C 6 1H5' C 6 -4.677 7.092 14.130 59 2H5* C 6 2H5' C 6 -5.551 8.000 15.378 60 H4* C 6 H4* C 6 -6.249 5.713 15.449 61 H3* C 6 H3* C 6 -5.197 7.024 17.753 62 H1* C 6 H1* C 6 -5.135 3.459 16.796 63 1H4 C 6 1H4 C 6 1.140 1.237 16.090 64 2H4 C 6 2H4 C 6 -0.004 -0.058 16.518 65 H5 C 6 H5 C 6 0.298 3.581 16.022 66 H6 C 6 H6 C 6 -1.721 4.933 16.195 67 2H2* C 6 1H2' C 6 -4.264 4.664 18.766 68 1H2* C 6 2H2' C 6 -3.236 5.676 17.739 69 1H5* C 7 1H5' C 7 -7.780 2.822 18.455 70 2H5* C 7 2H5' C 7 -8.739 3.258 19.881 71 H4* C 7 H4* C 7 -8.213 0.920 19.998 72 H3* C 7 H3* C 7 -7.670 2.654 22.137 73 H1* C 7 H1* C 7 -5.777 -0.269 21.125 74 1H4 C 7 1H4 C 7 0.487 0.887 19.174 75 2H4 C 7 2H4 C 7 0.185 -0.806 19.653 76 H5 C 7 H5 C 7 -1.384 2.537 19.466 77 H6 C 7 H6 C 7 -3.758 2.690 20.002 78 2H2* C 7 1H2' C 7 -5.312 1.543 22.782 79 1H2* C 7 2H2' C 7 -5.349 2.752 21.502 80 1H5* T 8 1H5' T 8 -5.650 -1.540 23.212 81 2H5* T 8 2H5' T 8 -6.148 -1.901 24.872 82 H4* T 8 H4* T 8 -3.860 -2.351 24.776 83 H3* T 8 H3* T 8 -4.698 -0.152 26.502 84 1H2* T 8 2H2' T 8 -3.302 1.285 25.165 85 2H2* T 8 1H2' T 8 -2.107 0.837 26.323 86 H1* T 8 H1* T 8 -1.497 -1.139 24.896 87 H3 T 8 H3 T 8 1.497 2.365 24.671 88 1H5M T 8 1H5M T 8 -3.157 4.011 22.475 89 2H5M T 8 2H5M T 8 -1.843 5.125 22.853 90 3H5M T 8 3H5M T 8 -1.806 4.206 21.342 91 H6 T 8 H6 T 8 -2.919 1.695 23.067 92 1H5* U 9 1H5' U 9 -0.177 -0.816 29.903 93 2H5* U 9 2H5' U 9 -0.894 0.804 29.631 94 H4* U 9 H4* U 9 1.084 -0.399 27.678 95 H3* U 9 H3* U 9 1.889 1.145 30.170 96 H1* U 9 H1* U 9 1.940 1.485 26.371 97 H3 U 9 H3 U 9 -0.122 6.188 26.922 98 H5 U 9 H5 U 9 3.483 5.590 24.857 99 H6 U 9 H6 U 9 3.690 3.441 25.886 100 2H2* U 9 1H2' U 9 3.625 1.258 27.675 101 1H2* U 9 2H2' U 9 3.201 2.618 28.782 102 1H5* T 10 1H5' T 1 6.461 -2.774 29.082 103 2H5* T 10 2H5' T 1 6.553 -1.093 28.555 104 H4* T 10 H4* T 1 4.069 -2.827 28.098 105 H3* T 10 H3* T 1 6.572 -2.676 26.406 106 1H2* T 10 2H2' T 1 5.256 -2.422 24.459 107 2H2* T 10 1H2' T 1 3.950 -3.409 25.126 108 H1* T 10 H1* T 1 2.889 -1.654 26.153 109 H3 T 10 H3 T 1 5.602 2.553 24.536 110 1H5M T 10 1H5M T 1 2.263 0.384 21.100 111 2H5M T 10 2H5M T 1 1.092 0.925 22.336 112 3H5M T 10 3H5M T 1 2.096 2.114 21.488 113 H6 T 10 H6 T 1 2.764 -1.053 23.227 114 1H5* T 11 1H5' T 2 4.602 -7.083 27.481 115 2H5* T 11 2H5' T 2 5.796 -8.161 26.735 116 H4* T 11 H4* T 2 3.716 -9.313 26.846 117 H3* T 11 H3* T 2 5.050 -9.016 24.373 118 1H2* T 11 2H2' T 2 3.528 -7.304 23.674 119 2H2* T 11 1H2' T 2 2.766 -8.711 22.919 120 H1* T 11 H1* T 2 1.399 -9.098 24.928 121 H3 T 11 H3 T 2 -2.135 -6.580 23.595 122 1H5M T 11 1H5M T 2 1.221 -2.887 25.012 123 2H5M T 11 2H5M T 2 2.018 -3.271 23.460 124 3H5M T 11 3H5M T 2 0.372 -2.626 23.482 125 H6 T 11 H6 T 2 2.419 -5.476 24.688 126 1H5* G 12 1H5' G 3 1.887 -12.153 21.133 127 2H5* G 12 2H5' G 3 2.559 -10.520 20.920 128 H4* G 12 H4* G 3 -0.261 -11.086 21.916 129 H3* G 12 H3* G 3 0.595 -11.413 19.253 130 H1* G 12 H1* G 3 -1.268 -8.465 20.638 131 H8 G 12 H8 G 3 2.489 -7.403 20.330 132 H1 G 12 H1 G 3 -1.764 -2.555 20.476 133 1H2 G 12 1H2 G 3 -4.002 -5.230 20.553 134 2H2 G 12 2H2 G 3 -3.820 -3.461 20.586 135 2H2* G 12 1H2' G 3 -0.386 -9.009 18.412 136 1H2* G 12 2H2' G 3 1.271 -9.139 19.051 137 1H5* G 13 1H5' G 4 -3.781 -9.560 20.012 138 2H5* G 13 2H5' G 4 -4.819 -10.524 18.946 139 H4* G 13 H4* G 4 -5.760 -8.349 19.141 140 H3* G 13 H3* G 4 -5.136 -9.463 16.610 141 H1* G 13 H1* G 4 -5.124 -5.884 17.635 142 H8 G 13 H8 G 4 -1.333 -6.907 17.440 143 H1 G 13 H1 G 4 -2.580 -0.589 17.087 144 1H2 G 13 1H2 G 4 -5.855 -1.765 17.355 145 2H2 G 13 2H2 G 4 -4.830 -0.326 17.205 146 2H2* G 13 1H2' G 4 -4.606 -7.022 15.510 147 1H2* G 13 2H2' G 4 -3.309 -7.962 16.298 148 1H5* A 14 1H5' A 5 -8.014 -5.457 16.771 149 2H5* A 14 2H5' A 5 -9.293 -5.930 15.638 150 H4* A 14 H4* A 5 -9.059 -3.572 15.523 151 H3* A 14 H3* A 5 -8.826 -5.178 13.209 152 H1* A 14 H1* A 5 -7.036 -1.955 13.944 153 H8 A 14 H8 A 5 -4.487 -4.887 14.429 154 1H6 A 14 1H6 A 5 -0.251 -0.364 13.775 155 2H6 A 14 2H6 A 5 -0.429 -2.093 14.116 156 H2 A 14 H2 A 5 -4.155 1.472 13.507 157 2H2* A 14 1H2' A 5 -7.010 -3.506 12.038 158 1H2* A 14 2H2' A 5 -6.482 -4.850 13.080 159 1H5* T 15 1H5' T 6 -9.440 -0.381 12.754 160 2H5* T 15 2H5' T 6 -10.620 -0.243 11.438 161 H4* T 15 H4* T 6 -9.178 1.692 11.466 162 H3* T 15 H3* T 6 -9.628 0.166 9.134 163 1H2* T 15 2H2' T 6 -7.480 -0.808 9.204 164 2H2* T 15 1H2' T 6 -7.111 0.590 8.174 165 H1* T 15 H1* T 6 -6.527 1.958 10.123 166 H3 T 15 H3 T 6 -2.125 0.888 10.276 167 1H5M T 15 1H5M T 6 -3.423 -3.743 9.845 168 2H5M T 15 2H5M T 6 -3.488 -3.658 11.606 169 3H5M T 15 3H5M T 6 -4.983 -3.785 10.671 170 H6 T 15 H6 T 6 -6.131 -1.749 10.733 171 1H5* C 16 1H5' C 7 -7.753 4.651 8.789 172 2H5* C 16 2H5' C 7 -8.576 5.325 7.371 173 H4* C 16 H4* C 7 -6.392 6.338 7.675 174 H3* C 16 H3* C 7 -7.273 5.331 5.212 175 H1* C 16 H1* C 7 -3.782 5.183 6.544 176 1H4 C 16 1H4 C 7 -2.163 -1.266 7.367 177 2H4 C 16 2H4 C 7 -0.733 -0.264 7.041 178 H5 C 16 H5 C 7 -4.385 -0.205 7.421 179 H6 C 16 H6 C 7 -5.542 1.922 7.229 180 2H2* C 16 1H2' C 7 -4.817 4.412 4.474 181 1H2* C 16 2H2' C 7 -5.960 3.380 5.344 182 1H5* C 17 1H5' C 8 -3.141 7.882 5.367 183 2H5* C 17 2H5' C 8 -3.355 9.023 4.027 184 H4* C 17 H4* C 8 -1.011 8.600 4.385 185 H3* C 17 H3* C 8 -2.217 8.398 1.856 186 H1* C 17 H1* C 8 0.559 6.238 3.174 187 1H4 C 17 1H4 C 8 -1.765 0.027 4.029 188 2H4 C 17 2H4 C 8 -0.016 0.026 3.719 189 H5 C 17 H5 C 8 -3.022 2.133 3.867 190 H6 C 17 H6 C 8 -2.763 4.548 3.628 191 2H2* C 17 1H2' C 8 -0.637 6.327 1.059 192 1H2* C 17 2H2' C 8 -2.201 6.042 1.853 193 1H5* T 18 1H5' T 9 2.521 7.913 2.196 194 2H5* T 18 2H5' T 9 3.163 9.022 0.971 195 H4* T 18 H4* T 9 4.678 7.170 1.244 196 H3* T 18 H3* T 9 3.680 7.931 -1.301 197 1H2* T 18 2H2' T 9 2.264 6.030 -1.468 198 2H2* T 18 1H2' T 9 3.748 5.384 -2.235 199 H1* T 18 H1* T 9 4.568 4.538 -0.098 200 H3 T 18 H3 T 9 2.580 0.470 -0.013 201 1H5M T 18 1H5M T 9 -1.682 2.562 0.792 202 2H5M T 18 2H5M T 9 -1.413 4.219 0.231 203 3H5M T 18 3H5M T 9 -1.596 2.910 -0.940 204 H6 T 18 H6 T 9 0.822 4.953 -0.063 Start of MODEL 8 1 1H5* A 1 1H5' A 1 7.013 -8.664 -1.263 2 2H5* A 1 2H5' A 1 8.323 -9.069 -0.141 3 H4* A 1 H4* A 1 8.729 -6.890 -1.152 4 H3* A 1 H3* A 1 8.837 -7.331 1.605 5 H1* A 1 H1* A 1 7.462 -4.205 -0.046 6 H8 A 1 H8 A 1 4.469 -6.532 0.983 7 1H6 A 1 1H6 A 1 1.164 -1.264 0.483 8 2H6 A 1 2H6 A 1 1.034 -2.975 0.917 9 H2 A 1 H2 A 1 5.255 -0.317 -0.501 10 H5* A 1 H5* A 1 6.268 -9.525 0.734 11 2H2* A 1 1H2' A 1 7.764 -4.901 2.260 12 1H2* A 1 2H2' A 1 6.727 -6.330 2.034 13 1H5* G 2 1H5' G 2 10.088 -2.764 0.413 14 2H5* G 2 2H5' G 2 11.491 -2.435 1.446 15 H4* G 2 H4* G 2 10.155 -0.475 1.357 16 H3* G 2 H3* G 2 10.744 -1.698 3.879 17 H1* G 2 H1* G 2 7.885 0.389 2.815 18 H8 G 2 H8 G 2 6.392 -3.180 3.356 19 H1 G 2 H1 G 2 2.121 1.641 3.065 20 1H2 G 2 1H2 G 2 5.058 3.494 2.797 21 2H2 G 2 2H2 G 2 3.290 3.573 2.905 22 2H2* G 2 1H2' G 2 8.404 -0.751 4.966 23 1H2* G 2 2H2' G 2 8.473 -2.322 4.144 24 1H5* G 3 1H5' G 3 9.210 2.873 3.514 25 2H5* G 3 2H5' G 3 10.230 3.758 4.661 26 H4* G 3 H4* G 3 8.111 4.858 4.433 27 H3* G 3 H3* G 3 9.161 4.132 6.965 28 H1* G 3 H1* G 3 5.602 4.372 5.895 29 H8 G 3 H8 G 3 6.334 0.496 5.969 30 H1 G 3 H1 G 3 0.139 2.216 6.456 31 1H2 G 3 1H2 G 3 1.535 5.398 6.279 32 2H2 G 3 2H2 G 3 0.034 4.465 6.432 33 2H2* G 3 1H2' G 3 6.669 3.778 8.031 34 1H2* G 3 2H2' G 3 7.544 2.428 7.268 35 1H5* A 4 1H5' A 4 5.360 7.173 6.718 36 2H5* A 4 2H5' A 4 5.838 8.460 7.838 37 H4* A 4 H4* A 4 3.464 8.306 7.812 38 H3* A 4 H3* A 4 4.930 8.138 10.232 39 H1* A 4 H1* A 4 1.664 6.419 9.387 40 H8 A 4 H8 A 4 4.582 3.813 9.208 41 1H6 A 4 1H6 A 4 -0.034 -0.318 9.819 42 2H6 A 4 2H6 A 4 1.715 -0.186 9.568 43 H2 A 4 H2 A 4 -1.823 3.607 9.788 44 2H2* A 4 1H2' A 4 3.042 6.526 11.392 45 1H2* A 4 2H2' A 4 4.444 5.845 10.540 46 1H5* T 5 1H5' T 5 0.201 8.683 10.288 47 2H5* T 5 2H5' T 5 -0.108 9.961 11.478 48 H4* T 5 H4* T 5 -1.959 8.440 11.422 49 H3* T 5 H3* T 5 -0.546 9.018 13.851 50 1H2* T 5 2H2' T 5 0.168 6.792 14.134 51 2H2* T 5 1H2' T 5 -1.415 6.628 14.891 52 H1* T 5 H1* T 5 -2.464 5.979 12.793 53 H3 T 5 H3 T 5 -1.568 1.534 13.160 54 1H5M T 5 1H5M T 5 3.141 3.001 13.758 55 2H5M T 5 2H5M T 5 3.044 2.373 12.105 56 3H5M T 5 3H5M T 5 3.209 4.109 12.381 57 H6 T 5 H6 T 5 1.251 5.405 12.603 58 1H5* C 6 1H5' C 6 -4.858 6.975 14.105 59 2H5* C 6 2H5' C 6 -5.724 7.884 15.359 60 H4* C 6 H4* C 6 -6.406 5.597 15.461 61 H3* C 6 H3* C 6 -5.320 6.928 17.736 62 H1* C 6 H1* C 6 -5.250 3.359 16.803 63 1H4 C 6 1H4 C 6 1.015 1.164 15.963 64 2H4 C 6 2H4 C 6 -0.110 -0.130 16.439 65 H5 C 6 H5 C 6 0.160 3.507 15.902 66 H6 C 6 H6 C 6 -1.862 4.848 16.114 67 2H2* C 6 1H2' C 6 -4.343 4.581 18.747 68 1H2* C 6 2H2' C 6 -3.349 5.597 17.689 69 1H5* C 7 1H5' C 7 -7.857 2.699 18.541 70 2H5* C 7 2H5' C 7 -8.798 3.172 19.968 71 H4* C 7 H4* C 7 -8.274 0.843 20.155 72 H3* C 7 H3* C 7 -7.672 2.654 22.216 73 H1* C 7 H1* C 7 -5.814 -0.326 21.262 74 1H4 C 7 1H4 C 7 0.381 0.817 19.075 75 2H4 C 7 2H4 C 7 0.122 -0.863 19.610 76 H5 C 7 H5 C 7 -1.487 2.454 19.387 77 H6 C 7 H6 C 7 -3.845 2.607 19.998 78 2H2* C 7 1H2' C 7 -5.314 1.520 22.858 79 1H2* C 7 2H2' C 7 -5.367 2.703 21.553 80 1H5* T 8 1H5' T 8 -5.725 -1.531 23.512 81 2H5* T 8 2H5' T 8 -6.233 -1.766 25.192 82 H4* T 8 H4* T 8 -3.963 -2.276 25.145 83 H3* T 8 H3* T 8 -4.733 0.070 26.700 84 1H2* T 8 2H2' T 8 -3.307 1.363 25.245 85 2H2* T 8 1H2' T 8 -2.117 0.977 26.434 86 H1* T 8 H1* T 8 -1.582 -1.123 25.181 87 H3 T 8 H3 T 8 1.564 2.201 24.620 88 1H5M T 8 1H5M T 8 -3.049 3.843 22.286 89 2H5M T 8 2H5M T 8 -1.791 4.968 22.795 90 3H5M T 8 3H5M T 8 -1.608 4.078 21.278 91 H6 T 8 H6 T 8 -2.911 1.629 23.138 92 1H5* U 9 1H5' U 9 -0.174 -0.489 30.095 93 2H5* U 9 2H5' U 9 -0.801 1.138 29.686 94 H4* U 9 H4* U 9 1.094 -0.345 27.843 95 H3* U 9 H3* U 9 2.003 1.391 30.172 96 H1* U 9 H1* U 9 2.034 1.400 26.347 97 H3 U 9 H3 U 9 0.220 6.233 26.657 98 H5 U 9 H5 U 9 3.722 5.318 24.532 99 H6 U 9 H6 U 9 3.856 3.234 25.686 100 2H2* U 9 1H2' U 9 3.690 1.130 27.650 101 1H2* U 9 2H2' U 9 3.409 2.616 28.637 102 1H5* T 10 1H5' T 1 6.563 -2.620 29.237 103 2H5* T 10 2H5' T 1 6.424 -1.013 28.527 104 H4* T 10 H4* T 1 4.173 -3.104 28.467 105 H3* T 10 H3* T 1 6.439 -2.681 26.498 106 1H2* T 10 2H2' T 1 4.878 -3.032 24.695 107 2H2* T 10 1H2' T 1 3.778 -3.929 25.756 108 H1* T 10 H1* T 1 2.654 -2.066 26.366 109 H3 T 10 H3 T 1 5.655 1.923 24.590 110 1H5M T 10 1H5M T 1 2.158 -0.158 21.243 111 2H5M T 10 2H5M T 1 1.040 0.583 22.420 112 3H5M T 10 3H5M T 1 2.167 1.600 21.510 113 H6 T 10 H6 T 1 2.519 -1.493 23.445 114 1H5* T 11 1H5' T 2 4.509 -7.169 27.433 115 2H5* T 11 2H5' T 2 5.725 -8.230 26.700 116 H4* T 11 H4* T 2 3.660 -9.312 26.498 117 H3* T 11 H3* T 2 5.114 -8.642 24.101 118 1H2* T 11 2H2' T 2 3.411 -7.088 23.495 119 2H2* T 11 1H2' T 2 2.802 -8.526 22.653 120 H1* T 11 H1* T 2 1.560 -9.196 24.698 121 H3 T 11 H3 T 2 -2.425 -7.319 23.706 122 1H5M T 11 1H5M T 2 -0.625 -3.010 23.300 123 2H5M T 11 2H5M T 2 0.352 -3.089 24.769 124 3H5M T 11 3H5M T 2 1.104 -3.353 23.174 125 H6 T 11 H6 T 2 1.959 -5.449 24.354 126 1H5* G 12 1H5' G 3 2.112 -12.036 20.801 127 2H5* G 12 2H5' G 3 2.603 -10.344 20.558 128 H4* G 12 H4* G 3 -0.070 -11.201 21.743 129 H3* G 12 H3* G 3 0.584 -11.455 19.049 130 H1* G 12 H1* G 3 -1.283 -8.509 20.476 131 H8 G 12 H8 G 3 2.471 -7.461 20.071 132 H1 G 12 H1 G 3 -1.759 -2.605 20.478 133 1H2 G 12 1H2 G 3 -3.996 -5.273 20.616 134 2H2 G 12 2H2 G 3 -3.812 -3.507 20.671 135 2H2* G 12 1H2' G 3 -0.464 -9.072 18.250 136 1H2* G 12 2H2' G 3 1.216 -9.162 18.828 137 1H5* G 13 1H5' G 4 -3.764 -9.646 20.042 138 2H5* G 13 2H5' G 4 -4.855 -10.597 19.018 139 H4* G 13 H4* G 4 -5.772 -8.416 19.276 140 H3* G 13 H3* G 4 -5.288 -9.518 16.710 141 H1* G 13 H1* G 4 -5.198 -5.950 17.753 142 H8 G 13 H8 G 4 -1.426 -6.980 17.369 143 H1 G 13 H1 G 4 -2.678 -0.659 17.101 144 1H2 G 13 1H2 G 4 -5.941 -1.844 17.470 145 2H2 G 13 2H2 G 4 -4.927 -0.401 17.293 146 2H2* G 13 1H2' G 4 -4.790 -7.077 15.597 147 1H2* G 13 2H2' G 4 -3.463 -8.030 16.318 148 1H5* A 14 1H5' A 5 -8.076 -5.444 17.000 149 2H5* A 14 2H5' A 5 -9.410 -5.883 15.919 150 H4* A 14 H4* A 5 -9.109 -3.534 15.773 151 H3* A 14 H3* A 5 -9.005 -5.166 13.468 152 H1* A 14 H1* A 5 -7.118 -1.997 14.113 153 H8 A 14 H8 A 5 -4.565 -4.949 14.528 154 1H6 A 14 1H6 A 5 -0.351 -0.435 13.658 155 2H6 A 14 2H6 A 5 -0.515 -2.164 14.013 156 H2 A 14 H2 A 5 -4.256 1.404 13.537 157 2H2* A 14 1H2' A 5 -7.176 -3.569 12.217 158 1H2* A 14 2H2' A 5 -6.662 -4.915 13.273 159 1H5* T 15 1H5' T 6 -9.355 -0.333 12.880 160 2H5* T 15 2H5' T 6 -10.562 -0.183 11.590 161 H4* T 15 H4* T 6 -9.025 1.652 11.465 162 H3* T 15 H3* T 6 -9.533 -0.039 9.225 163 1H2* T 15 2H2' T 6 -7.368 -0.947 9.297 164 2H2* T 15 1H2' T 6 -7.028 0.419 8.215 165 H1* T 15 H1* T 6 -6.493 1.875 10.130 166 H3 T 15 H3 T 6 -2.041 1.004 10.262 167 1H5M T 15 1H5M T 6 -2.690 -3.612 10.877 168 2H5M T 15 2H5M T 6 -4.335 -3.678 11.516 169 3H5M T 15 3H5M T 6 -4.065 -3.735 9.767 170 H6 T 15 H6 T 6 -5.922 -1.810 10.744 171 1H5* C 16 1H5' C 7 -7.764 4.444 8.676 172 2H5* C 16 2H5' C 7 -8.613 5.052 7.244 173 H4* C 16 H4* C 7 -6.452 6.121 7.487 174 H3* C 16 H3* C 7 -7.327 4.985 5.072 175 H1* C 16 H1* C 7 -3.831 5.015 6.386 176 1H4 C 16 1H4 C 7 -1.927 -1.322 7.443 177 2H4 C 16 2H4 C 7 -0.552 -0.270 7.040 178 H5 C 16 H5 C 7 -4.198 -0.350 7.509 179 H6 C 16 H6 C 7 -5.447 1.715 7.211 180 2H2* C 16 1H2' C 7 -4.847 4.118 4.354 181 1H2* C 16 2H2' C 7 -5.947 3.085 5.278 182 1H5* C 17 1H5' C 8 -3.333 7.735 5.125 183 2H5* C 17 2H5' C 8 -3.608 8.821 3.751 184 H4* C 17 H4* C 8 -1.243 8.545 4.130 185 H3* C 17 H3* C 8 -2.422 8.214 1.607 186 H1* C 17 H1* C 8 0.447 6.210 2.979 187 1H4 C 17 1H4 C 8 -1.623 -0.064 4.014 188 2H4 C 17 2H4 C 8 0.123 0.000 3.694 189 H5 C 17 H5 C 8 -2.967 1.989 3.814 190 H6 C 17 H6 C 8 -2.805 4.404 3.497 191 2H2* C 17 1H2' C 8 -0.753 6.194 0.867 192 1H2* C 17 2H2' C 8 -2.302 5.860 1.671 193 1H5* T 18 1H5' T 9 2.329 7.945 1.969 194 2H5* T 18 2H5' T 9 2.929 9.046 0.715 195 H4* T 18 H4* T 9 4.517 7.267 1.041 196 H3* T 18 H3* T 9 3.495 7.916 -1.525 197 1H2* T 18 2H2' T 9 2.161 5.952 -1.641 198 2H2* T 18 1H2' T 9 3.673 5.349 -2.389 199 H1* T 18 H1* T 9 4.523 4.599 -0.227 200 H3 T 18 H3 T 9 2.714 0.452 -0.056 201 1H5M T 18 1H5M T 9 -1.635 2.369 0.704 202 2H5M T 18 2H5M T 9 -1.439 4.025 0.113 203 3H5M T 18 3H5M T 9 -1.565 2.688 -1.034 204 H6 T 18 H6 T 9 0.762 4.850 -0.204 Start of MODEL 9 1 1H5* A 1 1H5' A 1 6.629 -8.724 -2.060 2 2H5* A 1 2H5' A 1 7.913 -9.233 -0.949 3 H4* A 1 H4* A 1 8.118 -6.847 -1.562 4 H3* A 1 H3* A 1 8.174 -7.821 1.119 5 H1* A 1 H1* A 1 6.956 -4.529 -0.207 6 H8 A 1 H8 A 1 3.798 -6.644 0.813 7 1H6 A 1 1H6 A 1 0.920 -1.121 0.502 8 2H6 A 1 2H6 A 1 0.661 -2.827 0.895 9 H2 A 1 H2 A 1 5.063 -0.471 -0.507 10 H5* A 1 H5* A 1 5.316 -8.429 -0.161 11 2H2* A 1 1H2' A 1 7.177 -5.444 2.062 12 1H2* A 1 2H2' A 1 6.107 -6.812 1.666 13 1H5* G 2 1H5' G 2 9.760 -3.271 0.359 14 2H5* G 2 2H5' G 2 11.157 -3.121 1.442 15 H4* G 2 H4* G 2 10.002 -1.037 1.380 16 H3* G 2 H3* G 2 10.466 -2.375 3.861 17 H1* G 2 H1* G 2 7.770 -0.046 2.867 18 H8 G 2 H8 G 2 6.034 -3.526 3.246 19 H1 G 2 H1 G 2 2.105 1.587 3.168 20 1H2 G 2 1H2 G 2 5.162 3.242 2.956 21 2H2 G 2 2H2 G 2 3.404 3.439 3.077 22 2H2* G 2 1H2' G 2 8.191 -1.305 4.969 23 1H2* G 2 2H2' G 2 8.155 -2.844 4.087 24 1H5* G 3 1H5' G 3 9.243 2.275 3.622 25 2H5* G 3 2H5' G 3 10.309 3.072 4.793 26 H4* G 3 H4* G 3 8.262 4.304 4.563 27 H3* G 3 H3* G 3 9.252 3.486 7.093 28 H1* G 3 H1* G 3 5.724 3.966 6.007 29 H8 G 3 H8 G 3 6.199 0.053 6.021 30 H1 G 3 H1 G 3 0.135 2.178 6.584 31 1H2 G 3 1H2 G 3 1.757 5.254 6.502 32 2H2 G 3 2H2 G 3 0.190 4.431 6.637 33 2H2* G 3 1H2' G 3 6.736 3.278 8.144 34 1H2* G 3 2H2' G 3 7.524 1.883 7.365 35 1H5* A 4 1H5' A 4 5.587 6.663 6.837 36 2H5* A 4 2H5' A 4 6.131 7.946 7.932 37 H4* A 4 H4* A 4 3.757 7.910 7.942 38 H3* A 4 H3* A 4 5.246 7.676 10.343 39 H1* A 4 H1* A 4 1.886 6.131 9.548 40 H8 A 4 H8 A 4 4.647 3.355 9.373 41 1H6 A 4 1H6 A 4 -0.211 -0.511 9.930 42 2H6 A 4 2H6 A 4 1.547 -0.477 9.710 43 H2 A 4 H2 A 4 -1.765 3.514 9.904 44 2H2* A 4 1H2' A 4 3.307 6.163 11.534 45 1H2* A 4 2H2' A 4 4.655 5.411 10.651 46 1H5* T 5 1H5' T 5 0.573 8.553 10.441 47 2H5* T 5 2H5' T 5 0.341 9.824 11.656 48 H4* T 5 H4* T 5 -1.598 8.397 11.537 49 H3* T 5 H3* T 5 -0.218 8.910 13.994 50 1H2* T 5 2H2' T 5 0.416 6.660 14.286 51 2H2* T 5 1H2' T 5 -1.185 6.547 15.013 52 H1* T 5 H1* T 5 -2.219 5.934 12.900 53 H3 T 5 H3 T 5 -1.452 1.467 13.254 54 1H5M T 5 1H5M T 5 3.295 2.870 13.941 55 2H5M T 5 2H5M T 5 3.194 2.123 12.337 56 3H5M T 5 3H5M T 5 3.401 3.871 12.487 57 H6 T 5 H6 T 5 1.482 5.256 12.769 58 1H5* C 6 1H5' C 6 -4.539 6.937 14.138 59 2H5* C 6 2H5' C 6 -5.442 7.881 15.337 60 H4* C 6 H4* C 6 -6.176 5.614 15.442 61 H3* C 6 H3* C 6 -5.179 6.959 17.740 62 H1* C 6 H1* C 6 -5.102 3.376 16.900 63 1H4 C 6 1H4 C 6 1.069 0.999 15.977 64 2H4 C 6 2H4 C 6 -0.096 -0.252 16.479 65 H5 C 6 H5 C 6 0.307 3.384 16.018 66 H6 C 6 H6 C 6 -1.671 4.793 16.280 67 2H2* C 6 1H2' C 6 -4.248 4.622 18.835 68 1H2* C 6 2H2' C 6 -3.211 5.613 17.787 69 1H5* C 7 1H5' C 7 -7.740 2.673 18.655 70 2H5* C 7 2H5' C 7 -8.726 3.279 19.998 71 H4* C 7 H4* C 7 -8.226 1.019 20.492 72 H3* C 7 H3* C 7 -7.630 3.020 22.327 73 H1* C 7 H1* C 7 -5.595 0.074 21.759 74 1H4 C 7 1H4 C 7 0.416 0.813 19.110 75 2H4 C 7 2H4 C 7 -0.021 -0.891 19.392 76 H5 C 7 H5 C 7 -1.301 2.573 19.590 77 H6 C 7 H6 C 7 -3.543 2.905 20.431 78 2H2* C 7 1H2' C 7 -5.223 2.104 23.061 79 1H2* C 7 2H2' C 7 -5.326 3.109 21.613 80 1H5* T 8 1H5' T 8 -5.651 -1.124 23.816 81 2H5* T 8 2H5' T 8 -6.059 -1.249 25.533 82 H4* T 8 H4* T 8 -3.803 -1.889 25.288 83 H3* T 8 H3* T 8 -4.438 0.422 26.942 84 1H2* T 8 2H2' T 8 -3.077 1.736 25.460 85 2H2* T 8 1H2' T 8 -1.824 1.294 26.562 86 H1* T 8 H1* T 8 -1.383 -0.766 25.206 87 H3 T 8 H3 T 8 1.748 2.553 24.591 88 1H5M T 8 1H5M T 8 -2.970 4.354 22.659 89 2H5M T 8 2H5M T 8 -1.584 5.415 22.915 90 3H5M T 8 3H5M T 8 -1.682 4.443 21.440 91 H6 T 8 H6 T 8 -2.812 2.061 23.345 92 1H5* U 9 1H5' U 9 0.296 -0.333 30.050 93 2H5* U 9 2H5' U 9 -0.323 1.322 29.748 94 H4* U 9 H4* U 9 1.406 -0.112 27.716 95 H3* U 9 H3* U 9 2.523 1.461 30.067 96 H1* U 9 H1* U 9 2.302 1.665 26.259 97 H3 U 9 H3 U 9 0.649 6.525 26.842 98 H5 U 9 H5 U 9 3.999 5.602 24.490 99 H6 U 9 H6 U 9 4.139 3.468 25.559 100 2H2* U 9 1H2' U 9 4.044 1.315 27.434 101 1H2* U 9 2H2' U 9 3.847 2.751 28.511 102 1H5* T 10 1H5' T 1 6.673 -2.853 28.759 103 2H5* T 10 2H5' T 1 6.799 -1.209 28.132 104 H4* T 10 H4* T 1 4.197 -2.831 28.029 105 H3* T 10 H3* T 1 6.503 -2.855 26.067 106 1H2* T 10 2H2' T 1 4.950 -2.708 24.259 107 2H2* T 10 1H2' T 1 3.695 -3.522 25.201 108 H1* T 10 H1* T 1 2.873 -1.606 26.100 109 H3 T 10 H3 T 1 5.864 2.265 24.185 110 1H5M T 10 1H5M T 1 2.096 0.365 21.045 111 2H5M T 10 2H5M T 1 1.072 1.041 22.343 112 3H5M T 10 3H5M T 1 2.118 2.111 21.393 113 H6 T 10 H6 T 1 2.588 -1.057 23.172 114 1H5* T 11 1H5' T 2 4.320 -7.108 27.435 115 2H5* T 11 2H5' T 2 5.435 -8.271 26.693 116 H4* T 11 H4* T 2 3.296 -9.300 26.921 117 H3* T 11 H3* T 2 4.601 -9.232 24.429 118 1H2* T 11 2H2' T 2 3.205 -7.446 23.653 119 2H2* T 11 1H2' T 2 2.337 -8.825 22.968 120 H1* T 11 H1* T 2 0.947 -9.015 24.988 121 H3 T 11 H3 T 2 -2.345 -6.262 23.490 122 1H5M T 11 1H5M T 2 2.116 -3.339 23.379 123 2H5M T 11 2H5M T 2 0.535 -2.572 23.204 124 3H5M T 11 3H5M T 2 1.221 -2.783 24.823 125 H6 T 11 H6 T 2 2.271 -5.510 24.619 126 1H5* G 12 1H5' G 3 1.243 -12.245 21.323 127 2H5* G 12 2H5' G 3 2.007 -10.660 21.064 128 H4* G 12 H4* G 3 -0.854 -11.032 22.036 129 H3* G 12 H3* G 3 0.049 -11.501 19.399 130 H1* G 12 H1* G 3 -1.747 -8.442 20.665 131 H8 G 12 H8 G 3 2.046 -7.552 20.315 132 H1 G 12 H1 G 3 -1.961 -2.499 20.272 133 1H2 G 12 1H2 G 3 -4.342 -5.024 20.481 134 2H2 G 12 2H2 G 3 -4.048 -3.272 20.430 135 2H2* G 12 1H2' G 3 -0.894 -9.115 18.461 136 1H2* G 12 2H2' G 3 0.762 -9.263 19.096 137 1H5* G 13 1H5' G 4 -4.305 -9.571 19.968 138 2H5* G 13 2H5' G 4 -5.344 -10.520 18.889 139 H4* G 13 H4* G 4 -6.180 -8.289 18.996 140 H3* G 13 H3* G 4 -5.533 -9.510 16.513 141 H1* G 13 H1* G 4 -5.402 -5.917 17.456 142 H8 G 13 H8 G 4 -1.644 -7.073 17.322 143 H1 G 13 H1 G 4 -2.672 -0.711 17.080 144 1H2 G 13 1H2 G 4 -5.990 -1.785 17.214 145 2H2 G 13 2H2 G 4 -4.911 -0.379 17.148 146 2H2* G 13 1H2' G 4 -4.878 -7.117 15.368 147 1H2* G 13 2H2' G 4 -3.641 -8.093 16.210 148 1H5* A 14 1H5' A 5 -8.269 -5.434 16.584 149 2H5* A 14 2H5' A 5 -9.543 -5.849 15.423 150 H4* A 14 H4* A 5 -9.223 -3.497 15.351 151 H3* A 14 H3* A 5 -9.017 -5.077 13.015 152 H1* A 14 H1* A 5 -7.132 -1.930 13.825 153 H8 A 14 H8 A 5 -4.672 -4.949 14.255 154 1H6 A 14 1H6 A 5 -0.308 -0.522 13.788 155 2H6 A 14 2H6 A 5 -0.533 -2.259 14.055 156 H2 A 14 H2 A 5 -4.155 1.428 13.566 157 2H2* A 14 1H2' A 5 -7.132 -3.448 11.893 158 1H2* A 14 2H2' A 5 -6.662 -4.826 12.919 159 1H5* T 15 1H5' T 6 -9.500 -0.261 12.648 160 2H5* T 15 2H5' T 6 -10.657 -0.064 11.319 161 H4* T 15 H4* T 6 -9.170 1.836 11.414 162 H3* T 15 H3* T 6 -9.626 0.378 9.041 163 1H2* T 15 2H2' T 6 -7.506 -0.657 9.118 164 2H2* T 15 1H2' T 6 -7.086 0.752 8.125 165 H1* T 15 H1* T 6 -6.490 2.060 10.112 166 H3 T 15 H3 T 6 -2.123 0.863 10.294 167 1H5M T 15 1H5M T 6 -3.559 -3.714 9.721 168 2H5M T 15 2H5M T 6 -3.611 -3.677 11.484 169 3H5M T 15 3H5M T 6 -5.115 -3.735 10.555 170 H6 T 15 H6 T 6 -6.206 -1.669 10.638 171 1H5* C 16 1H5' C 7 -7.634 4.827 8.811 172 2H5* C 16 2H5' C 7 -8.432 5.545 7.400 173 H4* C 16 H4* C 7 -6.230 6.506 7.736 174 H3* C 16 H3* C 7 -7.113 5.563 5.250 175 H1* C 16 H1* C 7 -3.633 5.300 6.602 176 1H4 C 16 1H4 C 7 -2.215 -1.207 7.334 177 2H4 C 16 2H4 C 7 -0.752 -0.246 7.028 178 H5 C 16 H5 C 7 -4.402 -0.079 7.400 179 H6 C 16 H6 C 7 -5.492 2.086 7.232 180 2H2* C 16 1H2' C 7 -4.677 4.592 4.515 181 1H2* C 16 2H2' C 7 -5.852 3.576 5.360 182 1H5* C 17 1H5' C 8 -2.908 7.989 5.470 183 2H5* C 17 2H5' C 8 -3.080 9.157 4.148 184 H4* C 17 H4* C 8 -0.752 8.656 4.507 185 H3* C 17 H3* C 8 -1.954 8.530 1.971 186 H1* C 17 H1* C 8 0.750 6.269 3.267 187 1H4 C 17 1H4 C 8 -1.753 0.115 4.022 188 2H4 C 17 2H4 C 8 -0.003 0.070 3.719 189 H5 C 17 H5 C 8 -2.950 2.258 3.884 190 H6 C 17 H6 C 8 -2.621 4.668 3.680 191 2H2* C 17 1H2' C 8 -0.433 6.423 1.148 192 1H2* C 17 2H2' C 8 -2.009 6.175 1.932 193 1H5* T 18 1H5' T 9 2.765 7.892 2.322 194 2H5* T 18 2H5' T 9 3.448 8.997 1.116 195 H4* T 18 H4* T 9 4.901 7.094 1.369 196 H3* T 18 H3* T 9 3.940 7.923 -1.169 197 1H2* T 18 2H2' T 9 2.465 6.071 -1.370 198 2H2* T 18 1H2' T 9 3.931 5.389 -2.140 199 H1* T 18 H1* T 9 4.714 4.486 -0.011 200 H3 T 18 H3 T 9 2.595 0.484 0.002 201 1H5M T 18 1H5M T 9 -1.601 2.701 0.822 202 2H5M T 18 2H5M T 9 -1.277 4.355 0.283 203 3H5M T 18 3H5M T 9 -1.496 3.067 -0.905 204 H6 T 18 H6 T 9 0.982 5.020 0.013
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