NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
6291 | 1ir5 | 5243 | cing | 1-original | 9 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H5* C 1 1H5' C 1 0.632 -6.293 -4.309 2 2H5* C 1 2H5' C 1 2.015 -7.064 -3.515 3 H4* C 1 H4' C 1 2.779 -5.038 -4.593 4 H3* C 1 H3' C 1 3.219 -5.496 -1.817 5 H1* C 1 H1' C 1 2.607 -2.180 -3.543 6 1H4 C 1 1H4 C 1 -2.974 0.523 -1.209 7 2H4 C 1 2H4 C 1 -1.785 1.696 -1.837 8 H5 C 1 H5 C 1 -2.320 -1.903 -1.252 9 H6 C 1 H6 C 1 -0.503 -3.423 -1.905 10 H5T C 1 H5T C 1 0.162 -7.020 -2.194 11 2H2* C 1 1H2' C 1 3.136 -2.842 -1.247 12 1H2* C 1 2H2' C 1 1.634 -3.818 -1.166 13 1H5* A 2 1H5' A 2 5.119 -1.595 -3.754 14 2H5* A 2 2H5' A 2 6.734 -1.472 -3.027 15 H4* A 2 H4' A 2 5.799 0.770 -3.270 16 H3* A 2 H3' A 2 6.673 -0.288 -0.720 17 H1* A 2 H1' A 2 4.008 2.261 -1.545 18 H8 A 2 H8 A 2 2.304 -0.965 -0.117 19 1H6 A 2 1H6 A 2 -2.112 1.228 0.758 20 2H6 A 2 2H6 A 2 -2.557 2.920 0.421 21 H2 A 2 H2 A 2 0.605 5.140 -1.286 22 2H2* A 2 1H2' A 2 5.017 1.488 0.544 23 1H2* A 2 2H2' A 2 4.482 -0.187 0.206 24 1H5* C 3 1H5' C 3 5.825 4.434 -1.124 25 2H5* C 3 2H5' C 3 7.071 5.182 -0.102 26 H4* C 3 H4' C 3 4.970 6.424 0.177 27 H3* C 3 H3' C 3 5.816 4.663 2.513 28 H1* C 3 H1' C 3 2.492 6.242 1.240 29 1H4 C 3 1H4 C 3 -0.771 0.871 3.195 30 2H4 C 3 2H4 C 3 -1.659 2.384 3.513 31 H5 C 3 H5 C 3 1.568 1.070 2.337 32 H6 C 3 H6 C 3 3.266 2.709 1.655 33 2H2* C 3 1H2' C 3 3.830 6.845 2.992 34 1H2* C 3 2H2' C 3 3.871 5.175 3.619 35 1H5* T 4 1H5' T 4 4.732 8.925 2.763 36 2H5* T 4 2H5' T 4 5.601 9.799 4.041 37 H4* T 4 H4' T 4 3.198 10.408 3.998 38 H3* T 4 H3' T 4 4.600 9.546 6.374 39 1H2* T 4 2H2' T 4 3.325 7.568 6.603 40 2H2* T 4 1H2' T 4 2.218 8.712 7.433 41 H1* T 4 H1' T 4 0.945 9.030 5.383 42 H3 T 4 H3 T 4 -1.672 5.385 5.594 43 1H5M T 4 1H5M T 4 1.964 2.472 4.864 44 2H5M T 4 2H5M T 4 2.644 3.438 3.546 45 3H5M T 4 3H5M T 4 3.355 3.512 5.173 46 H6 T 4 H6 T 4 3.053 6.014 4.939 47 1H5* A 5 1H5' A 5 0.222 10.920 6.620 48 2H5* A 5 2H5' A 5 0.239 12.219 7.828 49 H4* A 5 H4' A 5 -1.904 11.071 7.930 50 H3* A 5 H3' A 5 -0.154 11.345 10.218 51 H1* A 5 H1' A 5 -2.639 8.561 9.383 52 H8 A 5 H8 A 5 1.066 7.325 9.219 53 1H6 A 5 1H6 A 5 -1.677 1.726 9.512 54 2H6 A 5 2H6 A 5 -0.060 2.467 9.428 55 H2 A 5 H2 A 5 -4.774 4.616 9.510 56 2H2* A 5 1H2' A 5 -1.364 9.164 11.363 57 1H2* A 5 2H2' A 5 0.169 9.023 10.454 58 1H5* C 6 1H5' C 6 -4.672 10.190 10.468 59 2H5* C 6 2H5' C 6 -5.331 11.139 11.817 60 H4* C 6 H4' C 6 -6.568 9.007 11.557 61 H3* C 6 H3' C 6 -5.288 9.866 14.041 62 H1* C 6 H1' C 6 -6.052 6.394 12.621 63 1H4 C 6 1H4 C 6 -1.399 2.360 13.476 64 2H4 C 6 2H4 C 6 -0.160 3.343 12.657 65 H5 C 6 H5 C 6 -0.744 5.649 11.946 66 H6 C 6 H6 C 6 -2.593 7.242 11.824 67 2H2* C 6 1H2' C 6 -5.461 7.232 14.833 68 1H2* C 6 2H2' C 6 -3.954 7.946 14.184 69 1H5* T 7 1H5' T 7 -8.217 6.292 14.090 70 2H5* T 7 2H5' T 7 -9.299 6.529 15.479 71 H4* T 7 H4' T 7 -8.727 4.145 15.242 72 H3* T 7 H3' T 7 -8.098 5.695 17.690 73 1H2* T 7 2H2' T 7 -5.934 4.897 17.799 74 2H2* T 7 1H2' T 7 -6.693 3.371 18.333 75 H1* T 7 H1' T 7 -6.660 2.516 16.068 76 H3 T 7 H3 T 7 -2.382 1.256 15.598 77 1H5M T 7 1H5M T 7 -1.986 6.368 16.890 78 2H5M T 7 2H5M T 7 -0.805 5.691 15.756 79 3H5M T 7 3H5M T 7 -2.248 6.509 15.139 80 H6 T 7 H6 T 7 -4.493 5.532 16.251 81 1H5* C 8 1H5' C 8 -9.613 1.135 17.645 82 2H5* C 8 2H5' C 8 -10.361 0.848 19.231 83 H4* C 8 H4' C 8 -9.210 -1.205 18.432 84 H3* C 8 H3' C 8 -7.920 0.235 20.794 85 H1* C 8 H1' C 8 -6.286 -2.042 18.107 86 1H4 C 8 1H4 C 8 -0.903 0.693 19.202 87 2H4 C 8 2H4 C 8 -1.563 2.324 19.440 88 H5 C 8 H5 C 8 -4.018 2.649 19.387 89 H6 C 8 H6 C 8 -6.141 1.454 19.137 90 2H2* C 8 1H2' C 8 -7.433 -2.649 19.999 91 1H2* C 8 2H2' C 8 -6.347 -1.545 20.893 92 1H5* T 9 1H5' T 9 -8.636 -3.812 20.437 93 2H5* T 9 2H5' T 9 -9.382 -4.627 21.826 94 H4* T 9 H4' T 9 -7.589 -6.004 20.724 95 H3* T 9 H3' T 9 -7.946 -5.722 23.498 96 1H2* T 9 2H2' T 9 -6.224 -4.053 23.712 97 2H2* T 9 1H2' T 9 -5.305 -5.552 24.062 98 H1* T 9 H1' T 9 -4.553 -5.682 21.758 99 H3 T 9 H3 T 9 -1.146 -2.758 21.839 100 1H5M T 9 1H5M T 9 -5.149 -0.007 23.899 101 2H5M T 9 2H5M T 9 -3.936 0.860 22.945 102 3H5M T 9 3H5M T 9 -5.429 0.308 22.173 103 H6 T 9 H6 T 9 -5.872 -2.310 22.633 104 1H5* T 10 1H5' T 10 -4.170 -7.785 21.911 105 2H5* T 10 2H5' T 10 -3.920 -9.287 22.826 106 H4* T 10 H4' T 10 -1.749 -8.276 22.251 107 H3* T 10 H3' T 10 -2.537 -8.937 24.966 108 1H2* T 10 2H2' T 10 -2.410 -6.683 25.680 109 2H2* T 10 1H2' T 10 -0.684 -7.120 25.863 110 H1* T 10 H1' T 10 -0.202 -6.275 23.619 111 H3 T 10 H3 T 10 0.427 -2.029 24.957 112 1H5M T 10 1H5M T 10 -4.805 -2.473 24.507 113 2H5M T 10 2H5M T 10 -4.626 -2.965 26.206 114 3H5M T 10 3H5M T 10 -4.165 -1.333 25.700 115 H6 T 10 H6 T 10 -3.469 -4.839 24.632 116 1H5* T 11 1H5' T 11 1.857 -7.771 23.848 117 2H5* T 11 2H5' T 11 2.851 -9.021 24.624 118 H4* T 11 H4' T 11 4.084 -6.903 24.593 119 H3* T 11 H3' T 11 3.596 -8.408 27.003 120 1H2* T 11 2H2' T 11 2.174 -6.722 27.907 121 2H2* T 11 1H2' T 11 3.765 -6.135 28.488 122 H1* T 11 H1' T 11 3.969 -4.677 26.530 123 H3 T 11 H3 T 11 1.707 -1.356 28.591 124 1H5M T 11 1H5M T 11 -2.005 -5.013 27.734 125 2H5M T 11 2H5M T 11 -2.453 -3.308 27.584 126 3H5M T 11 3H5M T 11 -1.988 -4.223 26.143 127 H6 T 11 H6 T 11 0.382 -5.495 26.522 128 1H5* G 12 1H5' G 12 6.614 -4.816 26.522 129 2H5* G 12 2H5' G 12 8.063 -5.476 27.301 130 H4* G 12 H4' G 12 8.141 -3.024 27.356 131 H3* G 12 H3' G 12 8.478 -4.648 29.683 132 H1* G 12 H1' G 12 6.903 -1.239 29.440 133 H8 G 12 H8 G 12 4.024 -3.846 29.896 134 H1 G 12 H1 G 12 2.450 2.273 31.083 135 1H2 G 12 1H2 G 12 4.269 3.552 30.849 136 2H2 G 12 2H2 G 12 5.794 2.786 30.378 137 2H2* G 12 1H2' G 12 7.380 -2.775 31.295 138 1H2* G 12 2H2' G 12 6.323 -4.021 30.555 139 1H5* T 13 1H5' T 13 8.858 -0.002 29.494 140 2H5* T 13 2H5' T 13 10.486 0.222 30.163 141 H4* T 13 H4' T 13 9.182 2.292 30.376 142 H3* T 13 H3' T 13 10.604 1.046 32.519 143 1H2* T 13 2H2' T 13 8.616 0.366 33.634 144 2H2* T 13 1H2' T 13 8.847 1.987 34.369 145 H1* T 13 H1' T 13 7.302 2.965 32.746 146 H3 T 13 H3 T 13 3.734 1.807 35.285 147 1H5M T 13 1H5M T 13 4.543 -2.299 32.077 148 2H5M T 13 2H5M T 13 5.544 -2.813 33.451 149 3H5M T 13 3H5M T 13 3.797 -2.612 33.651 150 H6 T 13 H6 T 13 6.677 -0.625 32.360 151 1H5* A 14 1H5' A 14 8.550 5.175 32.980 152 2H5* A 14 2H5' A 14 9.753 6.234 33.744 153 H4* A 14 H4' A 14 7.463 6.920 34.360 154 H3* A 14 H3' A 14 9.556 6.318 36.302 155 H1* A 14 H1' A 14 5.768 6.088 36.495 156 H8 A 14 H8 A 14 7.327 2.490 36.612 157 1H6 A 14 1H6 A 14 1.773 1.131 39.124 158 2H6 A 14 2H6 A 14 3.317 0.353 38.699 159 H2 A 14 H2 A 14 1.744 5.269 38.224 160 2H2* A 14 1H2' A 14 7.552 6.005 38.155 161 1H2* A 14 2H2' A 14 8.295 4.607 37.319 162 1H5* G 15 1H5' G 15 5.625 8.584 37.419 163 2H5* G 15 2H5' G 15 6.199 10.009 38.309 164 H4* G 15 H4' G 15 3.981 9.318 39.140 165 H3* G 15 H3' G 15 6.305 9.649 40.858 166 H1* G 15 H1' G 15 3.230 7.493 41.156 167 H8 G 15 H8 G 15 6.322 5.182 40.505 168 H1 G 15 H1 G 15 1.136 2.277 42.960 169 1H2 G 15 1H2 G 15 -0.162 5.480 42.820 170 2H2 G 15 2H2 G 15 -0.472 3.794 43.259 171 2H2* G 15 1H2' G 15 5.082 8.035 42.684 172 1H2* G 15 2H2' G 15 6.252 7.361 41.504 173 1H5* T 16 1H5' T 16 1.831 9.342 42.356 174 2H5* T 16 2H5' T 16 1.702 10.593 43.608 175 H4* T 16 H4' T 16 0.173 8.717 44.090 176 H3* T 16 H3' T 16 2.206 9.667 45.980 177 1H2* T 16 2H2' T 16 3.144 7.526 46.215 178 2H2* T 16 1H2' T 16 1.746 7.277 47.306 179 H1* T 16 H1' T 16 0.450 6.319 45.469 180 H3 T 16 H3 T 16 2.397 2.315 46.427 181 1H5M T 16 1H5M T 16 5.897 3.175 43.394 182 2H5M T 16 2H5M T 16 5.114 4.407 42.393 183 3H5M T 16 3H5M T 16 6.140 4.891 43.758 184 H6 T 16 H6 T 16 3.691 6.150 43.828 185 1H5* G 17 1H5' G 17 -1.140 6.878 47.438 186 2H5* G 17 2H5' G 17 -1.796 7.609 48.917 187 H4* G 17 H4' G 17 -1.725 5.173 49.174 188 H3* G 17 H3' G 17 -0.398 6.989 51.021 189 H1* G 17 H1' G 17 0.300 3.421 50.032 190 H8 G 17 H8 G 17 3.378 5.651 49.161 191 H1 G 17 H1 G 17 4.179 -0.673 48.304 192 1H2 G 17 1H2 G 17 0.840 -0.755 49.204 193 2H2 G 17 2H2 G 17 2.246 -1.711 48.713 194 H3T G 17 H3T G 17 -2.150 5.562 51.482 195 2H2* G 17 1H2' G 17 1.205 4.893 51.779 196 1H2* G 17 2H2' G 17 1.743 6.064 50.533 197 1H5* C 1 1H5' C 1 6.921 -7.888 47.599 198 2H5* C 1 2H5' C 1 6.064 -9.156 46.695 199 H4* C 1 H4' C 1 4.615 -7.947 48.383 200 H3* C 1 H3' C 1 3.904 -8.400 45.573 201 H1* C 1 H1' C 1 2.942 -5.717 48.123 202 1H4 C 1 1H4 C 1 4.568 0.167 45.581 203 2H4 C 1 2H4 C 1 3.042 0.175 46.507 204 H5 C 1 H5 C 1 5.707 -2.060 45.271 205 H6 C 1 H6 C 1 5.510 -4.436 45.816 206 H5T C 1 H5T C 1 6.219 -6.493 45.815 207 2H2* C 1 1H2' C 1 2.012 -6.423 45.967 208 1H2* C 1 2H2' C 1 3.580 -6.110 45.175 209 1H5* A 2 1H5' A 2 0.788 -6.938 48.458 210 2H5* A 2 2H5' A 2 -0.752 -7.787 48.194 211 H4* A 2 H4' A 2 -1.212 -5.417 48.577 212 H3* A 2 H3' A 2 -2.059 -6.775 46.170 213 H1* A 2 H1' A 2 -1.050 -3.135 46.683 214 H8 A 2 H8 A 2 1.376 -4.992 44.239 215 1H6 A 2 1H6 A 2 3.795 0.727 43.616 216 2H6 A 2 2H6 A 2 3.965 -0.922 42.965 217 H2 A 2 H2 A 2 0.742 0.986 46.552 218 2H2* A 2 1H2' A 2 -2.085 -4.364 44.862 219 1H2* A 2 2H2' A 2 -0.677 -5.464 44.762 220 1H5* C 3 1H5' C 3 -3.552 -2.567 47.462 221 2H5* C 3 2H5' C 3 -5.265 -2.398 47.026 222 H4* C 3 H4' C 3 -4.072 -0.236 46.809 223 H3* C 3 H3' C 3 -5.579 -1.480 44.622 224 H1* C 3 H1' C 3 -2.624 0.931 44.709 225 1H4 C 3 1H4 C 3 2.318 -1.855 41.292 226 2H4 C 3 2H4 C 3 2.424 -0.079 41.427 227 H5 C 3 H5 C 3 0.306 -2.964 42.287 228 H6 C 3 H6 C 3 -1.740 -2.509 43.570 229 2H2* C 3 1H2' C 3 -4.205 0.274 42.977 230 1H2* C 3 2H2' C 3 -3.739 -1.444 43.171 231 1H5* T 4 1H5' T 4 -4.508 3.040 44.796 232 2H5* T 4 2H5' T 4 -5.955 3.931 44.279 233 H4* T 4 H4' T 4 -3.879 5.107 43.594 234 H3* T 4 H3' T 4 -6.021 4.372 41.738 235 1H2* T 4 2H2' T 4 -4.581 3.124 40.371 236 2H2* T 4 1H2' T 4 -4.156 4.749 39.740 237 H1* T 4 H1' T 4 -2.263 4.879 41.271 238 H3 T 4 H3 T 4 0.094 2.559 38.131 239 1H5M T 4 1H5M T 4 -2.799 -1.156 40.455 240 2H5M T 4 2H5M T 4 -1.109 -1.545 40.101 241 3H5M T 4 3H5M T 4 -1.565 -0.987 41.719 242 H6 T 4 H6 T 4 -2.897 1.311 41.690 243 1H5* A 5 1H5' A 5 -2.597 7.135 40.713 244 2H5* A 5 2H5' A 5 -3.243 8.588 39.924 245 H4* A 5 H4' A 5 -1.044 8.017 38.991 246 H3* A 5 H3' A 5 -3.498 8.104 37.312 247 H1* A 5 H1' A 5 -0.063 6.389 37.045 248 H8 A 5 H8 A 5 -3.078 3.914 37.256 249 1H6 A 5 1H6 A 5 -0.656 0.047 35.199 250 2H6 A 5 2H6 A 5 1.018 0.027 34.591 251 H2 A 5 H2 A 5 2.970 3.744 35.028 252 2H2* A 5 1H2' A 5 -1.692 7.116 35.410 253 1H2* A 5 2H2' A 5 -2.970 6.159 36.216 254 1H5* C 6 1H5' C 6 0.821 9.376 35.931 255 2H5* C 6 2H5' C 6 0.645 10.655 34.709 256 H4* C 6 H4' C 6 2.563 9.167 34.178 257 H3* C 6 H3' C 6 0.249 9.513 32.324 258 H1* C 6 H1' C 6 2.934 6.783 32.900 259 1H4 C 6 1H4 C 6 -0.881 1.386 33.529 260 2H4 C 6 2H4 C 6 0.817 1.017 33.133 261 H5 C 6 H5 C 6 -1.546 3.788 33.678 262 H6 C 6 H6 C 6 -0.663 6.072 33.520 263 2H2* C 6 1H2' C 6 1.757 7.546 30.970 264 1H2* C 6 2H2' C 6 0.180 7.290 31.771 265 1H5* A 7 1H5' A 7 4.077 7.962 31.298 266 2H5* A 7 2H5' A 7 4.871 8.972 30.073 267 H4* A 7 H4' A 7 5.552 6.593 29.871 268 H3* A 7 H3' A 7 4.545 8.205 27.683 269 H1* A 7 H1' A 7 4.317 4.453 28.334 270 H8 A 7 H8 A 7 0.809 6.128 28.757 271 1H6 A 7 1H6 A 7 -1.162 0.274 27.831 272 2H6 A 7 2H6 A 7 -1.797 1.906 28.155 273 H2 A 7 H2 A 7 3.065 0.212 27.568 274 2H2* A 7 1H2' A 7 3.873 5.867 26.397 275 1H2* A 7 2H2' A 7 2.672 6.811 27.331 276 1H5* A 8 1H5' A 8 7.241 4.397 27.204 277 2H5* A 8 2H5' A 8 8.426 4.858 25.964 278 H4* A 8 H4' A 8 8.061 2.382 26.082 279 H3* A 8 H3' A 8 8.027 3.960 23.656 280 H1* A 8 H1' A 8 6.072 0.792 24.568 281 H8 A 8 H8 A 8 3.738 3.934 24.545 282 1H6 A 8 1H6 A 8 -0.472 1.400 23.609 283 2H6 A 8 2H6 A 8 -0.643 -0.359 23.386 284 H2 A 8 H2 A 8 3.036 -2.413 23.708 285 2H2* A 8 1H2' A 8 6.494 1.986 22.500 286 1H2* A 8 2H2' A 8 5.761 3.469 23.180 287 1H5* A 9 1H5' A 9 8.077 -0.715 23.494 288 2H5* A 9 2H5' A 9 9.401 -1.092 22.374 289 H4* A 9 H4' A 9 7.624 -2.801 22.222 290 H3* A 9 H3' A 9 8.640 -1.313 19.934 291 H1* A 9 H1' A 9 5.222 -2.870 20.612 292 H8 A 9 H8 A 9 5.091 1.009 20.183 293 1H6 A 9 1H6 A 9 -1.070 0.045 20.391 294 2H6 A 9 2H6 A 9 0.110 1.357 20.150 295 H2 A 9 H2 A 9 0.775 -3.720 20.935 296 2H2* A 9 1H2' A 9 6.313 -1.987 18.626 297 1H2* A 9 2H2' A 9 6.531 -0.398 19.422 298 1H5* G 10 1H5' G 10 6.441 -5.433 19.748 299 2H5* G 10 2H5' G 10 7.224 -6.380 18.468 300 H4* G 10 H4' G 10 4.828 -6.990 18.738 301 H3* G 10 H3' G 10 6.073 -6.385 16.218 302 H1* G 10 H1' G 10 2.520 -5.729 17.337 303 H8 G 10 H8 G 10 4.401 -2.375 16.664 304 H1 G 10 H1 G 10 -1.868 -1.804 17.973 305 1H2 G 10 1H2 G 10 -1.618 -5.228 18.423 306 2H2 G 10 2H2 G 10 -2.697 -3.826 18.452 307 2H2* G 10 1H2' G 10 3.705 -5.484 15.218 308 1H2* G 10 2H2' G 10 4.862 -4.341 15.970 309 1H5* A 11 1H5' A 11 1.789 -7.898 16.878 310 2H5* A 11 2H5' A 11 1.430 -9.140 15.662 311 H4* A 11 H4' A 11 -0.618 -7.926 16.392 312 H3* A 11 H3' A 11 0.148 -8.347 13.631 313 H1* A 11 H1' A 11 -1.794 -5.490 15.266 314 H8 A 11 H8 A 11 1.790 -4.334 14.270 315 1H6 A 11 1H6 A 11 -0.843 1.327 14.485 316 2H6 A 11 2H6 A 11 0.732 0.550 14.189 317 H2 A 11 H2 A 11 -3.890 -1.486 15.340 318 2H2* A 11 1H2' A 11 -1.383 -6.174 12.957 319 1H2* A 11 2H2' A 11 0.385 -6.030 13.208 320 1H5* G 12 1H5' G 12 -4.084 -6.857 14.941 321 2H5* G 12 2H5' G 12 -5.244 -7.800 13.983 322 H4* G 12 H4' G 12 -6.127 -5.538 14.476 323 H3* G 12 H3' G 12 -5.854 -6.616 11.750 324 H1* G 12 H1' G 12 -5.936 -3.093 13.211 325 H8 G 12 H8 G 12 -2.389 -3.911 11.790 326 H1 G 12 H1 G 12 -3.938 2.328 11.943 327 1H2 G 12 1H2 G 12 -6.904 1.093 13.222 328 2H2 G 12 2H2 G 12 -5.999 2.544 12.772 329 2H2* G 12 1H2' G 12 -6.276 -3.990 10.972 330 1H2* G 12 2H2' G 12 -4.657 -4.756 11.009 331 1H5* T 13 1H5' T 13 -8.706 -2.937 12.279 332 2H5* T 13 2H5' T 13 -10.077 -3.227 11.185 333 H4* T 13 H4' T 13 -9.330 -0.906 10.905 334 H3* T 13 H3' T 13 -8.760 -2.857 8.655 335 1H2* T 13 2H2' T 13 -7.238 -1.468 7.720 336 2H2* T 13 1H2' T 13 -8.336 -0.067 7.844 337 H1* T 13 H1' T 13 -7.441 0.580 9.893 338 H3 T 13 H3 T 13 -3.258 1.782 8.838 339 1H5M T 13 1H5M T 13 -1.803 -2.677 8.516 340 2H5M T 13 2H5M T 13 -2.970 -3.439 9.606 341 3H5M T 13 3H5M T 13 -3.281 -3.394 7.856 342 H6 T 13 H6 T 13 -5.452 -2.487 9.240 343 1H5* A 14 1H5' A 14 -10.552 1.365 7.969 344 2H5* A 14 2H5' A 14 -11.616 1.254 6.552 345 H4* A 14 H4' A 14 -10.304 3.305 6.371 346 H3* A 14 H3' A 14 -10.347 1.344 4.301 347 H1* A 14 H1' A 14 -7.552 3.587 5.309 348 H8 A 14 H8 A 14 -6.312 -0.046 5.838 349 1H6 A 14 1H6 A 14 -1.649 1.264 7.093 350 2H6 A 14 2H6 A 14 -1.032 2.910 7.380 351 H2 A 14 H2 A 14 -3.983 5.883 6.806 352 2H2* A 14 1H2' A 14 -7.780 1.841 3.580 353 1H2* A 14 2H2' A 14 -8.090 0.610 4.848 354 1H5* G 15 1H5' G 15 -10.010 6.000 5.304 355 2H5* G 15 2H5' G 15 -11.267 7.073 4.655 356 H4* G 15 H4' G 15 -9.175 8.292 4.512 357 H3* G 15 H3' G 15 -10.664 7.760 2.163 358 H1* G 15 H1' G 15 -6.871 7.682 2.431 359 H8 G 15 H8 G 15 -8.320 4.213 1.539 360 H1 G 15 H1 G 15 -1.974 4.244 2.577 361 1H2 G 15 1H2 G 15 -2.592 7.534 3.452 362 2H2 G 15 2H2 G 15 -1.361 6.275 3.273 363 2H2* G 15 1H2' G 15 -8.471 7.373 0.618 364 1H2* G 15 2H2' G 15 -9.205 5.977 1.470 365 1H5* T 16 1H5' T 16 -6.516 9.794 1.667 366 2H5* T 16 2H5' T 16 -6.754 11.137 0.530 367 H4* T 16 H4' T 16 -4.552 10.156 0.156 368 H3* T 16 H3' T 16 -6.643 10.045 -1.971 369 1H2* T 16 2H2' T 16 -6.056 7.891 -2.557 370 2H2* T 16 1H2' T 16 -4.549 8.605 -3.200 371 H1* T 16 H1' T 16 -3.410 8.202 -1.103 372 H3 T 16 H3 T 16 -2.289 3.902 -1.410 373 1H5M T 16 1H5M T 16 -6.752 2.467 -1.747 374 2H5M T 16 2H5M T 16 -7.565 3.777 -0.882 375 3H5M T 16 3H5M T 16 -7.395 3.846 -2.650 376 H6 T 16 H6 T 16 -6.531 6.182 -1.446 377 1H5* G 17 1H5' G 17 -2.159 10.027 -2.948 378 2H5* G 17 2H5' G 17 -1.914 11.049 -4.379 379 H4* G 17 H4' G 17 -0.523 9.049 -4.584 380 H3* G 17 H3' G 17 -2.499 9.775 -6.583 381 H1* G 17 H1' G 17 -1.081 6.445 -5.547 382 H8 G 17 H8 G 17 -4.942 6.367 -5.281 383 H1 G 17 H1 G 17 -1.960 1.002 -3.355 384 1H2 G 17 1H2 G 17 0.865 2.922 -3.906 385 2H2 G 17 2H2 G 17 0.246 1.345 -3.397 386 H3T G 17 H3T G 17 -0.243 8.044 -6.708 387 2H2* G 17 1H2' G 17 -2.549 7.153 -7.386 388 1H2* G 17 2H2' G 17 -3.748 7.774 -6.207 Start of MODEL 2 1 1H5* C 1 1H5' C 1 1.148 -5.918 -3.004 2 2H5* C 1 2H5' C 1 0.995 -6.171 -4.753 3 H4* C 1 H4' C 1 3.193 -5.064 -5.112 4 H3* C 1 H3' C 1 3.737 -5.496 -2.379 5 H1* C 1 H1' C 1 3.125 -2.129 -3.975 6 1H4 C 1 1H4 C 1 -2.428 0.564 -1.566 7 2H4 C 1 2H4 C 1 -1.209 1.744 -2.120 8 H5 C 1 H5 C 1 -1.818 -1.868 -1.718 9 H6 C 1 H6 C 1 -0.022 -3.390 -2.426 10 H5T C 1 H5T C 1 2.920 -7.404 -4.653 11 2H2* C 1 1H2' C 1 3.630 -2.884 -1.703 12 1H2* C 1 2H2' C 1 2.119 -3.847 -1.664 13 1H5* A 2 1H5' A 2 5.517 -1.484 -4.237 14 2H5* A 2 2H5' A 2 7.139 -1.348 -3.530 15 H4* A 2 H4' A 2 6.161 0.879 -3.668 16 H3* A 2 H3' A 2 7.051 -0.266 -1.156 17 H1* A 2 H1' A 2 4.348 2.273 -1.898 18 H8 A 2 H8 A 2 2.709 -1.025 -0.566 19 1H6 A 2 1H6 A 2 -2.236 2.732 0.088 20 2H6 A 2 2H6 A 2 -1.740 1.045 0.373 21 H2 A 2 H2 A 2 0.886 5.076 -1.559 22 2H2* A 2 1H2' A 2 5.373 1.452 0.163 23 1H2* A 2 2H2' A 2 4.863 -0.220 -0.226 24 1H5* C 3 1H5' C 3 6.019 4.356 -1.513 25 2H5* C 3 2H5' C 3 7.224 5.192 -0.510 26 H4* C 3 H4' C 3 5.042 6.317 -0.265 27 H3* C 3 H3' C 3 6.061 4.709 2.109 28 H1* C 3 H1' C 3 2.622 6.030 0.846 29 1H4 C 3 1H4 C 3 -0.425 0.543 2.819 30 2H4 C 3 2H4 C 3 -1.394 2.017 3.080 31 H5 C 3 H5 C 3 1.923 0.837 2.020 32 H6 C 3 H6 C 3 3.559 2.541 1.348 33 2H2* C 3 1H2' C 3 3.900 6.688 2.633 34 1H2* C 3 2H2' C 3 4.086 5.010 3.212 35 1H5* T 4 1H5' T 4 4.544 8.826 2.206 36 2H5* T 4 2H5' T 4 5.337 9.845 3.425 37 H4* T 4 H4' T 4 2.890 10.218 3.400 38 H3* T 4 H3' T 4 4.399 9.554 5.791 39 1H2* T 4 2H2' T 4 3.245 7.533 6.149 40 2H2* T 4 1H2' T 4 2.064 8.649 6.909 41 H1* T 4 H1' T 4 0.776 8.747 4.846 42 H3 T 4 H3 T 4 -1.495 4.908 5.511 43 1H5M T 4 1H5M T 4 3.610 3.420 4.788 44 2H5M T 4 2H5M T 4 2.293 2.269 4.559 45 3H5M T 4 3H5M T 4 2.837 3.259 3.196 46 H6 T 4 H6 T 4 3.084 5.895 4.411 47 1H5* A 5 1H5' A 5 -0.037 10.668 5.989 48 2H5* A 5 2H5' A 5 -0.090 12.031 7.123 49 H4* A 5 H4' A 5 -2.170 10.801 7.305 50 H3* A 5 H3' A 5 -0.401 11.220 9.566 51 H1* A 5 H1' A 5 -2.819 8.344 8.851 52 H8 A 5 H8 A 5 0.914 7.199 8.661 53 1H6 A 5 1H6 A 5 -0.078 2.313 9.094 54 2H6 A 5 2H6 A 5 -1.679 1.552 9.266 55 H2 A 5 H2 A 5 -4.835 4.359 9.292 56 2H2* A 5 1H2' A 5 -1.562 9.060 10.804 57 1H2* A 5 2H2' A 5 -0.025 8.921 9.902 58 1H5* C 6 1H5' C 6 -4.916 10.069 9.884 59 2H5* C 6 2H5' C 6 -5.577 11.053 11.208 60 H4* C 6 H4' C 6 -6.806 8.906 10.998 61 H3* C 6 H3' C 6 -5.523 9.831 13.464 62 H1* C 6 H1' C 6 -6.299 6.327 12.113 63 1H4 C 6 1H4 C 6 -1.623 2.355 13.182 64 2H4 C 6 2H4 C 6 -0.392 3.305 12.313 65 H5 C 6 H5 C 6 -0.995 5.560 11.475 66 H6 C 6 H6 C 6 -2.848 7.139 11.289 67 2H2* C 6 1H2' C 6 -5.759 7.212 14.314 68 1H2* C 6 2H2' C 6 -4.230 7.899 13.690 69 1H5* T 7 1H5' T 7 -8.512 6.328 13.626 70 2H5* T 7 2H5' T 7 -9.595 6.616 15.004 71 H4* T 7 H4' T 7 -9.034 4.220 14.834 72 H3* T 7 H3' T 7 -8.428 5.830 17.245 73 1H2* T 7 2H2' T 7 -6.255 5.052 17.382 74 2H2* T 7 1H2' T 7 -7.009 3.540 17.963 75 H1* T 7 H1' T 7 -6.968 2.613 15.724 76 H3 T 7 H3 T 7 -2.686 1.343 15.311 77 1H5M T 7 1H5M T 7 -2.299 6.479 16.502 78 2H5M T 7 2H5M T 7 -1.105 5.776 15.400 79 3H5M T 7 3H5M T 7 -2.537 6.583 14.745 80 H6 T 7 H6 T 7 -4.799 5.633 15.859 81 1H5* C 8 1H5' C 8 -9.990 1.271 17.332 82 2H5* C 8 2H5' C 8 -10.718 1.028 18.934 83 H4* C 8 H4' C 8 -9.592 -1.050 18.138 84 H3* C 8 H3' C 8 -8.304 0.388 20.502 85 H1* C 8 H1' C 8 -6.646 -1.897 17.832 86 1H4 C 8 1H4 C 8 -1.302 0.882 19.043 87 2H4 C 8 2H4 C 8 -1.980 2.510 19.249 88 H5 C 8 H5 C 8 -4.431 2.821 19.106 89 H6 C 8 H6 C 8 -6.541 1.609 18.821 90 2H2* C 8 1H2' C 8 -7.822 -2.497 19.709 91 1H2* C 8 2H2' C 8 -6.738 -1.398 20.612 92 1H5* T 9 1H5' T 9 -8.915 -3.633 20.113 93 2H5* T 9 2H5' T 9 -9.681 -4.479 21.473 94 H4* T 9 H4' T 9 -7.828 -5.805 20.407 95 H3* T 9 H3' T 9 -8.276 -5.564 23.170 96 1H2* T 9 2H2' T 9 -6.598 -3.859 23.456 97 2H2* T 9 1H2' T 9 -5.659 -5.341 23.821 98 H1* T 9 H1' T 9 -4.831 -5.432 21.542 99 H3 T 9 H3 T 9 -1.487 -2.446 21.827 100 1H5M T 9 1H5M T 9 -5.850 0.531 21.869 101 2H5M T 9 2H5M T 9 -5.650 0.251 23.613 102 3H5M T 9 3H5M T 9 -4.409 1.129 22.706 103 H6 T 9 H6 T 9 -6.260 -2.084 22.333 104 1H5* T 10 1H5' T 10 -4.387 -7.502 21.716 105 2H5* T 10 2H5' T 10 -4.159 -9.022 22.606 106 H4* T 10 H4' T 10 -1.977 -7.967 22.167 107 H3* T 10 H3' T 10 -2.899 -8.693 24.827 108 1H2* T 10 2H2' T 10 -2.816 -6.460 25.598 109 2H2* T 10 1H2' T 10 -1.095 -6.886 25.843 110 H1* T 10 H1' T 10 -0.527 -5.983 23.644 111 H3 T 10 H3 T 10 -0.015 -1.757 25.092 112 1H5M T 10 1H5M T 10 -5.116 -2.757 26.059 113 2H5M T 10 2H5M T 10 -4.649 -1.117 25.587 114 3H5M T 10 3H5M T 10 -5.210 -2.258 24.356 115 H6 T 10 H6 T 10 -3.855 -4.604 24.521 116 1H5* T 11 1H5' T 11 1.545 -7.561 23.852 117 2H5* T 11 2H5' T 11 2.501 -8.828 24.648 118 H4* T 11 H4' T 11 3.776 -6.735 24.631 119 H3* T 11 H3' T 11 3.226 -8.225 27.033 120 1H2* T 11 2H2' T 11 1.802 -6.521 27.906 121 2H2* T 11 1H2' T 11 3.388 -5.957 28.524 122 H1* T 11 H1' T 11 3.655 -4.498 26.574 123 H3 T 11 H3 T 11 1.373 -1.199 28.674 124 1H5M T 11 1H5M T 11 -2.771 -3.015 27.381 125 2H5M T 11 2H5M T 11 -2.250 -3.897 25.939 126 3H5M T 11 3H5M T 11 -2.369 -4.734 27.501 127 H6 T 11 H6 T 11 0.067 -5.234 26.396 128 1H5* G 12 1H5' G 12 6.309 -4.689 26.580 129 2H5* G 12 2H5' G 12 7.735 -5.396 27.360 130 H4* G 12 H4' G 12 7.898 -2.947 27.401 131 H3* G 12 H3' G 12 8.203 -4.573 29.725 132 H1* G 12 H1' G 12 6.702 -1.126 29.511 133 H8 G 12 H8 G 12 3.768 -3.677 29.930 134 H1 G 12 H1 G 12 2.315 2.455 31.197 135 1H2 G 12 1H2 G 12 5.671 2.921 30.506 136 2H2 G 12 2H2 G 12 4.155 3.699 30.982 137 2H2* G 12 1H2' G 12 7.146 -2.692 31.349 138 1H2* G 12 2H2' G 12 6.060 -3.905 30.599 139 1H5* T 13 1H5' T 13 8.700 0.051 29.533 140 2H5* T 13 2H5' T 13 10.334 0.246 30.196 141 H4* T 13 H4' T 13 9.053 2.342 30.393 142 H3* T 13 H3' T 13 10.511 1.120 32.514 143 1H2* T 13 2H2' T 13 8.542 0.422 33.660 144 2H2* T 13 1H2' T 13 8.787 2.038 34.401 145 H1* T 13 H1' T 13 7.208 3.026 32.819 146 H3 T 13 H3 T 13 3.696 1.841 35.421 147 1H5M T 13 1H5M T 13 5.459 -2.761 33.508 148 2H5M T 13 2H5M T 13 3.716 -2.557 33.734 149 3H5M T 13 3H5M T 13 4.441 -2.232 32.153 150 H6 T 13 H6 T 13 6.580 -0.560 32.414 151 1H5* A 14 1H5' A 14 8.441 5.234 33.022 152 2H5* A 14 2H5' A 14 9.650 6.303 33.764 153 H4* A 14 H4' A 14 7.361 6.964 34.420 154 H3* A 14 H3' A 14 9.502 6.399 36.320 155 H1* A 14 H1' A 14 5.721 6.106 36.598 156 H8 A 14 H8 A 14 7.344 2.536 36.657 157 1H6 A 14 1H6 A 14 1.894 1.072 39.332 158 2H6 A 14 2H6 A 14 3.436 0.322 38.855 159 H2 A 14 H2 A 14 1.764 5.211 38.451 160 2H2* A 14 1H2' A 14 7.542 6.059 38.216 161 1H2* A 14 2H2' A 14 8.291 4.671 37.367 162 1H5* G 15 1H5' G 15 5.571 8.598 37.582 163 2H5* G 15 2H5' G 15 6.145 10.021 38.474 164 H4* G 15 H4' G 15 3.992 9.257 39.395 165 H3* G 15 H3' G 15 6.398 9.581 41.010 166 H1* G 15 H1' G 15 3.356 7.390 41.378 167 H8 G 15 H8 G 15 6.437 5.113 40.568 168 H1 G 15 H1 G 15 1.368 2.136 43.179 169 1H2 G 15 1H2 G 15 0.046 5.331 43.133 170 2H2 G 15 2H2 G 15 -0.237 3.638 43.562 171 2H2* G 15 1H2' G 15 5.252 7.924 42.855 172 1H2* G 15 2H2' G 15 6.389 7.288 41.625 173 1H5* T 16 1H5' T 16 1.987 9.286 42.705 174 2H5* T 16 2H5' T 16 1.924 10.521 43.978 175 H4* T 16 H4' T 16 0.398 8.646 44.492 176 H3* T 16 H3' T 16 2.508 9.561 46.316 177 1H2* T 16 2H2' T 16 3.437 7.414 46.498 178 2H2* T 16 1H2' T 16 2.073 7.157 47.629 179 H1* T 16 H1' T 16 0.720 6.220 45.825 180 H3 T 16 H3 T 16 2.790 2.243 46.721 181 1H5M T 16 1H5M T 16 6.104 3.146 43.496 182 2H5M T 16 2H5M T 16 5.258 4.368 42.536 183 3H5M T 16 3H5M T 16 6.339 4.863 43.853 184 H6 T 16 H6 T 16 3.866 6.080 44.027 185 1H5* G 17 1H5' G 17 -0.888 6.818 47.734 186 2H5* G 17 2H5' G 17 -1.525 7.521 49.235 187 H4* G 17 H4' G 17 -1.565 5.067 49.377 188 H3* G 17 H3' G 17 -0.254 6.753 51.338 189 H1* G 17 H1' G 17 0.439 3.219 50.219 190 H8 G 17 H8 G 17 3.475 5.492 49.274 191 H1 G 17 H1 G 17 4.431 -0.843 48.700 192 1H2 G 17 1H2 G 17 1.123 -0.971 49.698 193 2H2 G 17 2H2 G 17 2.541 -1.913 49.215 194 H3T G 17 H3T G 17 -1.122 4.045 51.459 195 2H2* G 17 1H2' G 17 1.323 4.623 52.032 196 1H2* G 17 2H2' G 17 1.891 5.832 50.838 197 1H5* C 1 1H5' C 1 6.742 -8.841 46.062 198 2H5* C 1 2H5' C 1 6.942 -7.197 45.423 199 H4* C 1 H4' C 1 5.511 -7.852 48.041 200 H3* C 1 H3' C 1 4.484 -8.220 45.332 201 H1* C 1 H1' C 1 3.615 -5.729 48.088 202 1H4 C 1 1H4 C 1 4.625 0.372 45.730 203 2H4 C 1 2H4 C 1 3.166 0.226 46.749 204 H5 C 1 H5 C 1 5.896 -1.749 45.243 205 H6 C 1 H6 C 1 5.902 -4.158 45.682 206 H5T C 1 H5T C 1 7.856 -8.186 47.927 207 2H2* C 1 1H2' C 1 2.540 -6.388 45.983 208 1H2* C 1 2H2' C 1 4.009 -5.928 45.077 209 1H5* A 2 1H5' A 2 1.582 -7.011 48.565 210 2H5* A 2 2H5' A 2 0.071 -7.934 48.396 211 H4* A 2 H4' A 2 -0.494 -5.610 48.870 212 H3* A 2 H3' A 2 -1.444 -6.947 46.508 213 H1* A 2 H1' A 2 -0.555 -3.277 46.967 214 H8 A 2 H8 A 2 1.800 -4.996 44.368 215 1H6 A 2 1H6 A 2 3.956 0.823 43.716 216 2H6 A 2 2H6 A 2 4.145 -0.804 43.019 217 H2 A 2 H2 A 2 1.112 0.903 46.862 218 2H2* A 2 1H2' A 2 -1.598 -4.558 45.185 219 1H2* A 2 2H2' A 2 -0.148 -5.597 45.040 220 1H5* C 3 1H5' C 3 -3.010 -2.751 47.828 221 2H5* C 3 2H5' C 3 -4.743 -2.643 47.454 222 H4* C 3 H4' C 3 -3.607 -0.458 47.132 223 H3* C 3 H3' C 3 -5.166 -1.798 45.027 224 H1* C 3 H1' C 3 -2.286 0.709 44.993 225 1H4 C 3 1H4 C 3 2.544 -1.942 41.315 226 2H4 C 3 2H4 C 3 2.621 -0.166 41.471 227 H5 C 3 H5 C 3 0.606 -3.104 42.398 228 H6 C 3 H6 C 3 -1.385 -2.703 43.783 229 2H2* C 3 1H2' C 3 -3.930 0.028 43.337 230 1H2* C 3 2H2' C 3 -3.413 -1.680 43.488 231 1H5* T 4 1H5' T 4 -4.258 2.758 45.159 232 2H5* T 4 2H5' T 4 -5.743 3.604 44.676 233 H4* T 4 H4' T 4 -3.710 4.830 43.940 234 H3* T 4 H3' T 4 -5.891 4.058 42.144 235 1H2* T 4 2H2' T 4 -4.464 2.856 40.724 236 2H2* T 4 1H2' T 4 -4.093 4.496 40.097 237 H1* T 4 H1' T 4 -2.161 4.655 41.576 238 H3 T 4 H3 T 4 0.166 2.417 38.354 239 1H5M T 4 1H5M T 4 -2.553 -1.387 40.738 240 2H5M T 4 2H5M T 4 -0.860 -1.725 40.348 241 3H5M T 4 3H5M T 4 -1.298 -1.186 41.977 242 H6 T 4 H6 T 4 -2.689 1.073 41.990 243 1H5* A 5 1H5' A 5 -2.557 6.916 41.084 244 2H5* A 5 2H5' A 5 -3.259 8.370 40.344 245 H4* A 5 H4' A 5 -1.062 7.884 39.354 246 H3* A 5 H3' A 5 -3.550 7.975 37.738 247 H1* A 5 H1' A 5 -0.108 6.316 37.321 248 H8 A 5 H8 A 5 -3.066 3.774 37.579 249 1H6 A 5 1H6 A 5 -0.643 0.008 35.337 250 2H6 A 5 2H6 A 5 1.011 0.038 34.676 251 H2 A 5 H2 A 5 2.914 3.771 35.169 252 2H2* A 5 1H2' A 5 -1.821 7.020 35.760 253 1H2* A 5 2H2' A 5 -3.044 6.032 36.613 254 1H5* C 6 1H5' C 6 0.724 9.384 36.320 255 2H5* C 6 2H5' C 6 0.494 10.683 35.131 256 H4* C 6 H4' C 6 2.481 9.288 34.583 257 H3* C 6 H3' C 6 0.211 9.677 32.708 258 H1* C 6 H1' C 6 2.881 6.919 33.176 259 1H4 C 6 1H4 C 6 -0.872 1.468 33.760 260 2H4 C 6 2H4 C 6 0.811 1.126 33.284 261 H5 C 6 H5 C 6 -1.537 3.859 34.047 262 H6 C 6 H6 C 6 -0.677 6.153 33.927 263 2H2* C 6 1H2' C 6 1.605 7.697 31.300 264 1H2* C 6 2H2' C 6 0.072 7.439 32.183 265 1H5* A 7 1H5' A 7 3.962 7.993 31.707 266 2H5* A 7 2H5' A 7 4.826 8.991 30.521 267 H4* A 7 H4' A 7 5.415 6.589 30.292 268 H3* A 7 H3' A 7 4.503 8.280 28.111 269 H1* A 7 H1' A 7 4.160 4.519 28.706 270 H8 A 7 H8 A 7 0.705 6.314 29.044 271 1H6 A 7 1H6 A 7 -2.041 2.205 28.230 272 2H6 A 7 2H6 A 7 -1.441 0.563 27.884 273 H2 A 7 H2 A 7 2.775 0.347 27.772 274 2H2* A 7 1H2' A 7 3.848 5.963 26.768 275 1H2* A 7 2H2' A 7 2.632 6.931 27.655 276 1H5* A 8 1H5' A 8 7.106 4.405 27.571 277 2H5* A 8 2H5' A 8 8.317 4.852 26.351 278 H4* A 8 H4' A 8 7.835 2.398 26.367 279 H3* A 8 H3' A 8 7.833 4.078 23.999 280 H1* A 8 H1' A 8 5.797 0.937 24.835 281 H8 A 8 H8 A 8 3.559 4.146 24.905 282 1H6 A 8 1H6 A 8 -0.731 1.768 23.936 283 2H6 A 8 2H6 A 8 -0.958 0.023 23.661 284 H2 A 8 H2 A 8 2.661 -2.150 23.886 285 2H2* A 8 1H2' A 8 6.254 2.163 22.794 286 1H2* A 8 2H2' A 8 5.564 3.651 23.507 287 1H5* A 9 1H5' A 9 7.814 -0.570 23.754 288 2H5* A 9 2H5' A 9 9.134 -0.960 22.633 289 H4* A 9 H4' A 9 7.329 -2.652 22.506 290 H3* A 9 H3' A 9 8.411 -1.241 20.209 291 H1* A 9 H1' A 9 4.933 -2.672 20.842 292 H8 A 9 H8 A 9 4.921 1.209 20.423 293 1H6 A 9 1H6 A 9 -1.267 0.417 20.509 294 2H6 A 9 2H6 A 9 -0.047 1.698 20.299 295 H2 A 9 H2 A 9 0.462 -3.400 21.062 296 2H2* A 9 1H2' A 9 6.080 -1.816 18.873 297 1H2* A 9 2H2' A 9 6.338 -0.238 19.680 298 1H5* G 10 1H5' G 10 6.092 -5.293 20.101 299 2H5* G 10 2H5' G 10 6.881 -6.294 18.867 300 H4* G 10 H4' G 10 4.476 -6.875 19.134 301 H3* G 10 H3' G 10 5.757 -6.386 16.610 302 H1* G 10 H1' G 10 2.200 -5.638 17.646 303 H8 G 10 H8 G 10 4.149 -2.319 16.968 304 H1 G 10 H1 G 10 -2.175 -1.665 17.924 305 1H2 G 10 1H2 G 10 -1.982 -5.077 18.477 306 2H2 G 10 2H2 G 10 -3.046 -3.665 18.415 307 2H2* G 10 1H2' G 10 3.423 -5.481 15.541 308 1H2* G 10 2H2' G 10 4.583 -4.329 16.274 309 1H5* A 11 1H5' A 11 1.455 -7.736 17.303 310 2H5* A 11 2H5' A 11 1.072 -9.046 16.169 311 H4* A 11 H4' A 11 -0.953 -7.752 16.821 312 H3* A 11 H3' A 11 -0.195 -8.355 14.089 313 H1* A 11 H1' A 11 -2.093 -5.376 15.552 314 H8 A 11 H8 A 11 1.517 -4.330 14.534 315 1H6 A 11 1H6 A 11 0.513 0.556 14.093 316 2H6 A 11 2H6 A 11 -1.067 1.353 14.294 317 H2 A 11 H2 A 11 -4.157 -1.360 15.251 318 2H2* A 11 1H2' A 11 -1.705 -6.209 13.289 319 1H2* A 11 2H2' A 11 0.066 -6.074 13.520 320 1H5* G 12 1H5' G 12 -4.393 -6.688 15.279 321 2H5* G 12 2H5' G 12 -5.566 -7.685 14.394 322 H4* G 12 H4' G 12 -6.422 -5.386 14.702 323 H3* G 12 H3' G 12 -6.156 -6.667 12.071 324 H1* G 12 H1' G 12 -6.186 -3.047 13.242 325 H8 G 12 H8 G 12 -2.607 -3.998 11.998 326 H1 G 12 H1 G 12 -4.128 2.235 11.562 327 1H2 G 12 1H2 G 12 -6.222 2.525 12.285 328 2H2 G 12 2H2 G 12 -7.141 1.112 12.828 329 2H2* G 12 1H2' G 12 -6.481 -4.112 11.069 330 1H2* G 12 2H2' G 12 -4.880 -4.903 11.215 331 1H5* T 13 1H5' T 13 -8.875 -2.855 12.344 332 2H5* T 13 2H5' T 13 -10.257 -3.162 11.269 333 H4* T 13 H4' T 13 -9.436 -0.879 10.881 334 H3* T 13 H3' T 13 -8.983 -2.947 8.714 335 1H2* T 13 2H2' T 13 -7.378 -1.696 7.727 336 2H2* T 13 1H2' T 13 -8.416 -0.244 7.746 337 H1* T 13 H1' T 13 -7.518 0.489 9.774 338 H3 T 13 H3 T 13 -3.316 1.504 8.575 339 1H5M T 13 1H5M T 13 -3.480 -3.742 8.069 340 2H5M T 13 2H5M T 13 -1.971 -3.002 8.627 341 3H5M T 13 3H5M T 13 -3.132 -3.628 9.808 342 H6 T 13 H6 T 13 -5.608 -2.659 9.352 343 1H5* A 14 1H5' A 14 -10.612 1.336 7.929 344 2H5* A 14 2H5' A 14 -11.705 1.236 6.533 345 H4* A 14 H4' A 14 -10.326 3.244 6.307 346 H3* A 14 H3' A 14 -10.506 1.283 4.253 347 H1* A 14 H1' A 14 -7.579 3.388 5.163 348 H8 A 14 H8 A 14 -6.510 -0.290 5.779 349 1H6 A 14 1H6 A 14 -1.038 2.429 7.061 350 2H6 A 14 2H6 A 14 -1.762 0.816 6.851 351 H2 A 14 H2 A 14 -3.852 5.542 6.436 352 2H2* A 14 1H2' A 14 -7.933 1.627 3.473 353 1H2* A 14 2H2' A 14 -8.275 0.434 4.770 354 1H5* G 15 1H5' G 15 -9.852 5.853 5.304 355 2H5* G 15 2H5' G 15 -11.015 7.054 4.707 356 H4* G 15 H4' G 15 -8.822 8.079 4.569 357 H3* G 15 H3' G 15 -10.370 7.709 2.197 358 H1* G 15 H1' G 15 -6.599 7.483 2.546 359 H8 G 15 H8 G 15 -8.117 4.116 1.385 360 H1 G 15 H1 G 15 -1.777 3.959 2.450 361 1H2 G 15 1H2 G 15 -2.339 7.197 3.530 362 2H2 G 15 2H2 G 15 -1.131 5.929 3.278 363 2H2* G 15 1H2' G 15 -8.152 7.360 0.662 364 1H2* G 15 2H2' G 15 -8.962 5.939 1.396 365 1H5* T 16 1H5' T 16 -6.165 9.638 1.845 366 2H5* T 16 2H5' T 16 -6.331 11.035 0.762 367 H4* T 16 H4' T 16 -4.169 9.968 0.377 368 H3* T 16 H3' T 16 -6.239 10.007 -1.786 369 1H2* T 16 2H2' T 16 -5.650 7.903 -2.506 370 2H2* T 16 1H2' T 16 -4.094 8.618 -3.018 371 H1* T 16 H1' T 16 -3.073 8.039 -0.912 372 H3 T 16 H3 T 16 -2.101 3.725 -1.416 373 1H5M T 16 1H5M T 16 -7.142 3.867 -2.808 374 2H5M T 16 2H5M T 16 -6.608 2.468 -1.865 375 3H5M T 16 3H5M T 16 -7.410 3.816 -1.053 376 H6 T 16 H6 T 16 -6.256 6.160 -1.452 377 1H5* G 17 1H5' G 17 -1.735 10.024 -2.660 378 2H5* G 17 2H5' G 17 -1.457 11.142 -4.011 379 H4* G 17 H4' G 17 -0.056 9.164 -4.318 380 H3* G 17 H3' G 17 -2.008 10.008 -6.306 381 H1* G 17 H1' G 17 -0.540 6.646 -5.457 382 H8 G 17 H8 G 17 -4.411 6.477 -5.258 383 H1 G 17 H1 G 17 -1.333 1.010 -3.837 384 1H2 G 17 1H2 G 17 1.456 3.025 -4.192 385 2H2 G 17 2H2 G 17 0.865 1.394 -3.844 386 H3T G 17 H3T G 17 -0.410 9.103 -7.684 387 2H2* G 17 1H2' G 17 -1.959 7.447 -7.297 388 1H2* G 17 2H2' G 17 -3.213 7.960 -6.123 Start of MODEL 3 1 1H5* C 1 1H5' C 1 2.842 -7.126 0.510 2 2H5* C 1 2H5' C 1 2.658 -7.778 -1.130 3 H4* C 1 H4' C 1 4.592 -6.428 -1.899 4 H3* C 1 H3' C 1 5.357 -6.162 0.807 5 H1* C 1 H1' C 1 4.100 -3.382 -1.400 6 1H4 C 1 1H4 C 1 -1.651 -1.001 0.855 7 2H4 C 1 2H4 C 1 -0.733 0.117 -0.191 8 H5 C 1 H5 C 1 -0.609 -3.241 1.322 9 H6 C 1 H6 C 1 1.368 -4.615 0.830 10 H5T C 1 H5T C 1 4.774 -8.626 -0.933 11 2H2* C 1 1H2' C 1 4.842 -3.515 0.927 12 1H2* C 1 2H2' C 1 3.520 -4.666 1.306 13 1H5* A 2 1H5' A 2 6.256 -2.485 -2.111 14 2H5* A 2 2H5' A 2 7.864 -1.916 -1.619 15 H4* A 2 H4' A 2 6.519 0.027 -2.194 16 H3* A 2 H3' A 2 7.693 -0.313 0.432 17 H1* A 2 H1' A 2 4.555 1.512 -0.646 18 H8 A 2 H8 A 2 3.571 -1.618 1.493 19 1H6 A 2 1H6 A 2 -1.906 1.373 1.742 20 2H6 A 2 2H6 A 2 -1.122 -0.114 2.330 21 H2 A 2 H2 A 2 0.695 3.755 -0.603 22 2H2* A 2 1H2' A 2 5.799 1.392 1.446 23 1H2* A 2 2H2' A 2 5.575 -0.384 1.506 24 1H5* C 3 1H5' C 3 6.022 4.017 -0.807 25 2H5* C 3 2H5' C 3 7.200 5.140 -0.095 26 H4* C 3 H4' C 3 4.952 6.088 0.150 27 H3* C 3 H3' C 3 6.509 5.236 2.573 28 H1* C 3 H1' C 3 2.799 5.886 1.674 29 1H4 C 3 1H4 C 3 -0.036 0.386 4.034 30 2H4 C 3 2H4 C 3 -1.162 1.749 3.787 31 H5 C 3 H5 C 3 2.391 0.814 3.580 32 H6 C 3 H6 C 3 3.958 2.543 2.811 33 2H2* C 3 1H2' C 3 4.088 6.312 3.640 34 1H2* C 3 2H2' C 3 4.640 4.613 3.702 35 1H5* T 4 1H5' T 4 3.790 8.948 2.322 36 2H5* T 4 2H5' T 4 4.488 10.237 3.324 37 H4* T 4 H4' T 4 2.036 10.234 3.520 38 H3* T 4 H3' T 4 3.820 9.928 5.841 39 1H2* T 4 2H2' T 4 2.772 7.990 6.583 40 2H2* T 4 1H2' T 4 1.515 9.130 7.161 41 H1* T 4 H1' T 4 0.213 8.781 5.149 42 H3 T 4 H3 T 4 -1.651 4.924 6.574 43 1H5M T 4 1H5M T 4 2.755 3.358 4.293 44 2H5M T 4 2H5M T 4 3.521 3.762 5.843 45 3H5M T 4 3H5M T 4 2.305 2.483 5.766 46 H6 T 4 H6 T 4 2.744 6.094 4.999 47 1H5* A 5 1H5' A 5 -0.592 10.885 6.237 48 2H5* A 5 2H5' A 5 -0.703 12.301 7.299 49 H4* A 5 H4' A 5 -2.633 10.901 7.699 50 H3* A 5 H3' A 5 -0.737 11.541 9.818 51 H1* A 5 H1' A 5 -3.017 8.509 9.333 52 H8 A 5 H8 A 5 0.768 7.564 9.110 53 1H6 A 5 1H6 A 5 -1.528 1.794 9.793 54 2H6 A 5 2H6 A 5 0.026 2.639 9.593 55 H2 A 5 H2 A 5 -4.823 4.450 9.835 56 2H2* A 5 1H2' A 5 -1.740 9.379 11.206 57 1H2* A 5 2H2' A 5 -0.229 9.293 10.255 58 1H5* C 6 1H5' C 6 -5.219 10.279 10.394 59 2H5* C 6 2H5' C 6 -5.826 11.266 11.740 60 H4* C 6 H4' C 6 -7.036 9.107 11.617 61 H3* C 6 H3' C 6 -5.638 10.059 14.006 62 H1* C 6 H1' C 6 -6.439 6.540 12.723 63 1H4 C 6 1H4 C 6 -1.725 2.544 13.371 64 2H4 C 6 2H4 C 6 -0.523 3.550 12.524 65 H5 C 6 H5 C 6 -1.148 5.853 11.854 66 H6 C 6 H6 C 6 -3.011 7.431 11.808 67 2H2* C 6 1H2' C 6 -5.765 7.448 14.883 68 1H2* C 6 2H2' C 6 -4.291 8.152 14.150 69 1H5* T 7 1H5' T 7 -8.598 6.523 14.225 70 2H5* T 7 2H5' T 7 -9.634 6.785 15.644 71 H4* T 7 H4' T 7 -9.114 4.386 15.383 72 H3* T 7 H3' T 7 -8.433 5.915 17.822 73 1H2* T 7 2H2' T 7 -6.257 5.135 17.871 74 2H2* T 7 1H2' T 7 -6.996 3.611 18.440 75 H1* T 7 H1' T 7 -7.016 2.733 16.183 76 H3 T 7 H3 T 7 -2.743 1.508 15.565 77 1H5M T 7 1H5M T 7 -1.189 5.949 15.767 78 2H5M T 7 2H5M T 7 -2.657 6.778 15.231 79 3H5M T 7 3H5M T 7 -2.326 6.585 16.965 80 H6 T 7 H6 T 7 -4.861 5.757 16.357 81 1H5* C 8 1H5' C 8 -9.863 1.321 17.808 82 2H5* C 8 2H5' C 8 -10.600 1.057 19.403 83 H4* C 8 H4' C 8 -9.437 -1.001 18.648 84 H3* C 8 H3' C 8 -8.129 0.509 20.958 85 H1* C 8 H1' C 8 -6.509 -1.824 18.312 86 1H4 C 8 1H4 C 8 -1.143 0.992 19.306 87 2H4 C 8 2H4 C 8 -1.820 2.625 19.481 88 H5 C 8 H5 C 8 -4.279 2.923 19.429 89 H6 C 8 H6 C 8 -6.390 1.698 19.230 90 2H2* C 8 1H2' C 8 -7.635 -2.391 20.232 91 1H2* C 8 2H2' C 8 -6.547 -1.258 21.086 92 1H5* T 9 1H5' T 9 -8.850 -3.510 20.632 93 2H5* T 9 2H5' T 9 -9.548 -4.354 22.030 94 H4* T 9 H4' T 9 -7.776 -5.698 20.859 95 H3* T 9 H3' T 9 -8.030 -5.421 23.659 96 1H2* T 9 2H2' T 9 -6.258 -3.805 23.809 97 2H2* T 9 1H2' T 9 -5.357 -5.329 24.089 98 H1* T 9 H1' T 9 -4.751 -5.448 21.734 99 H3 T 9 H3 T 9 -1.240 -2.661 21.581 100 1H5M T 9 1H5M T 9 -3.726 0.984 23.196 101 2H5M T 9 2H5M T 9 -5.302 0.560 22.512 102 3H5M T 9 3H5M T 9 -4.906 0.113 24.186 103 H6 T 9 H6 T 9 -5.840 -2.070 22.870 104 1H5* T 10 1H5' T 10 -4.390 -7.503 21.857 105 2H5* T 10 2H5' T 10 -4.057 -9.000 22.754 106 H4* T 10 H4' T 10 -1.943 -7.951 22.049 107 H3* T 10 H3' T 10 -2.550 -8.629 24.802 108 1H2* T 10 2H2' T 10 -2.457 -6.368 25.507 109 2H2* T 10 1H2' T 10 -0.713 -6.757 25.605 110 H1* T 10 H1' T 10 -0.365 -5.897 23.341 111 H3 T 10 H3 T 10 0.200 -1.646 24.707 112 1H5M T 10 1H5M T 10 -4.817 -2.745 26.045 113 2H5M T 10 2H5M T 10 -4.383 -1.085 25.613 114 3H5M T 10 3H5M T 10 -5.013 -2.178 24.372 115 H6 T 10 H6 T 10 -3.629 -4.554 24.467 116 1H5* T 11 1H5' T 11 1.730 -7.304 23.471 117 2H5* T 11 2H5' T 11 2.808 -8.524 24.180 118 H4* T 11 H4' T 11 3.963 -6.364 24.120 119 H3* T 11 H3' T 11 3.629 -7.911 26.533 120 1H2* T 11 2H2' T 11 2.202 -6.278 27.520 121 2H2* T 11 1H2' T 11 3.801 -5.647 28.033 122 H1* T 11 H1' T 11 3.868 -4.167 26.082 123 H3 T 11 H3 T 11 1.616 -0.934 28.287 124 1H5M T 11 1H5M T 11 -2.015 -4.710 27.589 125 2H5M T 11 2H5M T 11 -2.529 -3.019 27.502 126 3H5M T 11 3H5M T 11 -2.119 -3.889 26.017 127 H6 T 11 H6 T 11 0.310 -5.096 26.248 128 1H5* G 12 1H5' G 12 6.498 -4.184 26.033 129 2H5* G 12 2H5' G 12 7.993 -4.834 26.728 130 H4* G 12 H4' G 12 8.029 -2.398 26.906 131 H3* G 12 H3' G 12 8.420 -4.118 29.157 132 H1* G 12 H1' G 12 6.803 -0.720 29.076 133 H8 G 12 H8 G 12 3.977 -3.386 29.526 134 H1 G 12 H1 G 12 2.296 2.689 30.787 135 1H2 G 12 1H2 G 12 5.616 3.289 30.033 136 2H2 G 12 2H2 G 12 4.077 4.006 30.531 137 2H2* G 12 1H2' G 12 7.329 -2.322 30.861 138 1H2* G 12 2H2' G 12 6.275 -3.550 30.090 139 1H5* T 13 1H5' T 13 8.904 0.548 29.170 140 2H5* T 13 2H5' T 13 10.534 0.708 29.853 141 H4* T 13 H4' T 13 9.260 2.786 30.172 142 H3* T 13 H3' T 13 10.668 1.420 32.242 143 1H2* T 13 2H2' T 13 8.671 0.676 33.309 144 2H2* T 13 1H2' T 13 8.914 2.244 34.146 145 H1* T 13 H1' T 13 7.379 3.338 32.589 146 H3 T 13 H3 T 13 3.745 2.093 34.971 147 1H5M T 13 1H5M T 13 5.640 -2.471 33.093 148 2H5M T 13 2H5M T 13 3.886 -2.289 33.250 149 3H5M T 13 3H5M T 13 4.671 -1.941 31.702 150 H6 T 13 H6 T 13 6.777 -0.251 32.064 151 1H5* A 14 1H5' A 14 8.618 5.522 32.975 152 2H5* A 14 2H5' A 14 9.846 6.517 33.784 153 H4* A 14 H4' A 14 7.575 7.200 34.464 154 H3* A 14 H3' A 14 9.687 6.503 36.333 155 H1* A 14 H1' A 14 5.914 6.218 36.625 156 H8 A 14 H8 A 14 7.492 2.634 36.429 157 1H6 A 14 1H6 A 14 1.925 1.009 38.741 158 2H6 A 14 2H6 A 14 3.477 0.286 38.250 159 H2 A 14 H2 A 14 1.874 5.215 38.246 160 2H2* A 14 1H2' A 14 7.755 5.996 38.206 161 1H2* A 14 2H2' A 14 8.470 4.678 37.222 162 1H5* G 15 1H5' G 15 5.731 8.525 37.652 163 2H5* G 15 2H5' G 15 6.250 9.938 38.594 164 H4* G 15 H4' G 15 4.072 9.090 39.413 165 H3* G 15 H3' G 15 6.374 9.546 41.112 166 H1* G 15 H1' G 15 3.507 7.130 41.404 167 H8 G 15 H8 G 15 6.776 5.097 40.694 168 H1 G 15 H1 G 15 1.727 1.688 42.762 169 1H2 G 15 1H2 G 15 0.200 4.789 42.716 170 2H2 G 15 2H2 G 15 -0.005 3.064 43.049 171 2H2* G 15 1H2' G 15 5.361 7.751 42.895 172 1H2* G 15 2H2' G 15 6.544 7.229 41.653 173 1H5* T 16 1H5' T 16 1.964 8.766 42.779 174 2H5* T 16 2H5' T 16 1.820 9.947 44.097 175 H4* T 16 H4' T 16 0.499 7.956 44.641 176 H3* T 16 H3' T 16 2.758 8.851 46.333 177 1H2* T 16 2H2' T 16 3.644 6.707 46.472 178 2H2* T 16 1H2' T 16 2.283 6.398 47.592 179 H1* T 16 H1' T 16 0.935 5.525 45.762 180 H3 T 16 H3 T 16 2.984 1.487 46.232 181 1H5M T 16 1H5M T 16 6.611 4.495 43.810 182 2H5M T 16 2H5M T 16 5.615 4.010 42.423 183 3H5M T 16 3H5M T 16 6.489 2.787 43.358 184 H6 T 16 H6 T 16 4.153 5.611 44.043 185 1H5* G 17 1H5' G 17 -0.553 6.186 48.248 186 2H5* G 17 2H5' G 17 -0.802 6.822 49.887 187 H4* G 17 H4' G 17 -0.729 4.393 50.022 188 H3* G 17 H3' G 17 1.173 6.059 51.464 189 H1* G 17 H1' G 17 1.383 2.541 50.147 190 H8 G 17 H8 G 17 4.426 4.552 48.906 191 H1 G 17 H1 G 17 3.804 -1.301 46.309 192 1H2 G 17 1H2 G 17 0.784 -1.219 47.997 193 2H2 G 17 2H2 G 17 1.843 -2.167 46.943 194 H3T G 17 H3T G 17 -0.419 4.654 52.363 195 2H2* G 17 1H2' G 17 2.842 3.885 51.597 196 1H2* G 17 2H2' G 17 3.025 5.110 50.300 197 1H5* C 1 1H5' C 1 4.607 -10.583 45.962 198 2H5* C 1 2H5' C 1 5.599 -9.433 45.030 199 H4* C 1 H4' C 1 3.526 -8.734 47.172 200 H3* C 1 H3' C 1 3.663 -8.252 44.160 201 H1* C 1 H1' C 1 3.417 -5.894 47.238 202 1H4 C 1 1H4 C 1 6.858 -1.867 43.327 203 2H4 C 1 2H4 C 1 5.616 -1.032 44.299 204 H5 C 1 H5 C 1 6.916 -4.384 43.460 205 H6 C 1 H6 C 1 5.828 -6.302 44.528 206 H5T C 1 H5T C 1 6.178 -8.633 47.209 207 2H2* C 1 1H2' C 1 1.754 -6.837 46.016 208 1H2* C 1 2H2' C 1 2.509 -6.239 44.514 209 1H5* A 2 1H5' A 2 -0.187 -8.300 46.606 210 2H5* A 2 2H5' A 2 -1.533 -8.853 45.594 211 H4* A 2 H4' A 2 -2.167 -6.898 47.025 212 H3* A 2 H3' A 2 -2.791 -7.193 44.289 213 H1* A 2 H1' A 2 -1.703 -3.922 45.944 214 H8 A 2 H8 A 2 1.132 -5.430 43.706 215 1H6 A 2 1H6 A 2 3.545 0.287 44.299 216 2H6 A 2 2H6 A 2 3.848 -1.267 43.484 217 H2 A 2 H2 A 2 0.010 0.197 46.645 218 2H2* A 2 1H2' A 2 -2.453 -4.555 43.733 219 1H2* A 2 2H2' A 2 -1.080 -5.690 43.550 220 1H5* C 3 1H5' C 3 -4.189 -3.269 46.480 221 2H5* C 3 2H5' C 3 -5.848 -2.964 45.927 222 H4* C 3 H4' C 3 -4.656 -0.830 46.256 223 H3* C 3 H3' C 3 -5.914 -1.592 43.739 224 H1* C 3 H1' C 3 -2.935 0.655 44.504 225 1H4 C 3 1H4 C 3 2.334 -1.795 41.323 226 2H4 C 3 2H4 C 3 2.443 -0.051 41.685 227 H5 C 3 H5 C 3 0.219 -2.972 41.956 228 H6 C 3 H6 C 3 -1.962 -2.629 43.037 229 2H2* C 3 1H2' C 3 -4.305 0.282 42.518 230 1H2* C 3 2H2' C 3 -3.893 -1.462 42.539 231 1H5* T 4 1H5' T 4 -4.602 2.801 44.550 232 2H5* T 4 2H5' T 4 -5.989 3.804 44.081 233 H4* T 4 H4' T 4 -3.861 4.970 43.601 234 H3* T 4 H3' T 4 -5.949 4.525 41.619 235 1H2* T 4 2H2' T 4 -4.528 3.271 40.216 236 2H2* T 4 1H2' T 4 -4.032 4.914 39.689 237 H1* T 4 H1' T 4 -2.173 4.888 41.275 238 H3 T 4 H3 T 4 0.142 2.730 37.982 239 1H5M T 4 1H5M T 4 -2.779 -1.083 40.031 240 2H5M T 4 2H5M T 4 -1.070 -1.456 39.758 241 3H5M T 4 3H5M T 4 -1.622 -0.983 41.373 242 H6 T 4 H6 T 4 -2.866 1.322 41.465 243 1H5* A 5 1H5' A 5 -2.359 7.243 40.742 244 2H5* A 5 2H5' A 5 -3.001 8.748 40.051 245 H4* A 5 H4' A 5 -0.869 8.200 38.985 246 H3* A 5 H3' A 5 -3.402 8.323 37.423 247 H1* A 5 H1' A 5 0.031 6.647 36.957 248 H8 A 5 H8 A 5 -2.970 4.157 37.186 249 1H6 A 5 1H6 A 5 -0.606 0.369 34.923 250 2H6 A 5 2H6 A 5 1.044 0.379 34.252 251 H2 A 5 H2 A 5 2.991 4.093 34.728 252 2H2* A 5 1H2' A 5 -1.652 7.438 35.414 253 1H2* A 5 2H2' A 5 -2.900 6.441 36.220 254 1H5* C 6 1H5' C 6 0.812 9.699 35.859 255 2H5* C 6 2H5' C 6 0.562 11.000 34.676 256 H4* C 6 H4' C 6 2.444 9.527 33.999 257 H3* C 6 H3' C 6 0.001 9.859 32.298 258 H1* C 6 H1' C 6 2.784 7.190 32.689 259 1H4 C 6 1H4 C 6 -0.918 1.717 33.315 260 2H4 C 6 2H4 C 6 0.777 1.385 32.875 261 H5 C 6 H5 C 6 -1.621 4.102 33.528 262 H6 C 6 H6 C 6 -0.783 6.405 33.393 263 2H2* C 6 1H2' C 6 1.544 7.990 30.822 264 1H2* C 6 2H2' C 6 -0.007 7.667 31.649 265 1H5* A 7 1H5' A 7 3.812 8.496 31.017 266 2H5* A 7 2H5' A 7 4.495 9.544 29.757 267 H4* A 7 H4' A 7 5.228 7.192 29.471 268 H3* A 7 H3' A 7 3.972 8.789 27.384 269 H1* A 7 H1' A 7 4.016 5.018 28.028 270 H8 A 7 H8 A 7 0.462 6.514 28.664 271 1H6 A 7 1H6 A 7 -1.286 0.591 27.740 272 2H6 A 7 2H6 A 7 -1.975 2.185 28.131 273 H2 A 7 H2 A 7 2.917 0.732 27.235 274 2H2* A 7 1H2' A 7 3.419 6.399 26.114 275 1H2* A 7 2H2' A 7 2.201 7.273 27.092 276 1H5* A 8 1H5' A 8 6.841 5.168 26.677 277 2H5* A 8 2H5' A 8 7.931 5.712 25.385 278 H4* A 8 H4' A 8 7.694 3.220 25.457 279 H3* A 8 H3' A 8 7.381 4.862 23.074 280 H1* A 8 H1' A 8 5.736 1.532 24.073 281 H8 A 8 H8 A 8 3.212 4.514 24.236 282 1H6 A 8 1H6 A 8 -0.876 1.740 23.449 283 2H6 A 8 2H6 A 8 -0.947 -0.020 23.184 284 H2 A 8 H2 A 8 2.866 -1.842 23.260 285 2H2* A 8 1H2' A 8 5.984 2.736 21.988 286 1H2* A 8 2H2' A 8 5.167 4.164 22.689 287 1H5* A 9 1H5' A 9 7.863 0.236 22.800 288 2H5* A 9 2H5' A 9 9.143 -0.011 21.593 289 H4* A 9 H4' A 9 7.495 -1.855 21.514 290 H3* A 9 H3' A 9 8.251 -0.247 19.201 291 H1* A 9 H1' A 9 5.013 -2.095 20.053 292 H8 A 9 H8 A 9 4.567 1.770 19.704 293 1H6 A 9 1H6 A 9 -1.484 0.335 20.202 294 2H6 A 9 2H6 A 9 -0.419 1.737 19.935 295 H2 A 9 H2 A 9 0.668 -3.289 20.571 296 2H2* A 9 1H2' A 9 5.920 -1.124 18.019 297 1H2* A 9 2H2' A 9 6.050 0.476 18.810 298 1H5* G 10 1H5' G 10 6.327 -4.486 19.005 299 2H5* G 10 2H5' G 10 7.126 -5.359 17.683 300 H4* G 10 H4' G 10 4.775 -6.102 17.982 301 H3* G 10 H3' G 10 5.921 -5.322 15.454 302 H1* G 10 H1' G 10 2.369 -4.965 16.705 303 H8 G 10 H8 G 10 3.937 -1.475 15.962 304 H1 G 10 H1 G 10 -2.216 -1.382 17.827 305 1H2 G 10 1H2 G 10 -2.847 -3.462 18.358 306 2H2 G 10 2H2 G 10 -1.670 -4.775 18.208 307 2H2* G 10 1H2' G 10 3.454 -4.581 14.552 308 1H2* G 10 2H2' G 10 4.553 -3.376 15.296 309 1H5* A 11 1H5' A 11 1.827 -7.301 16.162 310 2H5* A 11 2H5' A 11 1.577 -8.532 14.909 311 H4* A 11 H4' A 11 -0.575 -7.590 15.744 312 H3* A 11 H3' A 11 0.134 -7.856 12.959 313 H1* A 11 H1' A 11 -2.031 -5.219 14.694 314 H8 A 11 H8 A 11 1.389 -3.765 13.518 315 1H6 A 11 1H6 A 11 0.023 1.040 13.819 316 2H6 A 11 2H6 A 11 -1.568 1.680 14.301 317 H2 A 11 H2 A 11 -4.332 -1.363 15.261 318 2H2* A 11 1H2' A 11 -1.590 -5.815 12.368 319 1H2* A 11 2H2' A 11 0.160 -5.513 12.601 320 1H5* G 12 1H5' G 12 -4.137 -6.773 14.429 321 2H5* G 12 2H5' G 12 -5.286 -7.721 13.464 322 H4* G 12 H4' G 12 -6.241 -5.522 14.113 323 H3* G 12 H3' G 12 -6.053 -6.450 11.323 324 H1* G 12 H1' G 12 -6.205 -3.006 12.974 325 H8 G 12 H8 G 12 -2.748 -3.638 11.262 326 H1 G 12 H1 G 12 -4.371 2.538 12.004 327 1H2 G 12 1H2 G 12 -7.227 1.157 13.378 328 2H2 G 12 2H2 G 12 -6.377 2.654 12.971 329 2H2* G 12 1H2' G 12 -6.639 -3.808 10.719 330 1H2* G 12 2H2' G 12 -4.990 -4.500 10.621 331 1H5* T 13 1H5' T 13 -8.854 -2.983 12.431 332 2H5* T 13 2H5' T 13 -10.347 -3.109 11.474 333 H4* T 13 H4' T 13 -9.562 -0.764 11.528 334 H3* T 13 H3' T 13 -9.470 -2.276 8.902 335 1H2* T 13 2H2' T 13 -8.039 -0.774 7.987 336 2H2* T 13 1H2' T 13 -9.041 0.600 8.530 337 H1* T 13 H1' T 13 -7.798 0.859 10.480 338 H3 T 13 H3 T 13 -3.814 2.150 8.853 339 1H5M T 13 1H5M T 13 -4.111 -2.963 7.510 340 2H5M T 13 2H5M T 13 -2.530 -2.282 7.921 341 3H5M T 13 3H5M T 13 -3.488 -3.096 9.168 342 H6 T 13 H6 T 13 -6.030 -2.113 9.183 343 1H5* A 14 1H5' A 14 -10.907 1.928 9.664 344 2H5* A 14 2H5' A 14 -12.358 2.250 8.693 345 H4* A 14 H4' A 14 -10.956 4.275 8.811 346 H3* A 14 H3' A 14 -11.898 3.119 6.359 347 H1* A 14 H1' A 14 -8.670 4.976 7.018 348 H8 A 14 H8 A 14 -7.954 1.238 6.150 349 1H6 A 14 1H6 A 14 -3.023 1.804 5.565 350 2H6 A 14 2H6 A 14 -2.065 3.280 5.846 351 H2 A 14 H2 A 14 -4.426 6.544 7.121 352 2H2* A 14 1H2' A 14 -9.745 4.099 5.008 353 1H2* A 14 2H2' A 14 -9.708 2.440 5.687 354 1H5* G 15 1H5' G 15 -9.715 7.428 6.066 355 2H5* G 15 2H5' G 15 -10.751 8.269 4.895 356 H4* G 15 H4' G 15 -8.465 8.935 4.450 357 H3* G 15 H3' G 15 -10.051 7.507 2.445 358 H1* G 15 H1' G 15 -6.324 7.801 3.055 359 H8 G 15 H8 G 15 -7.503 4.133 3.720 360 H1 G 15 H1 G 15 -1.192 4.883 2.744 361 1H2 G 15 1H2 G 15 -0.762 7.040 2.375 362 2H2 G 15 2H2 G 15 -2.104 8.195 2.394 363 2H2* G 15 1H2' G 15 -7.663 6.957 1.189 364 1H2* G 15 2H2' G 15 -8.457 5.774 2.276 365 1H5* T 16 1H5' T 16 -6.054 9.415 1.322 366 2H5* T 16 2H5' T 16 -6.330 10.352 -0.162 367 H4* T 16 H4' T 16 -4.123 9.321 -0.283 368 H3* T 16 H3' T 16 -6.271 8.565 -2.210 369 1H2* T 16 2H2' T 16 -5.702 6.328 -2.107 370 2H2* T 16 1H2' T 16 -4.228 6.796 -3.007 371 H1* T 16 H1' T 16 -2.998 7.058 -0.935 372 H3 T 16 H3 T 16 -1.915 2.760 -0.380 373 1H5M T 16 1H5M T 16 -6.295 1.536 0.811 374 2H5M T 16 2H5M T 16 -6.887 3.085 1.421 375 3H5M T 16 3H5M T 16 -7.174 2.626 -0.270 376 H6 T 16 H6 T 16 -6.085 5.151 -0.105 377 1H5* G 17 1H5' G 17 -1.793 8.311 -3.267 378 2H5* G 17 2H5' G 17 -1.616 8.866 -4.944 379 H4* G 17 H4' G 17 -0.142 6.952 -4.572 380 H3* G 17 H3' G 17 -2.181 6.962 -6.649 381 H1* G 17 H1' G 17 -0.542 4.186 -4.710 382 H8 G 17 H8 G 17 -4.395 4.018 -4.212 383 H1 G 17 H1 G 17 -1.006 -0.583 -1.257 384 1H2 G 17 1H2 G 17 1.665 1.238 -2.494 385 2H2 G 17 2H2 G 17 1.173 -0.186 -1.566 386 H3T G 17 H3T G 17 0.115 6.874 -6.918 387 2H2* G 17 1H2' G 17 -2.052 4.220 -6.651 388 1H2* G 17 2H2' G 17 -3.291 5.084 -5.686 Start of MODEL 4 1 1H5* C 1 1H5' C 1 3.737 -7.720 -1.913 2 2H5* C 1 2H5' C 1 2.472 -6.916 -0.949 3 H4* C 1 H4' C 1 4.260 -5.609 -3.056 4 H3* C 1 H3' C 1 4.745 -5.938 -0.251 5 H1* C 1 H1' C 1 3.709 -2.812 -2.115 6 1H4 C 1 1H4 C 1 -2.118 -0.680 0.218 7 2H4 C 1 2H4 C 1 -1.115 0.583 -0.547 8 H5 C 1 H5 C 1 -1.149 -2.995 0.334 9 H6 C 1 H6 C 1 0.829 -4.317 -0.281 10 H5T C 1 H5T C 1 1.699 -6.230 -3.108 11 2H2* C 1 1H2' C 1 4.340 -3.284 0.206 12 1H2* C 1 2H2' C 1 2.979 -4.440 0.358 13 1H5* A 2 1H5' A 2 6.068 -1.962 -2.437 14 2H5* A 2 2H5' A 2 7.673 -1.587 -1.777 15 H4* A 2 H4' A 2 6.475 0.503 -2.179 16 H3* A 2 H3' A 2 7.504 -0.240 0.434 17 H1* A 2 H1' A 2 4.569 1.939 -0.560 18 H8 A 2 H8 A 2 3.278 -1.283 1.255 19 1H6 A 2 1H6 A 2 -2.020 2.013 1.459 20 2H6 A 2 2H6 A 2 -1.355 0.441 1.964 21 H2 A 2 H2 A 2 0.851 4.412 -0.533 22 2H2* A 2 1H2' A 2 5.710 1.511 1.553 23 1H2* A 2 2H2' A 2 5.347 -0.238 1.419 24 1H5* C 3 1H5' C 3 6.271 4.273 -0.543 25 2H5* C 3 2H5' C 3 7.508 5.247 0.281 26 H4* C 3 H4' C 3 5.347 6.409 0.400 27 H3* C 3 H3' C 3 6.786 5.511 2.833 28 H1* C 3 H1' C 3 3.109 6.294 1.997 29 1H4 C 3 1H4 C 3 -0.099 0.792 3.863 30 2H4 C 3 2H4 C 3 -1.159 2.206 3.616 31 H5 C 3 H5 C 3 2.356 1.125 3.536 32 H6 C 3 H6 C 3 4.036 2.811 2.934 33 2H2* C 3 1H2' C 3 4.393 6.305 4.048 34 1H2* C 3 2H2' C 3 4.893 4.609 3.780 35 1H5* T 4 1H5' T 4 3.929 9.206 2.680 36 2H5* T 4 2H5' T 4 4.648 10.450 3.725 37 H4* T 4 H4' T 4 2.193 10.521 3.878 38 H3* T 4 H3' T 4 3.932 10.162 6.204 39 1H2* T 4 2H2' T 4 2.917 8.162 6.851 40 2H2* T 4 1H2' T 4 1.673 9.270 7.515 41 H1* T 4 H1' T 4 0.330 9.026 5.509 42 H3 T 4 H3 T 4 -1.549 5.117 6.759 43 1H5M T 4 1H5M T 4 2.882 3.648 4.431 44 2H5M T 4 2H5M T 4 3.610 3.954 6.021 45 3H5M T 4 3H5M T 4 2.388 2.691 5.837 46 H6 T 4 H6 T 4 2.852 6.333 5.233 47 1H5* A 5 1H5' A 5 -0.519 11.137 6.634 48 2H5* A 5 2H5' A 5 -0.595 12.514 7.749 49 H4* A 5 H4' A 5 -2.549 11.141 8.112 50 H3* A 5 H3' A 5 -0.619 11.648 10.240 51 H1* A 5 H1' A 5 -2.983 8.701 9.645 52 H8 A 5 H8 A 5 0.772 7.659 9.322 53 1H6 A 5 1H6 A 5 -0.105 2.737 9.736 54 2H6 A 5 2H6 A 5 -1.685 1.948 9.964 55 H2 A 5 H2 A 5 -4.888 4.693 10.132 56 2H2* A 5 1H2' A 5 -1.674 9.459 11.546 57 1H2* A 5 2H2' A 5 -0.170 9.373 10.585 58 1H5* C 6 1H5' C 6 -5.098 10.418 10.805 59 2H5* C 6 2H5' C 6 -5.697 11.323 12.212 60 H4* C 6 H4' C 6 -6.889 9.161 11.971 61 H3* C 6 H3' C 6 -5.470 9.985 14.404 62 H1* C 6 H1' C 6 -6.297 6.548 12.909 63 1H4 C 6 1H4 C 6 -1.575 2.535 13.419 64 2H4 C 6 2H4 C 6 -0.377 3.572 12.605 65 H5 C 6 H5 C 6 -1.005 5.902 12.031 66 H6 C 6 H6 C 6 -2.873 7.475 12.047 67 2H2* C 6 1H2' C 6 -5.655 7.321 15.127 68 1H2* C 6 2H2' C 6 -4.163 8.053 14.464 69 1H5* T 7 1H5' T 7 -8.423 6.466 14.446 70 2H5* T 7 2H5' T 7 -9.468 6.653 15.871 71 H4* T 7 H4' T 7 -8.931 4.273 15.507 72 H3* T 7 H3' T 7 -8.245 5.701 18.009 73 1H2* T 7 2H2' T 7 -6.077 4.904 18.031 74 2H2* T 7 1H2' T 7 -6.824 3.356 18.519 75 H1* T 7 H1' T 7 -6.840 2.594 16.221 76 H3 T 7 H3 T 7 -2.568 1.395 15.540 77 1H5M T 7 1H5M T 7 -2.155 6.402 17.193 78 2H5M T 7 2H5M T 7 -1.002 5.815 15.983 79 3H5M T 7 3H5M T 7 -2.462 6.668 15.464 80 H6 T 7 H6 T 7 -4.677 5.602 16.552 81 1H5* C 8 1H5' C 8 -9.756 1.141 17.821 82 2H5* C 8 2H5' C 8 -10.482 0.812 19.410 83 H4* C 8 H4' C 8 -9.352 -1.221 18.541 84 H3* C 8 H3' C 8 -8.013 0.153 20.917 85 H1* C 8 H1' C 8 -6.438 -2.064 18.147 86 1H4 C 8 1H4 C 8 -1.025 0.623 19.232 87 2H4 C 8 2H4 C 8 -1.678 2.253 19.496 88 H5 C 8 H5 C 8 -4.131 2.589 19.483 89 H6 C 8 H6 C 8 -6.262 1.406 19.243 90 2H2* C 8 1H2' C 8 -7.561 -2.713 20.041 91 1H2* C 8 2H2' C 8 -6.453 -1.639 20.946 92 1H5* T 9 1H5' T 9 -8.773 -3.876 20.467 93 2H5* T 9 2H5' T 9 -9.508 -4.716 21.847 94 H4* T 9 H4' T 9 -7.753 -6.094 20.694 95 H3* T 9 H3' T 9 -8.053 -5.849 23.478 96 1H2* T 9 2H2' T 9 -6.306 -4.205 23.682 97 2H2* T 9 1H2' T 9 -5.400 -5.721 23.994 98 H1* T 9 H1' T 9 -4.699 -5.832 21.672 99 H3 T 9 H3 T 9 -1.252 -2.961 21.630 100 1H5M T 9 1H5M T 9 -5.107 -0.236 24.008 101 2H5M T 9 2H5M T 9 -3.900 0.648 23.064 102 3H5M T 9 3H5M T 9 -5.429 0.174 22.309 103 H6 T 9 H6 T 9 -5.917 -2.467 22.711 104 1H5* T 10 1H5' T 10 -4.343 -7.925 21.787 105 2H5* T 10 2H5' T 10 -4.047 -9.425 22.691 106 H4* T 10 H4' T 10 -1.906 -8.380 22.061 107 H3* T 10 H3' T 10 -2.612 -9.058 24.794 108 1H2* T 10 2H2' T 10 -2.511 -6.804 25.510 109 2H2* T 10 1H2' T 10 -0.773 -7.207 25.648 110 H1* T 10 H1' T 10 -0.362 -6.342 23.399 111 H3 T 10 H3 T 10 0.191 -2.086 24.734 112 1H5M T 10 1H5M T 10 -4.394 -1.524 25.636 113 2H5M T 10 2H5M T 10 -5.007 -2.572 24.348 114 3H5M T 10 3H5M T 10 -4.856 -3.191 26.007 115 H6 T 10 H6 T 10 -3.642 -4.987 24.475 116 1H5* T 11 1H5' T 11 1.720 -7.819 23.575 117 2H5* T 11 2H5' T 11 2.778 -9.022 24.342 118 H4* T 11 H4' T 11 3.920 -6.852 24.259 119 H3* T 11 H3' T 11 3.551 -8.354 26.698 120 1H2* T 11 2H2' T 11 2.117 -6.701 27.634 121 2H2* T 11 1H2' T 11 3.709 -6.053 28.145 122 H1* T 11 H1' T 11 3.789 -4.622 26.158 123 H3 T 11 H3 T 11 1.516 -1.347 28.281 124 1H5M T 11 1H5M T 11 -2.195 -4.366 26.045 125 2H5M T 11 2H5M T 11 -2.106 -5.137 27.643 126 3H5M T 11 3H5M T 11 -2.620 -3.450 27.498 127 H6 T 11 H6 T 11 0.232 -5.553 26.320 128 1H5* G 12 1H5' G 12 6.429 -4.688 26.047 129 2H5* G 12 2H5' G 12 7.928 -5.298 26.770 130 H4* G 12 H4' G 12 7.948 -2.843 26.766 131 H3* G 12 H3' G 12 8.450 -4.405 29.102 132 H1* G 12 H1' G 12 6.757 -1.048 28.888 133 H8 G 12 H8 G 12 3.988 -3.742 29.488 134 H1 G 12 H1 G 12 2.267 2.324 30.737 135 1H2 G 12 1H2 G 12 5.557 2.957 29.877 136 2H2 G 12 2H2 G 12 4.026 3.660 30.419 137 2H2* G 12 1H2' G 12 7.374 -2.542 30.736 138 1H2* G 12 2H2' G 12 6.320 -3.830 30.066 139 1H5* T 13 1H5' T 13 8.526 0.229 28.845 140 2H5* T 13 2H5' T 13 10.180 0.564 29.393 141 H4* T 13 H4' T 13 8.780 2.553 29.688 142 H3* T 13 H3' T 13 10.397 1.403 31.745 143 1H2* T 13 2H2' T 13 8.521 0.622 32.982 144 2H2* T 13 1H2' T 13 8.707 2.258 33.696 145 H1* T 13 H1' T 13 7.015 3.140 32.165 146 H3 T 13 H3 T 13 3.670 1.790 34.919 147 1H5M T 13 1H5M T 13 4.496 -2.263 31.655 148 2H5M T 13 2H5M T 13 5.618 -2.718 32.954 149 3H5M T 13 3H5M T 13 3.880 -2.618 33.276 150 H6 T 13 H6 T 13 6.562 -0.475 31.816 151 1H5* A 14 1H5' A 14 8.276 5.546 32.282 152 2H5* A 14 2H5' A 14 9.496 6.603 33.022 153 H4* A 14 H4' A 14 7.226 7.269 33.719 154 H3* A 14 H3' A 14 9.382 6.666 35.580 155 H1* A 14 H1' A 14 5.608 6.349 35.928 156 H8 A 14 H8 A 14 7.286 2.805 35.933 157 1H6 A 14 1H6 A 14 1.745 1.135 38.268 158 2H6 A 14 2H6 A 14 3.326 0.441 37.838 159 H2 A 14 H2 A 14 1.563 5.304 37.527 160 2H2* A 14 1H2' A 14 7.468 6.246 37.498 161 1H2* A 14 2H2' A 14 8.195 4.889 36.581 162 1H5* G 15 1H5' G 15 5.448 8.756 36.864 163 2H5* G 15 2H5' G 15 5.974 10.195 37.761 164 H4* G 15 H4' G 15 3.813 9.377 38.639 165 H3* G 15 H3' G 15 6.150 9.837 40.289 166 H1* G 15 H1' G 15 3.269 7.436 40.665 167 H8 G 15 H8 G 15 6.551 5.419 39.974 168 H1 G 15 H1 G 15 1.543 1.978 42.085 169 1H2 G 15 1H2 G 15 -0.021 5.062 42.003 170 2H2 G 15 2H2 G 15 -0.205 3.339 42.361 171 2H2* G 15 1H2' G 15 5.149 8.080 42.118 172 1H2* G 15 2H2' G 15 6.310 7.531 40.867 173 1H5* T 16 1H5' T 16 1.729 9.312 42.055 174 2H5* T 16 2H5' T 16 1.668 10.532 43.342 175 H4* T 16 H4' T 16 0.231 8.617 43.915 176 H3* T 16 H3' T 16 2.444 9.522 45.634 177 1H2* T 16 2H2' T 16 3.361 7.373 45.768 178 2H2* T 16 1H2' T 16 2.033 7.099 46.937 179 H1* T 16 H1' T 16 0.623 6.193 45.164 180 H3 T 16 H3 T 16 2.603 2.146 45.773 181 1H5M T 16 1H5M T 16 6.248 4.909 43.160 182 2H5M T 16 2H5M T 16 6.020 3.215 42.706 183 3H5M T 16 3H5M T 16 5.200 4.489 41.791 184 H6 T 16 H6 T 16 3.804 6.139 43.375 185 1H5* G 17 1H5' G 17 -0.798 6.728 47.221 186 2H5* G 17 2H5' G 17 -1.372 7.436 48.745 187 H4* G 17 H4' G 17 -1.353 4.999 48.948 188 H3* G 17 H3' G 17 0.097 6.736 50.767 189 H1* G 17 H1' G 17 0.691 3.185 49.674 190 H8 G 17 H8 G 17 3.723 5.381 48.557 191 H1 G 17 H1 G 17 4.422 -0.971 47.816 192 1H2 G 17 1H2 G 17 1.171 -1.005 48.998 193 2H2 G 17 2H2 G 17 2.527 -1.984 48.422 194 H3T G 17 H3T G 17 -0.766 4.034 51.008 195 2H2* G 17 1H2' G 17 1.723 4.618 51.387 196 1H2* G 17 2H2' G 17 2.198 5.801 50.127 197 1H5* C 1 1H5' C 1 5.894 -9.572 46.251 198 2H5* C 1 2H5' C 1 6.284 -8.024 45.476 199 H4* C 1 H4' C 1 4.671 -8.286 48.057 200 H3* C 1 H3' C 1 3.750 -8.795 45.324 201 H1* C 1 H1' C 1 3.001 -6.025 47.840 202 1H4 C 1 1H4 C 1 4.604 -0.249 45.041 203 2H4 C 1 2H4 C 1 3.194 -0.168 46.134 204 H5 C 1 H5 C 1 5.610 -2.529 44.643 205 H6 C 1 H6 C 1 5.383 -4.888 45.258 206 H5T C 1 H5T C 1 6.970 -8.830 48.115 207 2H2* C 1 1H2' C 1 1.941 -6.763 45.752 208 1H2* C 1 2H2' C 1 3.473 -6.505 44.872 209 1H5* A 2 1H5' A 2 0.850 -7.116 48.327 210 2H5* A 2 2H5' A 2 -0.745 -7.883 48.149 211 H4* A 2 H4' A 2 -1.065 -5.480 48.448 212 H3* A 2 H3' A 2 -2.015 -6.857 46.076 213 H1* A 2 H1' A 2 -0.823 -3.259 46.544 214 H8 A 2 H8 A 2 1.432 -5.272 44.055 215 1H6 A 2 1H6 A 2 4.059 0.328 43.221 216 2H6 A 2 2H6 A 2 4.145 -1.339 42.603 217 H2 A 2 H2 A 2 1.116 0.777 46.242 218 2H2* A 2 1H2' A 2 -1.995 -4.432 44.772 219 1H2* A 2 2H2' A 2 -0.652 -5.603 44.614 220 1H5* C 3 1H5' C 3 -3.430 -2.592 47.447 221 2H5* C 3 2H5' C 3 -5.146 -2.434 47.017 222 H4* C 3 H4' C 3 -4.002 -0.253 46.834 223 H3* C 3 H3' C 3 -5.448 -1.497 44.606 224 H1* C 3 H1' C 3 -2.535 0.974 44.755 225 1H4 C 3 1H4 C 3 2.424 -1.800 41.341 226 2H4 C 3 2H4 C 3 2.530 -0.024 41.474 227 H5 C 3 H5 C 3 0.428 -2.910 42.362 228 H6 C 3 H6 C 3 -1.628 -2.455 43.625 229 2H2* C 3 1H2' C 3 -4.090 0.310 43.006 230 1H2* C 3 2H2' C 3 -3.594 -1.402 43.184 231 1H5* T 4 1H5' T 4 -4.348 2.987 44.778 232 2H5* T 4 2H5' T 4 -5.791 3.896 44.280 233 H4* T 4 H4' T 4 -3.713 5.047 43.562 234 H3* T 4 H3' T 4 -5.881 4.306 41.728 235 1H2* T 4 2H2' T 4 -4.456 3.096 40.323 236 2H2* T 4 1H2' T 4 -4.019 4.731 39.725 237 H1* T 4 H1' T 4 -2.118 4.812 41.243 238 H3 T 4 H3 T 4 0.213 2.480 38.090 239 1H5M T 4 1H5M T 4 -2.704 -1.222 40.400 240 2H5M T 4 2H5M T 4 -1.008 -1.612 40.073 241 3H5M T 4 3H5M T 4 -1.488 -1.046 41.681 242 H6 T 4 H6 T 4 -2.792 1.253 41.645 243 1H5* A 5 1H5' A 5 -2.503 7.084 40.610 244 2H5* A 5 2H5' A 5 -3.190 8.535 39.852 245 H4* A 5 H4' A 5 -1.040 7.977 38.809 246 H3* A 5 H3' A 5 -3.578 8.040 37.261 247 H1* A 5 H1' A 5 -0.152 6.355 36.818 248 H8 A 5 H8 A 5 -3.118 3.835 37.180 249 1H6 A 5 1H6 A 5 -0.739 0.005 35.001 250 2H6 A 5 2H6 A 5 0.902 0.015 34.308 251 H2 A 5 H2 A 5 2.813 3.761 34.652 252 2H2* A 5 1H2' A 5 -1.878 7.047 35.268 253 1H2* A 5 2H2' A 5 -3.098 6.085 36.154 254 1H5* C 6 1H5' C 6 0.652 9.404 35.683 255 2H5* C 6 2H5' C 6 0.394 10.668 34.461 256 H4* C 6 H4' C 6 2.343 9.231 33.882 257 H3* C 6 H3' C 6 -0.031 9.516 32.094 258 H1* C 6 H1' C 6 2.737 6.849 32.596 259 1H4 C 6 1H4 C 6 -0.952 1.379 33.326 260 2H4 C 6 2H4 C 6 0.723 1.041 32.821 261 H5 C 6 H5 C 6 -1.641 3.764 33.562 262 H6 C 6 H6 C 6 -0.806 6.065 33.393 263 2H2* C 6 1H2' C 6 1.499 7.592 30.699 264 1H2* C 6 2H2' C 6 -0.053 7.294 31.533 265 1H5* A 7 1H5' A 7 3.767 8.042 30.978 266 2H5* A 7 2H5' A 7 4.528 9.046 29.728 267 H4* A 7 H4' A 7 5.218 6.671 29.529 268 H3* A 7 H3' A 7 4.123 8.254 27.352 269 H1* A 7 H1' A 7 4.001 4.503 28.057 270 H8 A 7 H8 A 7 0.472 6.103 28.555 271 1H6 A 7 1H6 A 7 -1.404 0.220 27.619 272 2H6 A 7 2H6 A 7 -2.063 1.834 27.978 273 H2 A 7 H2 A 7 2.814 0.248 27.238 274 2H2* A 7 1H2' A 7 3.507 5.876 26.103 275 1H2* A 7 2H2' A 7 2.293 6.805 27.033 276 1H5* A 8 1H5' A 8 6.924 4.525 26.836 277 2H5* A 8 2H5' A 8 8.076 5.029 25.583 278 H4* A 8 H4' A 8 7.796 2.544 25.684 279 H3* A 8 H3' A 8 7.635 4.145 23.271 280 H1* A 8 H1' A 8 5.843 0.887 24.214 281 H8 A 8 H8 A 8 3.385 3.931 24.274 282 1H6 A 8 1H6 A 8 -0.864 -0.518 23.229 283 2H6 A 8 2H6 A 8 -0.740 1.243 23.467 284 H2 A 8 H2 A 8 2.914 -2.432 23.397 285 2H2* A 8 1H2' A 8 6.177 2.096 22.140 286 1H2* A 8 2H2' A 8 5.392 3.546 22.833 287 1H5* A 9 1H5' A 9 7.934 -0.511 23.029 288 2H5* A 9 2H5' A 9 9.231 -0.816 21.855 289 H4* A 9 H4' A 9 7.502 -2.581 21.730 290 H3* A 9 H3' A 9 8.380 -0.994 19.437 291 H1* A 9 H1' A 9 5.063 -2.732 20.225 292 H8 A 9 H8 A 9 4.761 1.141 19.819 293 1H6 A 9 1H6 A 9 -1.347 -0.078 20.190 294 2H6 A 9 2H6 A 9 -0.228 1.282 19.926 295 H2 A 9 H2 A 9 0.668 -3.766 20.661 296 2H2* A 9 1H2' A 9 6.053 -1.821 18.202 297 1H2* A 9 2H2' A 9 6.217 -0.215 18.975 298 1H5* G 10 1H5' G 10 6.347 -5.177 19.230 299 2H5* G 10 2H5' G 10 7.133 -6.084 17.922 300 H4* G 10 H4' G 10 4.753 -6.748 18.201 301 H3* G 10 H3' G 10 5.957 -6.046 15.683 302 H1* G 10 H1' G 10 2.408 -5.517 16.866 303 H8 G 10 H8 G 10 4.142 -2.100 16.152 304 H1 G 10 H1 G 10 -2.061 -1.748 17.810 305 1H2 G 10 1H2 G 10 -2.792 -3.800 18.331 306 2H2 G 10 2H2 G 10 -1.659 -5.158 18.234 307 2H2* G 10 1H2' G 10 3.552 -5.184 14.735 308 1H2* G 10 2H2' G 10 4.689 -4.030 15.501 309 1H5* A 11 1H5' A 11 1.730 -7.706 16.351 310 2H5* A 11 2H5' A 11 1.386 -8.916 15.099 311 H4* A 11 H4' A 11 -0.684 -7.791 15.893 312 H3* A 11 H3' A 11 0.067 -8.064 13.105 313 H1* A 11 H1' A 11 -1.950 -5.347 14.894 314 H8 A 11 H8 A 11 1.568 -4.056 13.826 315 1H6 A 11 1H6 A 11 0.404 0.808 14.057 316 2H6 A 11 2H6 A 11 -1.177 1.518 14.467 317 H2 A 11 H2 A 11 -4.113 -1.398 15.307 318 2H2* A 11 1H2' A 11 -1.561 -5.925 12.554 319 1H2* A 11 2H2' A 11 0.205 -5.728 12.778 320 1H5* G 12 1H5' G 12 -4.152 -6.794 14.580 321 2H5* G 12 2H5' G 12 -5.325 -7.712 13.614 322 H4* G 12 H4' G 12 -6.236 -5.500 14.278 323 H3* G 12 H3' G 12 -6.068 -6.420 11.485 324 H1* G 12 H1' G 12 -6.145 -2.976 13.141 325 H8 G 12 H8 G 12 -2.677 -3.687 11.489 326 H1 G 12 H1 G 12 -4.226 2.524 12.075 327 1H2 G 12 1H2 G 12 -7.122 1.206 13.431 328 2H2 G 12 2H2 G 12 -6.246 2.685 13.011 329 2H2* G 12 1H2' G 12 -6.593 -3.764 10.885 330 1H2* G 12 2H2' G 12 -4.960 -4.493 10.789 331 1H5* T 13 1H5' T 13 -8.808 -2.861 12.504 332 2H5* T 13 2H5' T 13 -10.295 -3.016 11.543 333 H4* T 13 H4' T 13 -9.515 -0.680 11.481 334 H3* T 13 H3' T 13 -9.324 -2.323 8.938 335 1H2* T 13 2H2' T 13 -7.904 -0.836 7.984 336 2H2* T 13 1H2' T 13 -8.931 0.545 8.456 337 H1* T 13 H1' T 13 -7.725 0.899 10.410 338 H3 T 13 H3 T 13 -3.688 2.127 8.898 339 1H5M T 13 1H5M T 13 -3.935 -3.013 7.677 340 2H5M T 13 2H5M T 13 -2.374 -2.335 8.162 341 3H5M T 13 3H5M T 13 -3.405 -3.118 9.369 342 H6 T 13 H6 T 13 -5.926 -2.122 9.262 343 1H5* A 14 1H5' A 14 -10.806 1.846 9.521 344 2H5* A 14 2H5' A 14 -12.233 2.158 8.511 345 H4* A 14 H4' A 14 -10.822 4.181 8.659 346 H3* A 14 H3' A 14 -11.723 3.029 6.186 347 H1* A 14 H1' A 14 -8.503 4.880 6.917 348 H8 A 14 H8 A 14 -7.786 1.136 6.070 349 1H6 A 14 1H6 A 14 -2.849 1.693 5.531 350 2H6 A 14 2H6 A 14 -1.893 3.170 5.811 351 H2 A 14 H2 A 14 -4.265 6.447 7.033 352 2H2* A 14 1H2' A 14 -9.545 4.024 4.883 353 1H2* A 14 2H2' A 14 -9.522 2.359 5.546 354 1H5* G 15 1H5' G 15 -9.524 7.297 6.106 355 2H5* G 15 2H5' G 15 -10.589 8.218 5.025 356 H4* G 15 H4' G 15 -8.306 8.985 4.677 357 H3* G 15 H3' G 15 -9.898 7.832 2.520 358 H1* G 15 H1' G 15 -6.164 8.028 3.104 359 H8 G 15 H8 G 15 -7.350 4.312 3.355 360 H1 G 15 H1 G 15 -1.058 5.146 2.324 361 1H2 G 15 1H2 G 15 -1.936 8.486 2.456 362 2H2 G 15 2H2 G 15 -0.615 7.327 2.252 363 2H2* G 15 1H2' G 15 -7.540 7.395 1.180 364 1H2* G 15 2H2' G 15 -8.322 6.104 2.147 365 1H5* T 16 1H5' T 16 -5.882 9.741 1.546 366 2H5* T 16 2H5' T 16 -6.125 10.819 0.155 367 H4* T 16 H4' T 16 -3.977 9.692 -0.084 368 H3* T 16 H3' T 16 -6.179 9.167 -2.042 369 1H2* T 16 2H2' T 16 -5.614 6.940 -2.208 370 2H2* T 16 1H2' T 16 -4.113 7.488 -3.011 371 H1* T 16 H1' T 16 -2.931 7.490 -0.906 372 H3 T 16 H3 T 16 -1.949 3.141 -0.751 373 1H5M T 16 1H5M T 16 -6.341 1.929 0.410 374 2H5M T 16 2H5M T 16 -6.920 3.454 1.087 375 3H5M T 16 3H5M T 16 -7.198 3.080 -0.627 376 H6 T 16 H6 T 16 -6.065 5.592 -0.261 377 1H5* G 17 1H5' G 17 -1.735 8.973 -3.171 378 2H5* G 17 2H5' G 17 -1.552 9.662 -4.798 379 H4* G 17 H4' G 17 -0.137 7.677 -4.611 380 H3* G 17 H3' G 17 -2.178 7.941 -6.654 381 H1* G 17 H1' G 17 -0.704 4.918 -4.973 382 H8 G 17 H8 G 17 -4.550 4.859 -4.581 383 H1 G 17 H1 G 17 -1.419 0.126 -1.551 384 1H2 G 17 1H2 G 17 1.351 1.923 -2.585 385 2H2 G 17 2H2 G 17 0.780 0.495 -1.711 386 H3T G 17 H3T G 17 0.110 7.711 -6.945 387 2H2* G 17 1H2' G 17 -2.251 5.210 -6.861 388 1H2* G 17 2H2' G 17 -3.406 6.076 -5.797 Start of MODEL 5 1 1H5* C 1 1H5' C 1 3.684 -7.599 -1.786 2 2H5* C 1 2H5' C 1 2.233 -6.809 -1.135 3 H4* C 1 H4' C 1 4.093 -5.551 -3.210 4 H3* C 1 H3' C 1 4.700 -5.881 -0.431 5 H1* C 1 H1' C 1 3.634 -2.746 -2.251 6 1H4 C 1 1H4 C 1 -2.039 -0.526 0.362 7 2H4 C 1 2H4 C 1 -1.069 0.717 -0.474 8 H5 C 1 H5 C 1 -1.091 -2.852 0.449 9 H6 C 1 H6 C 1 0.836 -4.200 -0.257 10 H5T C 1 H5T C 1 1.800 -8.194 -2.903 11 2H2* C 1 1H2' C 1 4.362 -3.227 0.041 12 1H2* C 1 2H2' C 1 2.989 -4.358 0.257 13 1H5* A 2 1H5' A 2 5.969 -1.891 -2.614 14 2H5* A 2 2H5' A 2 7.595 -1.522 -2.001 15 H4* A 2 H4' A 2 6.361 0.566 -2.303 16 H3* A 2 H3' A 2 7.489 -0.234 0.257 17 H1* A 2 H1' A 2 4.506 1.949 -0.600 18 H8 A 2 H8 A 2 3.322 -1.316 1.213 19 1H6 A 2 1H6 A 2 -1.983 1.939 1.721 20 2H6 A 2 2H6 A 2 -1.287 0.363 2.170 21 H2 A 2 H2 A 2 0.772 4.387 -0.368 22 2H2* A 2 1H2' A 2 5.735 1.511 1.458 23 1H2* A 2 2H2' A 2 5.377 -0.239 1.326 24 1H5* C 3 1H5' C 3 6.177 4.277 -0.586 25 2H5* C 3 2H5' C 3 7.419 5.256 0.224 26 H4* C 3 H4' C 3 5.243 6.366 0.461 27 H3* C 3 H3' C 3 6.741 5.355 2.832 28 H1* C 3 H1' C 3 3.057 6.196 2.050 29 1H4 C 3 1H4 C 3 -0.114 0.688 3.948 30 2H4 C 3 2H4 C 3 -1.162 2.125 3.802 31 H5 C 3 H5 C 3 2.330 1.003 3.504 32 H6 C 3 H6 C 3 3.997 2.691 2.869 33 2H2* C 3 1H2' C 3 4.370 6.241 4.071 34 1H2* C 3 2H2' C 3 4.854 4.536 3.834 35 1H5* T 4 1H5' T 4 3.978 9.063 2.807 36 2H5* T 4 2H5' T 4 4.708 10.294 3.858 37 H4* T 4 H4' T 4 2.259 10.354 4.061 38 H3* T 4 H3' T 4 4.040 9.907 6.355 39 1H2* T 4 2H2' T 4 2.972 7.944 7.000 40 2H2* T 4 1H2' T 4 1.746 9.074 7.661 41 H1* T 4 H1' T 4 0.406 8.856 5.653 42 H3 T 4 H3 T 4 -1.515 4.958 6.877 43 1H5M T 4 1H5M T 4 2.854 3.461 4.463 44 2H5M T 4 2H5M T 4 3.621 3.733 6.041 45 3H5M T 4 3H5M T 4 2.376 2.491 5.866 46 H6 T 4 H6 T 4 2.885 6.136 5.320 47 1H5* A 5 1H5' A 5 -0.354 10.976 6.827 48 2H5* A 5 2H5' A 5 -0.399 12.350 7.946 49 H4* A 5 H4' A 5 -2.385 11.029 8.305 50 H3* A 5 H3' A 5 -0.444 11.473 10.434 51 H1* A 5 H1' A 5 -2.883 8.595 9.832 52 H8 A 5 H8 A 5 0.832 7.443 9.447 53 1H6 A 5 1H6 A 5 -1.773 1.798 10.080 54 2H6 A 5 2H6 A 5 -0.183 2.557 9.823 55 H2 A 5 H2 A 5 -4.896 4.645 10.368 56 2H2* A 5 1H2' A 5 -1.541 9.301 11.730 57 1H2* A 5 2H2' A 5 -0.047 9.182 10.757 58 1H5* C 6 1H5' C 6 -4.949 10.324 11.008 59 2H5* C 6 2H5' C 6 -5.521 11.248 12.414 60 H4* C 6 H4' C 6 -6.757 9.111 12.197 61 H3* C 6 H3' C 6 -5.282 9.904 14.612 62 H1* C 6 H1' C 6 -6.226 6.492 13.123 63 1H4 C 6 1H4 C 6 -1.606 2.350 13.580 64 2H4 C 6 2H4 C 6 -0.391 3.360 12.759 65 H5 C 6 H5 C 6 -0.965 5.701 12.190 66 H6 C 6 H6 C 6 -2.789 7.326 12.229 67 2H2* C 6 1H2' C 6 -5.555 7.246 15.338 68 1H2* C 6 2H2' C 6 -4.043 7.930 14.673 69 1H5* T 7 1H5' T 7 -8.329 6.479 14.683 70 2H5* T 7 2H5' T 7 -9.353 6.689 16.119 71 H4* T 7 H4' T 7 -8.884 4.298 15.740 72 H3* T 7 H3' T 7 -8.149 5.692 18.244 73 1H2* T 7 2H2' T 7 -5.986 4.867 18.226 74 2H2* T 7 1H2' T 7 -6.752 3.336 18.739 75 H1* T 7 H1' T 7 -6.829 2.563 16.441 76 H3 T 7 H3 T 7 -2.603 1.232 15.734 77 1H5M T 7 1H5M T 7 -2.334 6.488 15.566 78 2H5M T 7 2H5M T 7 -2.040 6.258 17.302 79 3H5M T 7 3H5M T 7 -0.902 5.605 16.114 80 H6 T 7 H6 T 7 -4.578 5.512 16.710 81 1H5* C 8 1H5' C 8 -9.663 1.152 17.979 82 2H5* C 8 2H5' C 8 -10.400 0.797 19.557 83 H4* C 8 H4' C 8 -9.283 -1.230 18.659 84 H3* C 8 H3' C 8 -7.944 0.100 21.059 85 H1* C 8 H1' C 8 -6.366 -2.082 18.259 86 1H4 C 8 1H4 C 8 -0.948 0.598 19.327 87 2H4 C 8 2H4 C 8 -1.602 2.220 19.634 88 H5 C 8 H5 C 8 -4.054 2.550 19.659 89 H6 C 8 H6 C 8 -6.186 1.370 19.421 90 2H2* C 8 1H2' C 8 -7.489 -2.752 20.144 91 1H2* C 8 2H2' C 8 -6.382 -1.690 21.063 92 1H5* T 9 1H5' T 9 -8.690 -3.922 20.534 93 2H5* T 9 2H5' T 9 -9.401 -4.801 21.902 94 H4* T 9 H4' T 9 -7.632 -6.129 20.719 95 H3* T 9 H3' T 9 -7.894 -5.905 23.519 96 1H2* T 9 2H2' T 9 -6.135 -4.276 23.707 97 2H2* T 9 1H2' T 9 -5.226 -5.799 23.973 98 H1* T 9 H1' T 9 -4.596 -5.881 21.625 99 H3 T 9 H3 T 9 -1.108 -3.067 21.547 100 1H5M T 9 1H5M T 9 -5.241 0.102 22.426 101 2H5M T 9 2H5M T 9 -4.811 -0.317 24.099 102 3H5M T 9 3H5M T 9 -3.664 0.566 23.081 103 H6 T 9 H6 T 9 -5.732 -2.518 22.763 104 1H5* T 10 1H5' T 10 -4.223 -7.973 21.719 105 2H5* T 10 2H5' T 10 -3.903 -9.475 22.611 106 H4* T 10 H4' T 10 -1.778 -8.429 21.939 107 H3* T 10 H3' T 10 -2.424 -9.100 24.688 108 1H2* T 10 2H2' T 10 -2.315 -6.841 25.392 109 2H2* T 10 1H2' T 10 -0.574 -7.242 25.499 110 H1* T 10 H1' T 10 -0.208 -6.389 23.237 111 H3 T 10 H3 T 10 0.386 -2.139 24.585 112 1H5M T 10 1H5M T 10 -4.190 -1.546 25.509 113 2H5M T 10 2H5M T 10 -4.824 -2.608 24.242 114 3H5M T 10 3H5M T 10 -4.649 -3.208 25.906 115 H6 T 10 H6 T 10 -3.466 -5.017 24.351 116 1H5* T 11 1H5' T 11 1.874 -7.790 23.429 117 2H5* T 11 2H5' T 11 2.945 -9.005 24.157 118 H4* T 11 H4' T 11 4.088 -6.841 24.130 119 H3* T 11 H3' T 11 3.691 -8.383 26.543 120 1H2* T 11 2H2' T 11 2.263 -6.737 27.496 121 2H2* T 11 1H2' T 11 3.855 -6.105 28.026 122 H1* T 11 H1' T 11 3.952 -4.642 26.063 123 H3 T 11 H3 T 11 1.664 -1.363 28.154 124 1H5M T 11 1H5M T 11 -2.463 -3.501 27.421 125 2H5M T 11 2H5M T 11 -2.042 -4.422 25.970 126 3H5M T 11 3H5M T 11 -1.935 -5.183 27.573 127 H6 T 11 H6 T 11 0.395 -5.591 26.235 128 1H5* G 12 1H5' G 12 6.600 -4.711 26.027 129 2H5* G 12 2H5' G 12 8.081 -5.332 26.776 130 H4* G 12 H4' G 12 8.096 -2.887 26.871 131 H3* G 12 H3' G 12 8.463 -4.530 29.186 132 H1* G 12 H1' G 12 6.835 -1.148 28.956 133 H8 G 12 H8 G 12 3.994 -3.793 29.431 134 H1 G 12 H1 G 12 2.345 2.308 30.610 135 1H2 G 12 1H2 G 12 4.146 3.610 30.360 136 2H2 G 12 2H2 G 12 5.678 2.863 29.882 137 2H2* G 12 1H2' G 12 7.338 -2.683 30.808 138 1H2* G 12 2H2' G 12 6.301 -3.942 30.064 139 1H5* T 13 1H5' T 13 8.799 0.109 28.990 140 2H5* T 13 2H5' T 13 10.423 0.359 29.659 141 H4* T 13 H4' T 13 9.076 2.414 29.841 142 H3* T 13 H3' T 13 10.563 1.252 31.973 143 1H2* T 13 2H2' T 13 8.614 0.487 33.112 144 2H2* T 13 1H2' T 13 8.799 2.112 33.850 145 H1* T 13 H1' T 13 7.191 3.041 32.263 146 H3 T 13 H3 T 13 3.685 1.727 34.816 147 1H5M T 13 1H5M T 13 4.662 -2.354 31.626 148 2H5M T 13 2H5M T 13 5.703 -2.809 32.990 149 3H5M T 13 3H5M T 13 3.951 -2.693 33.211 150 H6 T 13 H6 T 13 6.722 -0.577 31.883 151 1H5* A 14 1H5' A 14 8.476 5.431 32.367 152 2H5* A 14 2H5' A 14 9.683 6.476 33.144 153 H4* A 14 H4' A 14 7.393 7.210 33.709 154 H3* A 14 H3' A 14 9.449 6.647 35.672 155 H1* A 14 H1' A 14 5.665 6.310 35.907 156 H8 A 14 H8 A 14 7.351 2.771 35.892 157 1H6 A 14 1H6 A 14 1.794 1.053 38.147 158 2H6 A 14 2H6 A 14 3.379 0.368 37.713 159 H2 A 14 H2 A 14 1.617 5.238 37.490 160 2H2* A 14 1H2' A 14 7.483 6.214 37.525 161 1H2* A 14 2H2' A 14 8.237 4.855 36.632 162 1H5* G 15 1H5' G 15 5.456 8.727 36.849 163 2H5* G 15 2H5' G 15 5.963 10.166 37.758 164 H4* G 15 H4' G 15 3.797 9.335 38.607 165 H3* G 15 H3' G 15 6.119 9.791 40.285 166 H1* G 15 H1' G 15 3.227 7.398 40.617 167 H8 G 15 H8 G 15 6.512 5.367 39.985 168 H1 G 15 H1 G 15 1.453 1.945 42.003 169 1H2 G 15 1H2 G 15 -0.103 5.033 41.873 170 2H2 G 15 2H2 G 15 -0.299 3.312 42.234 171 2H2* G 15 1H2' G 15 5.085 8.038 42.101 172 1H2* G 15 2H2' G 15 6.263 7.488 40.868 173 1H5* T 16 1H5' T 16 1.680 9.292 41.983 174 2H5* T 16 2H5' T 16 1.593 10.535 43.248 175 H4* T 16 H4' T 16 0.142 8.625 43.818 176 H3* T 16 H3' T 16 2.302 9.578 45.572 177 1H2* T 16 2H2' T 16 3.248 7.445 45.755 178 2H2* T 16 1H2' T 16 1.904 7.174 46.907 179 H1* T 16 H1' T 16 0.536 6.215 45.129 180 H3 T 16 H3 T 16 2.590 2.220 45.864 181 1H5M T 16 1H5M T 16 5.961 3.253 42.736 182 2H5M T 16 2H5M T 16 5.127 4.508 41.809 183 3H5M T 16 3H5M T 16 6.186 4.956 43.161 184 H6 T 16 H6 T 16 3.715 6.165 43.353 185 1H5* G 17 1H5' G 17 -1.038 6.851 47.209 186 2H5* G 17 2H5' G 17 -1.596 7.613 48.713 187 H4* G 17 H4' G 17 -1.626 5.175 48.973 188 H3* G 17 H3' G 17 -0.167 6.931 50.764 189 H1* G 17 H1' G 17 0.408 3.349 49.752 190 H8 G 17 H8 G 17 3.446 5.521 48.613 191 H1 G 17 H1 G 17 4.137 -0.838 47.931 192 1H2 G 17 1H2 G 17 0.883 -0.853 49.106 193 2H2 G 17 2H2 G 17 2.236 -1.843 48.540 194 H3T G 17 H3T G 17 -1.048 4.241 51.059 195 2H2* G 17 1H2' G 17 1.438 4.814 51.436 196 1H2* G 17 2H2' G 17 1.929 5.966 50.154 197 1H5* C 1 1H5' C 1 5.837 -9.279 46.481 198 2H5* C 1 2H5' C 1 6.173 -7.703 45.736 199 H4* C 1 H4' C 1 4.556 -8.069 48.303 200 H3* C 1 H3' C 1 3.663 -8.636 45.594 201 H1* C 1 H1' C 1 2.783 -5.817 48.002 202 1H4 C 1 1H4 C 1 4.394 -0.068 45.147 203 2H4 C 1 2H4 C 1 2.890 -0.005 46.107 204 H5 C 1 H5 C 1 5.515 -2.316 44.924 205 H6 C 1 H6 C 1 5.319 -4.661 45.593 206 H5T C 1 H5T C 1 6.869 -8.533 48.365 207 2H2* C 1 1H2' C 1 1.843 -6.605 45.873 208 1H2* C 1 2H2' C 1 3.417 -6.345 45.070 209 1H5* A 2 1H5' A 2 0.646 -6.878 48.440 210 2H5* A 2 2H5' A 2 -0.926 -7.686 48.240 211 H4* A 2 H4' A 2 -1.316 -5.287 48.417 212 H3* A 2 H3' A 2 -2.119 -6.785 46.060 213 H1* A 2 H1' A 2 -1.058 -3.140 46.447 214 H8 A 2 H8 A 2 1.350 -5.150 44.107 215 1H6 A 2 1H6 A 2 3.899 0.485 43.275 216 2H6 A 2 2H6 A 2 4.042 -1.194 42.699 217 H2 A 2 H2 A 2 0.800 0.936 46.141 218 2H2* A 2 1H2' A 2 -2.113 -4.411 44.667 219 1H2* A 2 2H2' A 2 -0.729 -5.544 44.614 220 1H5* C 3 1H5' C 3 -3.716 -2.549 47.240 221 2H5* C 3 2H5' C 3 -5.414 -2.427 46.735 222 H4* C 3 H4' C 3 -4.262 -0.237 46.553 223 H3* C 3 H3' C 3 -5.660 -1.526 44.318 224 H1* C 3 H1' C 3 -2.753 0.951 44.494 225 1H4 C 3 1H4 C 3 2.315 -1.847 41.270 226 2H4 C 3 2H4 C 3 2.412 -0.070 41.395 227 H5 C 3 H5 C 3 0.270 -2.952 42.206 228 H6 C 3 H6 C 3 -1.821 -2.489 43.409 229 2H2* C 3 1H2' C 3 -4.275 0.270 42.725 230 1H2* C 3 2H2' C 3 -3.784 -1.441 42.926 231 1H5* T 4 1H5' T 4 -4.587 2.967 44.504 232 2H5* T 4 2H5' T 4 -6.015 3.867 43.956 233 H4* T 4 H4' T 4 -3.925 5.038 43.322 234 H3* T 4 H3' T 4 -6.015 4.297 41.406 235 1H2* T 4 2H2' T 4 -4.531 3.074 40.066 236 2H2* T 4 1H2' T 4 -4.090 4.706 39.466 237 H1* T 4 H1' T 4 -2.244 4.822 41.053 238 H3 T 4 H3 T 4 0.226 2.506 37.992 239 1H5M T 4 1H5M T 4 -2.753 -1.216 40.172 240 2H5M T 4 2H5M T 4 -1.042 -1.596 39.923 241 3H5M T 4 3H5M T 4 -1.600 -1.040 41.509 242 H6 T 4 H6 T 4 -2.901 1.257 41.432 243 1H5* A 5 1H5' A 5 -2.586 7.056 40.400 244 2H5* A 5 2H5' A 5 -3.246 8.513 39.629 245 H4* A 5 H4' A 5 -1.065 7.957 38.650 246 H3* A 5 H3' A 5 -3.555 8.025 37.023 247 H1* A 5 H1' A 5 -0.111 6.342 36.681 248 H8 A 5 H8 A 5 -3.103 3.843 36.939 249 1H6 A 5 1H6 A 5 -0.705 0.012 34.792 250 2H6 A 5 2H6 A 5 0.954 0.007 34.145 251 H2 A 5 H2 A 5 2.894 3.732 34.575 252 2H2* A 5 1H2' A 5 -1.775 7.064 35.081 253 1H2* A 5 2H2' A 5 -3.030 6.093 35.906 254 1H5* C 6 1H5' C 6 0.713 9.369 35.551 255 2H5* C 6 2H5' C 6 0.486 10.651 34.342 256 H4* C 6 H4' C 6 2.417 9.199 33.758 257 H3* C 6 H3' C 6 0.053 9.515 31.959 258 H1* C 6 H1' C 6 2.802 6.828 32.457 259 1H4 C 6 1H4 C 6 -0.926 1.375 33.117 260 2H4 C 6 2H4 C 6 0.764 1.030 32.665 261 H5 C 6 H5 C 6 -1.614 3.764 33.320 262 H6 C 6 H6 C 6 -0.765 6.061 33.167 263 2H2* C 6 1H2' C 6 1.580 7.594 30.557 264 1H2* C 6 2H2' C 6 0.021 7.298 31.381 265 1H5* A 7 1H5' A 7 3.869 8.040 30.841 266 2H5* A 7 2H5' A 7 4.620 9.053 29.593 267 H4* A 7 H4' A 7 5.314 6.685 29.364 268 H3* A 7 H3' A 7 4.168 8.276 27.213 269 H1* A 7 H1' A 7 4.102 4.519 27.904 270 H8 A 7 H8 A 7 0.558 6.084 28.420 271 1H6 A 7 1H6 A 7 -1.261 0.179 27.517 272 2H6 A 7 2H6 A 7 -1.934 1.789 27.868 273 H2 A 7 H2 A 7 2.957 0.248 27.126 274 2H2* A 7 1H2' A 7 3.584 5.888 25.958 275 1H2* A 7 2H2' A 7 2.362 6.800 26.894 276 1H5* A 8 1H5' A 8 6.999 4.589 26.653 277 2H5* A 8 2H5' A 8 8.135 5.101 25.388 278 H4* A 8 H4' A 8 7.867 2.612 25.496 279 H3* A 8 H3' A 8 7.692 4.212 23.083 280 H1* A 8 H1' A 8 5.921 0.946 24.037 281 H8 A 8 H8 A 8 3.437 3.970 24.095 282 1H6 A 8 1H6 A 8 -0.666 1.235 23.251 283 2H6 A 8 2H6 A 8 -0.753 -0.529 23.013 284 H2 A 8 H2 A 8 3.033 -2.396 23.214 285 2H2* A 8 1H2' A 8 6.240 2.153 21.959 286 1H2* A 8 2H2' A 8 5.450 3.600 22.652 287 1H5* A 9 1H5' A 9 7.993 -0.460 22.805 288 2H5* A 9 2H5' A 9 9.283 -0.742 21.617 289 H4* A 9 H4' A 9 7.558 -2.502 21.452 290 H3* A 9 H3' A 9 8.378 -0.819 19.194 291 H1* A 9 H1' A 9 5.117 -2.655 20.005 292 H8 A 9 H8 A 9 4.729 1.219 19.665 293 1H6 A 9 1H6 A 9 -1.345 -0.144 20.098 294 2H6 A 9 2H6 A 9 -0.261 1.246 19.842 295 H2 A 9 H2 A 9 0.760 -3.793 20.480 296 2H2* A 9 1H2' A 9 6.055 -1.708 17.977 297 1H2* A 9 2H2' A 9 6.194 -0.104 18.759 298 1H5* G 10 1H5' G 10 6.448 -5.030 18.902 299 2H5* G 10 2H5' G 10 7.226 -5.893 17.560 300 H4* G 10 H4' G 10 4.860 -6.595 17.856 301 H3* G 10 H3' G 10 6.015 -5.810 15.339 302 H1* G 10 H1' G 10 2.476 -5.366 16.592 303 H8 G 10 H8 G 10 4.141 -1.911 15.905 304 H1 G 10 H1 G 10 -2.007 -1.677 17.772 305 1H2 G 10 1H2 G 10 -1.559 -5.091 18.111 306 2H2 G 10 2H2 G 10 -2.694 -3.743 18.270 307 2H2* G 10 1H2' G 10 3.579 -4.968 14.451 308 1H2* G 10 2H2' G 10 4.712 -3.814 15.223 309 1H5* A 11 1H5' A 11 1.853 -7.650 16.024 310 2H5* A 11 2H5' A 11 1.540 -8.838 14.744 311 H4* A 11 H4' A 11 -0.560 -7.818 15.622 312 H3* A 11 H3' A 11 0.116 -8.039 12.817 313 H1* A 11 H1' A 11 -1.938 -5.398 14.668 314 H8 A 11 H8 A 11 1.493 -3.987 13.472 315 1H6 A 11 1H6 A 11 0.187 0.836 13.809 316 2H6 A 11 2H6 A 11 -1.390 1.491 14.315 317 H2 A 11 H2 A 11 -4.174 -1.526 15.302 318 2H2* A 11 1H2' A 11 -1.566 -5.936 12.316 319 1H2* A 11 2H2' A 11 0.197 -5.693 12.517 320 1H5* G 12 1H5' G 12 -4.110 -6.896 14.416 321 2H5* G 12 2H5' G 12 -5.284 -7.808 13.445 322 H4* G 12 H4' G 12 -6.217 -5.629 14.191 323 H3* G 12 H3' G 12 -6.120 -6.482 11.381 324 H1* G 12 H1' G 12 -6.175 -3.067 13.089 325 H8 G 12 H8 G 12 -2.763 -3.727 11.299 326 H1 G 12 H1 G 12 -4.241 2.461 12.227 327 1H2 G 12 1H2 G 12 -6.218 2.591 13.261 328 2H2 G 12 2H2 G 12 -7.079 1.093 13.647 329 2H2* G 12 1H2' G 12 -6.637 -3.823 10.821 330 1H2* G 12 2H2' G 12 -5.002 -4.546 10.705 331 1H5* T 13 1H5' T 13 -8.808 -2.933 12.582 332 2H5* T 13 2H5' T 13 -10.318 -3.029 11.650 333 H4* T 13 H4' T 13 -9.498 -0.700 11.678 334 H3* T 13 H3' T 13 -9.432 -2.227 9.059 335 1H2* T 13 2H2' T 13 -7.995 -0.741 8.127 336 2H2* T 13 1H2' T 13 -8.971 0.646 8.682 337 H1* T 13 H1' T 13 -7.704 0.890 10.615 338 H3 T 13 H3 T 13 -3.682 2.084 9.029 339 1H5M T 13 1H5M T 13 -3.546 -3.190 9.200 340 2H5M T 13 2H5M T 13 -4.121 -2.965 7.534 341 3H5M T 13 3H5M T 13 -2.525 -2.365 8.011 342 H6 T 13 H6 T 13 -6.024 -2.118 9.263 343 1H5* A 14 1H5' A 14 -10.807 1.995 9.825 344 2H5* A 14 2H5' A 14 -12.250 2.343 8.851 345 H4* A 14 H4' A 14 -10.813 4.344 8.993 346 H3* A 14 H3' A 14 -11.776 3.235 6.524 347 H1* A 14 H1' A 14 -8.532 5.044 7.215 348 H8 A 14 H8 A 14 -7.841 1.323 6.259 349 1H6 A 14 1H6 A 14 -2.914 1.893 5.638 350 2H6 A 14 2H6 A 14 -1.949 3.356 5.956 351 H2 A 14 H2 A 14 -4.286 6.585 7.358 352 2H2* A 14 1H2' A 14 -9.612 4.211 5.189 353 1H2* A 14 2H2' A 14 -9.593 2.541 5.841 354 1H5* G 15 1H5' G 15 -9.503 7.475 6.457 355 2H5* G 15 2H5' G 15 -10.553 8.420 5.381 356 H4* G 15 H4' G 15 -8.253 9.136 5.024 357 H3* G 15 H3' G 15 -9.893 8.044 2.878 358 H1* G 15 H1' G 15 -6.150 8.113 3.417 359 H8 G 15 H8 G 15 -7.446 4.433 3.678 360 H1 G 15 H1 G 15 -1.136 5.082 2.626 361 1H2 G 15 1H2 G 15 -1.918 8.446 2.754 362 2H2 G 15 2H2 G 15 -0.631 7.251 2.546 363 2H2* G 15 1H2' G 15 -7.569 7.516 1.514 364 1H2* G 15 2H2' G 15 -8.382 6.256 2.497 365 1H5* T 16 1H5' T 16 -5.805 9.850 1.841 366 2H5* T 16 2H5' T 16 -6.065 10.920 0.447 367 H4* T 16 H4' T 16 -3.951 9.764 0.136 368 H3* T 16 H3' T 16 -6.246 9.170 -1.703 369 1H2* T 16 2H2' T 16 -5.624 6.970 -1.904 370 2H2* T 16 1H2' T 16 -4.143 7.546 -2.725 371 H1* T 16 H1' T 16 -2.931 7.555 -0.648 372 H3 T 16 H3 T 16 -1.951 3.208 -0.458 373 1H5M T 16 1H5M T 16 -6.332 2.009 0.759 374 2H5M T 16 2H5M T 16 -6.927 3.547 1.393 375 3H5M T 16 3H5M T 16 -7.186 3.128 -0.314 376 H6 T 16 H6 T 16 -6.060 5.666 0.055 377 1H5* G 17 1H5' G 17 -1.918 9.000 -3.091 378 2H5* G 17 2H5' G 17 -1.831 9.700 -4.721 379 H4* G 17 H4' G 17 -0.430 7.700 -4.648 380 H3* G 17 H3' G 17 -2.634 7.982 -6.528 381 H1* G 17 H1' G 17 -0.997 4.970 -4.978 382 H8 G 17 H8 G 17 -4.810 4.847 -4.336 383 H1 G 17 H1 G 17 -1.414 0.122 -1.593 384 1H2 G 17 1H2 G 17 1.255 1.970 -2.790 385 2H2 G 17 2H2 G 17 0.761 0.515 -1.913 386 H3T G 17 H3T G 17 -1.203 6.713 -7.793 387 2H2* G 17 1H2' G 17 -2.660 5.247 -6.766 388 1H2* G 17 2H2' G 17 -3.763 6.085 -5.628 Start of MODEL 6 1 1H5* C 1 1H5' C 1 2.346 -7.167 -3.418 2 2H5* C 1 2H5' C 1 0.914 -6.323 -2.798 3 H4* C 1 H4' C 1 2.883 -5.114 -4.797 4 H3* C 1 H3' C 1 3.358 -5.509 -1.977 5 H1* C 1 H1' C 1 2.615 -2.347 -3.912 6 1H4 C 1 1H4 C 1 -2.842 0.470 -1.409 7 2H4 C 1 2H4 C 1 -1.719 1.605 -2.208 8 H5 C 1 H5 C 1 -2.155 -1.944 -1.318 9 H6 C 1 H6 C 1 -0.360 -3.489 -1.974 10 H5T C 1 H5T C 1 1.515 -6.905 -5.516 11 2H2* C 1 1H2' C 1 3.291 -2.808 -1.598 12 1H2* C 1 2H2' C 1 1.822 -3.804 -1.354 13 1H5* A 2 1H5' A 2 5.139 -1.657 -4.047 14 2H5* A 2 2H5' A 2 6.767 -1.481 -3.363 15 H4* A 2 H4' A 2 5.768 0.732 -3.611 16 H3* A 2 H3' A 2 6.723 -0.268 -1.064 17 H1* A 2 H1' A 2 3.984 2.205 -1.877 18 H8 A 2 H8 A 2 2.377 -1.037 -0.373 19 1H6 A 2 1H6 A 2 -2.562 2.741 0.201 20 2H6 A 2 2H6 A 2 -2.061 1.067 0.546 21 H2 A 2 H2 A 2 0.535 5.019 -1.579 22 2H2* A 2 1H2' A 2 5.055 1.499 0.204 23 1H2* A 2 2H2' A 2 4.553 -0.195 -0.089 24 1H5* C 3 1H5' C 3 5.713 4.392 -1.568 25 2H5* C 3 2H5' C 3 6.974 5.216 -0.625 26 H4* C 3 H4' C 3 4.848 6.413 -0.317 27 H3* C 3 H3' C 3 5.852 4.779 2.046 28 H1* C 3 H1' C 3 2.435 6.216 0.852 29 1H4 C 3 1H4 C 3 -0.715 0.852 2.992 30 2H4 C 3 2H4 C 3 -1.611 2.364 3.299 31 H5 C 3 H5 C 3 1.606 1.060 2.085 32 H6 C 3 H6 C 3 3.266 2.704 1.328 33 2H2* C 3 1H2' C 3 3.791 6.866 2.578 34 1H2* C 3 2H2' C 3 3.921 5.199 3.199 35 1H5* T 4 1H5' T 4 4.565 9.007 2.249 36 2H5* T 4 2H5' T 4 5.451 9.936 3.476 37 H4* T 4 H4' T 4 3.024 10.434 3.540 38 H3* T 4 H3' T 4 4.569 9.633 5.861 39 1H2* T 4 2H2' T 4 3.340 7.653 6.199 40 2H2* T 4 1H2' T 4 2.231 8.796 7.026 41 H1* T 4 H1' T 4 0.886 9.011 5.012 42 H3 T 4 H3 T 4 -1.575 5.270 5.441 43 1H5M T 4 1H5M T 4 2.720 3.449 3.232 44 2H5M T 4 2H5M T 4 3.497 3.583 4.825 45 3H5M T 4 3H5M T 4 2.136 2.483 4.597 46 H6 T 4 H6 T 4 3.085 6.066 4.541 47 1H5* A 5 1H5' A 5 0.211 10.990 6.214 48 2H5* A 5 2H5' A 5 0.248 12.315 7.392 49 H4* A 5 H4' A 5 -1.897 11.178 7.544 50 H3* A 5 H3' A 5 -0.132 11.500 9.810 51 H1* A 5 H1' A 5 -2.613 8.691 9.062 52 H8 A 5 H8 A 5 1.092 7.463 8.843 53 1H6 A 5 1H6 A 5 -0.019 2.591 9.096 54 2H6 A 5 2H6 A 5 -1.640 1.863 9.215 55 H2 A 5 H2 A 5 -4.731 4.740 9.301 56 2H2* A 5 1H2' A 5 -1.308 9.332 11.009 57 1H2* A 5 2H2' A 5 0.211 9.180 10.078 58 1H5* C 6 1H5' C 6 -4.663 10.344 10.140 59 2H5* C 6 2H5' C 6 -5.297 11.317 11.485 60 H4* C 6 H4' C 6 -6.544 9.185 11.278 61 H3* C 6 H3' C 6 -5.227 10.077 13.729 62 H1* C 6 H1' C 6 -6.014 6.587 12.376 63 1H4 C 6 1H4 C 6 -1.344 2.565 13.211 64 2H4 C 6 2H4 C 6 -0.129 3.523 12.328 65 H5 C 6 H5 C 6 -0.732 5.811 11.573 66 H6 C 6 H6 C 6 -2.581 7.404 11.468 67 2H2* C 6 1H2' C 6 -5.379 7.458 14.563 68 1H2* C 6 2H2' C 6 -3.885 8.161 13.873 69 1H5* T 7 1H5' T 7 -8.143 6.502 13.850 70 2H5* T 7 2H5' T 7 -9.212 6.743 15.247 71 H4* T 7 H4' T 7 -8.637 4.357 14.998 72 H3* T 7 H3' T 7 -8.034 5.895 17.455 73 1H2* T 7 2H2' T 7 -5.850 5.138 17.550 74 2H2* T 7 1H2' T 7 -6.584 3.604 18.098 75 H1* T 7 H1' T 7 -6.554 2.738 15.835 76 H3 T 7 H3 T 7 -2.262 1.513 15.377 77 1H5M T 7 1H5M T 7 -2.163 6.753 14.859 78 2H5M T 7 2H5M T 7 -1.935 6.651 16.617 79 3H5M T 7 3H5M T 7 -0.725 5.962 15.523 80 H6 T 7 H6 T 7 -4.415 5.774 15.996 81 1H5* C 8 1H5' C 8 -9.535 1.322 17.382 82 2H5* C 8 2H5' C 8 -10.288 1.035 18.965 83 H4* C 8 H4' C 8 -9.152 -1.023 18.154 84 H3* C 8 H3' C 8 -7.867 0.387 20.537 85 H1* C 8 H1' C 8 -6.212 -1.871 17.847 86 1H4 C 8 1H4 C 8 -0.857 0.858 19.122 87 2H4 C 8 2H4 C 8 -1.525 2.489 19.342 88 H5 C 8 H5 C 8 -3.976 2.816 19.192 89 H6 C 8 H6 C 8 -6.090 1.621 18.878 90 2H2* C 8 1H2' C 8 -7.396 -2.492 19.714 91 1H2* C 8 2H2' C 8 -6.310 -1.408 20.634 92 1H5* T 9 1H5' T 9 -8.581 -3.641 20.125 93 2H5* T 9 2H5' T 9 -9.358 -4.472 21.488 94 H4* T 9 H4' T 9 -7.549 -5.841 20.396 95 H3* T 9 H3' T 9 -7.971 -5.612 23.162 96 1H2* T 9 2H2' T 9 -6.257 -3.949 23.456 97 2H2* T 9 1H2' T 9 -5.345 -5.453 23.798 98 H1* T 9 H1' T 9 -4.523 -5.529 21.520 99 H3 T 9 H3 T 9 -1.152 -2.571 21.801 100 1H5M T 9 1H5M T 9 -4.039 1.020 22.731 101 2H5M T 9 2H5M T 9 -5.493 0.438 21.907 102 3H5M T 9 3H5M T 9 -5.274 0.143 23.646 103 H6 T 9 H6 T 9 -5.917 -2.176 22.350 104 1H5* T 10 1H5' T 10 -4.149 -7.653 21.656 105 2H5* T 10 2H5' T 10 -3.951 -9.182 22.537 106 H4* T 10 H4' T 10 -1.749 -8.180 22.068 107 H3* T 10 H3' T 10 -2.647 -8.899 24.740 108 1H2* T 10 2H2' T 10 -2.481 -6.676 25.525 109 2H2* T 10 1H2' T 10 -0.769 -7.153 25.732 110 H1* T 10 H1' T 10 -0.220 -6.255 23.526 111 H3 T 10 H3 T 10 0.464 -2.056 24.967 112 1H5M T 10 1H5M T 10 -4.122 -1.296 25.684 113 2H5M T 10 2H5M T 10 -4.775 -2.411 24.475 114 3H5M T 10 3H5M T 10 -4.607 -2.929 26.166 115 H6 T 10 H6 T 10 -3.477 -4.787 24.538 116 1H5* T 11 1H5' T 11 1.768 -7.767 23.793 117 2H5* T 11 2H5' T 11 2.748 -9.026 24.570 118 H4* T 11 H4' T 11 3.962 -6.900 24.626 119 H3* T 11 H3' T 11 3.400 -8.456 26.993 120 1H2* T 11 2H2' T 11 1.970 -6.780 27.895 121 2H2* T 11 1H2' T 11 3.550 -6.205 28.517 122 H1* T 11 H1' T 11 3.797 -4.721 26.583 123 H3 T 11 H3 T 11 1.507 -1.438 28.684 124 1H5M T 11 1H5M T 11 -2.637 -3.312 27.480 125 2H5M T 11 2H5M T 11 -2.133 -4.198 26.034 126 3H5M T 11 3H5M T 11 -2.212 -5.026 27.603 127 H6 T 11 H6 T 11 0.209 -5.504 26.456 128 1H5* G 12 1H5' G 12 6.463 -4.903 26.616 129 2H5* G 12 2H5' G 12 7.891 -5.586 27.413 130 H4* G 12 H4' G 12 7.993 -3.130 27.469 131 H3* G 12 H3' G 12 8.314 -4.762 29.789 132 H1* G 12 H1' G 12 6.751 -1.349 29.560 133 H8 G 12 H8 G 12 3.842 -3.934 29.950 134 H1 G 12 H1 G 12 2.329 2.177 31.248 135 1H2 G 12 1H2 G 12 5.687 2.674 30.585 136 2H2 G 12 2H2 G 12 4.161 3.438 31.052 137 2H2* G 12 1H2' G 12 7.209 -2.900 31.408 138 1H2* G 12 2H2' G 12 6.153 -4.136 30.651 139 1H5* T 13 1H5' T 13 8.737 -0.114 29.615 140 2H5* T 13 2H5' T 13 10.360 0.098 30.300 141 H4* T 13 H4' T 13 9.057 2.176 30.494 142 H3* T 13 H3' T 13 10.479 0.951 32.643 143 1H2* T 13 2H2' T 13 8.487 0.250 33.746 144 2H2* T 13 1H2' T 13 8.714 1.867 34.492 145 H1* T 13 H1' T 13 7.171 2.852 32.867 146 H3 T 13 H3 T 13 3.645 1.664 35.462 147 1H5M T 13 1H5M T 13 4.358 -2.362 32.130 148 2H5M T 13 2H5M T 13 5.369 -2.923 33.477 149 3H5M T 13 3H5M T 13 3.627 -2.707 33.705 150 H6 T 13 H6 T 13 6.513 -0.718 32.424 151 1H5* A 14 1H5' A 14 8.419 5.093 33.010 152 2H5* A 14 2H5' A 14 9.608 6.164 33.779 153 H4* A 14 H4' A 14 7.293 6.870 34.302 154 H3* A 14 H3' A 14 9.350 6.403 36.293 155 H1* A 14 H1' A 14 5.579 6.046 36.490 156 H8 A 14 H8 A 14 7.208 2.480 36.606 157 1H6 A 14 1H6 A 14 1.741 1.043 39.263 158 2H6 A 14 2H6 A 14 3.289 0.290 38.811 159 H2 A 14 H2 A 14 1.610 5.169 38.318 160 2H2* A 14 1H2' A 14 7.372 6.010 38.145 161 1H2* A 14 2H2' A 14 8.148 4.630 37.305 162 1H5* G 15 1H5' G 15 5.314 8.559 37.397 163 2H5* G 15 2H5' G 15 5.870 10.018 38.241 164 H4* G 15 H4' G 15 3.691 9.300 39.141 165 H3* G 15 H3' G 15 6.041 9.725 40.790 166 H1* G 15 H1' G 15 3.049 7.483 41.223 167 H8 G 15 H8 G 15 6.190 5.251 40.528 168 H1 G 15 H1 G 15 1.128 2.226 43.095 169 1H2 G 15 1H2 G 15 -0.261 5.390 42.943 170 2H2 G 15 2H2 G 15 -0.519 3.701 43.403 171 2H2* G 15 1H2' G 15 4.941 8.095 42.675 172 1H2* G 15 2H2' G 15 6.086 7.441 41.461 173 1H5* T 16 1H5' T 16 1.608 9.379 42.449 174 2H5* T 16 2H5' T 16 1.511 10.645 43.689 175 H4* T 16 H4' T 16 0.011 8.765 44.242 176 H3* T 16 H3' T 16 2.082 9.762 46.058 177 1H2* T 16 2H2' T 16 3.074 7.639 46.267 178 2H2* T 16 1H2' T 16 1.730 7.379 47.422 179 H1* T 16 H1' T 16 0.370 6.378 45.652 180 H3 T 16 H3 T 16 2.417 2.410 46.559 181 1H5M T 16 1H5M T 16 6.046 5.069 43.814 182 2H5M T 16 2H5M T 16 5.847 3.344 43.469 183 3H5M T 16 3H5M T 16 5.012 4.543 42.469 184 H6 T 16 H6 T 16 3.571 6.263 43.921 185 1H5* G 17 1H5' G 17 -1.156 6.896 47.630 186 2H5* G 17 2H5' G 17 -1.777 7.618 49.129 187 H4* G 17 H4' G 17 -1.646 5.186 49.393 188 H3* G 17 H3' G 17 -0.305 7.039 51.186 189 H1* G 17 H1' G 17 0.458 3.491 50.193 190 H8 G 17 H8 G 17 3.433 5.789 49.148 191 H1 G 17 H1 G 17 4.368 -0.529 48.380 192 1H2 G 17 1H2 G 17 1.084 -0.681 49.457 193 2H2 G 17 2H2 G 17 2.498 -1.611 48.941 194 H3T G 17 H3T G 17 -0.744 5.324 52.653 195 2H2* G 17 1H2' G 17 1.396 5.006 51.888 196 1H2* G 17 2H2' G 17 1.844 6.179 50.610 197 1H5* C 1 1H5' C 1 6.299 -6.763 45.619 198 2H5* C 1 2H5' C 1 7.316 -7.046 47.045 199 H4* C 1 H4' C 1 5.372 -8.008 48.253 200 H3* C 1 H3' C 1 4.114 -8.375 45.778 201 H1* C 1 H1' C 1 3.042 -5.684 48.300 202 1H4 C 1 1H4 C 1 4.627 0.183 45.645 203 2H4 C 1 2H4 C 1 3.164 0.211 46.668 204 H5 C 1 H5 C 1 5.762 -2.047 45.334 205 H6 C 1 H6 C 1 5.593 -4.415 45.936 206 H5T C 1 H5T C 1 6.829 -9.273 46.839 207 2H2* C 1 1H2' C 1 2.262 -6.438 46.125 208 1H2* C 1 2H2' C 1 3.832 -6.014 45.384 209 1H5* A 2 1H5' A 2 1.186 -6.796 48.866 210 2H5* A 2 2H5' A 2 -0.341 -7.700 48.742 211 H4* A 2 H4' A 2 -0.886 -5.341 48.975 212 H3* A 2 H3' A 2 -1.704 -6.845 46.636 213 H1* A 2 H1' A 2 -0.833 -3.147 47.003 214 H8 A 2 H8 A 2 1.572 -5.002 44.539 215 1H6 A 2 1H6 A 2 3.903 0.740 43.799 216 2H6 A 2 2H6 A 2 4.081 -0.915 43.166 217 H2 A 2 H2 A 2 0.887 1.000 46.774 218 2H2* A 2 1H2' A 2 -1.871 -4.474 45.255 219 1H2* A 2 2H2' A 2 -0.426 -5.524 45.151 220 1H5* C 3 1H5' C 3 -3.279 -2.671 47.815 221 2H5* C 3 2H5' C 3 -5.006 -2.543 47.419 222 H4* C 3 H4' C 3 -3.857 -0.367 47.116 223 H3* C 3 H3' C 3 -5.385 -1.702 44.990 224 H1* C 3 H1' C 3 -2.489 0.784 44.978 225 1H4 C 3 1H4 C 3 2.436 -1.929 41.480 226 2H4 C 3 2H4 C 3 2.487 -0.148 41.571 227 H5 C 3 H5 C 3 0.483 -3.075 42.554 228 H6 C 3 H6 C 3 -1.542 -2.650 43.879 229 2H2* C 3 1H2' C 3 -4.101 0.081 43.296 230 1H2* C 3 2H2' C 3 -3.593 -1.626 43.489 231 1H5* T 4 1H5' T 4 -4.431 2.845 45.115 232 2H5* T 4 2H5' T 4 -5.910 3.695 44.621 233 H4* T 4 H4' T 4 -3.875 4.925 43.901 234 H3* T 4 H3' T 4 -6.041 4.151 42.096 235 1H2* T 4 2H2' T 4 -4.615 2.903 40.710 236 2H2* T 4 1H2' T 4 -4.240 4.528 40.046 237 H1* T 4 H1' T 4 -2.310 4.718 41.524 238 H3 T 4 H3 T 4 0.011 2.423 38.341 239 1H5M T 4 1H5M T 4 -1.049 -1.690 40.371 240 2H5M T 4 2H5M T 4 -1.440 -1.127 42.003 241 3H5M T 4 3H5M T 4 -2.728 -1.334 40.800 242 H6 T 4 H6 T 4 -2.848 1.140 41.995 243 1H5* A 5 1H5' A 5 -2.657 6.904 41.028 244 2H5* A 5 2H5' A 5 -3.302 8.363 40.247 245 H4* A 5 H4' A 5 -1.100 7.788 39.316 246 H3* A 5 H3' A 5 -3.551 7.911 37.636 247 H1* A 5 H1' A 5 -0.126 6.183 37.353 248 H8 A 5 H8 A 5 -3.141 3.707 37.547 249 1H6 A 5 1H6 A 5 -0.749 -0.116 35.369 250 2H6 A 5 2H6 A 5 0.917 -0.120 34.737 251 H2 A 5 H2 A 5 2.875 3.584 35.232 252 2H2* A 5 1H2' A 5 -1.748 6.938 35.724 253 1H2* A 5 2H2' A 5 -3.032 5.977 36.516 254 1H5* C 6 1H5' C 6 0.777 9.176 36.280 255 2H5* C 6 2H5' C 6 0.609 10.477 35.081 256 H4* C 6 H4' C 6 2.522 8.993 34.529 257 H3* C 6 H3' C 6 0.221 9.391 32.673 258 H1* C 6 H1' C 6 2.882 6.632 33.199 259 1H4 C 6 1H4 C 6 -0.937 1.229 33.746 260 2H4 C 6 2H4 C 6 0.755 0.866 33.321 261 H5 C 6 H5 C 6 -1.594 3.628 33.963 262 H6 C 6 H6 C 6 -0.709 5.914 33.843 263 2H2* C 6 1H2' C 6 1.692 7.424 31.287 264 1H2* C 6 2H2' C 6 0.120 7.171 32.100 265 1H5* A 7 1H5' A 7 4.016 7.780 31.667 266 2H5* A 7 2H5' A 7 4.848 8.782 30.462 267 H4* A 7 H4' A 7 5.481 6.388 30.260 268 H3* A 7 H3' A 7 4.590 8.047 28.068 269 H1* A 7 H1' A 7 4.210 4.307 28.648 270 H8 A 7 H8 A 7 0.740 6.058 29.069 271 1H6 A 7 1H6 A 7 -1.356 0.284 27.940 272 2H6 A 7 2H6 A 7 -1.956 1.920 28.306 273 H2 A 7 H2 A 7 2.874 0.129 27.732 274 2H2* A 7 1H2' A 7 3.817 5.775 26.736 275 1H2* A 7 2H2' A 7 2.649 6.742 27.690 276 1H5* A 8 1H5' A 8 7.226 4.185 27.629 277 2H5* A 8 2H5' A 8 8.451 4.657 26.434 278 H4* A 8 H4' A 8 8.089 2.175 26.534 279 H3* A 8 H3' A 8 8.205 3.748 24.129 280 H1* A 8 H1' A 8 6.099 0.641 24.867 281 H8 A 8 H8 A 8 3.862 3.855 24.860 282 1H6 A 8 1H6 A 8 -0.611 -0.263 23.446 283 2H6 A 8 2H6 A 8 -0.379 1.481 23.720 284 H2 A 8 H2 A 8 2.998 -2.447 23.853 285 2H2* A 8 1H2' A 8 6.614 1.907 22.862 286 1H2* A 8 2H2' A 8 5.917 3.386 23.590 287 1H5* A 9 1H5' A 9 8.088 -0.942 23.874 288 2H5* A 9 2H5' A 9 9.438 -1.337 22.790 289 H4* A 9 H4' A 9 7.610 -2.985 22.550 290 H3* A 9 H3' A 9 8.771 -1.514 20.327 291 H1* A 9 H1' A 9 5.267 -2.930 20.834 292 H8 A 9 H8 A 9 5.303 0.957 20.474 293 1H6 A 9 1H6 A 9 -0.894 0.236 20.463 294 2H6 A 9 2H6 A 9 0.344 1.505 20.289 295 H2 A 9 H2 A 9 0.782 -3.608 20.998 296 2H2* A 9 1H2' A 9 6.471 -2.041 18.916 297 1H2* A 9 2H2' A 9 6.724 -0.485 19.765 298 1H5* G 10 1H5' G 10 6.411 -5.536 20.018 299 2H5* G 10 2H5' G 10 7.200 -6.501 18.755 300 H4* G 10 H4' G 10 4.777 -7.032 18.954 301 H3* G 10 H3' G 10 6.115 -6.459 16.473 302 H1* G 10 H1' G 10 2.555 -5.705 17.495 303 H8 G 10 H8 G 10 4.542 -2.396 16.901 304 H1 G 10 H1 G 10 -1.762 -1.680 17.944 305 1H2 G 10 1H2 G 10 -1.610 -5.109 18.402 306 2H2 G 10 2H2 G 10 -2.656 -3.682 18.387 307 2H2* G 10 1H2' G 10 3.803 -5.488 15.409 308 1H2* G 10 2H2' G 10 4.971 -4.380 16.196 309 1H5* A 11 1H5' A 11 1.781 -7.786 17.047 310 2H5* A 11 2H5' A 11 1.378 -9.013 15.830 311 H4* A 11 H4' A 11 -0.618 -7.703 16.538 312 H3* A 11 H3' A 11 0.166 -8.148 13.776 313 H1* A 11 H1' A 11 -1.697 -5.242 15.429 314 H8 A 11 H8 A 11 1.944 -4.193 14.544 315 1H6 A 11 1H6 A 11 -0.549 1.533 14.536 316 2H6 A 11 2H6 A 11 1.019 0.712 14.341 317 H2 A 11 H2 A 11 -3.714 -1.189 15.245 318 2H2* A 11 1H2' A 11 -1.333 -5.941 13.119 319 1H2* A 11 2H2' A 11 0.441 -5.844 13.347 320 1H5* G 12 1H5' G 12 -3.987 -6.550 15.116 321 2H5* G 12 2H5' G 12 -5.175 -7.519 14.220 322 H4* G 12 H4' G 12 -6.051 -5.249 14.702 323 H3* G 12 H3' G 12 -5.910 -6.405 12.009 324 H1* G 12 H1' G 12 -5.899 -2.829 13.321 325 H8 G 12 H8 G 12 -2.379 -3.737 11.896 326 H1 G 12 H1 G 12 -3.911 2.505 11.694 327 1H2 G 12 1H2 G 12 -5.967 2.776 12.528 328 2H2 G 12 2H2 G 12 -6.860 1.350 13.076 329 2H2* G 12 1H2' G 12 -6.291 -3.816 11.126 330 1H2* G 12 2H2' G 12 -4.681 -4.601 11.168 331 1H5* T 13 1H5' T 13 -8.632 -2.620 12.510 332 2H5* T 13 2H5' T 13 -10.055 -2.917 11.487 333 H4* T 13 H4' T 13 -9.275 -0.628 11.088 334 H3* T 13 H3' T 13 -8.839 -2.669 8.891 335 1H2* T 13 2H2' T 13 -7.310 -1.361 7.858 336 2H2* T 13 1H2' T 13 -8.375 0.069 7.950 337 H1* T 13 H1' T 13 -7.409 0.782 9.949 338 H3 T 13 H3 T 13 -3.264 1.880 8.645 339 1H5M T 13 1H5M T 13 -1.854 -2.605 8.554 340 2H5M T 13 2H5M T 13 -2.971 -3.274 9.753 341 3H5M T 13 3H5M T 13 -3.366 -3.357 8.022 342 H6 T 13 H6 T 13 -5.472 -2.333 9.398 343 1H5* A 14 1H5' A 14 -10.576 1.576 8.098 344 2H5* A 14 2H5' A 14 -11.693 1.417 6.726 345 H4* A 14 H4' A 14 -10.357 3.431 6.393 346 H3* A 14 H3' A 14 -10.494 1.362 4.433 347 H1* A 14 H1' A 14 -7.640 3.615 5.230 348 H8 A 14 H8 A 14 -6.432 -0.002 5.923 349 1H6 A 14 1H6 A 14 -1.063 2.943 7.135 350 2H6 A 14 2H6 A 14 -1.726 1.300 6.958 351 H2 A 14 H2 A 14 -3.989 5.936 6.459 352 2H2* A 14 1H2' A 14 -7.947 1.783 3.605 353 1H2* A 14 2H2' A 14 -8.231 0.625 4.947 354 1H5* G 15 1H5' G 15 -10.082 6.024 5.237 355 2H5* G 15 2H5' G 15 -11.296 7.127 4.557 356 H4* G 15 H4' G 15 -9.151 8.240 4.360 357 H3* G 15 H3' G 15 -10.671 7.658 2.017 358 H1* G 15 H1' G 15 -6.893 7.605 2.372 359 H8 G 15 H8 G 15 -8.291 4.111 1.469 360 H1 G 15 H1 G 15 -1.930 4.276 2.390 361 1H2 G 15 1H2 G 15 -2.598 7.556 3.267 362 2H2 G 15 2H2 G 15 -1.345 6.323 3.065 363 2H2* G 15 1H2' G 15 -8.441 7.291 0.506 364 1H2* G 15 2H2' G 15 -9.193 5.892 1.337 365 1H5* T 16 1H5' T 16 -6.504 9.661 1.453 366 2H5* T 16 2H5' T 16 -6.772 10.994 0.311 367 H4* T 16 H4' T 16 -4.592 10.010 -0.138 368 H3* T 16 H3' T 16 -6.768 9.846 -2.177 369 1H2* T 16 2H2' T 16 -6.191 7.686 -2.745 370 2H2* T 16 1H2' T 16 -4.715 8.397 -3.462 371 H1* T 16 H1' T 16 -3.491 8.044 -1.403 372 H3 T 16 H3 T 16 -2.337 3.751 -1.655 373 1H5M T 16 1H5M T 16 -7.477 3.615 -2.734 374 2H5M T 16 2H5M T 16 -6.792 2.265 -1.819 375 3H5M T 16 3H5M T 16 -7.593 3.586 -0.961 376 H6 T 16 H6 T 16 -6.602 5.987 -1.601 377 1H5* G 17 1H5' G 17 -2.319 9.869 -3.352 378 2H5* G 17 2H5' G 17 -2.163 10.866 -4.813 379 H4* G 17 H4' G 17 -0.751 8.889 -5.060 380 H3* G 17 H3' G 17 -2.855 9.532 -6.954 381 H1* G 17 H1' G 17 -1.324 6.248 -5.930 382 H8 G 17 H8 G 17 -5.159 6.135 -5.408 383 H1 G 17 H1 G 17 -1.996 0.817 -3.651 384 1H2 G 17 1H2 G 17 0.765 2.768 -4.381 385 2H2 G 17 2H2 G 17 0.198 1.188 -3.824 386 H3T G 17 H3T G 17 -0.590 7.824 -7.181 387 2H2* G 17 1H2' G 17 -2.914 6.893 -7.690 388 1H2* G 17 2H2' G 17 -4.047 7.524 -6.452 Start of MODEL 7 1 1H5* C 1 1H5' C 1 3.879 -8.004 -0.708 2 2H5* C 1 2H5' C 1 2.437 -7.170 -0.097 3 H4* C 1 H4' C 1 4.220 -6.113 -2.345 4 H3* C 1 H3' C 1 4.900 -6.138 0.440 5 H1* C 1 H1' C 1 3.774 -3.241 -1.687 6 1H4 C 1 1H4 C 1 -1.825 -0.676 0.758 7 2H4 C 1 2H4 C 1 -0.836 0.463 -0.197 8 H5 C 1 H5 C 1 -0.915 -3.000 1.065 9 H6 C 1 H6 C 1 0.979 -4.448 0.472 10 H5T C 1 H5T C 1 1.981 -8.739 -1.701 11 2H2* C 1 1H2' C 1 4.541 -3.453 0.634 12 1H2* C 1 2H2' C 1 3.182 -4.565 0.997 13 1H5* A 2 1H5' A 2 6.069 -2.417 -2.257 14 2H5* A 2 2H5' A 2 7.689 -1.942 -1.708 15 H4* A 2 H4' A 2 6.440 0.081 -2.240 16 H3* A 2 H3' A 2 7.574 -0.395 0.372 17 H1* A 2 H1' A 2 4.503 1.573 -0.621 18 H8 A 2 H8 A 2 3.391 -1.632 1.337 19 1H6 A 2 1H6 A 2 -1.268 -0.010 2.211 20 2H6 A 2 2H6 A 2 -1.981 1.537 1.691 21 H2 A 2 H2 A 2 0.716 3.937 -0.501 22 2H2* A 2 1H2' A 2 5.716 1.280 1.477 23 1H2* A 2 2H2' A 2 5.436 -0.488 1.419 24 1H5* C 3 1H5' C 3 6.041 4.039 -0.752 25 2H5* C 3 2H5' C 3 7.269 5.084 -0.005 26 H4* C 3 H4' C 3 5.068 6.155 0.193 27 H3* C 3 H3' C 3 6.621 5.326 2.594 28 H1* C 3 H1' C 3 2.904 6.011 1.831 29 1H4 C 3 1H4 C 3 -0.085 0.503 4.007 30 2H4 C 3 2H4 C 3 -1.175 1.903 3.814 31 H5 C 3 H5 C 3 2.345 0.867 3.516 32 H6 C 3 H6 C 3 3.954 2.574 2.787 33 2H2* C 3 1H2' C 3 4.243 6.180 3.831 34 1H2* C 3 2H2' C 3 4.777 4.482 3.658 35 1H5* T 4 1H5' T 4 3.727 8.985 2.471 36 2H5* T 4 2H5' T 4 4.450 10.255 3.480 37 H4* T 4 H4' T 4 2.004 10.263 3.725 38 H3* T 4 H3' T 4 3.828 9.920 6.003 39 1H2* T 4 2H2' T 4 2.812 7.952 6.718 40 2H2* T 4 1H2' T 4 1.570 9.073 7.363 41 H1* T 4 H1' T 4 0.210 8.771 5.379 42 H3 T 4 H3 T 4 -1.606 4.864 6.737 43 1H5M T 4 1H5M T 4 2.336 2.464 5.762 44 2H5M T 4 2H5M T 4 2.780 3.401 4.326 45 3H5M T 4 3H5M T 4 3.549 3.743 5.889 46 H6 T 4 H6 T 4 2.749 6.102 5.102 47 1H5* A 5 1H5' A 5 -0.596 10.904 6.468 48 2H5* A 5 2H5' A 5 -0.661 12.310 7.546 49 H4* A 5 H4' A 5 -2.633 10.968 7.932 50 H3* A 5 H3' A 5 -0.735 11.548 10.055 51 H1* A 5 H1' A 5 -3.063 8.564 9.567 52 H8 A 5 H8 A 5 0.687 7.525 9.206 53 1H6 A 5 1H6 A 5 -0.155 2.621 9.820 54 2H6 A 5 2H6 A 5 -1.724 1.832 10.117 55 H2 A 5 H2 A 5 -4.937 4.571 10.265 56 2H2* A 5 1H2' A 5 -1.725 9.379 11.426 57 1H2* A 5 2H2' A 5 -0.239 9.280 10.438 58 1H5* C 6 1H5' C 6 -5.220 10.271 10.649 59 2H5* C 6 2H5' C 6 -5.816 11.224 12.025 60 H4* C 6 H4' C 6 -7.004 9.049 11.858 61 H3* C 6 H3' C 6 -5.597 9.970 14.262 62 H1* C 6 H1' C 6 -6.395 6.474 12.896 63 1H4 C 6 1H4 C 6 -1.658 2.494 13.503 64 2H4 C 6 2H4 C 6 -0.462 3.521 12.675 65 H5 C 6 H5 C 6 -1.098 5.830 12.044 66 H6 C 6 H6 C 6 -2.970 7.399 12.019 67 2H2* C 6 1H2' C 6 -5.760 7.335 15.083 68 1H2* C 6 2H2' C 6 -4.273 8.053 14.394 69 1H5* T 7 1H5' T 7 -8.587 6.450 14.444 70 2H5* T 7 2H5' T 7 -9.611 6.700 15.874 71 H4* T 7 H4' T 7 -9.103 4.303 15.582 72 H3* T 7 H3' T 7 -8.408 5.800 18.034 73 1H2* T 7 2H2' T 7 -6.225 5.027 18.052 74 2H2* T 7 1H2' T 7 -6.957 3.498 18.620 75 H1* T 7 H1' T 7 -7.007 2.637 16.355 76 H3 T 7 H3 T 7 -2.754 1.388 15.666 77 1H5M T 7 1H5M T 7 -1.151 5.806 15.950 78 2H5M T 7 2H5M T 7 -2.605 6.648 15.396 79 3H5M T 7 3H5M T 7 -2.297 6.451 17.135 80 H6 T 7 H6 T 7 -4.824 5.643 16.549 81 1H5* C 8 1H5' C 8 -9.860 1.211 18.001 82 2H5* C 8 2H5' C 8 -10.557 0.914 19.608 83 H4* C 8 H4' C 8 -9.399 -1.120 18.770 84 H3* C 8 H3' C 8 -8.066 0.329 21.103 85 H1* C 8 H1' C 8 -6.469 -1.914 18.366 86 1H4 C 8 1H4 C 8 -1.107 0.913 19.341 87 2H4 C 8 2H4 C 8 -1.793 2.532 19.584 88 H5 C 8 H5 C 8 -4.253 2.814 19.584 89 H6 C 8 H6 C 8 -6.359 1.580 19.392 90 2H2* C 8 1H2' C 8 -7.568 -2.545 20.280 91 1H2* C 8 2H2' C 8 -6.473 -1.436 21.156 92 1H5* T 9 1H5' T 9 -8.768 -3.723 20.727 93 2H5* T 9 2H5' T 9 -9.444 -4.568 22.135 94 H4* T 9 H4' T 9 -7.676 -5.904 20.944 95 H3* T 9 H3' T 9 -7.915 -5.643 23.740 96 1H2* T 9 2H2' T 9 -6.181 -3.984 23.889 97 2H2* T 9 1H2' T 9 -5.247 -5.488 24.171 98 H1* T 9 H1' T 9 -4.626 -5.592 21.823 99 H3 T 9 H3 T 9 -1.205 -2.692 21.678 100 1H5M T 9 1H5M T 9 -5.392 0.396 22.540 101 2H5M T 9 2H5M T 9 -4.978 -0.012 24.220 102 3H5M T 9 3H5M T 9 -3.832 0.889 23.216 103 H6 T 9 H6 T 9 -5.833 -2.242 22.920 104 1H5* T 10 1H5' T 10 -4.237 -7.673 21.926 105 2H5* T 10 2H5' T 10 -3.897 -9.169 22.820 106 H4* T 10 H4' T 10 -1.787 -8.110 22.115 107 H3* T 10 H3' T 10 -2.395 -8.787 24.872 108 1H2* T 10 2H2' T 10 -2.280 -6.531 25.581 109 2H2* T 10 1H2' T 10 -0.536 -6.924 25.658 110 H1* T 10 H1' T 10 -0.211 -6.061 23.393 111 H3 T 10 H3 T 10 0.358 -1.796 24.703 112 1H5M T 10 1H5M T 10 -4.198 -1.259 25.745 113 2H5M T 10 2H5M T 10 -4.859 -2.365 24.532 114 3H5M T 10 3H5M T 10 -4.605 -2.919 26.201 115 H6 T 10 H6 T 10 -3.457 -4.729 24.592 116 1H5* T 11 1H5' T 11 1.892 -7.458 23.575 117 2H5* T 11 2H5' T 11 2.964 -8.680 24.289 118 H4* T 11 H4' T 11 4.117 -6.526 24.282 119 H3* T 11 H3' T 11 3.703 -8.074 26.686 120 1H2* T 11 2H2' T 11 2.267 -6.427 27.633 121 2H2* T 11 1H2' T 11 3.856 -5.807 28.183 122 H1* T 11 H1' T 11 3.984 -4.336 26.227 123 H3 T 11 H3 T 11 1.698 -1.012 28.238 124 1H5M T 11 1H5M T 11 -2.432 -3.170 27.574 125 2H5M T 11 2H5M T 11 -2.016 -4.132 26.148 126 3H5M T 11 3H5M T 11 -1.902 -4.847 27.771 127 H6 T 11 H6 T 11 0.422 -5.285 26.422 128 1H5* G 12 1H5' G 12 6.676 -4.413 26.208 129 2H5* G 12 2H5' G 12 8.130 -5.099 26.954 130 H4* G 12 H4' G 12 8.247 -2.662 27.091 131 H3* G 12 H3' G 12 8.523 -4.355 29.374 132 H1* G 12 H1' G 12 6.995 -0.919 29.219 133 H8 G 12 H8 G 12 4.086 -3.509 29.578 134 H1 G 12 H1 G 12 2.532 2.608 30.802 135 1H2 G 12 1H2 G 12 5.893 3.114 30.153 136 2H2 G 12 2H2 G 12 4.360 3.876 30.604 137 2H2* G 12 1H2' G 12 7.423 -2.523 31.027 138 1H2* G 12 2H2' G 12 6.362 -3.728 30.229 139 1H5* T 13 1H5' T 13 9.104 0.285 29.345 140 2H5* T 13 2H5' T 13 10.715 0.430 30.074 141 H4* T 13 H4' T 13 9.461 2.534 30.314 142 H3* T 13 H3' T 13 10.807 1.201 32.441 143 1H2* T 13 2H2' T 13 8.779 0.478 33.466 144 2H2* T 13 1H2' T 13 9.011 2.055 34.291 145 H1* T 13 H1' T 13 7.519 3.140 32.688 146 H3 T 13 H3 T 13 3.799 1.947 34.959 147 1H5M T 13 1H5M T 13 3.978 -2.462 33.317 148 2H5M T 13 2H5M T 13 4.828 -2.148 31.797 149 3H5M T 13 3H5M T 13 5.736 -2.657 33.236 150 H6 T 13 H6 T 13 6.921 -0.458 32.202 151 1H5* A 14 1H5' A 14 8.835 5.388 32.983 152 2H5* A 14 2H5' A 14 10.047 6.371 33.829 153 H4* A 14 H4' A 14 7.761 7.134 34.370 154 H3* A 14 H3' A 14 9.755 6.437 36.360 155 H1* A 14 H1' A 14 5.960 6.228 36.473 156 H8 A 14 H8 A 14 7.508 2.627 36.426 157 1H6 A 14 1H6 A 14 1.811 1.089 38.465 158 2H6 A 14 2H6 A 14 3.380 0.345 38.072 159 H2 A 14 H2 A 14 1.825 5.286 37.901 160 2H2* A 14 1H2' A 14 7.720 6.021 38.144 161 1H2* A 14 2H2' A 14 8.456 4.664 37.234 162 1H5* G 15 1H5' G 15 5.802 8.599 37.433 163 2H5* G 15 2H5' G 15 6.302 10.010 38.386 164 H4* G 15 H4' G 15 4.063 9.215 39.095 165 H3* G 15 H3' G 15 6.283 9.647 40.909 166 H1* G 15 H1' G 15 3.350 7.293 41.074 167 H8 G 15 H8 G 15 6.616 5.196 40.566 168 H1 G 15 H1 G 15 1.427 1.902 42.462 169 1H2 G 15 1H2 G 15 -0.053 5.023 42.267 170 2H2 G 15 2H2 G 15 -0.299 3.310 42.637 171 2H2* G 15 1H2' G 15 5.126 7.906 42.659 172 1H2* G 15 2H2' G 15 6.368 7.339 41.497 173 1H5* T 16 1H5' T 16 1.793 8.985 42.325 174 2H5* T 16 2H5' T 16 1.580 10.189 43.612 175 H4* T 16 H4' T 16 0.198 8.225 44.100 176 H3* T 16 H3' T 16 2.358 9.117 45.919 177 1H2* T 16 2H2' T 16 3.199 6.966 46.152 178 2H2* T 16 1H2' T 16 1.763 6.693 47.182 179 H1* T 16 H1' T 16 0.530 5.803 45.282 180 H3 T 16 H3 T 16 2.533 1.775 46.016 181 1H5M T 16 1H5M T 16 6.196 2.962 43.297 182 2H5M T 16 2H5M T 16 5.411 4.199 42.304 183 3H5M T 16 3H5M T 16 6.328 4.668 43.750 184 H6 T 16 H6 T 16 3.845 5.818 43.760 185 1H5* G 17 1H5' G 17 -1.093 6.513 47.617 186 2H5* G 17 2H5' G 17 -1.455 7.159 49.231 187 H4* G 17 H4' G 17 -1.429 4.731 49.376 188 H3* G 17 H3' G 17 0.376 6.372 50.960 189 H1* G 17 H1' G 17 0.642 2.851 49.670 190 H8 G 17 H8 G 17 3.754 4.854 48.551 191 H1 G 17 H1 G 17 3.366 -1.129 46.218 192 1H2 G 17 1H2 G 17 0.263 -1.023 47.746 193 2H2 G 17 2H2 G 17 1.393 -2.004 46.801 194 H3T G 17 H3T G 17 -0.521 3.688 51.269 195 2H2* G 17 1H2' G 17 2.012 4.186 51.217 196 1H2* G 17 2H2' G 17 2.300 5.402 49.930 197 1H5* C 1 1H5' C 1 6.220 -9.076 45.813 198 2H5* C 1 2H5' C 1 5.095 -9.753 44.623 199 H4* C 1 H4' C 1 3.859 -8.789 46.497 200 H3* C 1 H3' C 1 3.585 -7.292 43.863 201 H1* C 1 H1' C 1 3.410 -5.571 47.313 202 1H4 C 1 1H4 C 1 5.224 -0.733 44.080 203 2H4 C 1 2H4 C 1 6.473 -1.570 43.124 204 H5 C 1 H5 C 1 6.654 -4.054 43.342 205 H6 C 1 H6 C 1 5.717 -5.979 44.530 206 H5T C 1 H5T C 1 5.401 -7.905 43.361 207 2H2* C 1 1H2' C 1 1.844 -6.970 46.328 208 1H2* C 1 2H2' C 1 2.022 -5.832 44.958 209 1H5* A 2 1H5' A 2 -0.152 -8.306 46.106 210 2H5* A 2 2H5' A 2 -1.434 -8.750 44.967 211 H4* A 2 H4' A 2 -2.150 -7.030 46.686 212 H3* A 2 H3' A 2 -2.849 -7.062 43.977 213 H1* A 2 H1' A 2 -1.766 -3.890 45.832 214 H8 A 2 H8 A 2 1.111 -5.304 43.588 215 1H6 A 2 1H6 A 2 3.226 0.546 44.012 216 2H6 A 2 2H6 A 2 3.600 -1.008 43.228 217 H2 A 2 H2 A 2 -0.261 0.322 46.419 218 2H2* A 2 1H2' A 2 -2.546 -4.397 43.604 219 1H2* A 2 2H2' A 2 -1.158 -5.493 43.325 220 1H5* C 3 1H5' C 3 -4.142 -3.219 46.364 221 2H5* C 3 2H5' C 3 -5.821 -2.902 45.882 222 H4* C 3 H4' C 3 -4.618 -0.776 46.178 223 H3* C 3 H3' C 3 -5.976 -1.506 43.711 224 H1* C 3 H1' C 3 -2.967 0.720 44.361 225 1H4 C 3 1H4 C 3 2.207 -1.686 40.998 226 2H4 C 3 2H4 C 3 2.275 0.073 41.289 227 H5 C 3 H5 C 3 0.162 -2.902 41.786 228 H6 C 3 H6 C 3 -1.978 -2.576 42.950 229 2H2* C 3 1H2' C 3 -4.395 0.332 42.416 230 1H2* C 3 2H2' C 3 -3.989 -1.412 42.442 231 1H5* T 4 1H5' T 4 -4.556 2.868 44.486 232 2H5* T 4 2H5' T 4 -5.918 3.911 44.029 233 H4* T 4 H4' T 4 -3.754 4.998 43.508 234 H3* T 4 H3' T 4 -5.885 4.606 41.550 235 1H2* T 4 2H2' T 4 -4.509 3.351 40.114 236 2H2* T 4 1H2' T 4 -3.961 4.986 39.616 237 H1* T 4 H1' T 4 -2.101 4.871 41.190 238 H3 T 4 H3 T 4 0.169 2.681 37.893 239 1H5M T 4 1H5M T 4 -1.728 -1.008 41.231 240 2H5M T 4 2H5M T 4 -2.886 -1.067 39.887 241 3H5M T 4 3H5M T 4 -1.187 -1.485 39.614 242 H6 T 4 H6 T 4 -2.917 1.328 41.331 243 1H5* A 5 1H5' A 5 -2.238 7.218 40.726 244 2H5* A 5 2H5' A 5 -2.810 8.751 40.035 245 H4* A 5 H4' A 5 -0.673 8.121 39.015 246 H3* A 5 H3' A 5 -3.160 8.384 37.395 247 H1* A 5 H1' A 5 0.206 6.565 36.987 248 H8 A 5 H8 A 5 -2.907 4.206 37.084 249 1H6 A 5 1H6 A 5 -0.649 0.366 34.799 250 2H6 A 5 2H6 A 5 1.018 0.317 34.175 251 H2 A 5 H2 A 5 3.114 3.927 34.796 252 2H2* A 5 1H2' A 5 -1.398 7.456 35.416 253 1H2* A 5 2H2' A 5 -2.711 6.504 36.170 254 1H5* C 6 1H5' C 6 1.161 9.582 35.931 255 2H5* C 6 2H5' C 6 0.983 10.913 34.768 256 H4* C 6 H4' C 6 2.801 9.374 34.077 257 H3* C 6 H3' C 6 0.381 9.822 32.368 258 H1* C 6 H1' C 6 3.063 7.050 32.741 259 1H4 C 6 1H4 C 6 -0.843 1.706 33.222 260 2H4 C 6 2H4 C 6 0.844 1.320 32.795 261 H5 C 6 H5 C 6 -1.460 4.110 33.477 262 H6 C 6 H6 C 6 -0.538 6.383 33.395 263 2H2* C 6 1H2' C 6 1.867 7.921 30.875 264 1H2* C 6 2H2' C 6 0.299 7.643 31.687 265 1H5* A 7 1H5' A 7 4.160 8.351 31.099 266 2H5* A 7 2H5' A 7 4.881 9.383 29.848 267 H4* A 7 H4' A 7 5.540 7.015 29.543 268 H3* A 7 H3' A 7 4.300 8.650 27.467 269 H1* A 7 H1' A 7 4.294 4.876 28.113 270 H8 A 7 H8 A 7 0.766 6.438 28.729 271 1H6 A 7 1H6 A 7 -1.087 0.546 27.811 272 2H6 A 7 2H6 A 7 -1.748 2.154 28.198 273 H2 A 7 H2 A 7 3.119 0.610 27.315 274 2H2* A 7 1H2' A 7 3.740 6.261 26.191 275 1H2* A 7 2H2' A 7 2.524 7.153 27.152 276 1H5* A 8 1H5' A 8 7.075 4.963 26.749 277 2H5* A 8 2H5' A 8 8.178 5.486 25.459 278 H4* A 8 H4' A 8 7.878 3.005 25.507 279 H3* A 8 H3' A 8 7.591 4.676 23.142 280 H1* A 8 H1' A 8 5.882 1.376 24.116 281 H8 A 8 H8 A 8 3.410 4.398 24.326 282 1H6 A 8 1H6 A 8 -0.843 -0.047 23.279 283 2H6 A 8 2H6 A 8 -0.722 1.707 23.560 284 H2 A 8 H2 A 8 2.950 -1.942 23.294 285 2H2* A 8 1H2' A 8 6.134 2.601 22.043 286 1H2* A 8 2H2' A 8 5.355 4.037 22.770 287 1H5* A 9 1H5' A 9 7.942 0.039 22.812 288 2H5* A 9 2H5' A 9 9.210 -0.224 21.596 289 H4* A 9 H4' A 9 7.517 -2.024 21.495 290 H3* A 9 H3' A 9 8.258 -0.356 19.198 291 H1* A 9 H1' A 9 5.050 -2.250 20.100 292 H8 A 9 H8 A 9 4.595 1.612 19.726 293 1H6 A 9 1H6 A 9 -1.453 0.161 20.227 294 2H6 A 9 2H6 A 9 -0.393 1.566 19.950 295 H2 A 9 H2 A 9 0.709 -3.451 20.624 296 2H2* A 9 1H2' A 9 5.934 -1.323 18.041 297 1H2* A 9 2H2' A 9 6.052 0.298 18.789 298 1H5* G 10 1H5' G 10 6.398 -4.593 19.008 299 2H5* G 10 2H5' G 10 7.183 -5.472 17.681 300 H4* G 10 H4' G 10 4.836 -6.213 18.008 301 H3* G 10 H3' G 10 5.955 -5.443 15.466 302 H1* G 10 H1' G 10 2.415 -5.079 16.752 303 H8 G 10 H8 G 10 3.984 -1.594 15.984 304 H1 G 10 H1 G 10 -2.150 -1.477 17.902 305 1H2 G 10 1H2 G 10 -1.624 -4.878 18.276 306 2H2 G 10 2H2 G 10 -2.786 -3.553 18.434 307 2H2* G 10 1H2' G 10 3.477 -4.708 14.587 308 1H2* G 10 2H2' G 10 4.585 -3.500 15.311 309 1H5* A 11 1H5' A 11 1.851 -7.395 16.190 310 2H5* A 11 2H5' A 11 1.595 -8.634 14.946 311 H4* A 11 H4' A 11 -0.552 -7.661 15.757 312 H3* A 11 H3' A 11 0.188 -7.929 12.969 313 H1* A 11 H1' A 11 -1.993 -5.310 14.719 314 H8 A 11 H8 A 11 1.401 -3.842 13.487 315 1H6 A 11 1H6 A 11 0.015 0.958 13.805 316 2H6 A 11 2H6 A 11 -1.571 1.590 14.315 317 H2 A 11 H2 A 11 -4.296 -1.467 15.339 318 2H2* A 11 1H2' A 11 -1.577 -5.912 12.392 319 1H2* A 11 2H2' A 11 0.173 -5.596 12.600 320 1H5* G 12 1H5' G 12 -4.082 -6.867 14.428 321 2H5* G 12 2H5' G 12 -5.232 -7.805 13.452 322 H4* G 12 H4' G 12 -6.184 -5.606 14.092 323 H3* G 12 H3' G 12 -5.928 -6.504 11.289 324 H1* G 12 H1' G 12 -6.128 -3.087 13.002 325 H8 G 12 H8 G 12 -2.670 -3.686 11.278 326 H1 G 12 H1 G 12 -4.282 2.473 12.168 327 1H2 G 12 1H2 G 12 -7.133 1.064 13.522 328 2H2 G 12 2H2 G 12 -6.282 2.569 13.149 329 2H2* G 12 1H2' G 12 -6.556 -3.854 10.736 330 1H2* G 12 2H2' G 12 -4.902 -4.530 10.626 331 1H5* T 13 1H5' T 13 -8.777 -3.103 12.395 332 2H5* T 13 2H5' T 13 -10.260 -3.236 11.425 333 H4* T 13 H4' T 13 -9.511 -0.883 11.499 334 H3* T 13 H3' T 13 -9.334 -2.376 8.864 335 1H2* T 13 2H2' T 13 -7.940 -0.821 7.982 336 2H2* T 13 1H2' T 13 -8.975 0.520 8.545 337 H1* T 13 H1' T 13 -7.746 0.774 10.501 338 H3 T 13 H3 T 13 -3.751 2.122 8.959 339 1H5M T 13 1H5M T 13 -3.408 -3.137 9.185 340 2H5M T 13 2H5M T 13 -3.965 -2.956 7.507 341 3H5M T 13 3H5M T 13 -2.403 -2.285 8.002 342 H6 T 13 H6 T 13 -5.934 -2.164 9.183 343 1H5* A 14 1H5' A 14 -10.877 1.741 9.683 344 2H5* A 14 2H5' A 14 -12.314 2.084 8.699 345 H4* A 14 H4' A 14 -10.923 4.115 8.930 346 H3* A 14 H3' A 14 -11.847 3.074 6.424 347 H1* A 14 H1' A 14 -8.612 4.889 7.174 348 H8 A 14 H8 A 14 -7.917 1.180 6.173 349 1H6 A 14 1H6 A 14 -2.010 3.177 5.977 350 2H6 A 14 2H6 A 14 -2.990 1.728 5.643 351 H2 A 14 H2 A 14 -4.361 6.425 7.350 352 2H2* A 14 1H2' A 14 -9.682 4.101 5.129 353 1H2* A 14 2H2' A 14 -9.655 2.414 5.737 354 1H5* G 15 1H5' G 15 -9.606 7.338 6.382 355 2H5* G 15 2H5' G 15 -10.649 8.275 5.292 356 H4* G 15 H4' G 15 -8.357 8.968 4.898 357 H3* G 15 H3' G 15 -9.981 7.776 2.786 358 H1* G 15 H1' G 15 -6.244 7.913 3.358 359 H8 G 15 H8 G 15 -7.508 4.227 3.671 360 H1 G 15 H1 G 15 -1.176 4.923 2.803 361 1H2 G 15 1H2 G 15 -1.995 8.280 2.834 362 2H2 G 15 2H2 G 15 -0.691 7.093 2.690 363 2H2* G 15 1H2' G 15 -7.635 7.244 1.457 364 1H2* G 15 2H2' G 15 -8.443 6.004 2.468 365 1H5* T 16 1H5' T 16 -5.912 9.590 1.728 366 2H5* T 16 2H5' T 16 -6.172 10.625 0.308 367 H4* T 16 H4' T 16 -4.040 9.497 0.042 368 H3* T 16 H3' T 16 -6.293 8.878 -1.820 369 1H2* T 16 2H2' T 16 -5.759 6.635 -1.854 370 2H2* T 16 1H2' T 16 -4.299 7.118 -2.768 371 H1* T 16 H1' T 16 -3.012 7.254 -0.722 372 H3 T 16 H3 T 16 -2.002 2.922 -0.360 373 1H5M T 16 1H5M T 16 -7.256 2.867 -0.272 374 2H5M T 16 2H5M T 16 -6.405 1.712 0.763 375 3H5M T 16 3H5M T 16 -6.980 3.239 1.442 376 H6 T 16 H6 T 16 -6.130 5.367 0.045 377 1H5* G 17 1H5' G 17 -1.879 8.574 -3.076 378 2H5* G 17 2H5' G 17 -1.758 9.207 -4.731 379 H4* G 17 H4' G 17 -0.323 7.242 -4.528 380 H3* G 17 H3' G 17 -2.487 7.381 -6.481 381 H1* G 17 H1' G 17 -0.763 4.509 -4.755 382 H8 G 17 H8 G 17 -4.595 4.305 -4.175 383 H1 G 17 H1 G 17 -1.125 -0.339 -1.387 384 1H2 G 17 1H2 G 17 1.515 1.557 -2.572 385 2H2 G 17 2H2 G 17 1.045 0.101 -1.683 386 H3T G 17 H3T G 17 -0.106 5.824 -6.382 387 2H2* G 17 1H2' G 17 -2.347 4.636 -6.627 388 1H2* G 17 2H2' G 17 -3.546 5.454 -5.575 Start of MODEL 8 1 1H5* C 1 1H5' C 1 0.536 -5.933 -2.313 2 2H5* C 1 2H5' C 1 0.374 -6.259 -4.049 3 H4* C 1 H4' C 1 2.603 -5.230 -4.454 4 H3* C 1 H3' C 1 3.124 -5.527 -1.695 5 H1* C 1 H1' C 1 2.606 -2.242 -3.486 6 1H4 C 1 1H4 C 1 -2.883 0.717 -1.246 7 2H4 C 1 2H4 C 1 -1.645 1.834 -1.884 8 H5 C 1 H5 C 1 -2.326 -1.732 -1.249 9 H6 C 1 H6 C 1 -0.565 -3.332 -1.857 10 H5T C 1 H5T C 1 2.396 -7.269 -2.339 11 2H2* C 1 1H2' C 1 3.090 -2.878 -1.174 12 1H2* C 1 2H2' C 1 1.553 -3.796 -1.082 13 1H5* A 2 1H5' A 2 5.039 -1.686 -3.795 14 2H5* A 2 2H5' A 2 6.666 -1.577 -3.094 15 H4* A 2 H4' A 2 5.787 0.679 -3.367 16 H3* A 2 H3' A 2 6.650 -0.346 -0.807 17 H1* A 2 H1' A 2 4.025 2.229 -1.643 18 H8 A 2 H8 A 2 2.229 -0.962 -0.247 19 1H6 A 2 1H6 A 2 -2.507 3.060 0.372 20 2H6 A 2 2H6 A 2 -2.102 1.353 0.675 21 H2 A 2 H2 A 2 0.729 5.214 -1.313 22 2H2* A 2 1H2' A 2 5.010 1.439 0.456 23 1H2* A 2 2H2' A 2 4.449 -0.227 0.112 24 1H5* C 3 1H5' C 3 5.736 4.336 -1.281 25 2H5* C 3 2H5' C 3 6.992 5.128 -0.304 26 H4* C 3 H4' C 3 4.880 6.355 -0.022 27 H3* C 3 H3' C 3 5.828 4.683 2.336 28 H1* C 3 H1' C 3 2.447 6.183 1.109 29 1H4 C 3 1H4 C 3 -0.816 0.835 3.135 30 2H4 C 3 2H4 C 3 -1.697 2.357 3.437 31 H5 C 3 H5 C 3 1.523 1.022 2.263 32 H6 C 3 H6 C 3 3.217 2.653 1.553 33 2H2* C 3 1H2' C 3 3.777 6.773 2.881 34 1H2* C 3 2H2' C 3 3.878 5.088 3.458 35 1H5* T 4 1H5' T 4 4.545 8.908 2.604 36 2H5* T 4 2H5' T 4 5.419 9.809 3.860 37 H4* T 4 H4' T 4 2.990 10.302 3.918 38 H3* T 4 H3' T 4 4.519 9.434 6.229 39 1H2* T 4 2H2' T 4 3.275 7.458 6.515 40 2H2* T 4 1H2' T 4 2.159 8.587 7.351 41 H1* T 4 H1' T 4 0.838 8.844 5.327 42 H3 T 4 H3 T 4 -1.613 5.086 5.699 43 1H5M T 4 1H5M T 4 3.456 3.424 5.041 44 2H5M T 4 2H5M T 4 2.098 2.329 4.773 45 3H5M T 4 3H5M T 4 2.692 3.331 3.440 46 H6 T 4 H6 T 4 3.041 5.916 4.801 47 1H5* A 5 1H5' A 5 0.172 10.735 6.572 48 2H5* A 5 2H5' A 5 0.185 12.056 7.756 49 H4* A 5 H4' A 5 -1.950 10.894 7.884 50 H3* A 5 H3' A 5 -0.199 11.227 10.162 51 H1* A 5 H1' A 5 -2.655 8.395 9.387 52 H8 A 5 H8 A 5 1.069 7.219 9.203 53 1H6 A 5 1H6 A 5 0.026 2.332 9.500 54 2H6 A 5 2H6 A 5 -1.588 1.584 9.596 55 H2 A 5 H2 A 5 -4.718 4.413 9.616 56 2H2* A 5 1H2' A 5 -1.386 9.056 11.350 57 1H2* A 5 2H2' A 5 0.148 8.914 10.443 58 1H5* C 6 1H5' C 6 -4.719 10.081 10.436 59 2H5* C 6 2H5' C 6 -5.381 11.034 11.781 60 H4* C 6 H4' C 6 -6.610 8.894 11.520 61 H3* C 6 H3' C 6 -5.335 9.760 14.011 62 H1* C 6 H1' C 6 -6.109 6.289 12.578 63 1H4 C 6 1H4 C 6 -1.464 2.249 13.466 64 2H4 C 6 2H4 C 6 -0.216 3.239 12.670 65 H5 C 6 H5 C 6 -0.793 5.548 11.966 66 H6 C 6 H6 C 6 -2.641 7.141 11.836 67 2H2* C 6 1H2' C 6 -5.564 7.124 14.799 68 1H2* C 6 2H2' C 6 -4.037 7.825 14.186 69 1H5* T 7 1H5' T 7 -8.316 6.256 14.018 70 2H5* T 7 2H5' T 7 -9.418 6.488 15.392 71 H4* T 7 H4' T 7 -8.861 4.101 15.139 72 H3* T 7 H3' T 7 -8.258 5.622 17.610 73 1H2* T 7 2H2' T 7 -6.099 4.813 17.741 74 2H2* T 7 1H2' T 7 -6.873 3.286 18.252 75 H1* T 7 H1' T 7 -6.814 2.451 15.980 76 H3 T 7 H3 T 7 -2.542 1.158 15.563 77 1H5M T 7 1H5M T 7 -2.093 6.226 16.957 78 2H5M T 7 2H5M T 7 -0.927 5.574 15.794 79 3H5M T 7 3H5M T 7 -2.363 6.428 15.213 80 H6 T 7 H6 T 7 -4.622 5.445 16.243 81 1H5* C 8 1H5' C 8 -9.737 1.042 17.545 82 2H5* C 8 2H5' C 8 -10.503 0.763 19.124 83 H4* C 8 H4' C 8 -9.313 -1.282 18.375 84 H3* C 8 H3' C 8 -8.061 0.215 20.722 85 H1* C 8 H1' C 8 -6.384 -2.088 18.083 86 1H4 C 8 1H4 C 8 -1.031 0.727 19.127 87 2H4 C 8 2H4 C 8 -1.712 2.350 19.367 88 H5 C 8 H5 C 8 -4.171 2.643 19.325 89 H6 C 8 H6 C 8 -6.279 1.421 19.092 90 2H2* C 8 1H2' C 8 -7.528 -2.674 19.982 91 1H2* C 8 2H2' C 8 -6.464 -1.538 20.861 92 1H5* T 9 1H5' T 9 -8.741 -3.855 20.426 93 2H5* T 9 2H5' T 9 -9.471 -4.655 21.833 94 H4* T 9 H4' T 9 -7.664 -6.030 20.754 95 H3* T 9 H3' T 9 -8.010 -5.691 23.523 96 1H2* T 9 2H2' T 9 -6.311 -3.991 23.686 97 2H2* T 9 1H2' T 9 -5.370 -5.468 24.069 98 H1* T 9 H1' T 9 -4.630 -5.647 21.764 99 H3 T 9 H3 T 9 -1.253 -2.691 21.765 100 1H5M T 9 1H5M T 9 -4.071 0.923 22.812 101 2H5M T 9 2H5M T 9 -5.558 0.345 22.046 102 3H5M T 9 3H5M T 9 -5.279 0.066 23.780 103 H6 T 9 H6 T 9 -5.979 -2.269 22.571 104 1H5* T 10 1H5' T 10 -4.204 -7.714 21.958 105 2H5* T 10 2H5' T 10 -3.937 -9.199 22.896 106 H4* T 10 H4' T 10 -1.778 -8.177 22.296 107 H3* T 10 H3' T 10 -2.553 -8.799 25.027 108 1H2* T 10 2H2' T 10 -2.419 -6.538 25.708 109 2H2* T 10 1H2' T 10 -0.690 -6.967 25.876 110 H1* T 10 H1' T 10 -0.237 -6.149 23.617 111 H3 T 10 H3 T 10 0.377 -1.882 24.898 112 1H5M T 10 1H5M T 10 -4.673 -2.823 26.163 113 2H5M T 10 2H5M T 10 -4.218 -1.196 25.636 114 3H5M T 10 3H5M T 10 -4.851 -2.355 24.458 115 H6 T 10 H6 T 10 -3.505 -4.716 24.622 116 1H5* T 11 1H5' T 11 1.823 -7.635 23.871 117 2H5* T 11 2H5' T 11 2.829 -8.870 24.655 118 H4* T 11 H4' T 11 4.052 -6.749 24.606 119 H3* T 11 H3' T 11 3.551 -8.225 27.035 120 1H2* T 11 2H2' T 11 2.132 -6.524 27.912 121 2H2* T 11 1H2' T 11 3.723 -5.931 28.488 122 H1* T 11 H1' T 11 3.932 -4.504 26.505 123 H3 T 11 H3 T 11 1.680 -1.146 28.522 124 1H5M T 11 1H5M T 11 -2.486 -3.089 27.517 125 2H5M T 11 2H5M T 11 -2.018 -4.025 26.090 126 3H5M T 11 3H5M T 11 -2.047 -4.795 27.691 127 H6 T 11 H6 T 11 0.343 -5.305 26.498 128 1H5* G 12 1H5' G 12 6.601 -4.655 26.529 129 2H5* G 12 2H5' G 12 8.038 -5.339 27.308 130 H4* G 12 H4' G 12 8.176 -2.896 27.364 131 H3* G 12 H3' G 12 8.449 -4.515 29.700 132 H1* G 12 H1' G 12 6.947 -1.075 29.435 133 H8 G 12 H8 G 12 4.003 -3.618 29.821 134 H1 G 12 H1 G 12 2.550 2.522 31.052 135 1H2 G 12 1H2 G 12 4.402 3.760 30.870 136 2H2 G 12 2H2 G 12 5.919 2.966 30.420 137 2H2* G 12 1H2' G 12 7.364 -2.624 31.296 138 1H2* G 12 2H2' G 12 6.292 -3.845 30.538 139 1H5* T 13 1H5' T 13 8.943 0.116 29.514 140 2H5* T 13 2H5' T 13 10.564 0.312 30.207 141 H4* T 13 H4' T 13 9.282 2.404 30.386 142 H3* T 13 H3' T 13 10.687 1.181 32.542 143 1H2* T 13 2H2' T 13 8.686 0.477 33.633 144 2H2* T 13 1H2' T 13 8.915 2.089 34.387 145 H1* T 13 H1' T 13 7.382 3.089 32.765 146 H3 T 13 H3 T 13 3.785 1.916 35.258 147 1H5M T 13 1H5M T 13 4.640 -2.183 32.051 148 2H5M T 13 2H5M T 13 5.626 -2.693 33.437 149 3H5M T 13 3H5M T 13 3.876 -2.498 33.616 150 H6 T 13 H6 T 13 6.765 -0.501 32.359 151 1H5* A 14 1H5' A 14 8.611 5.310 32.993 152 2H5* A 14 2H5' A 14 9.796 6.375 33.777 153 H4* A 14 H4' A 14 7.481 7.031 34.356 154 H3* A 14 H3' A 14 9.568 6.492 36.317 155 H1* A 14 H1' A 14 5.787 6.164 36.499 156 H8 A 14 H8 A 14 7.413 2.595 36.576 157 1H6 A 14 1H6 A 14 1.924 1.125 39.168 158 2H6 A 14 2H6 A 14 3.470 0.372 38.710 159 H2 A 14 H2 A 14 1.808 5.264 38.297 160 2H2* A 14 1H2' A 14 7.570 6.119 38.162 161 1H2* A 14 2H2' A 14 8.348 4.741 37.322 162 1H5* G 15 1H5' G 15 5.568 8.619 37.485 163 2H5* G 15 2H5' G 15 6.103 10.054 38.382 164 H4* G 15 H4' G 15 3.946 9.268 39.269 165 H3* G 15 H3' G 15 6.321 9.615 40.925 166 H1* G 15 H1' G 15 3.292 7.399 41.243 167 H8 G 15 H8 G 15 6.403 5.142 40.492 168 H1 G 15 H1 G 15 1.295 2.139 42.993 169 1H2 G 15 1H2 G 15 -0.044 5.326 42.911 170 2H2 G 15 2H2 G 15 -0.329 3.631 43.331 171 2H2* G 15 1H2' G 15 5.157 7.948 42.750 172 1H2* G 15 2H2' G 15 6.321 7.322 41.540 173 1H5* T 16 1H5' T 16 1.904 9.209 42.562 174 2H5* T 16 2H5' T 16 1.796 10.443 43.834 175 H4* T 16 H4' T 16 0.323 8.542 44.363 176 H3* T 16 H3' T 16 2.470 9.443 46.165 177 1H2* T 16 2H2' T 16 3.357 7.288 46.365 178 2H2* T 16 1H2' T 16 1.972 7.037 47.472 179 H1* T 16 H1' T 16 0.639 6.127 45.643 180 H3 T 16 H3 T 16 2.603 2.092 46.435 181 1H5M T 16 1H5M T 16 5.994 3.028 43.297 182 2H5M T 16 2H5M T 16 5.238 4.359 42.409 183 3H5M T 16 3H5M T 16 6.304 4.701 43.787 184 H6 T 16 H6 T 16 3.836 6.001 43.916 185 1H5* G 17 1H5' G 17 -0.998 6.816 47.792 186 2H5* G 17 2H5' G 17 -1.513 7.595 49.302 187 H4* G 17 H4' G 17 -1.604 5.156 49.561 188 H3* G 17 H3' G 17 -0.103 6.878 51.342 189 H1* G 17 H1' G 17 0.414 3.290 50.328 190 H8 G 17 H8 G 17 3.510 5.406 49.276 191 H1 G 17 H1 G 17 4.027 -0.937 48.345 192 1H2 G 17 1H2 G 17 0.742 -0.901 49.427 193 2H2 G 17 2H2 G 17 2.084 -1.907 48.865 194 H3T G 17 H3T G 17 -0.622 5.187 52.804 195 2H2* G 17 1H2' G 17 1.485 4.745 51.994 196 1H2* G 17 2H2' G 17 1.976 5.886 50.702 197 1H5* C 1 1H5' C 1 5.713 -9.416 46.985 198 2H5* C 1 2H5' C 1 6.134 -7.880 46.201 199 H4* C 1 H4' C 1 4.378 -8.110 48.692 200 H3* C 1 H3' C 1 3.618 -8.660 45.915 201 H1* C 1 H1' C 1 2.711 -5.879 48.363 202 1H4 C 1 1H4 C 1 4.354 -0.107 45.584 203 2H4 C 1 2H4 C 1 2.841 -0.050 46.529 204 H5 C 1 H5 C 1 5.475 -2.351 45.348 205 H6 C 1 H6 C 1 5.265 -4.707 45.982 206 H5T C 1 H5T C 1 6.673 -8.618 48.894 207 2H2* C 1 1H2' C 1 1.763 -6.647 46.233 208 1H2* C 1 2H2' C 1 3.333 -6.382 45.426 209 1H5* A 2 1H5' A 2 0.511 -6.987 48.719 210 2H5* A 2 2H5' A 2 -1.051 -7.794 48.451 211 H4* A 2 H4' A 2 -1.434 -5.392 48.692 212 H3* A 2 H3' A 2 -2.234 -6.844 46.313 213 H1* A 2 H1' A 2 -1.149 -3.214 46.736 214 H8 A 2 H8 A 2 1.266 -5.204 44.390 215 1H6 A 2 1H6 A 2 4.026 -1.237 43.094 216 2H6 A 2 2H6 A 2 3.884 0.425 43.721 217 H2 A 2 H2 A 2 0.782 0.839 46.566 218 2H2* A 2 1H2' A 2 -2.177 -4.471 44.929 219 1H2* A 2 2H2' A 2 -0.797 -5.611 44.898 220 1H5* C 3 1H5' C 3 -3.754 -2.583 47.472 221 2H5* C 3 2H5' C 3 -5.447 -2.426 46.959 222 H4* C 3 H4' C 3 -4.252 -0.263 46.760 223 H3* C 3 H3' C 3 -5.647 -1.551 44.522 224 H1* C 3 H1' C 3 -2.704 0.876 44.718 225 1H4 C 3 1H4 C 3 2.358 -1.966 41.522 226 2H4 C 3 2H4 C 3 2.474 -0.191 41.662 227 H5 C 3 H5 C 3 0.302 -3.055 42.450 228 H6 C 3 H6 C 3 -1.792 -2.578 43.643 229 2H2* C 3 1H2' C 3 -4.206 0.203 42.928 230 1H2* C 3 2H2' C 3 -3.749 -1.514 43.154 231 1H5* T 4 1H5' T 4 -4.601 2.959 44.732 232 2H5* T 4 2H5' T 4 -6.028 3.848 44.159 233 H4* T 4 H4' T 4 -3.917 5.037 43.597 234 H3* T 4 H3' T 4 -5.990 4.367 41.648 235 1H2* T 4 2H2' T 4 -4.515 3.122 40.310 236 2H2* T 4 1H2' T 4 -4.056 4.754 39.722 237 H1* T 4 H1' T 4 -2.216 4.844 41.317 238 H3 T 4 H3 T 4 0.207 2.556 38.197 239 1H5M T 4 1H5M T 4 -1.504 -0.994 41.773 240 2H5M T 4 2H5M T 4 -2.667 -1.201 40.448 241 3H5M T 4 3H5M T 4 -0.952 -1.551 40.185 242 H6 T 4 H6 T 4 -2.839 1.280 41.699 243 1H5* A 5 1H5' A 5 -2.513 7.169 40.777 244 2H5* A 5 2H5' A 5 -3.160 8.634 40.009 245 H4* A 5 H4' A 5 -0.936 8.105 39.105 246 H3* A 5 H3' A 5 -3.357 8.251 37.397 247 H1* A 5 H1' A 5 0.058 6.516 37.100 248 H8 A 5 H8 A 5 -2.953 4.030 37.266 249 1H6 A 5 1H6 A 5 -0.520 0.203 35.147 250 2H6 A 5 2H6 A 5 1.156 0.197 34.543 251 H2 A 5 H2 A 5 3.102 3.906 35.057 252 2H2* A 5 1H2' A 5 -1.589 7.250 35.480 253 1H2* A 5 2H2' A 5 -2.859 6.291 36.297 254 1H5* C 6 1H5' C 6 0.996 9.523 36.071 255 2H5* C 6 2H5' C 6 0.827 10.828 34.878 256 H4* C 6 H4' C 6 2.761 9.357 34.343 257 H3* C 6 H3' C 6 0.504 9.801 32.457 258 H1* C 6 H1' C 6 3.106 6.986 32.968 259 1H4 C 6 1H4 C 6 -0.804 1.639 33.457 260 2H4 C 6 2H4 C 6 0.888 1.252 33.051 261 H5 C 6 H5 C 6 -1.422 4.048 33.689 262 H6 C 6 H6 C 6 -0.499 6.318 33.594 263 2H2* C 6 1H2' C 6 1.902 7.801 31.065 264 1H2* C 6 2H2' C 6 0.339 7.575 31.902 265 1H5* A 7 1H5' A 7 4.285 8.093 31.418 266 2H5* A 7 2H5' A 7 5.112 9.091 30.206 267 H4* A 7 H4' A 7 5.696 6.697 29.946 268 H3* A 7 H3' A 7 4.686 8.377 27.800 269 H1* A 7 H1' A 7 4.403 4.620 28.417 270 H8 A 7 H8 A 7 0.933 6.362 28.874 271 1H6 A 7 1H6 A 7 -1.164 0.558 27.918 272 2H6 A 7 2H6 A 7 -1.763 2.199 28.260 273 H2 A 7 H2 A 7 3.059 0.413 27.615 274 2H2* A 7 1H2' A 7 3.985 6.055 26.491 275 1H2* A 7 2H2' A 7 2.801 7.014 27.430 276 1H5* A 8 1H5' A 8 7.287 4.526 27.229 277 2H5* A 8 2H5' A 8 8.467 4.969 25.980 278 H4* A 8 H4' A 8 8.029 2.504 26.074 279 H3* A 8 H3' A 8 8.010 4.111 23.664 280 H1* A 8 H1' A 8 5.979 0.987 24.570 281 H8 A 8 H8 A 8 3.733 4.190 24.624 282 1H6 A 8 1H6 A 8 -0.785 0.050 23.446 283 2H6 A 8 2H6 A 8 -0.548 1.796 23.708 284 H2 A 8 H2 A 8 2.852 -2.117 23.668 285 2H2* A 8 1H2' A 8 6.416 2.184 22.508 286 1H2* A 8 2H2' A 8 5.729 3.681 23.206 287 1H5* A 9 1H5' A 9 7.978 -0.565 23.494 288 2H5* A 9 2H5' A 9 9.304 -0.955 22.379 289 H4* A 9 H4' A 9 7.516 -2.658 22.241 290 H3* A 9 H3' A 9 8.539 -1.183 19.937 291 H1* A 9 H1' A 9 5.131 -2.764 20.645 292 H8 A 9 H8 A 9 4.985 1.107 20.143 293 1H6 A 9 1H6 A 9 -1.171 0.111 20.305 294 2H6 A 9 2H6 A 9 0.004 1.427 20.058 295 H2 A 9 H2 A 9 0.689 -3.636 20.914 296 2H2* A 9 1H2' A 9 6.225 -1.939 18.638 297 1H2* A 9 2H2' A 9 6.425 -0.322 19.381 298 1H5* G 10 1H5' G 10 6.347 -5.295 19.796 299 2H5* G 10 2H5' G 10 7.152 -6.269 18.550 300 H4* G 10 H4' G 10 4.752 -6.866 18.769 301 H3* G 10 H3' G 10 6.049 -6.264 16.267 302 H1* G 10 H1' G 10 2.473 -5.646 17.331 303 H8 G 10 H8 G 10 4.308 -2.276 16.616 304 H1 G 10 H1 G 10 -1.975 -1.778 17.890 305 1H2 G 10 1H2 G 10 -1.676 -5.192 18.388 306 2H2 G 10 2H2 G 10 -2.776 -3.806 18.393 307 2H2* G 10 1H2' G 10 3.677 -5.417 15.221 308 1H2* G 10 2H2' G 10 4.811 -4.248 15.969 309 1H5* A 11 1H5' A 11 1.800 -7.804 16.898 310 2H5* A 11 2H5' A 11 1.463 -9.082 15.714 311 H4* A 11 H4' A 11 -0.604 -7.875 16.404 312 H3* A 11 H3' A 11 0.192 -8.343 13.651 313 H1* A 11 H1' A 11 -1.824 -5.505 15.237 314 H8 A 11 H8 A 11 1.719 -4.291 14.167 315 1H6 A 11 1H6 A 11 -1.044 1.311 14.285 316 2H6 A 11 2H6 A 11 0.545 0.563 13.986 317 H2 A 11 H2 A 11 -4.011 -1.551 15.253 318 2H2* A 11 1H2' A 11 -1.422 -6.236 12.943 319 1H2* A 11 2H2' A 11 0.344 -6.037 13.167 320 1H5* G 12 1H5' G 12 -4.080 -6.897 14.884 321 2H5* G 12 2H5' G 12 -5.213 -7.871 13.924 322 H4* G 12 H4' G 12 -6.130 -5.612 14.318 323 H3* G 12 H3' G 12 -5.711 -6.727 11.619 324 H1* G 12 H1' G 12 -5.924 -3.192 13.045 325 H8 G 12 H8 G 12 -2.330 -3.965 11.719 326 H1 G 12 H1 G 12 -3.962 2.254 11.831 327 1H2 G 12 1H2 G 12 -6.942 0.984 13.039 328 2H2 G 12 2H2 G 12 -6.044 2.446 12.604 329 2H2* G 12 1H2' G 12 -6.183 -4.113 10.808 330 1H2* G 12 2H2' G 12 -4.550 -4.845 10.896 331 1H5* T 13 1H5' T 13 -8.694 -3.150 12.013 332 2H5* T 13 2H5' T 13 -10.003 -3.453 10.849 333 H4* T 13 H4' T 13 -9.269 -1.109 10.654 334 H3* T 13 H3' T 13 -8.583 -3.000 8.381 335 1H2* T 13 2H2' T 13 -7.107 -1.523 7.498 336 2H2* T 13 1H2' T 13 -8.235 -0.154 7.697 337 H1* T 13 H1' T 13 -7.341 0.414 9.762 338 H3 T 13 H3 T 13 -3.135 1.618 8.789 339 1H5M T 13 1H5M T 13 -2.878 -3.610 9.510 340 2H5M T 13 2H5M T 13 -3.158 -3.553 7.756 341 3H5M T 13 3H5M T 13 -1.690 -2.845 8.445 342 H6 T 13 H6 T 13 -5.356 -2.645 9.080 343 1H5* A 14 1H5' A 14 -10.589 1.176 7.729 344 2H5* A 14 2H5' A 14 -11.586 1.026 6.267 345 H4* A 14 H4' A 14 -10.412 3.161 6.177 346 H3* A 14 H3' A 14 -10.224 1.243 4.071 347 H1* A 14 H1' A 14 -7.659 3.672 5.245 348 H8 A 14 H8 A 14 -6.180 0.130 5.847 349 1H6 A 14 1H6 A 14 -1.188 3.471 7.548 350 2H6 A 14 2H6 A 14 -1.692 1.783 7.289 351 H2 A 14 H2 A 14 -4.298 6.228 6.738 352 2H2* A 14 1H2' A 14 -7.676 1.957 3.469 353 1H2* A 14 2H2' A 14 -7.939 0.674 4.695 354 1H5* G 15 1H5' G 15 -10.275 5.911 5.097 355 2H5* G 15 2H5' G 15 -11.464 6.991 4.343 356 H4* G 15 H4' G 15 -9.324 8.142 4.310 357 H3* G 15 H3' G 15 -10.698 7.583 1.872 358 H1* G 15 H1' G 15 -6.938 7.576 2.444 359 H8 G 15 H8 G 15 -8.276 4.073 1.459 360 H1 G 15 H1 G 15 -1.946 4.298 2.562 361 1H2 G 15 1H2 G 15 -2.665 7.568 3.422 362 2H2 G 15 2H2 G 15 -1.399 6.344 3.254 363 2H2* G 15 1H2' G 15 -8.374 7.300 0.487 364 1H2* G 15 2H2' G 15 -9.151 5.867 1.234 365 1H5* T 16 1H5' T 16 -6.578 9.740 1.584 366 2H5* T 16 2H5' T 16 -6.820 11.088 0.453 367 H4* T 16 H4' T 16 -4.586 10.158 0.121 368 H3* T 16 H3' T 16 -6.629 10.050 -2.048 369 1H2* T 16 2H2' T 16 -6.037 7.890 -2.623 370 2H2* T 16 1H2' T 16 -4.533 8.615 -3.263 371 H1* T 16 H1' T 16 -3.396 8.219 -1.160 372 H3 T 16 H3 T 16 -2.231 3.935 -1.519 373 1H5M T 16 1H5M T 16 -7.306 3.767 -2.750 374 2H5M T 16 2H5M T 16 -6.687 2.451 -1.741 375 3H5M T 16 3H5M T 16 -7.532 3.807 -0.988 376 H6 T 16 H6 T 16 -6.497 6.167 -1.503 377 1H5* G 17 1H5' G 17 -2.147 10.002 -2.932 378 2H5* G 17 2H5' G 17 -1.854 11.035 -4.345 379 H4* G 17 H4' G 17 -0.480 9.026 -4.537 380 H3* G 17 H3' G 17 -2.423 9.771 -6.572 381 H1* G 17 H1' G 17 -0.997 6.449 -5.522 382 H8 G 17 H8 G 17 -4.869 6.341 -5.300 383 H1 G 17 H1 G 17 -1.848 0.949 -3.516 384 1H2 G 17 1H2 G 17 0.962 2.900 -4.026 385 2H2 G 17 2H2 G 17 0.355 1.305 -3.559 386 H3T G 17 H3T G 17 -0.138 8.076 -6.663 387 2H2* G 17 1H2' G 17 -2.411 7.154 -7.404 388 1H2* G 17 2H2' G 17 -3.655 7.754 -6.262 Start of MODEL 9 1 1H5* C 1 1H5' C 1 2.595 -6.917 -0.799 2 2H5* C 1 2H5' C 1 2.469 -7.257 -2.536 3 H4* C 1 H4' C 1 4.459 -5.833 -2.968 4 H3* C 1 H3' C 1 5.086 -6.067 -0.221 5 H1* C 1 H1' C 1 3.980 -2.920 -1.977 6 1H4 C 1 1H4 C 1 -1.844 -0.865 0.418 7 2H4 C 1 2H4 C 1 -0.860 0.411 -0.350 8 H5 C 1 H5 C 1 -0.854 -3.174 0.507 9 H6 C 1 H6 C 1 1.125 -4.475 -0.143 10 H5T C 1 H5T C 1 3.591 -8.883 -1.397 11 2H2* C 1 1H2' C 1 4.616 -3.462 0.325 12 1H2* C 1 2H2' C 1 3.261 -4.630 0.447 13 1H5* A 2 1H5' A 2 6.141 -1.971 -2.360 14 2H5* A 2 2H5' A 2 7.755 -1.551 -1.752 15 H4* A 2 H4' A 2 6.467 0.499 -2.014 16 H3* A 2 H3' A 2 7.550 -0.335 0.571 17 H1* A 2 H1' A 2 4.582 1.832 -0.388 18 H8 A 2 H8 A 2 3.391 -1.404 1.471 19 1H6 A 2 1H6 A 2 -1.945 1.821 1.821 20 2H6 A 2 2H6 A 2 -1.247 0.258 2.310 21 H2 A 2 H2 A 2 0.826 4.245 -0.274 22 2H2* A 2 1H2' A 2 5.775 1.449 1.702 23 1H2* A 2 2H2' A 2 5.432 -0.306 1.601 24 1H5* C 3 1H5' C 3 6.355 4.185 -0.364 25 2H5* C 3 2H5' C 3 7.574 5.159 0.486 26 H4* C 3 H4' C 3 5.407 6.304 0.603 27 H3* C 3 H3' C 3 6.783 5.324 3.057 28 H1* C 3 H1' C 3 3.152 6.193 2.099 29 1H4 C 3 1H4 C 3 -0.215 0.785 3.941 30 2H4 C 3 2H4 C 3 -1.217 2.253 3.773 31 H5 C 3 H5 C 3 2.242 1.024 3.528 32 H6 C 3 H6 C 3 3.974 2.665 2.941 33 2H2* C 3 1H2' C 3 4.369 6.233 4.182 34 1H2* C 3 2H2' C 3 4.843 4.521 3.976 35 1H5* T 4 1H5' T 4 4.028 9.044 2.856 36 2H5* T 4 2H5' T 4 4.717 10.283 3.925 37 H4* T 4 H4' T 4 2.261 10.359 4.009 38 H3* T 4 H3' T 4 3.928 9.961 6.389 39 1H2* T 4 2H2' T 4 2.842 7.993 7.008 40 2H2* T 4 1H2' T 4 1.591 9.128 7.610 41 H1* T 4 H1' T 4 0.332 8.894 5.550 42 H3 T 4 H3 T 4 -1.628 5.029 6.843 43 1H5M T 4 1H5M T 4 3.513 3.773 6.138 44 2H5M T 4 2H5M T 4 2.272 2.528 5.951 45 3H5M T 4 3H5M T 4 2.794 3.471 4.544 46 H6 T 4 H6 T 4 2.800 6.158 5.328 47 1H5* A 5 1H5' A 5 -0.505 10.933 6.704 48 2H5* A 5 2H5' A 5 -0.605 12.333 7.787 49 H4* A 5 H4' A 5 -2.565 10.972 8.148 50 H3* A 5 H3' A 5 -0.671 11.520 10.292 51 H1* A 5 H1' A 5 -3.012 8.554 9.732 52 H8 A 5 H8 A 5 0.745 7.512 9.460 53 1H6 A 5 1H6 A 5 -0.130 2.595 9.908 54 2H6 A 5 2H6 A 5 -1.712 1.804 10.117 55 H2 A 5 H2 A 5 -4.922 4.545 10.213 56 2H2* A 5 1H2' A 5 -1.713 9.344 11.626 57 1H2* A 5 2H2' A 5 -0.205 9.250 10.671 58 1H5* C 6 1H5' C 6 -5.171 10.286 10.882 59 2H5* C 6 2H5' C 6 -5.751 11.236 12.267 60 H4* C 6 H4' C 6 -6.955 9.077 12.118 61 H3* C 6 H3' C 6 -5.468 9.947 14.498 62 H1* C 6 H1' C 6 -6.371 6.486 13.100 63 1H4 C 6 1H4 C 6 -1.693 2.418 13.561 64 2H4 C 6 2H4 C 6 -0.488 3.444 12.744 65 H5 C 6 H5 C 6 -1.093 5.777 12.169 66 H6 C 6 H6 C 6 -2.941 7.374 12.197 67 2H2* C 6 1H2' C 6 -5.684 7.303 15.287 68 1H2* C 6 2H2' C 6 -4.192 7.997 14.586 69 1H5* T 7 1H5' T 7 -8.481 6.492 14.623 70 2H5* T 7 2H5' T 7 -9.504 6.709 16.059 71 H4* T 7 H4' T 7 -9.040 4.314 15.686 72 H3* T 7 H3' T 7 -8.328 5.718 18.186 73 1H2* T 7 2H2' T 7 -6.153 4.923 18.176 74 2H2* T 7 1H2' T 7 -6.902 3.389 18.706 75 H1* T 7 H1' T 7 -6.965 2.588 16.418 76 H3 T 7 H3 T 7 -2.718 1.301 15.742 77 1H5M T 7 1H5M T 7 -2.515 6.562 15.530 78 2H5M T 7 2H5M T 7 -2.225 6.346 17.269 79 3H5M T 7 3H5M T 7 -1.074 5.701 16.090 80 H6 T 7 H6 T 7 -4.751 5.566 16.663 81 1H5* C 8 1H5' C 8 -9.805 1.151 17.981 82 2H5* C 8 2H5' C 8 -10.530 0.811 19.567 83 H4* C 8 H4' C 8 -9.390 -1.213 18.689 84 H3* C 8 H3' C 8 -8.060 0.154 21.073 85 H1* C 8 H1' C 8 -6.464 -2.034 18.290 86 1H4 C 8 1H4 C 8 -1.077 0.712 19.337 87 2H4 C 8 2H4 C 8 -1.748 2.331 19.622 88 H5 C 8 H5 C 8 -4.203 2.636 19.639 89 H6 C 8 H6 C 8 -6.322 1.431 19.412 90 2H2* C 8 1H2' C 8 -7.583 -2.701 20.179 91 1H2* C 8 2H2' C 8 -6.484 -1.624 21.091 92 1H5* T 9 1H5' T 9 -8.782 -3.873 20.583 93 2H5* T 9 2H5' T 9 -9.468 -4.759 21.960 94 H4* T 9 H4' T 9 -7.692 -6.060 20.748 95 H3* T 9 H3' T 9 -7.941 -5.867 23.551 96 1H2* T 9 2H2' T 9 -6.200 -4.216 23.742 97 2H2* T 9 1H2' T 9 -5.273 -5.731 23.992 98 H1* T 9 H1' T 9 -4.660 -5.792 21.638 99 H3 T 9 H3 T 9 -1.189 -2.957 21.565 100 1H5M T 9 1H5M T 9 -3.742 0.630 23.210 101 2H5M T 9 2H5M T 9 -5.301 0.200 22.491 102 3H5M T 9 3H5M T 9 -4.929 -0.272 24.163 103 H6 T 9 H6 T 9 -5.808 -2.449 22.820 104 1H5* T 10 1H5' T 10 -4.231 -7.889 21.732 105 2H5* T 10 2H5' T 10 -3.902 -9.386 22.628 106 H4* T 10 H4' T 10 -1.782 -8.325 21.975 107 H3* T 10 H3' T 10 -2.448 -8.992 24.718 108 1H2* T 10 2H2' T 10 -2.376 -6.729 25.414 109 2H2* T 10 1H2' T 10 -0.633 -7.110 25.548 110 H1* T 10 H1' T 10 -0.243 -6.263 23.286 111 H3 T 10 H3 T 10 0.285 -1.998 24.612 112 1H5M T 10 1H5M T 10 -4.917 -2.541 24.210 113 2H5M T 10 2H5M T 10 -4.749 -3.107 25.886 114 3H5M T 10 3H5M T 10 -4.309 -1.446 25.461 115 H6 T 10 H6 T 10 -3.530 -4.922 24.351 116 1H5* T 11 1H5' T 11 1.887 -7.708 23.459 117 2H5* T 11 2H5' T 11 2.938 -8.917 24.225 118 H4* T 11 H4' T 11 4.103 -6.763 24.146 119 H3* T 11 H3' T 11 3.712 -8.252 26.582 120 1H2* T 11 2H2' T 11 2.251 -6.599 27.490 121 2H2* T 11 1H2' T 11 3.834 -5.960 28.039 122 H1* T 11 H1' T 11 3.964 -4.522 26.057 123 H3 T 11 H3 T 11 1.660 -1.228 28.114 124 1H5M T 11 1H5M T 11 -2.464 -3.349 27.319 125 2H5M T 11 2H5M T 11 -2.026 -4.280 25.879 126 3H5M T 11 3H5M T 11 -1.945 -5.033 27.487 127 H6 T 11 H6 T 11 0.403 -5.454 26.180 128 1H5* G 12 1H5' G 12 6.635 -4.566 26.010 129 2H5* G 12 2H5' G 12 8.101 -5.202 26.774 130 H4* G 12 H4' G 12 8.162 -2.756 26.829 131 H3* G 12 H3' G 12 8.515 -4.370 29.155 132 H1* G 12 H1' G 12 6.896 -0.982 28.926 133 H8 G 12 H8 G 12 4.055 -3.630 29.377 134 H1 G 12 H1 G 12 2.379 2.465 30.541 135 1H2 G 12 1H2 G 12 5.714 3.044 29.832 136 2H2 G 12 2H2 G 12 4.172 3.772 30.302 137 2H2* G 12 1H2' G 12 7.384 -2.526 30.772 138 1H2* G 12 2H2' G 12 6.346 -3.778 30.019 139 1H5* T 13 1H5' T 13 8.900 0.292 28.990 140 2H5* T 13 2H5' T 13 10.520 0.511 29.680 141 H4* T 13 H4' T 13 9.195 2.577 29.887 142 H3* T 13 H3' T 13 10.644 1.360 32.013 143 1H2* T 13 2H2' T 13 8.670 0.589 33.111 144 2H2* T 13 1H2' T 13 8.866 2.194 33.888 145 H1* T 13 H1' T 13 7.297 3.182 32.297 146 H3 T 13 H3 T 13 3.709 1.907 34.743 147 1H5M T 13 1H5M T 13 4.716 -2.177 31.563 148 2H5M T 13 2H5M T 13 5.703 -2.653 32.960 149 3H5M T 13 3H5M T 13 3.947 -2.508 33.122 150 H6 T 13 H6 T 13 6.785 -0.430 31.878 151 1H5* A 14 1H5' A 14 8.603 5.567 32.496 152 2H5* A 14 2H5' A 14 9.830 6.568 33.300 153 H4* A 14 H4' A 14 7.560 7.336 33.890 154 H3* A 14 H3' A 14 9.599 6.680 35.831 155 H1* A 14 H1' A 14 5.821 6.385 36.076 156 H8 A 14 H8 A 14 7.437 2.816 35.932 157 1H6 A 14 1H6 A 14 1.867 1.141 38.192 158 2H6 A 14 2H6 A 14 3.439 0.439 37.739 159 H2 A 14 H2 A 14 1.752 5.339 37.621 160 2H2* A 14 1H2' A 14 7.651 6.166 37.673 161 1H2* A 14 2H2' A 14 8.372 4.845 36.699 162 1H5* G 15 1H5' G 15 5.622 8.784 37.140 163 2H5* G 15 2H5' G 15 6.186 10.166 38.103 164 H4* G 15 H4' G 15 4.008 9.370 38.946 165 H3* G 15 H3' G 15 6.368 9.657 40.617 166 H1* G 15 H1' G 15 3.371 7.386 40.861 167 H8 G 15 H8 G 15 6.539 5.227 40.076 168 H1 G 15 H1 G 15 1.369 1.980 42.096 169 1H2 G 15 1H2 G 15 -0.026 5.145 42.164 170 2H2 G 15 2H2 G 15 -0.300 3.420 42.446 171 2H2* G 15 1H2' G 15 5.257 7.881 42.366 172 1H2* G 15 2H2' G 15 6.409 7.329 41.110 173 1H5* T 16 1H5' T 16 1.933 9.232 42.316 174 2H5* T 16 2H5' T 16 1.884 10.429 43.627 175 H4* T 16 H4' T 16 0.379 8.534 44.123 176 H3* T 16 H3' T 16 2.563 9.366 45.912 177 1H2* T 16 2H2' T 16 3.442 7.203 46.038 178 2H2* T 16 1H2' T 16 2.076 6.928 47.161 179 H1* T 16 H1' T 16 0.712 6.062 45.338 180 H3 T 16 H3 T 16 2.706 2.008 45.937 181 1H5M T 16 1H5M T 16 6.324 4.787 43.301 182 2H5M T 16 2H5M T 16 6.090 3.094 42.843 183 3H5M T 16 3H5M T 16 5.260 4.372 41.943 184 H6 T 16 H6 T 16 3.881 6.016 43.553 185 1H5* G 17 1H5' G 17 -0.836 6.665 47.483 186 2H5* G 17 2H5' G 17 -1.366 7.408 49.006 187 H4* G 17 H4' G 17 -1.441 4.980 49.249 188 H3* G 17 H3' G 17 0.138 6.666 51.009 189 H1* G 17 H1' G 17 0.548 3.079 49.931 190 H8 G 17 H8 G 17 3.619 5.166 48.734 191 H1 G 17 H1 G 17 4.083 -1.198 47.922 192 1H2 G 17 1H2 G 17 0.870 -1.137 49.197 193 2H2 G 17 2H2 G 17 2.174 -2.153 48.566 194 H3T G 17 H3T G 17 -0.831 4.006 51.307 195 2H2* G 17 1H2' G 17 1.681 4.478 51.604 196 1H2* G 17 2H2' G 17 2.176 5.631 50.324 197 1H5* C 1 1H5' C 1 5.696 -9.493 46.006 198 2H5* C 1 2H5' C 1 6.012 -7.894 45.304 199 H4* C 1 H4' C 1 4.444 -8.352 47.886 200 H3* C 1 H3' C 1 3.504 -8.807 45.170 201 H1* C 1 H1' C 1 2.670 -6.099 47.713 202 1H4 C 1 1H4 C 1 4.174 -0.229 45.045 203 2H4 C 1 2H4 C 1 2.749 -0.197 46.119 204 H5 C 1 H5 C 1 5.257 -2.470 44.643 205 H6 C 1 H6 C 1 5.086 -4.843 45.216 206 H5T C 1 H5T C 1 6.765 -8.797 47.893 207 2H2* C 1 1H2' C 1 1.691 -6.790 45.564 208 1H2* C 1 2H2' C 1 3.252 -6.494 44.749 209 1H5* A 2 1H5' A 2 0.539 -7.133 48.149 210 2H5* A 2 2H5' A 2 -1.050 -7.900 47.916 211 H4* A 2 H4' A 2 -1.386 -5.501 48.201 212 H3* A 2 H3' A 2 -2.241 -6.880 45.795 213 H1* A 2 H1' A 2 -1.077 -3.280 46.300 214 H8 A 2 H8 A 2 1.280 -5.275 43.894 215 1H6 A 2 1H6 A 2 3.995 0.314 43.290 216 2H6 A 2 2H6 A 2 4.101 -1.345 42.651 217 H2 A 2 H2 A 2 0.904 0.741 46.161 218 2H2* A 2 1H2' A 2 -2.168 -4.463 44.483 219 1H2* A 2 2H2' A 2 -0.816 -5.632 44.389 220 1H5* C 3 1H5' C 3 -3.668 -2.623 47.110 221 2H5* C 3 2H5' C 3 -5.364 -2.427 46.623 222 H4* C 3 H4' C 3 -4.152 -0.273 46.476 223 H3* C 3 H3' C 3 -5.569 -1.490 44.209 224 H1* C 3 H1' C 3 -2.593 0.911 44.445 225 1H4 C 3 1H4 C 3 2.320 -2.017 41.089 226 2H4 C 3 2H4 C 3 2.507 -0.252 41.276 227 H5 C 3 H5 C 3 0.233 -3.053 42.009 228 H6 C 3 H6 C 3 -1.818 -2.533 43.257 229 2H2* C 3 1H2' C 3 -4.139 0.321 42.667 230 1H2* C 3 2H2' C 3 -3.696 -1.407 42.822 231 1H5* T 4 1H5' T 4 -4.461 2.983 44.441 232 2H5* T 4 2H5' T 4 -5.883 3.904 43.911 233 H4* T 4 H4' T 4 -3.784 5.048 43.256 234 H3* T 4 H3' T 4 -5.898 4.320 41.354 235 1H2* T 4 2H2' T 4 -4.431 3.120 39.984 236 2H2* T 4 1H2' T 4 -3.975 4.758 39.412 237 H1* T 4 H1' T 4 -2.123 4.827 40.992 238 H3 T 4 H3 T 4 0.318 2.525 37.903 239 1H5M T 4 1H5M T 4 -0.987 -1.587 39.786 240 2H5M T 4 2H5M T 4 -1.521 -1.042 41.384 241 3H5M T 4 3H5M T 4 -2.691 -1.195 40.059 242 H6 T 4 H6 T 4 -2.818 1.264 41.330 243 1H5* A 5 1H5' A 5 -2.517 7.157 40.331 244 2H5* A 5 2H5' A 5 -3.208 8.601 39.561 245 H4* A 5 H4' A 5 -1.032 8.068 38.558 246 H3* A 5 H3' A 5 -3.542 8.082 36.955 247 H1* A 5 H1' A 5 -0.067 6.464 36.600 248 H8 A 5 H8 A 5 -3.021 3.923 36.869 249 1H6 A 5 1H6 A 5 -0.570 0.124 34.722 250 2H6 A 5 2H6 A 5 1.087 0.144 34.071 251 H2 A 5 H2 A 5 2.971 3.899 34.487 252 2H2* A 5 1H2' A 5 -1.740 7.166 35.006 253 1H2* A 5 2H2' A 5 -2.980 6.171 35.824 254 1H5* C 6 1H5' C 6 0.687 9.478 35.461 255 2H5* C 6 2H5' C 6 0.445 10.762 34.257 256 H4* C 6 H4' C 6 2.388 9.326 33.667 257 H3* C 6 H3' C 6 0.028 9.646 31.867 258 H1* C 6 H1' C 6 2.781 6.966 32.346 259 1H4 C 6 1H4 C 6 -0.896 1.483 33.031 260 2H4 C 6 2H4 C 6 0.809 1.154 32.627 261 H5 C 6 H5 C 6 -1.619 3.867 33.173 262 H6 C 6 H6 C 6 -0.794 6.171 33.008 263 2H2* C 6 1H2' C 6 1.535 7.724 30.455 264 1H2* C 6 2H2' C 6 -0.013 7.426 31.296 265 1H5* A 7 1H5' A 7 3.868 8.191 30.726 266 2H5* A 7 2H5' A 7 4.601 9.217 29.477 267 H4* A 7 H4' A 7 5.313 6.852 29.239 268 H3* A 7 H3' A 7 4.140 8.441 27.097 269 H1* A 7 H1' A 7 4.120 4.675 27.785 270 H8 A 7 H8 A 7 0.571 6.234 28.280 271 1H6 A 7 1H6 A 7 -1.917 1.920 27.766 272 2H6 A 7 2H6 A 7 -1.225 0.313 27.434 273 H2 A 7 H2 A 7 2.981 0.386 27.056 274 2H2* A 7 1H2' A 7 3.612 6.039 25.836 275 1H2* A 7 2H2' A 7 2.368 6.938 26.756 276 1H5* A 8 1H5' A 8 6.986 4.781 26.489 277 2H5* A 8 2H5' A 8 8.104 5.272 25.200 278 H4* A 8 H4' A 8 7.786 2.790 25.305 279 H3* A 8 H3' A 8 7.518 4.409 22.891 280 H1* A 8 H1' A 8 5.831 1.124 23.962 281 H8 A 8 H8 A 8 3.328 4.130 23.997 282 1H6 A 8 1H6 A 8 -0.770 1.359 23.252 283 2H6 A 8 2H6 A 8 -0.850 -0.408 23.041 284 H2 A 8 H2 A 8 2.950 -2.251 23.215 285 2H2* A 8 1H2' A 8 6.117 2.260 21.843 286 1H2* A 8 2H2' A 8 5.308 3.718 22.489 287 1H5* A 9 1H5' A 9 7.955 -0.234 22.682 288 2H5* A 9 2H5' A 9 9.224 -0.514 21.471 289 H4* A 9 H4' A 9 7.541 -2.323 21.402 290 H3* A 9 H3' A 9 8.295 -0.716 19.079 291 H1* A 9 H1' A 9 5.058 -2.543 19.982 292 H8 A 9 H8 A 9 4.632 1.322 19.606 293 1H6 A 9 1H6 A 9 -1.425 -0.084 20.132 294 2H6 A 9 2H6 A 9 -0.356 1.313 19.850 295 H2 A 9 H2 A 9 0.713 -3.711 20.526 296 2H2* A 9 1H2' A 9 5.950 -1.608 17.925 297 1H2* A 9 2H2' A 9 6.097 0.003 18.692 298 1H5* G 10 1H5' G 10 6.336 -4.940 18.909 299 2H5* G 10 2H5' G 10 7.109 -5.822 17.576 300 H4* G 10 H4' G 10 4.750 -6.530 17.887 301 H3* G 10 H3' G 10 5.885 -5.751 15.359 302 H1* G 10 H1' G 10 2.351 -5.315 16.631 303 H8 G 10 H8 G 10 4.003 -1.858 15.925 304 H1 G 10 H1 G 10 -2.126 -1.631 17.857 305 1H2 G 10 1H2 G 10 -2.806 -3.703 18.363 306 2H2 G 10 2H2 G 10 -1.662 -5.043 18.184 307 2H2* G 10 1H2' G 10 3.440 -4.923 14.482 308 1H2* G 10 2H2' G 10 4.573 -3.762 15.242 309 1H5* A 11 1H5' A 11 1.720 -7.621 16.032 310 2H5* A 11 2H5' A 11 1.431 -8.808 14.745 311 H4* A 11 H4' A 11 -0.689 -7.807 15.586 312 H3* A 11 H3' A 11 0.047 -7.989 12.792 313 H1* A 11 H1' A 11 -2.063 -5.380 14.634 314 H8 A 11 H8 A 11 1.387 -3.953 13.515 315 1H6 A 11 1H6 A 11 0.089 0.865 13.916 316 2H6 A 11 2H6 A 11 -1.495 1.517 14.407 317 H2 A 11 H2 A 11 -4.305 -1.508 15.290 318 2H2* A 11 1H2' A 11 -1.645 -5.895 12.284 319 1H2* A 11 2H2' A 11 0.112 -5.641 12.519 320 1H5* G 12 1H5' G 12 -4.195 -6.892 14.323 321 2H5* G 12 2H5' G 12 -5.357 -7.798 13.333 322 H4* G 12 H4' G 12 -6.300 -5.625 14.083 323 H3* G 12 H3' G 12 -6.159 -6.453 11.263 324 H1* G 12 H1' G 12 -6.256 -3.059 13.017 325 H8 G 12 H8 G 12 -2.822 -3.681 11.254 326 H1 G 12 H1 G 12 -4.343 2.488 12.236 327 1H2 G 12 1H2 G 12 -6.335 2.597 13.241 328 2H2 G 12 2H2 G 12 -7.196 1.090 13.594 329 2H2* G 12 1H2' G 12 -6.706 -3.790 10.739 330 1H2* G 12 2H2' G 12 -5.066 -4.498 10.617 331 1H5* T 13 1H5' T 13 -8.869 -2.958 12.502 332 2H5* T 13 2H5' T 13 -10.378 -3.040 11.567 333 H4* T 13 H4' T 13 -9.568 -0.709 11.639 334 H3* T 13 H3' T 13 -9.473 -2.189 8.992 335 1H2* T 13 2H2' T 13 -8.061 -0.659 8.092 336 2H2* T 13 1H2' T 13 -9.051 0.702 8.687 337 H1* T 13 H1' T 13 -7.781 0.910 10.619 338 H3 T 13 H3 T 13 -3.785 2.175 9.017 339 1H5M T 13 1H5M T 13 -3.560 -3.093 9.165 340 2H5M T 13 2H5M T 13 -4.167 -2.879 7.509 341 3H5M T 13 3H5M T 13 -2.575 -2.251 7.958 342 H6 T 13 H6 T 13 -6.069 -2.060 9.233 343 1H5* A 14 1H5' A 14 -10.882 1.996 9.787 344 2H5* A 14 2H5' A 14 -12.337 2.335 8.826 345 H4* A 14 H4' A 14 -10.922 4.350 8.957 346 H3* A 14 H3' A 14 -11.864 3.213 6.485 347 H1* A 14 H1' A 14 -8.665 5.097 7.200 348 H8 A 14 H8 A 14 -7.886 1.390 6.248 349 1H6 A 14 1H6 A 14 -2.051 3.566 5.862 350 2H6 A 14 2H6 A 14 -2.994 2.084 5.571 351 H2 A 14 H2 A 14 -4.463 6.754 7.270 352 2H2* A 14 1H2' A 14 -9.725 4.267 5.162 353 1H2* A 14 2H2' A 14 -9.669 2.589 5.792 354 1H5* G 15 1H5' G 15 -9.654 7.447 6.305 355 2H5* G 15 2H5' G 15 -10.698 8.379 5.213 356 H4* G 15 H4' G 15 -8.388 9.015 4.787 357 H3* G 15 H3' G 15 -10.085 7.871 2.708 358 H1* G 15 H1' G 15 -6.330 7.884 3.205 359 H8 G 15 H8 G 15 -7.748 4.254 3.483 360 H1 G 15 H1 G 15 -1.379 4.681 2.703 361 1H2 G 15 1H2 G 15 -2.055 8.071 2.748 362 2H2 G 15 2H2 G 15 -0.800 6.831 2.612 363 2H2* G 15 1H2' G 15 -7.784 7.264 1.337 364 1H2* G 15 2H2' G 15 -8.611 6.051 2.364 365 1H5* T 16 1H5' T 16 -5.965 9.701 1.727 366 2H5* T 16 2H5' T 16 -6.224 10.760 0.325 367 H4* T 16 H4' T 16 -4.036 9.727 0.116 368 H3* T 16 H3' T 16 -6.186 9.102 -1.861 369 1H2* T 16 2H2' T 16 -5.577 6.874 -1.938 370 2H2* T 16 1H2' T 16 -4.107 7.436 -2.788 371 H1* T 16 H1' T 16 -2.895 7.560 -0.693 372 H3 T 16 H3 T 16 -1.752 3.237 -0.699 373 1H5M T 16 1H5M T 16 -6.402 3.252 1.706 374 2H5M T 16 2H5M T 16 -7.020 3.157 0.042 375 3H5M T 16 3H5M T 16 -6.024 1.852 0.696 376 H6 T 16 H6 T 16 -5.881 5.549 0.194 377 1H5* G 17 1H5' G 17 -1.738 8.878 -2.905 378 2H5* G 17 2H5' G 17 -1.530 9.538 -4.540 379 H4* G 17 H4' G 17 -0.125 7.557 -4.311 380 H3* G 17 H3' G 17 -2.197 7.756 -6.352 381 H1* G 17 H1' G 17 -0.605 4.826 -4.607 382 H8 G 17 H8 G 17 -4.458 4.717 -4.093 383 H1 G 17 H1 G 17 -1.163 -0.168 -1.512 384 1H2 G 17 1H2 G 17 1.545 1.694 -2.591 385 2H2 G 17 2H2 G 17 1.022 0.214 -1.777 386 H3T G 17 H3T G 17 -0.646 6.502 -7.484 387 2H2* G 17 1H2' G 17 -2.127 5.015 -6.529 388 1H2* G 17 2H2' G 17 -3.338 5.848 -5.503 Start of MODEL 10 1 1H5* C 1 1H5' C 1 0.389 -6.001 -4.333 2 2H5* C 1 2H5' C 1 1.689 -6.901 -3.536 3 H4* C 1 H4' C 1 2.645 -4.942 -4.589 4 H3* C 1 H3' C 1 3.024 -5.465 -1.820 5 H1* C 1 H1' C 1 2.695 -2.080 -3.489 6 1H4 C 1 1H4 C 1 -2.705 0.990 -1.181 7 2H4 C 1 2H4 C 1 -1.441 2.082 -1.812 8 H5 C 1 H5 C 1 -2.211 -1.472 -1.215 9 H6 C 1 H6 C 1 -0.501 -3.111 -1.867 10 H5T C 1 H5T C 1 -0.165 -6.699 -2.230 11 2H2* C 1 1H2' C 1 3.136 -2.825 -1.201 12 1H2* C 1 2H2' C 1 1.560 -3.680 -1.158 13 1H5* A 2 1H5' A 2 5.255 -1.669 -3.666 14 2H5* A 2 2H5' A 2 6.843 -1.651 -2.871 15 H4* A 2 H4' A 2 6.051 0.645 -3.103 16 H3* A 2 H3' A 2 6.755 -0.506 -0.545 17 H1* A 2 H1' A 2 4.267 2.199 -1.412 18 H8 A 2 H8 A 2 2.316 -0.967 -0.179 19 1H6 A 2 1H6 A 2 -2.335 3.172 0.303 20 2H6 A 2 2H6 A 2 -1.991 1.449 0.591 21 H2 A 2 H2 A 2 1.036 5.270 -1.170 22 2H2* A 2 1H2' A 2 5.133 1.310 0.698 23 1H2* A 2 2H2' A 2 4.526 -0.322 0.281 24 1H5* C 3 1H5' C 3 6.070 4.234 -0.871 25 2H5* C 3 2H5' C 3 7.294 4.931 0.214 26 H4* C 3 H4' C 3 5.212 6.216 0.444 27 H3* C 3 H3' C 3 5.921 4.376 2.766 28 H1* C 3 H1' C 3 2.689 6.064 1.404 29 1H4 C 3 1H4 C 3 -0.760 0.733 3.137 30 2H4 C 3 2H4 C 3 -1.626 2.259 3.454 31 H5 C 3 H5 C 3 1.606 0.895 2.348 32 H6 C 3 H6 C 3 3.365 2.507 1.768 33 2H2* C 3 1H2' C 3 3.981 6.610 3.207 34 1H2* C 3 2H2' C 3 3.953 4.933 3.815 35 1H5* T 4 1H5' T 4 4.963 8.664 3.060 36 2H5* T 4 2H5' T 4 5.798 9.489 4.392 37 H4* T 4 H4' T 4 3.412 10.166 4.241 38 H3* T 4 H3' T 4 4.691 9.264 6.667 39 1H2* T 4 2H2' T 4 3.377 7.302 6.821 40 2H2* T 4 1H2' T 4 2.259 8.455 7.622 41 H1* T 4 H1' T 4 1.072 8.819 5.527 42 H3 T 4 H3 T 4 -1.613 5.219 5.666 43 1H5M T 4 1H5M T 4 3.382 3.257 5.286 44 2H5M T 4 2H5M T 4 1.976 2.252 4.931 45 3H5M T 4 3H5M T 4 2.700 3.231 3.645 46 H6 T 4 H6 T 4 3.132 5.773 5.090 47 1H5* A 5 1H5' A 5 0.319 10.649 6.728 48 2H5* A 5 2H5' A 5 0.299 11.959 7.925 49 H4* A 5 H4' A 5 -1.860 10.836 7.941 50 H3* A 5 H3' A 5 -0.221 11.124 10.301 51 H1* A 5 H1' A 5 -2.668 8.325 9.395 52 H8 A 5 H8 A 5 1.047 7.111 9.369 53 1H6 A 5 1H6 A 5 -1.663 1.491 9.500 54 2H6 A 5 2H6 A 5 -0.050 2.246 9.475 55 H2 A 5 H2 A 5 -4.781 4.363 9.451 56 2H2* A 5 1H2' A 5 -1.474 8.953 11.414 57 1H2* A 5 2H2' A 5 0.094 8.803 10.570 58 1H5* C 6 1H5' C 6 -4.774 9.997 10.411 59 2H5* C 6 2H5' C 6 -5.464 10.956 11.738 60 H4* C 6 H4' C 6 -6.695 8.822 11.465 61 H3* C 6 H3' C 6 -5.447 9.679 13.975 62 H1* C 6 H1' C 6 -6.233 6.218 12.522 63 1H4 C 6 1H4 C 6 -1.641 2.141 13.513 64 2H4 C 6 2H4 C 6 -0.369 3.116 12.734 65 H5 C 6 H5 C 6 -0.915 5.425 12.003 66 H6 C 6 H6 C 6 -2.747 7.033 11.833 67 2H2* C 6 1H2' C 6 -5.720 7.042 14.755 68 1H2* C 6 2H2' C 6 -4.174 7.729 14.172 69 1H5* T 7 1H5' T 7 -8.461 6.193 13.970 70 2H5* T 7 2H5' T 7 -9.571 6.447 15.334 71 H4* T 7 H4' T 7 -9.028 4.052 15.103 72 H3* T 7 H3' T 7 -8.463 5.586 17.570 73 1H2* T 7 2H2' T 7 -6.291 4.802 17.720 74 2H2* T 7 1H2' T 7 -7.058 3.280 18.255 75 H1* T 7 H1' T 7 -6.988 2.406 15.994 76 H3 T 7 H3 T 7 -2.717 1.106 15.599 77 1H5M T 7 1H5M T 7 -2.510 6.365 15.221 78 2H5M T 7 2H5M T 7 -2.286 6.191 16.975 79 3H5M T 7 3H5M T 7 -1.092 5.518 15.854 80 H6 T 7 H6 T 7 -4.793 5.400 16.255 81 1H5* C 8 1H5' C 8 -9.918 0.998 17.523 82 2H5* C 8 2H5' C 8 -10.675 0.706 19.104 83 H4* C 8 H4' C 8 -9.460 -1.321 18.337 84 H3* C 8 H3' C 8 -8.233 0.174 20.699 85 H1* C 8 H1' C 8 -6.523 -2.089 18.044 86 1H4 C 8 1H4 C 8 -1.203 0.781 19.099 87 2H4 C 8 2H4 C 8 -1.902 2.394 19.353 88 H5 C 8 H5 C 8 -4.365 2.658 19.322 89 H6 C 8 H6 C 8 -6.459 1.412 19.082 90 2H2* C 8 1H2' C 8 -7.659 -2.702 19.939 91 1H2* C 8 2H2' C 8 -6.611 -1.557 20.827 92 1H5* T 9 1H5' T 9 -8.844 -3.889 20.348 93 2H5* T 9 2H5' T 9 -9.556 -4.731 21.739 94 H4* T 9 H4' T 9 -7.720 -6.045 20.631 95 H3* T 9 H3' T 9 -8.073 -5.763 23.410 96 1H2* T 9 2H2' T 9 -6.389 -4.052 23.608 97 2H2* T 9 1H2' T 9 -5.431 -5.528 23.951 98 H1* T 9 H1' T 9 -4.704 -5.646 21.636 99 H3 T 9 H3 T 9 -1.344 -2.673 21.711 100 1H5M T 9 1H5M T 9 -5.372 0.029 23.775 101 2H5M T 9 2H5M T 9 -4.189 0.909 22.795 102 3H5M T 9 3H5M T 9 -5.683 0.322 22.050 103 H6 T 9 H6 T 9 -6.074 -2.294 22.514 104 1H5* T 10 1H5' T 10 -4.233 -7.721 21.830 105 2H5* T 10 2H5' T 10 -3.956 -9.215 22.750 106 H4* T 10 H4' T 10 -1.803 -8.160 22.203 107 H3* T 10 H3' T 10 -2.623 -8.794 24.923 108 1H2* T 10 2H2' T 10 -2.502 -6.537 25.611 109 2H2* T 10 1H2' T 10 -0.772 -6.958 25.794 110 H1* T 10 H1' T 10 -0.304 -6.135 23.540 111 H3 T 10 H3 T 10 0.285 -1.870 24.843 112 1H5M T 10 1H5M T 10 -4.327 -1.180 25.458 113 2H5M T 10 2H5M T 10 -4.948 -2.392 24.328 114 3H5M T 10 3H5M T 10 -4.767 -2.789 26.051 115 H6 T 10 H6 T 10 -3.587 -4.711 24.504 116 1H5* T 11 1H5' T 11 1.757 -7.613 23.815 117 2H5* T 11 2H5' T 11 2.755 -8.853 24.601 118 H4* T 11 H4' T 11 3.988 -6.741 24.566 119 H3* T 11 H3' T 11 3.464 -8.213 26.989 120 1H2* T 11 2H2' T 11 2.032 -6.512 27.850 121 2H2* T 11 1H2' T 11 3.617 -5.923 28.448 122 H1* T 11 H1' T 11 3.854 -4.491 26.471 123 H3 T 11 H3 T 11 1.572 -1.146 28.482 124 1H5M T 11 1H5M T 11 -2.140 -4.791 27.532 125 2H5M T 11 2H5M T 11 -2.578 -3.082 27.400 126 3H5M T 11 3H5M T 11 -2.088 -3.977 25.954 127 H6 T 11 H6 T 11 0.266 -5.284 26.398 128 1H5* G 12 1H5' G 12 6.535 -4.654 26.511 129 2H5* G 12 2H5' G 12 7.959 -5.350 27.304 130 H4* G 12 H4' G 12 8.116 -2.905 27.349 131 H3* G 12 H3' G 12 8.381 -4.521 29.684 132 H1* G 12 H1' G 12 6.880 -1.078 29.429 133 H8 G 12 H8 G 12 3.935 -3.624 29.796 134 H1 G 12 H1 G 12 2.474 2.512 31.037 135 1H2 G 12 1H2 G 12 5.846 2.969 30.420 136 2H2 G 12 2H2 G 12 4.323 3.749 30.871 137 2H2* G 12 1H2' G 12 7.289 -2.637 31.282 138 1H2* G 12 2H2' G 12 6.218 -3.854 30.515 139 1H5* T 13 1H5' T 13 8.902 0.114 29.508 140 2H5* T 13 2H5' T 13 10.526 0.292 30.201 141 H4* T 13 H4' T 13 9.265 2.398 30.384 142 H3* T 13 H3' T 13 10.667 1.164 32.531 143 1H2* T 13 2H2' T 13 8.665 0.458 33.621 144 2H2* T 13 1H2' T 13 8.904 2.064 34.387 145 H1* T 13 H1' T 13 7.372 3.084 32.779 146 H3 T 13 H3 T 13 3.756 1.916 35.246 147 1H5M T 13 1H5M T 13 5.581 -2.695 33.408 148 2H5M T 13 2H5M T 13 3.831 -2.489 33.581 149 3H5M T 13 3H5M T 13 4.604 -2.168 32.022 150 H6 T 13 H6 T 13 6.740 -0.502 32.351 151 1H5* A 14 1H5' A 14 8.631 5.327 32.957 152 2H5* A 14 2H5' A 14 9.827 6.373 33.751 153 H4* A 14 H4' A 14 7.519 7.080 34.297 154 H3* A 14 H3' A 14 9.570 6.523 36.282 155 H1* A 14 H1' A 14 5.786 6.229 36.443 156 H8 A 14 H8 A 14 7.390 2.651 36.518 157 1H6 A 14 1H6 A 14 1.866 1.188 39.033 158 2H6 A 14 2H6 A 14 3.417 0.436 38.588 159 H2 A 14 H2 A 14 1.773 5.334 38.181 160 2H2* A 14 1H2' A 14 7.562 6.152 38.110 161 1H2* A 14 2H2' A 14 8.327 4.771 37.264 162 1H5* G 15 1H5' G 15 5.565 8.650 37.434 163 2H5* G 15 2H5' G 15 6.101 10.081 38.339 164 H4* G 15 H4' G 15 3.943 9.302 39.224 165 H3* G 15 H3' G 15 6.319 9.623 40.878 166 H1* G 15 H1' G 15 3.291 7.409 41.190 167 H8 G 15 H8 G 15 6.398 5.154 40.412 168 H1 G 15 H1 G 15 1.284 2.135 42.885 169 1H2 G 15 1H2 G 15 -0.337 3.632 43.244 170 2H2 G 15 2H2 G 15 -0.037 5.329 42.835 171 2H2* G 15 1H2' G 15 5.174 7.932 42.688 172 1H2* G 15 2H2' G 15 6.323 7.318 41.456 173 1H5* T 16 1H5' T 16 1.884 9.281 42.513 174 2H5* T 16 2H5' T 16 1.804 10.513 43.788 175 H4* T 16 H4' T 16 0.273 8.641 44.287 176 H3* T 16 H3' T 16 2.387 9.530 46.125 177 1H2* T 16 2H2' T 16 3.283 7.373 46.319 178 2H2* T 16 1H2' T 16 1.899 7.127 47.427 179 H1* T 16 H1' T 16 0.564 6.209 45.601 180 H3 T 16 H3 T 16 2.536 2.177 46.412 181 1H5M T 16 1H5M T 16 6.236 4.791 43.765 182 2H5M T 16 2H5M T 16 5.937 3.114 43.284 183 3H5M T 16 3H5M T 16 5.177 4.436 42.386 184 H6 T 16 H6 T 16 3.763 6.080 43.883 185 1H5* G 17 1H5' G 17 -1.001 6.812 47.655 186 2H5* G 17 2H5' G 17 -1.603 7.577 49.141 187 H4* G 17 H4' G 17 -1.619 5.142 49.418 188 H3* G 17 H3' G 17 -0.228 6.925 51.228 189 H1* G 17 H1' G 17 0.426 3.348 50.268 190 H8 G 17 H8 G 17 3.513 5.524 49.321 191 H1 G 17 H1 G 17 4.147 -0.795 48.299 192 1H2 G 17 1H2 G 17 2.217 -1.809 48.790 193 2H2 G 17 2H2 G 17 0.851 -0.824 49.337 194 H3T G 17 H3T G 17 -1.060 4.220 51.521 195 2H2* G 17 1H2' G 17 1.409 4.852 51.948 196 1H2* G 17 2H2' G 17 1.900 5.994 50.656 197 1H5* C 1 1H5' C 1 6.105 -9.061 46.501 198 2H5* C 1 2H5' C 1 6.330 -7.420 45.864 199 H4* C 1 H4' C 1 4.838 -8.055 48.454 200 H3* C 1 H3' C 1 3.863 -8.520 45.774 201 H1* C 1 H1' C 1 2.934 -5.802 48.281 202 1H4 C 1 1H4 C 1 4.447 0.069 45.615 203 2H4 C 1 2H4 C 1 2.913 0.068 46.528 204 H5 C 1 H5 C 1 5.641 -2.137 45.376 205 H6 C 1 H6 C 1 5.490 -4.505 45.979 206 H5T C 1 H5T C 1 8.089 -8.147 47.128 207 2H2* C 1 1H2' C 1 2.019 -6.534 46.124 208 1H2* C 1 2H2' C 1 3.587 -6.204 45.334 209 1H5* A 2 1H5' A 2 0.836 -6.895 48.713 210 2H5* A 2 2H5' A 2 -0.715 -7.740 48.502 211 H4* A 2 H4' A 2 -1.154 -5.350 48.744 212 H3* A 2 H3' A 2 -1.990 -6.823 46.396 213 H1* A 2 H1' A 2 -0.958 -3.167 46.757 214 H8 A 2 H8 A 2 1.433 -5.145 44.378 215 1H6 A 2 1H6 A 2 4.009 0.491 43.634 216 2H6 A 2 2H6 A 2 4.141 -1.176 43.023 217 H2 A 2 H2 A 2 0.938 0.905 46.530 218 2H2* A 2 1H2' A 2 -2.006 -4.462 44.991 219 1H2* A 2 2H2' A 2 -0.608 -5.578 44.936 220 1H5* C 3 1H5' C 3 -3.499 -2.579 47.548 221 2H5* C 3 2H5' C 3 -5.205 -2.414 47.084 222 H4* C 3 H4' C 3 -3.992 -0.264 46.830 223 H3* C 3 H3' C 3 -5.474 -1.557 44.647 224 H1* C 3 H1' C 3 -2.506 0.848 44.743 225 1H4 C 3 1H4 C 3 2.432 -2.045 41.407 226 2H4 C 3 2H4 C 3 2.570 -0.271 41.537 227 H5 C 3 H5 C 3 0.391 -3.113 42.387 228 H6 C 3 H6 C 3 -1.664 -2.616 43.637 229 2H2* C 3 1H2' C 3 -4.081 0.198 43.008 230 1H2* C 3 2H2' C 3 -3.631 -1.524 43.209 231 1H5* T 4 1H5' T 4 -4.432 2.959 44.828 232 2H5* T 4 2H5' T 4 -5.871 3.849 44.290 233 H4* T 4 H4' T 4 -3.775 5.032 43.663 234 H3* T 4 H3' T 4 -5.897 4.349 41.772 235 1H2* T 4 2H2' T 4 -4.457 3.090 40.410 236 2H2* T 4 1H2' T 4 -4.013 4.717 39.795 237 H1* T 4 H1' T 4 -2.132 4.820 41.342 238 H3 T 4 H3 T 4 0.249 2.505 38.216 239 1H5M T 4 1H5M T 4 -2.672 -1.216 40.485 240 2H5M T 4 2H5M T 4 -0.972 -1.597 40.173 241 3H5M T 4 3H5M T 4 -1.470 -1.043 41.779 242 H6 T 4 H6 T 4 -2.789 1.257 41.735 243 1H5* A 5 1H5' A 5 -2.448 7.162 40.829 244 2H5* A 5 2H5' A 5 -3.110 8.623 40.067 245 H4* A 5 H4' A 5 -0.889 8.097 39.146 246 H3* A 5 H3' A 5 -3.323 8.249 37.456 247 H1* A 5 H1' A 5 0.092 6.509 37.132 248 H8 A 5 H8 A 5 -2.934 4.043 37.312 249 1H6 A 5 1H6 A 5 -0.561 0.221 35.120 250 2H6 A 5 2H6 A 5 1.107 0.206 34.496 251 H2 A 5 H2 A 5 3.094 3.892 35.028 252 2H2* A 5 1H2' A 5 -1.556 7.267 35.526 253 1H2* A 5 2H2' A 5 -2.827 6.303 36.335 254 1H5* C 6 1H5' C 6 1.013 9.516 36.090 255 2H5* C 6 2H5' C 6 0.840 10.825 34.901 256 H4* C 6 H4' C 6 2.752 9.334 34.341 257 H3* C 6 H3' C 6 0.475 9.799 32.481 258 H1* C 6 H1' C 6 3.072 6.977 32.964 259 1H4 C 6 1H4 C 6 -0.842 1.635 33.454 260 2H4 C 6 2H4 C 6 0.855 1.244 33.072 261 H5 C 6 H5 C 6 -1.465 4.043 33.652 262 H6 C 6 H6 C 6 -0.542 6.314 33.560 263 2H2* C 6 1H2' C 6 1.867 7.805 31.070 264 1H2* C 6 2H2' C 6 0.305 7.580 31.909 265 1H5* A 7 1H5' A 7 4.243 8.095 31.406 266 2H5* A 7 2H5' A 7 5.065 9.087 30.185 267 H4* A 7 H4' A 7 5.631 6.689 29.926 268 H3* A 7 H3' A 7 4.606 8.372 27.784 269 H1* A 7 H1' A 7 4.332 4.613 28.419 270 H8 A 7 H8 A 7 0.868 6.362 28.887 271 1H6 A 7 1H6 A 7 -1.246 0.566 27.917 272 2H6 A 7 2H6 A 7 -1.839 2.207 28.270 273 H2 A 7 H2 A 7 2.975 0.414 27.590 274 2H2* A 7 1H2' A 7 3.925 6.034 26.483 275 1H2* A 7 2H2' A 7 2.735 6.998 27.409 276 1H5* A 8 1H5' A 8 7.205 4.524 27.195 277 2H5* A 8 2H5' A 8 8.387 4.974 25.949 278 H4* A 8 H4' A 8 7.939 2.511 26.016 279 H3* A 8 H3' A 8 7.912 4.147 23.624 280 H1* A 8 H1' A 8 5.886 1.011 24.509 281 H8 A 8 H8 A 8 3.645 4.216 24.602 282 1H6 A 8 1H6 A 8 -0.880 0.100 23.364 283 2H6 A 8 2H6 A 8 -0.641 1.842 23.648 284 H2 A 8 H2 A 8 2.752 -2.075 23.562 285 2H2* A 8 1H2' A 8 6.320 2.223 22.455 286 1H2* A 8 2H2' A 8 5.634 3.715 23.164 287 1H5* A 9 1H5' A 9 7.899 -0.529 23.407 288 2H5* A 9 2H5' A 9 9.219 -0.901 22.278 289 H4* A 9 H4' A 9 7.437 -2.608 22.131 290 H3* A 9 H3' A 9 8.430 -1.090 19.837 291 H1* A 9 H1' A 9 5.041 -2.711 20.560 292 H8 A 9 H8 A 9 4.870 1.165 20.098 293 1H6 A 9 1H6 A 9 -1.280 0.134 20.284 294 2H6 A 9 2H6 A 9 -0.113 1.458 20.047 295 H2 A 9 H2 A 9 0.604 -3.610 20.846 296 2H2* A 9 1H2' A 9 6.112 -1.864 18.550 297 1H2* A 9 2H2' A 9 6.305 -0.251 19.302 298 1H5* G 10 1H5' G 10 6.259 -5.205 19.672 299 2H5* G 10 2H5' G 10 7.062 -6.164 18.412 300 H4* G 10 H4' G 10 4.668 -6.777 18.633 301 H3* G 10 H3' G 10 5.949 -6.119 16.132 302 H1* G 10 H1' G 10 2.369 -5.567 17.235 303 H8 G 10 H8 G 10 4.160 -2.175 16.521 304 H1 G 10 H1 G 10 -2.108 -1.742 17.889 305 1H2 G 10 1H2 G 10 -1.769 -5.153 18.375 306 2H2 G 10 2H2 G 10 -2.880 -3.777 18.405 307 2H2* G 10 1H2' G 10 3.548 -5.309 15.116 308 1H2* G 10 2H2' G 10 4.673 -4.128 15.859 309 1H5* A 11 1H5' A 11 1.743 -7.787 16.750 310 2H5* A 11 2H5' A 11 1.438 -9.052 15.544 311 H4* A 11 H4' A 11 -0.658 -7.913 16.263 312 H3* A 11 H3' A 11 0.132 -8.324 13.503 313 H1* A 11 H1' A 11 -1.937 -5.543 15.125 314 H8 A 11 H8 A 11 1.586 -4.256 14.068 315 1H6 A 11 1H6 A 11 -1.261 1.299 14.285 316 2H6 A 11 2H6 A 11 0.337 0.581 13.968 317 H2 A 11 H2 A 11 -4.181 -1.622 15.217 318 2H2* A 11 1H2' A 11 -1.518 -6.238 12.823 319 1H2* A 11 2H2' A 11 0.244 -6.008 13.052 320 1H5* G 12 1H5' G 12 -4.146 -6.977 14.781 321 2H5* G 12 2H5' G 12 -5.278 -7.954 13.823 322 H4* G 12 H4' G 12 -6.215 -5.708 14.271 323 H3* G 12 H3' G 12 -5.868 -6.801 11.560 324 H1* G 12 H1' G 12 -6.054 -3.273 12.989 325 H8 G 12 H8 G 12 -2.477 -4.015 11.596 326 H1 G 12 H1 G 12 -4.128 2.195 11.847 327 1H2 G 12 1H2 G 12 -6.203 2.363 12.665 328 2H2 G 12 2H2 G 12 -7.076 0.881 13.082 329 2H2* G 12 1H2' G 12 -6.322 -4.192 10.749 330 1H2* G 12 2H2' G 12 -4.689 -4.924 10.830 331 1H5* T 13 1H5' T 13 -8.784 -3.168 12.021 332 2H5* T 13 2H5' T 13 -10.120 -3.457 10.884 333 H4* T 13 H4' T 13 -9.363 -1.130 10.650 334 H3* T 13 H3' T 13 -8.739 -3.057 8.392 335 1H2* T 13 2H2' T 13 -7.217 -1.642 7.495 336 2H2* T 13 1H2' T 13 -8.321 -0.247 7.637 337 H1* T 13 H1' T 13 -7.449 0.362 9.705 338 H3 T 13 H3 T 13 -3.239 1.569 8.790 339 1H5M T 13 1H5M T 13 -3.281 -3.590 7.666 340 2H5M T 13 2H5M T 13 -1.801 -2.884 8.332 341 3H5M T 13 3H5M T 13 -2.966 -3.662 9.414 342 H6 T 13 H6 T 13 -5.460 -2.699 9.009 343 1H5* A 14 1H5' A 14 -10.580 1.150 7.730 344 2H5* A 14 2H5' A 14 -11.599 1.057 6.278 345 H4* A 14 H4' A 14 -10.300 3.123 6.179 346 H3* A 14 H3' A 14 -10.263 1.203 4.071 347 H1* A 14 H1' A 14 -7.522 3.453 5.207 348 H8 A 14 H8 A 14 -6.271 -0.181 5.711 349 1H6 A 14 1H6 A 14 -1.653 1.137 7.108 350 2H6 A 14 2H6 A 14 -1.051 2.783 7.428 351 H2 A 14 H2 A 14 -3.999 5.749 6.801 352 2H2* A 14 1H2' A 14 -7.681 1.742 3.436 353 1H2* A 14 2H2' A 14 -8.015 0.481 4.668 354 1H5* G 15 1H5' G 15 -9.978 5.804 5.248 355 2H5* G 15 2H5' G 15 -11.189 6.930 4.602 356 H4* G 15 H4' G 15 -9.062 8.099 4.582 357 H3* G 15 H3' G 15 -10.490 7.699 2.161 358 H1* G 15 H1' G 15 -6.715 7.584 2.579 359 H8 G 15 H8 G 15 -8.140 4.166 1.459 360 H1 G 15 H1 G 15 -1.813 4.162 2.602 361 1H2 G 15 1H2 G 15 -2.451 7.405 3.623 362 2H2 G 15 2H2 G 15 -1.217 6.156 3.404 363 2H2* G 15 1H2' G 15 -8.235 7.397 0.680 364 1H2* G 15 2H2' G 15 -9.011 5.956 1.413 365 1H5* T 16 1H5' T 16 -6.306 9.751 1.833 366 2H5* T 16 2H5' T 16 -6.537 11.133 0.743 367 H4* T 16 H4' T 16 -4.348 10.156 0.314 368 H3* T 16 H3' T 16 -6.469 10.081 -1.791 369 1H2* T 16 2H2' T 16 -5.857 7.963 -2.457 370 2H2* T 16 1H2' T 16 -4.353 8.710 -3.071 371 H1* T 16 H1' T 16 -3.213 8.241 -0.992 372 H3 T 16 H3 T 16 -2.089 3.952 -1.407 373 1H5M T 16 1H5M T 16 -6.547 2.529 -1.847 374 2H5M T 16 2H5M T 16 -7.383 3.825 -0.984 375 3H5M T 16 3H5M T 16 -7.159 3.926 -2.744 376 H6 T 16 H6 T 16 -6.331 6.231 -1.427 377 1H5* G 17 1H5' G 17 -2.007 10.154 -2.801 378 2H5* G 17 2H5' G 17 -1.783 11.213 -4.209 379 H4* G 17 H4' G 17 -0.369 9.241 -4.477 380 H3* G 17 H3' G 17 -2.383 9.978 -6.436 381 H1* G 17 H1' G 17 -0.895 6.652 -5.491 382 H8 G 17 H8 G 17 -4.752 6.523 -5.097 383 H1 G 17 H1 G 17 -1.645 1.097 -3.586 384 1H2 G 17 1H2 G 17 1.137 3.076 -4.145 385 2H2 G 17 2H2 G 17 0.555 1.466 -3.698 386 H3T G 17 H3T G 17 -0.843 8.982 -7.820 387 2H2* G 17 1H2' G 17 -2.400 7.375 -7.296 388 1H2* G 17 2H2' G 17 -3.593 7.950 -6.088 Start of MODEL 11 1 1H5* C 1 1H5' C 1 1.326 -6.625 -1.366 2 2H5* C 1 2H5' C 1 1.112 -7.022 -3.082 3 H4* C 1 H4' C 1 3.207 -5.805 -3.634 4 H3* C 1 H3' C 1 3.891 -5.961 -0.893 5 H1* C 1 H1' C 1 2.998 -2.808 -2.780 6 1H4 C 1 1H4 C 1 -2.551 -0.220 -0.238 7 2H4 C 1 2H4 C 1 -1.427 0.978 -0.936 8 H5 C 1 H5 C 1 -1.826 -2.624 -0.272 9 H6 C 1 H6 C 1 0.008 -4.101 -0.975 10 H5T C 1 H5T C 1 3.308 -7.779 -1.457 11 2H2* C 1 1H2' C 1 3.675 -3.297 -0.480 12 1H2* C 1 2H2' C 1 2.230 -4.333 -0.252 13 1H5* A 2 1H5' A 2 5.318 -2.042 -3.162 14 2H5* A 2 2H5' A 2 6.982 -1.789 -2.595 15 H4* A 2 H4' A 2 5.897 0.382 -2.820 16 H3* A 2 H3' A 2 7.009 -0.547 -0.299 17 H1* A 2 H1' A 2 4.171 1.850 -1.050 18 H8 A 2 H8 A 2 2.789 -1.354 0.733 19 1H6 A 2 1H6 A 2 -1.709 0.606 1.727 20 2H6 A 2 2H6 A 2 -2.294 2.231 1.292 21 H2 A 2 H2 A 2 0.594 4.512 -0.786 22 2H2* A 2 1H2' A 2 5.391 1.265 0.981 23 1H2* A 2 2H2' A 2 4.912 -0.451 0.800 24 1H5* C 3 1H5' C 3 6.112 4.100 -1.119 25 2H5* C 3 2H5' C 3 7.440 4.942 -0.292 26 H4* C 3 H4' C 3 5.395 6.287 -0.120 27 H3* C 3 H3' C 3 6.811 5.262 2.257 28 H1* C 3 H1' C 3 3.185 6.302 1.568 29 1H4 C 3 1H4 C 3 -0.458 1.035 3.305 30 2H4 C 3 2H4 C 3 -1.384 2.553 3.164 31 H5 C 3 H5 C 3 2.003 1.148 2.871 32 H6 C 3 H6 C 3 3.813 2.701 2.284 33 2H2* C 3 1H2' C 3 4.505 6.060 3.594 34 1H2* C 3 2H2' C 3 4.882 4.361 3.174 35 1H5* T 4 1H5' T 4 4.101 9.070 2.261 36 2H5* T 4 2H5' T 4 4.897 10.260 3.312 37 H4* T 4 H4' T 4 2.449 10.447 3.501 38 H3* T 4 H3' T 4 4.205 9.979 5.796 39 1H2* T 4 2H2' T 4 3.097 8.029 6.446 40 2H2* T 4 1H2' T 4 1.918 9.195 7.132 41 H1* T 4 H1' T 4 0.541 9.034 5.141 42 H3 T 4 H3 T 4 -1.501 5.227 6.453 43 1H5M T 4 1H5M T 4 2.248 2.592 5.347 44 2H5M T 4 2H5M T 4 2.784 3.558 3.962 45 3H5M T 4 3H5M T 4 3.546 3.775 5.552 46 H6 T 4 H6 T 4 2.902 6.213 4.777 47 1H5* A 5 1H5' A 5 -0.176 11.078 6.361 48 2H5* A 5 2H5' A 5 -0.174 12.473 7.455 49 H4* A 5 H4' A 5 -2.151 11.167 7.913 50 H3* A 5 H3' A 5 -0.130 11.640 9.963 51 H1* A 5 H1' A 5 -2.604 8.764 9.497 52 H8 A 5 H8 A 5 1.091 7.597 8.994 53 1H6 A 5 1H6 A 5 -1.465 1.975 9.929 54 2H6 A 5 2H6 A 5 0.111 2.731 9.590 55 H2 A 5 H2 A 5 -4.590 4.822 10.222 56 2H2* A 5 1H2' A 5 -1.192 9.499 11.336 57 1H2* A 5 2H2' A 5 0.266 9.354 10.313 58 1H5* C 6 1H5' C 6 -4.603 10.507 10.650 59 2H5* C 6 2H5' C 6 -5.151 11.451 12.052 60 H4* C 6 H4' C 6 -6.411 9.319 11.851 61 H3* C 6 H3' C 6 -4.972 10.155 14.262 62 H1* C 6 H1' C 6 -5.865 6.703 12.849 63 1H4 C 6 1H4 C 6 -1.208 2.610 13.359 64 2H4 C 6 2H4 C 6 -0.013 3.605 12.490 65 H5 C 6 H5 C 6 -0.608 5.931 11.879 66 H6 C 6 H6 C 6 -2.445 7.541 11.899 67 2H2* C 6 1H2' C 6 -5.176 7.512 15.040 68 1H2* C 6 2H2' C 6 -3.683 8.206 14.340 69 1H5* T 7 1H5' T 7 -7.967 6.669 14.363 70 2H5* T 7 2H5' T 7 -9.000 6.883 15.792 71 H4* T 7 H4' T 7 -8.494 4.493 15.439 72 H3* T 7 H3' T 7 -7.800 5.925 17.934 73 1H2* T 7 2H2' T 7 -5.635 5.115 17.959 74 2H2* T 7 1H2' T 7 -6.393 3.578 18.463 75 H1* T 7 H1' T 7 -6.422 2.795 16.171 76 H3 T 7 H3 T 7 -2.162 1.520 15.565 77 1H5M T 7 1H5M T 7 -1.689 6.579 17.011 78 2H5M T 7 2H5M T 7 -0.551 5.936 15.816 79 3H5M T 7 3H5M T 7 -2.004 6.787 15.275 80 H6 T 7 H6 T 7 -4.226 5.787 16.402 81 1H5* C 8 1H5' C 8 -9.407 1.390 17.754 82 2H5* C 8 2H5' C 8 -10.142 1.081 19.342 83 H4* C 8 H4' C 8 -9.068 -0.983 18.468 84 H3* C 8 H3' C 8 -7.705 0.345 20.856 85 H1* C 8 H1' C 8 -6.152 -1.890 18.090 86 1H4 C 8 1H4 C 8 -0.712 0.688 19.305 87 2H4 C 8 2H4 C 8 -1.337 2.330 19.562 88 H5 C 8 H5 C 8 -3.782 2.716 19.480 89 H6 C 8 H6 C 8 -5.930 1.576 19.188 90 2H2* C 8 1H2' C 8 -7.319 -2.525 19.962 91 1H2* C 8 2H2' C 8 -6.192 -1.489 20.887 92 1H5* T 9 1H5' T 9 -8.552 -3.655 20.359 93 2H5* T 9 2H5' T 9 -9.298 -4.507 21.725 94 H4* T 9 H4' T 9 -7.562 -5.884 20.532 95 H3* T 9 H3' T 9 -7.873 -5.722 23.319 96 1H2* T 9 2H2' T 9 -6.104 -4.108 23.581 97 2H2* T 9 1H2' T 9 -5.222 -5.645 23.854 98 H1* T 9 H1' T 9 -4.507 -5.697 21.534 99 H3 T 9 H3 T 9 -1.005 -2.896 21.705 100 1H5M T 9 1H5M T 9 -3.657 0.764 22.987 101 2H5M T 9 2H5M T 9 -5.178 0.296 22.213 102 3H5M T 9 3H5M T 9 -4.888 -0.100 23.921 103 H6 T 9 H6 T 9 -5.705 -2.323 22.567 104 1H5* T 10 1H5' T 10 -4.169 -7.812 21.608 105 2H5* T 10 2H5' T 10 -3.926 -9.347 22.466 106 H4* T 10 H4' T 10 -1.749 -8.329 21.915 107 H3* T 10 H3' T 10 -2.528 -9.087 24.608 108 1H2* T 10 2H2' T 10 -2.380 -6.865 25.408 109 2H2* T 10 1H2' T 10 -0.656 -7.318 25.560 110 H1* T 10 H1' T 10 -0.185 -6.389 23.348 111 H3 T 10 H3 T 10 0.473 -2.182 24.773 112 1H5M T 10 1H5M T 10 -4.559 -3.196 26.123 113 2H5M T 10 2H5M T 10 -4.084 -1.535 25.743 114 3H5M T 10 3H5M T 10 -4.752 -2.569 24.471 115 H6 T 10 H6 T 10 -3.430 -4.987 24.490 116 1H5* T 11 1H5' T 11 1.828 -7.865 23.519 117 2H5* T 11 2H5' T 11 2.865 -9.102 24.257 118 H4* T 11 H4' T 11 4.026 -6.945 24.291 119 H3* T 11 H3' T 11 3.576 -8.530 26.662 120 1H2* T 11 2H2' T 11 2.114 -6.903 27.608 121 2H2* T 11 1H2' T 11 3.691 -6.288 28.201 122 H1* T 11 H1' T 11 3.855 -4.786 26.271 123 H3 T 11 H3 T 11 1.557 -1.548 28.411 124 1H5M T 11 1H5M T 11 -2.577 -3.597 27.495 125 2H5M T 11 2H5M T 11 -2.131 -4.461 26.016 126 3H5M T 11 3H5M T 11 -2.079 -5.292 27.586 127 H6 T 11 H6 T 11 0.283 -5.690 26.312 128 1H5* G 12 1H5' G 12 6.508 -4.859 26.245 129 2H5* G 12 2H5' G 12 7.970 -5.498 27.016 130 H4* G 12 H4' G 12 7.995 -3.046 27.101 131 H3* G 12 H3' G 12 8.369 -4.692 29.409 132 H1* G 12 H1' G 12 6.721 -1.313 29.202 133 H8 G 12 H8 G 12 3.906 -3.992 29.639 134 H1 G 12 H1 G 12 2.187 2.071 30.909 135 1H2 G 12 1H2 G 12 5.511 2.688 30.181 136 2H2 G 12 2H2 G 12 3.965 3.397 30.669 137 2H2* G 12 1H2' G 12 7.240 -2.856 31.041 138 1H2* G 12 2H2' G 12 6.207 -4.116 30.294 139 1H5* T 13 1H5' T 13 8.646 -0.065 29.228 140 2H5* T 13 2H5' T 13 10.269 0.211 29.889 141 H4* T 13 H4' T 13 8.898 2.244 30.074 142 H3* T 13 H3' T 13 10.390 1.097 32.219 143 1H2* T 13 2H2' T 13 8.438 0.339 33.356 144 2H2* T 13 1H2' T 13 8.617 1.971 34.081 145 H1* T 13 H1' T 13 7.017 2.882 32.471 146 H3 T 13 H3 T 13 3.545 1.586 35.090 147 1H5M T 13 1H5M T 13 5.476 -2.956 33.200 148 2H5M T 13 2H5M T 13 3.725 -2.815 33.418 149 3H5M T 13 3H5M T 13 4.445 -2.471 31.838 150 H6 T 13 H6 T 13 6.514 -0.721 32.091 151 1H5* A 14 1H5' A 14 8.152 5.142 32.513 152 2H5* A 14 2H5' A 14 9.312 6.279 33.231 153 H4* A 14 H4' A 14 6.992 6.938 33.766 154 H3* A 14 H3' A 14 9.075 6.538 35.755 155 H1* A 14 H1' A 14 5.299 6.136 35.970 156 H8 A 14 H8 A 14 7.043 2.633 36.231 157 1H6 A 14 1H6 A 14 1.558 1.070 38.774 158 2H6 A 14 2H6 A 14 3.147 0.364 38.389 159 H2 A 14 H2 A 14 1.294 5.153 37.689 160 2H2* A 14 1H2' A 14 7.089 6.208 37.619 161 1H2* A 14 2H2' A 14 7.893 4.807 36.842 162 1H5* G 15 1H5' G 15 5.058 8.685 36.851 163 2H5* G 15 2H5' G 15 5.581 10.154 37.699 164 H4* G 15 H4' G 15 3.428 9.362 38.606 165 H3* G 15 H3' G 15 5.784 9.834 40.255 166 H1* G 15 H1' G 15 2.808 7.558 40.655 167 H8 G 15 H8 G 15 5.985 5.364 40.019 168 H1 G 15 H1 G 15 0.933 2.300 42.561 169 1H2 G 15 1H2 G 15 -0.489 5.446 42.375 170 2H2 G 15 2H2 G 15 -0.734 3.757 42.840 171 2H2* G 15 1H2' G 15 4.654 8.218 42.144 172 1H2* G 15 2H2' G 15 5.840 7.570 40.967 173 1H5* T 16 1H5' T 16 1.377 9.332 41.879 174 2H5* T 16 2H5' T 16 1.214 10.601 43.110 175 H4* T 16 H4' T 16 -0.188 8.659 43.685 176 H3* T 16 H3' T 16 1.869 9.737 45.482 177 1H2* T 16 2H2' T 16 2.910 7.644 45.712 178 2H2* T 16 1H2' T 16 1.567 7.351 46.860 179 H1* T 16 H1' T 16 0.246 6.313 45.082 180 H3 T 16 H3 T 16 2.375 2.411 46.058 181 1H5M T 16 1H5M T 16 5.907 5.153 43.214 182 2H5M T 16 2H5M T 16 5.836 3.397 43.017 183 3H5M T 16 3H5M T 16 4.921 4.444 41.921 184 H6 T 16 H6 T 16 3.456 6.246 43.363 185 1H5* G 17 1H5' G 17 -1.298 6.809 47.107 186 2H5* G 17 2H5' G 17 -1.911 7.527 48.610 187 H4* G 17 H4' G 17 -1.720 5.107 48.902 188 H3* G 17 H3' G 17 -0.367 7.004 50.638 189 H1* G 17 H1' G 17 0.442 3.460 49.662 190 H8 G 17 H8 G 17 3.334 5.811 48.510 191 H1 G 17 H1 G 17 4.390 -0.491 47.774 192 1H2 G 17 1H2 G 17 1.146 -0.710 48.948 193 2H2 G 17 2H2 G 17 2.563 -1.611 48.393 194 H3T G 17 H3T G 17 -1.041 4.263 50.998 195 2H2* G 17 1H2' G 17 1.392 5.012 51.315 196 1H2* G 17 2H2' G 17 1.783 6.179 50.012 197 1H5* C 1 1H5' C 1 6.373 -6.963 45.227 198 2H5* C 1 2H5' C 1 7.407 -7.172 46.654 199 H4* C 1 H4' C 1 5.455 -7.981 47.959 200 H3* C 1 H3' C 1 4.148 -8.465 45.512 201 H1* C 1 H1' C 1 3.196 -5.695 47.969 202 1H4 C 1 1H4 C 1 4.580 0.135 45.132 203 2H4 C 1 2H4 C 1 3.099 0.142 46.129 204 H5 C 1 H5 C 1 5.781 -2.071 44.886 205 H6 C 1 H6 C 1 5.676 -4.427 45.549 206 H5T C 1 H5T C 1 7.505 -8.955 45.250 207 2H2* C 1 1H2' C 1 2.314 -6.503 45.842 208 1H2* C 1 2H2' C 1 3.861 -6.122 45.030 209 1H5* A 2 1H5' A 2 1.314 -6.730 48.598 210 2H5* A 2 2H5' A 2 -0.229 -7.614 48.543 211 H4* A 2 H4' A 2 -0.733 -5.241 48.680 212 H3* A 2 H3' A 2 -1.590 -6.813 46.384 213 H1* A 2 H1' A 2 -0.696 -3.115 46.704 214 H8 A 2 H8 A 2 1.641 -5.015 44.207 215 1H6 A 2 1H6 A 2 4.089 -0.935 42.658 216 2H6 A 2 2H6 A 2 3.904 0.728 43.270 217 H2 A 2 H2 A 2 1.002 1.031 46.330 218 2H2* A 2 1H2' A 2 -1.802 -4.442 44.994 219 1H2* A 2 2H2' A 2 -0.369 -5.504 44.851 220 1H5* C 3 1H5' C 3 -3.220 -2.635 47.564 221 2H5* C 3 2H5' C 3 -4.947 -2.525 47.162 222 H4* C 3 H4' C 3 -3.803 -0.344 46.836 223 H3* C 3 H3' C 3 -5.278 -1.739 44.685 224 H1* C 3 H1' C 3 -2.420 0.827 44.757 225 1H4 C 3 1H4 C 3 2.363 -1.908 41.069 226 2H4 C 3 2H4 C 3 2.425 -0.126 41.140 227 H5 C 3 H5 C 3 0.467 -3.040 42.252 228 H6 C 3 H6 C 3 -1.514 -2.599 43.634 229 2H2* C 3 1H2' C 3 -4.075 0.221 43.097 230 1H2* C 3 2H2' C 3 -3.555 -1.490 43.162 231 1H5* T 4 1H5' T 4 -4.478 2.778 44.833 232 2H5* T 4 2H5' T 4 -5.969 3.618 44.357 233 H4* T 4 H4' T 4 -3.956 4.853 43.595 234 H3* T 4 H3' T 4 -6.142 4.053 41.827 235 1H2* T 4 2H2' T 4 -4.726 2.792 40.440 236 2H2* T 4 1H2' T 4 -4.378 4.410 39.745 237 H1* T 4 H1' T 4 -2.426 4.640 41.193 238 H3 T 4 H3 T 4 -0.141 2.321 37.995 239 1H5M T 4 1H5M T 4 -1.109 -1.767 40.117 240 2H5M T 4 2H5M T 4 -1.483 -1.181 41.746 241 3H5M T 4 3H5M T 4 -2.786 -1.423 40.565 242 H6 T 4 H6 T 4 -2.914 1.068 41.725 243 1H5* A 5 1H5' A 5 -2.782 6.826 40.673 244 2H5* A 5 2H5' A 5 -3.460 8.270 39.892 245 H4* A 5 H4' A 5 -1.278 7.718 38.910 246 H3* A 5 H3' A 5 -3.776 7.749 37.288 247 H1* A 5 H1' A 5 -0.309 6.103 36.962 248 H8 A 5 H8 A 5 -3.279 3.581 37.239 249 1H6 A 5 1H6 A 5 -0.857 -0.237 35.092 250 2H6 A 5 2H6 A 5 0.798 -0.226 34.434 251 H2 A 5 H2 A 5 2.704 3.518 34.837 252 2H2* A 5 1H2' A 5 -1.964 6.819 35.354 253 1H2* A 5 2H2' A 5 -3.219 5.834 36.163 254 1H5* C 6 1H5' C 6 0.460 9.123 35.799 255 2H5* C 6 2H5' C 6 0.231 10.398 34.582 256 H4* C 6 H4' C 6 2.147 8.935 33.985 257 H3* C 6 H3' C 6 -0.259 9.189 32.219 258 H1* C 6 H1' C 6 2.555 6.574 32.745 259 1H4 C 6 1H4 C 6 -1.077 1.062 33.418 260 2H4 C 6 2H4 C 6 0.626 0.748 32.999 261 H5 C 6 H5 C 6 -1.820 3.440 33.567 262 H6 C 6 H6 C 6 -1.013 5.753 33.398 263 2H2* C 6 1H2' C 6 1.362 7.318 30.827 264 1H2* C 6 2H2' C 6 -0.209 6.986 31.612 265 1H5* A 7 1H5' A 7 3.584 7.864 31.141 266 2H5* A 7 2H5' A 7 4.333 8.886 29.899 267 H4* A 7 H4' A 7 5.109 6.528 29.746 268 H3* A 7 H3' A 7 4.082 8.075 27.529 269 H1* A 7 H1' A 7 3.944 4.331 28.209 270 H8 A 7 H8 A 7 0.386 5.888 28.651 271 1H6 A 7 1H6 A 7 -1.399 -0.014 27.656 272 2H6 A 7 2H6 A 7 -2.083 1.592 28.007 273 H2 A 7 H2 A 7 2.829 0.066 27.377 274 2H2* A 7 1H2' A 7 3.445 5.721 26.265 275 1H2* A 7 2H2' A 7 2.228 6.639 27.205 276 1H5* A 8 1H5' A 8 6.943 4.379 27.147 277 2H5* A 8 2H5' A 8 8.131 4.894 25.932 278 H4* A 8 H4' A 8 7.915 2.397 26.095 279 H3* A 8 H3' A 8 7.899 3.922 23.646 280 H1* A 8 H1' A 8 6.042 0.688 24.510 281 H8 A 8 H8 A 8 3.569 3.721 24.419 282 1H6 A 8 1H6 A 8 -0.581 -0.762 23.140 283 2H6 A 8 2H6 A 8 -0.484 1.001 23.368 284 H2 A 8 H2 A 8 3.187 -2.652 23.574 285 2H2* A 8 1H2' A 8 6.465 1.903 22.454 286 1H2* A 8 2H2' A 8 5.656 3.355 23.119 287 1H5* A 9 1H5' A 9 8.090 -0.765 23.430 288 2H5* A 9 2H5' A 9 9.441 -1.088 22.323 289 H4* A 9 H4' A 9 7.688 -2.808 22.073 290 H3* A 9 H3' A 9 8.733 -1.235 19.861 291 H1* A 9 H1' A 9 5.310 -2.826 20.406 292 H8 A 9 H8 A 9 5.154 1.061 20.097 293 1H6 A 9 1H6 A 9 -1.000 0.054 20.309 294 2H6 A 9 2H6 A 9 0.172 1.380 20.099 295 H2 A 9 H2 A 9 0.874 -3.713 20.742 296 2H2* A 9 1H2' A 9 6.432 -1.842 18.484 297 1H2* A 9 2H2' A 9 6.629 -0.293 19.360 298 1H5* G 10 1H5' G 10 6.543 -5.351 19.488 299 2H5* G 10 2H5' G 10 7.343 -6.244 18.180 300 H4* G 10 H4' G 10 4.946 -6.875 18.407 301 H3* G 10 H3' G 10 6.209 -6.172 15.921 302 H1* G 10 H1' G 10 2.644 -5.575 17.036 303 H8 G 10 H8 G 10 4.499 -2.195 16.449 304 H1 G 10 H1 G 10 -1.750 -1.687 17.873 305 1H2 G 10 1H2 G 10 -1.483 -5.121 18.219 306 2H2 G 10 2H2 G 10 -2.565 -3.724 18.302 307 2H2* G 10 1H2' G 10 3.842 -5.250 14.935 308 1H2* G 10 2H2' G 10 4.988 -4.129 15.736 309 1H5* A 11 1H5' A 11 1.944 -7.725 16.511 310 2H5* A 11 2H5' A 11 1.579 -8.922 15.252 311 H4* A 11 H4' A 11 -0.463 -7.728 16.036 312 H3* A 11 H3' A 11 0.304 -8.034 13.249 313 H1* A 11 H1' A 11 -1.659 -5.267 15.032 314 H8 A 11 H8 A 11 1.895 -4.069 13.980 315 1H6 A 11 1H6 A 11 -0.721 1.579 14.504 316 2H6 A 11 2H6 A 11 0.843 0.813 14.131 317 H2 A 11 H2 A 11 -3.744 -1.263 15.344 318 2H2* A 11 1H2' A 11 -1.304 -5.875 12.697 319 1H2* A 11 2H2' A 11 0.467 -5.709 12.901 320 1H5* G 12 1H5' G 12 -3.837 -6.674 14.742 321 2H5* G 12 2H5' G 12 -5.051 -7.588 13.823 322 H4* G 12 H4' G 12 -5.907 -5.352 14.480 323 H3* G 12 H3' G 12 -5.835 -6.318 11.698 324 H1* G 12 H1' G 12 -5.813 -2.848 13.299 325 H8 G 12 H8 G 12 -2.392 -3.636 11.585 326 H1 G 12 H1 G 12 -3.859 2.605 12.056 327 1H2 G 12 1H2 G 12 -6.748 1.356 13.488 328 2H2 G 12 2H2 G 12 -5.861 2.813 13.018 329 2H2* G 12 1H2' G 12 -6.337 -3.665 11.070 330 1H2* G 12 2H2' G 12 -4.719 -4.419 10.939 331 1H5* T 13 1H5' T 13 -8.439 -2.706 12.795 332 2H5* T 13 2H5' T 13 -9.982 -2.839 11.921 333 H4* T 13 H4' T 13 -9.179 -0.514 11.810 334 H3* T 13 H3' T 13 -9.139 -2.166 9.264 335 1H2* T 13 2H2' T 13 -7.759 -0.693 8.232 336 2H2* T 13 1H2' T 13 -8.742 0.700 8.759 337 H1* T 13 H1' T 13 -7.423 1.041 10.640 338 H3 T 13 H3 T 13 -3.455 2.191 8.887 339 1H5M T 13 1H5M T 13 -3.814 -2.979 7.822 340 2H5M T 13 2H5M T 13 -2.226 -2.304 8.214 341 3H5M T 13 3H5M T 13 -3.208 -3.038 9.490 342 H6 T 13 H6 T 13 -5.724 -2.017 9.463 343 1H5* A 14 1H5' A 14 -10.513 2.000 9.918 344 2H5* A 14 2H5' A 14 -12.003 2.340 9.014 345 H4* A 14 H4' A 14 -10.536 4.336 9.079 346 H3* A 14 H3' A 14 -11.680 3.245 6.686 347 H1* A 14 H1' A 14 -8.341 4.980 7.130 348 H8 A 14 H8 A 14 -7.827 1.199 6.285 349 1H6 A 14 1H6 A 14 -1.930 3.029 5.400 350 2H6 A 14 2H6 A 14 -2.966 1.589 5.251 351 H2 A 14 H2 A 14 -4.073 6.413 6.791 352 2H2* A 14 1H2' A 14 -9.592 4.174 5.200 353 1H2* A 14 2H2' A 14 -9.567 2.504 5.853 354 1H5* G 15 1H5' G 15 -9.397 7.431 6.395 355 2H5* G 15 2H5' G 15 -10.521 8.410 5.431 356 H4* G 15 H4' G 15 -8.228 9.050 4.870 357 H3* G 15 H3' G 15 -10.124 8.103 2.880 358 H1* G 15 H1' G 15 -6.346 7.925 3.021 359 H8 G 15 H8 G 15 -7.923 4.354 3.115 360 H1 G 15 H1 G 15 -1.559 4.550 2.200 361 1H2 G 15 1H2 G 15 -2.070 7.947 2.591 362 2H2 G 15 2H2 G 15 -0.877 6.672 2.306 363 2H2* G 15 1H2' G 15 -7.998 7.449 1.280 364 1H2* G 15 2H2' G 15 -8.779 6.227 2.333 365 1H5* T 16 1H5' T 16 -6.011 9.888 1.670 366 2H5* T 16 2H5' T 16 -6.349 11.010 0.335 367 H4* T 16 H4' T 16 -4.198 9.950 -0.065 368 H3* T 16 H3' T 16 -6.485 9.470 -1.921 369 1H2* T 16 2H2' T 16 -5.952 7.228 -2.125 370 2H2* T 16 1H2' T 16 -4.533 7.787 -3.060 371 H1* T 16 H1' T 16 -3.168 7.794 -1.055 372 H3 T 16 H3 T 16 -2.123 3.454 -1.278 373 1H5M T 16 1H5M T 16 -7.362 3.499 -0.231 374 2H5M T 16 2H5M T 16 -6.376 2.099 0.208 375 3H5M T 16 3H5M T 16 -6.604 3.408 1.374 376 H6 T 16 H6 T 16 -6.149 5.810 -0.082 377 1H5* G 17 1H5' G 17 -2.127 9.185 -3.305 378 2H5* G 17 2H5' G 17 -2.022 9.940 -4.909 379 H4* G 17 H4' G 17 -0.659 7.917 -4.909 380 H3* G 17 H3' G 17 -2.848 8.303 -6.780 381 H1* G 17 H1' G 17 -1.293 5.198 -5.332 382 H8 G 17 H8 G 17 -5.099 5.210 -4.603 383 H1 G 17 H1 G 17 -1.856 0.198 -2.208 384 1H2 G 17 1H2 G 17 0.862 1.971 -3.407 385 2H2 G 17 2H2 G 17 0.326 0.506 -2.572 386 H3T G 17 H3T G 17 -1.454 7.049 -8.085 387 2H2* G 17 1H2' G 17 -2.963 5.582 -7.098 388 1H2* G 17 2H2' G 17 -4.030 6.414 -5.922 Start of MODEL 12 1 1H5* C 1 1H5' C 1 0.667 -5.906 -3.210 2 2H5* C 1 2H5' C 1 0.464 -6.232 -4.942 3 H4* C 1 H4' C 1 2.640 -5.133 -5.417 4 H3* C 1 H3' C 1 3.293 -5.471 -2.697 5 H1* C 1 H1' C 1 2.615 -2.162 -4.377 6 1H4 C 1 1H4 C 1 -2.843 0.632 -1.874 7 2H4 C 1 2H4 C 1 -1.651 1.785 -2.536 8 H5 C 1 H5 C 1 -2.231 -1.805 -1.933 9 H6 C 1 H6 C 1 -0.463 -3.356 -2.644 10 H5T C 1 H5T C 1 2.387 -7.463 -4.848 11 2H2* C 1 1H2' C 1 3.200 -2.840 -2.099 12 1H2* C 1 2H2' C 1 1.693 -3.804 -1.975 13 1H5* A 2 1H5' A 2 4.988 -1.445 -4.621 14 2H5* A 2 2H5' A 2 6.636 -1.319 -3.973 15 H4* A 2 H4' A 2 5.639 0.905 -4.007 16 H3* A 2 H3' A 2 6.639 -0.308 -1.571 17 H1* A 2 H1' A 2 3.896 2.234 -2.126 18 H8 A 2 H8 A 2 2.343 -1.098 -0.771 19 1H6 A 2 1H6 A 2 -2.632 2.583 0.058 20 2H6 A 2 2H6 A 2 -2.104 0.903 0.320 21 H2 A 2 H2 A 2 0.402 4.981 -1.668 22 2H2* A 2 1H2' A 2 5.009 1.361 -0.131 23 1H2* A 2 2H2' A 2 4.493 -0.303 -0.548 24 1H5* C 3 1H5' C 3 5.731 4.393 -1.791 25 2H5* C 3 2H5' C 3 6.997 5.143 -0.794 26 H4* C 3 H4' C 3 4.892 6.375 -0.468 27 H3* C 3 H3' C 3 5.794 4.611 1.847 28 H1* C 3 H1' C 3 2.427 6.157 0.649 29 1H4 C 3 1H4 C 3 -0.683 0.740 2.729 30 2H4 C 3 2H4 C 3 -1.581 2.244 3.069 31 H5 C 3 H5 C 3 1.621 0.973 1.779 32 H6 C 3 H6 C 3 3.269 2.638 1.042 33 2H2* C 3 1H2' C 3 3.811 6.795 2.350 34 1H2* C 3 2H2' C 3 3.876 5.136 3.001 35 1H5* T 4 1H5' T 4 4.686 8.850 2.070 36 2H5* T 4 2H5' T 4 5.568 9.758 3.314 37 H4* T 4 H4' T 4 3.155 10.347 3.283 38 H3* T 4 H3' T 4 4.608 9.586 5.661 39 1H2* T 4 2H2' T 4 3.365 7.604 5.985 40 2H2* T 4 1H2' T 4 2.256 8.762 6.791 41 H1* T 4 H1' T 4 0.939 8.976 4.756 42 H3 T 4 H3 T 4 -1.554 5.262 5.270 43 1H5M T 4 1H5M T 4 2.693 3.393 3.000 44 2H5M T 4 2H5M T 4 3.488 3.518 4.584 45 3H5M T 4 3H5M T 4 2.113 2.433 4.369 46 H6 T 4 H6 T 4 3.099 6.008 4.294 47 1H5* A 5 1H5' A 5 0.226 10.877 5.906 48 2H5* A 5 2H5' A 5 0.221 12.227 7.056 49 H4* A 5 H4' A 5 -1.896 11.039 7.222 50 H3* A 5 H3' A 5 -0.126 11.432 9.486 51 H1* A 5 H1' A 5 -2.597 8.603 8.767 52 H8 A 5 H8 A 5 1.113 7.380 8.614 53 1H6 A 5 1H6 A 5 -1.589 1.803 9.384 54 2H6 A 5 2H6 A 5 0.023 2.539 9.207 55 H2 A 5 H2 A 5 -4.699 4.673 9.254 56 2H2* A 5 1H2' A 5 -1.342 9.303 10.727 57 1H2* A 5 2H2' A 5 0.199 9.130 9.837 58 1H5* C 6 1H5' C 6 -4.651 10.293 9.804 59 2H5* C 6 2H5' C 6 -5.301 11.288 11.124 60 H4* C 6 H4' C 6 -6.539 9.149 10.941 61 H3* C 6 H3' C 6 -5.265 10.093 13.392 62 H1* C 6 H1' C 6 -6.009 6.572 12.100 63 1H4 C 6 1H4 C 6 -1.336 2.590 13.074 64 2H4 C 6 2H4 C 6 -0.109 3.539 12.198 65 H5 C 6 H5 C 6 -0.709 5.812 11.394 66 H6 C 6 H6 C 6 -2.564 7.393 11.229 67 2H2* C 6 1H2' C 6 -5.396 7.491 14.275 68 1H2* C 6 2H2' C 6 -3.903 8.193 13.582 69 1H5* T 7 1H5' T 7 -8.150 6.484 13.502 70 2H5* T 7 2H5' T 7 -9.249 6.738 14.874 71 H4* T 7 H4' T 7 -8.668 4.350 14.662 72 H3* T 7 H3' T 7 -8.120 5.914 17.114 73 1H2* T 7 2H2' T 7 -5.934 5.173 17.259 74 2H2* T 7 1H2' T 7 -6.669 3.643 17.814 75 H1* T 7 H1' T 7 -6.588 2.744 15.566 76 H3 T 7 H3 T 7 -2.275 1.550 15.223 77 1H5M T 7 1H5M T 7 -2.004 6.700 16.397 78 2H5M T 7 2H5M T 7 -0.783 6.015 15.314 79 3H5M T 7 3H5M T 7 -2.222 6.790 14.637 80 H6 T 7 H6 T 7 -4.478 5.800 15.726 81 1H5* C 8 1H5' C 8 -9.565 1.331 17.042 82 2H5* C 8 2H5' C 8 -10.347 1.044 18.612 83 H4* C 8 H4' C 8 -9.175 -1.007 17.833 84 H3* C 8 H3' C 8 -7.956 0.427 20.236 85 H1* C 8 H1' C 8 -6.224 -1.830 17.594 86 1H4 C 8 1H4 C 8 -0.923 0.948 19.006 87 2H4 C 8 2H4 C 8 -1.611 2.574 19.198 88 H5 C 8 H5 C 8 -4.058 2.882 18.969 89 H6 C 8 H6 C 8 -6.153 1.669 18.601 90 2H2* C 8 1H2' C 8 -7.439 -2.451 19.439 91 1H2* C 8 2H2' C 8 -6.384 -1.350 20.375 92 1H5* T 9 1H5' T 9 -8.599 -3.592 19.805 93 2H5* T 9 2H5' T 9 -9.407 -4.440 21.140 94 H4* T 9 H4' T 9 -7.554 -5.785 20.099 95 H3* T 9 H3' T 9 -8.057 -5.564 22.853 96 1H2* T 9 2H2' T 9 -6.365 -3.886 23.196 97 2H2* T 9 1H2' T 9 -5.452 -5.384 23.563 98 H1* T 9 H1' T 9 -4.567 -5.453 21.307 99 H3 T 9 H3 T 9 -1.221 -2.476 21.709 100 1H5M T 9 1H5M T 9 -5.402 0.227 23.408 101 2H5M T 9 2H5M T 9 -4.163 1.104 22.498 102 3H5M T 9 3H5M T 9 -5.599 0.497 21.662 103 H6 T 9 H6 T 9 -6.006 -2.107 22.084 104 1H5* T 10 1H5' T 10 -4.181 -7.553 21.448 105 2H5* T 10 2H5' T 10 -4.009 -9.095 22.312 106 H4* T 10 H4' T 10 -1.792 -8.095 21.924 107 H3* T 10 H3' T 10 -2.777 -8.838 24.559 108 1H2* T 10 2H2' T 10 -2.622 -6.626 25.374 109 2H2* T 10 1H2' T 10 -0.919 -7.115 25.625 110 H1* T 10 H1' T 10 -0.302 -6.193 23.446 111 H3 T 10 H3 T 10 0.348 -2.012 24.965 112 1H5M T 10 1H5M T 10 -4.767 -2.859 25.953 113 2H5M T 10 2H5M T 10 -4.260 -1.230 25.481 114 3H5M T 10 3H5M T 10 -4.873 -2.348 24.254 115 H6 T 10 H6 T 10 -3.584 -4.721 24.351 116 1H5* T 11 1H5' T 11 1.671 -7.725 23.768 117 2H5* T 11 2H5' T 11 2.612 -9.014 24.548 118 H4* T 11 H4' T 11 3.857 -6.914 24.688 119 H3* T 11 H3' T 11 3.175 -8.489 27.013 120 1H2* T 11 2H2' T 11 1.753 -6.793 27.887 121 2H2* T 11 1H2' T 11 3.322 -6.257 28.567 122 H1* T 11 H1' T 11 3.661 -4.755 26.661 123 H3 T 11 H3 T 11 1.340 -1.470 28.735 124 1H5M T 11 1H5M T 11 -2.392 -4.965 27.430 125 2H5M T 11 2H5M T 11 -2.778 -3.243 27.305 126 3H5M T 11 3H5M T 11 -2.223 -4.124 25.875 127 H6 T 11 H6 T 11 0.071 -5.470 26.375 128 1H5* G 12 1H5' G 12 6.303 -5.017 26.736 129 2H5* G 12 2H5' G 12 7.705 -5.720 27.562 130 H4* G 12 H4' G 12 7.841 -3.262 27.596 131 H3* G 12 H3' G 12 8.124 -4.886 29.927 132 H1* G 12 H1' G 12 6.601 -1.452 29.672 133 H8 G 12 H8 G 12 3.675 -4.019 30.046 134 H1 G 12 H1 G 12 2.195 2.092 31.385 135 1H2 G 12 1H2 G 12 5.555 2.576 30.725 136 2H2 G 12 2H2 G 12 4.034 3.342 31.203 137 2H2* G 12 1H2' G 12 7.033 -3.002 31.528 138 1H2* G 12 2H2' G 12 5.966 -4.229 30.771 139 1H5* T 13 1H5' T 13 8.508 -0.270 29.716 140 2H5* T 13 2H5' T 13 10.138 -0.036 30.375 141 H4* T 13 H4' T 13 8.825 2.038 30.538 142 H3* T 13 H3' T 13 10.295 0.880 32.687 143 1H2* T 13 2H2' T 13 8.331 0.171 33.835 144 2H2* T 13 1H2' T 13 8.551 1.802 34.551 145 H1* T 13 H1' T 13 6.964 2.742 32.943 146 H3 T 13 H3 T 13 3.512 1.521 35.629 147 1H5M T 13 1H5M T 13 4.197 -2.503 32.291 148 2H5M T 13 2H5M T 13 5.251 -3.049 33.611 149 3H5M T 13 3H5M T 13 3.512 -2.857 33.884 150 H6 T 13 H6 T 13 6.343 -0.834 32.535 151 1H5* A 14 1H5' A 14 8.176 4.994 32.997 152 2H5* A 14 2H5' A 14 9.367 6.103 33.708 153 H4* A 14 H4' A 14 7.052 6.791 34.262 154 H3* A 14 H3' A 14 9.165 6.427 36.211 155 H1* A 14 H1' A 14 5.409 5.985 36.536 156 H8 A 14 H8 A 14 7.120 2.457 36.636 157 1H6 A 14 1H6 A 14 3.325 0.206 39.010 158 2H6 A 14 2H6 A 14 1.785 0.947 39.512 159 H2 A 14 H2 A 14 1.538 5.049 38.538 160 2H2* A 14 1H2' A 14 7.254 6.035 38.128 161 1H2* A 14 2H2' A 14 8.035 4.651 37.299 162 1H5* G 15 1H5' G 15 5.120 8.497 37.395 163 2H5* G 15 2H5' G 15 5.653 9.996 38.183 164 H4* G 15 H4' G 15 3.543 9.227 39.191 165 H3* G 15 H3' G 15 5.947 9.759 40.729 166 H1* G 15 H1' G 15 3.053 7.433 41.333 167 H8 G 15 H8 G 15 6.224 5.270 40.555 168 H1 G 15 H1 G 15 1.322 2.172 43.339 169 1H2 G 15 1H2 G 15 -0.346 3.626 43.693 170 2H2 G 15 2H2 G 15 -0.122 5.311 43.198 171 2H2* G 15 1H2' G 15 4.987 8.128 42.689 172 1H2* G 15 2H2' G 15 6.097 7.488 41.436 173 1H5* T 16 1H5' T 16 1.584 9.350 42.563 174 2H5* T 16 2H5' T 16 1.511 10.655 43.763 175 H4* T 16 H4' T 16 0.047 8.781 44.420 176 H3* T 16 H3' T 16 2.144 9.860 46.147 177 1H2* T 16 2H2' T 16 3.198 7.763 46.364 178 2H2* T 16 1H2' T 16 1.909 7.510 47.582 179 H1* T 16 H1' T 16 0.498 6.431 45.899 180 H3 T 16 H3 T 16 2.619 2.509 46.790 181 1H5M T 16 1H5M T 16 5.138 4.759 42.657 182 2H5M T 16 2H5M T 16 6.216 5.098 44.026 183 3H5M T 16 3H5M T 16 5.903 3.426 43.533 184 H6 T 16 H6 T 16 3.668 6.350 44.092 185 1H5* G 17 1H5' G 17 -0.984 6.952 47.896 186 2H5* G 17 2H5' G 17 -1.555 7.696 49.403 187 H4* G 17 H4' G 17 -1.380 5.278 49.719 188 H3* G 17 H3' G 17 0.045 7.182 51.399 189 H1* G 17 H1' G 17 0.751 3.604 50.450 190 H8 G 17 H8 G 17 3.670 5.889 49.232 191 H1 G 17 H1 G 17 4.623 -0.442 48.601 192 1H2 G 17 1H2 G 17 1.391 -0.586 49.826 193 2H2 G 17 2H2 G 17 2.784 -1.521 49.264 194 H3T G 17 H3T G 17 -1.630 5.728 52.036 195 2H2* G 17 1H2' G 17 1.756 5.146 52.081 196 1H2* G 17 2H2' G 17 2.161 6.292 50.764 197 1H5* C 1 1H5' C 1 6.551 -6.755 45.981 198 2H5* C 1 2H5' C 1 7.590 -6.977 47.401 199 H4* C 1 H4' C 1 5.661 -7.849 48.694 200 H3* C 1 H3' C 1 4.347 -8.318 46.253 201 H1* C 1 H1' C 1 3.356 -5.563 48.724 202 1H4 C 1 1H4 C 1 4.716 0.250 45.837 203 2H4 C 1 2H4 C 1 3.264 0.277 46.875 204 H5 C 1 H5 C 1 5.901 -1.956 45.578 205 H6 C 1 H6 C 1 5.813 -4.304 46.264 206 H5T C 1 H5T C 1 6.177 -9.012 46.024 207 2H2* C 1 1H2' C 1 2.497 -6.377 46.594 208 1H2* C 1 2H2' C 1 4.042 -5.973 45.791 209 1H5* A 2 1H5' A 2 1.470 -6.656 49.342 210 2H5* A 2 2H5' A 2 -0.052 -7.574 49.273 211 H4* A 2 H4' A 2 -0.615 -5.215 49.414 212 H3* A 2 H3' A 2 -1.416 -6.803 47.112 213 H1* A 2 H1' A 2 -0.610 -3.085 47.424 214 H8 A 2 H8 A 2 1.791 -4.931 44.949 215 1H6 A 2 1H6 A 2 4.174 -0.799 43.438 216 2H6 A 2 2H6 A 2 3.947 0.859 44.050 217 H2 A 2 H2 A 2 1.006 1.095 47.080 218 2H2* A 2 1H2' A 2 -1.660 -4.445 45.709 219 1H2* A 2 2H2' A 2 -0.202 -5.475 45.589 220 1H5* C 3 1H5' C 3 -3.102 -2.662 48.250 221 2H5* C 3 2H5' C 3 -4.833 -2.584 47.862 222 H4* C 3 H4' C 3 -3.730 -0.384 47.533 223 H3* C 3 H3' C 3 -5.268 -1.756 45.444 224 H1* C 3 H1' C 3 -2.410 0.769 45.357 225 1H4 C 3 1H4 C 3 2.493 -1.914 41.796 226 2H4 C 3 2H4 C 3 2.533 -0.132 41.886 227 H5 C 3 H5 C 3 0.575 -3.075 42.918 228 H6 C 3 H6 C 3 -1.437 -2.664 44.267 229 2H2* C 3 1H2' C 3 -4.027 0.011 43.704 230 1H2* C 3 2H2' C 3 -3.490 -1.684 43.919 231 1H5* T 4 1H5' T 4 -4.352 2.795 45.495 232 2H5* T 4 2H5' T 4 -5.842 3.629 45.006 233 H4* T 4 H4' T 4 -3.822 4.863 44.254 234 H3* T 4 H3' T 4 -6.004 4.064 42.481 235 1H2* T 4 2H2' T 4 -4.587 2.804 41.093 236 2H2* T 4 1H2' T 4 -4.230 4.423 40.405 237 H1* T 4 H1' T 4 -2.283 4.641 41.857 238 H3 T 4 H3 T 4 0.020 2.311 38.682 239 1H5M T 4 1H5M T 4 -2.674 -1.424 41.210 240 2H5M T 4 2H5M T 4 -0.990 -1.774 40.795 241 3H5M T 4 3H5M T 4 -1.394 -1.187 42.416 242 H6 T 4 H6 T 4 -2.802 1.069 42.379 243 1H5* A 5 1H5' A 5 -2.640 6.790 41.308 244 2H5* A 5 2H5' A 5 -3.299 8.246 40.532 245 H4* A 5 H4' A 5 -1.123 7.645 39.551 246 H3* A 5 H3' A 5 -3.615 7.788 37.934 247 H1* A 5 H1' A 5 -0.217 6.021 37.568 248 H8 A 5 H8 A 5 -3.253 3.581 37.858 249 1H6 A 5 1H6 A 5 -0.984 -0.265 35.596 250 2H6 A 5 2H6 A 5 0.659 -0.291 34.908 251 H2 A 5 H2 A 5 2.681 3.389 35.346 252 2H2* A 5 1H2' A 5 -1.868 6.794 35.980 253 1H2* A 5 2H2' A 5 -3.144 5.849 36.803 254 1H5* C 6 1H5' C 6 0.694 9.059 36.544 255 2H5* C 6 2H5' C 6 0.524 10.366 35.352 256 H4* C 6 H4' C 6 2.453 8.893 34.809 257 H3* C 6 H3' C 6 0.176 9.320 32.935 258 H1* C 6 H1' C 6 2.811 6.534 33.444 259 1H4 C 6 1H4 C 6 -1.053 1.154 33.910 260 2H4 C 6 2H4 C 6 0.621 0.783 33.422 261 H5 C 6 H5 C 6 -1.674 3.549 34.218 262 H6 C 6 H6 C 6 -0.768 5.828 34.149 263 2H2* C 6 1H2' C 6 1.617 7.347 31.539 264 1H2* C 6 2H2' C 6 0.049 7.101 32.361 265 1H5* A 7 1H5' A 7 3.932 7.659 31.958 266 2H5* A 7 2H5' A 7 4.807 8.669 30.791 267 H4* A 7 H4' A 7 5.411 6.270 30.559 268 H3* A 7 H3' A 7 4.578 7.978 28.378 269 H1* A 7 H1' A 7 4.148 4.229 28.894 270 H8 A 7 H8 A 7 0.697 6.025 29.277 271 1H6 A 7 1H6 A 7 -2.051 1.938 28.361 272 2H6 A 7 2H6 A 7 -1.452 0.306 27.975 273 H2 A 7 H2 A 7 2.764 0.092 27.856 274 2H2* A 7 1H2' A 7 3.823 5.728 26.994 275 1H2* A 7 2H2' A 7 2.641 6.695 27.930 276 1H5* A 8 1H5' A 8 7.156 4.087 27.921 277 2H5* A 8 2H5' A 8 8.420 4.553 26.765 278 H4* A 8 H4' A 8 7.993 2.080 26.808 279 H3* A 8 H3' A 8 8.200 3.699 24.435 280 H1* A 8 H1' A 8 6.018 0.617 25.073 281 H8 A 8 H8 A 8 3.853 3.879 25.056 282 1H6 A 8 1H6 A 8 -0.669 -0.111 23.452 283 2H6 A 8 2H6 A 8 -0.407 1.623 23.763 284 H2 A 8 H2 A 8 2.878 -2.383 23.915 285 2H2* A 8 1H2' A 8 6.621 1.892 23.100 286 1H2* A 8 2H2' A 8 5.929 3.377 23.820 287 1H5* A 9 1H5' A 9 8.020 -0.981 24.095 288 2H5* A 9 2H5' A 9 9.386 -1.381 23.033 289 H4* A 9 H4' A 9 7.528 -2.985 22.719 290 H3* A 9 H3' A 9 8.762 -1.477 20.549 291 H1* A 9 H1' A 9 5.237 -2.878 20.973 292 H8 A 9 H8 A 9 5.324 1.012 20.654 293 1H6 A 9 1H6 A 9 -0.877 0.359 20.462 294 2H6 A 9 2H6 A 9 0.379 1.616 20.337 295 H2 A 9 H2 A 9 0.744 -3.510 20.993 296 2H2* A 9 1H2' A 9 6.490 -2.002 19.083 297 1H2* A 9 2H2' A 9 6.737 -0.447 19.936 298 1H5* G 10 1H5' G 10 6.394 -5.470 20.155 299 2H5* G 10 2H5' G 10 7.206 -6.437 18.908 300 H4* G 10 H4' G 10 4.777 -6.952 19.046 301 H3* G 10 H3' G 10 6.179 -6.366 16.599 302 H1* G 10 H1' G 10 2.596 -5.618 17.548 303 H8 G 10 H8 G 10 4.602 -2.307 17.026 304 H1 G 10 H1 G 10 -1.737 -1.597 17.842 305 1H2 G 10 1H2 G 10 -1.597 -5.025 18.312 306 2H2 G 10 2H2 G 10 -2.643 -3.599 18.260 307 2H2* G 10 1H2' G 10 3.886 -5.400 15.488 308 1H2* G 10 2H2' G 10 5.037 -4.292 16.300 309 1H5* A 11 1H5' A 11 1.858 -7.694 17.098 310 2H5* A 11 2H5' A 11 1.472 -8.932 15.886 311 H4* A 11 H4' A 11 -0.536 -7.624 16.570 312 H3* A 11 H3' A 11 0.266 -8.103 13.822 313 H1* A 11 H1' A 11 -1.608 -5.175 15.413 314 H8 A 11 H8 A 11 2.045 -4.120 14.590 315 1H6 A 11 1H6 A 11 -0.484 1.588 14.411 316 2H6 A 11 2H6 A 11 1.094 0.774 14.270 317 H2 A 11 H2 A 11 -3.646 -1.142 15.102 318 2H2* A 11 1H2' A 11 -1.206 -5.896 13.115 319 1H2* A 11 2H2' A 11 0.564 -5.802 13.373 320 1H5* G 12 1H5' G 12 -3.907 -6.495 15.112 321 2H5* G 12 2H5' G 12 -5.078 -7.487 14.220 322 H4* G 12 H4' G 12 -5.982 -5.221 14.670 323 H3* G 12 H3' G 12 -5.824 -6.418 11.999 324 H1* G 12 H1' G 12 -5.841 -2.820 13.238 325 H8 G 12 H8 G 12 -2.288 -3.717 11.888 326 H1 G 12 H1 G 12 -3.896 2.498 11.511 327 1H2 G 12 1H2 G 12 -6.861 1.343 12.870 328 2H2 G 12 2H2 G 12 -5.969 2.761 12.300 329 2H2* G 12 1H2' G 12 -6.190 -3.853 11.056 330 1H2* G 12 2H2' G 12 -4.578 -4.628 11.141 331 1H5* T 13 1H5' T 13 -8.530 -2.616 12.436 332 2H5* T 13 2H5' T 13 -9.951 -2.917 11.409 333 H4* T 13 H4' T 13 -9.163 -0.636 10.989 334 H3* T 13 H3' T 13 -8.692 -2.701 8.817 335 1H2* T 13 2H2' T 13 -7.197 -1.369 7.763 336 2H2* T 13 1H2' T 13 -8.273 0.051 7.874 337 H1* T 13 H1' T 13 -7.291 0.764 9.861 338 H3 T 13 H3 T 13 -3.173 1.861 8.471 339 1H5M T 13 1H5M T 13 -3.220 -3.387 8.007 340 2H5M T 13 2H5M T 13 -1.718 -2.610 8.532 341 3H5M T 13 3H5M T 13 -2.838 -3.261 9.738 342 H6 T 13 H6 T 13 -5.338 -2.346 9.371 343 1H5* A 14 1H5' A 14 -10.507 1.498 7.949 344 2H5* A 14 2H5' A 14 -11.595 1.301 6.559 345 H4* A 14 H4' A 14 -10.286 3.327 6.215 346 H3* A 14 H3' A 14 -10.326 1.208 4.293 347 H1* A 14 H1' A 14 -7.576 3.579 5.118 348 H8 A 14 H8 A 14 -6.249 0.017 5.897 349 1H6 A 14 1H6 A 14 -1.000 3.179 7.092 350 2H6 A 14 2H6 A 14 -1.602 1.509 6.950 351 H2 A 14 H2 A 14 -4.021 6.049 6.320 352 2H2* A 14 1H2' A 14 -7.780 1.725 3.502 353 1H2* A 14 2H2' A 14 -8.046 0.567 4.847 354 1H5* G 15 1H5' G 15 -10.114 5.846 5.112 355 2H5* G 15 2H5' G 15 -11.330 6.935 4.415 356 H4* G 15 H4' G 15 -9.191 8.084 4.304 357 H3* G 15 H3' G 15 -10.667 7.554 1.925 358 H1* G 15 H1' G 15 -6.888 7.507 2.322 359 H8 G 15 H8 G 15 -8.286 4.013 1.393 360 H1 G 15 H1 G 15 -1.915 4.202 2.236 361 1H2 G 15 1H2 G 15 -2.584 7.474 3.136 362 2H2 G 15 2H2 G 15 -1.331 6.244 2.917 363 2H2* G 15 1H2' G 15 -8.415 7.239 0.435 364 1H2* G 15 2H2' G 15 -9.170 5.814 1.220 365 1H5* T 16 1H5' T 16 -6.517 9.591 1.477 366 2H5* T 16 2H5' T 16 -6.770 10.962 0.377 367 H4* T 16 H4' T 16 -4.579 9.991 -0.067 368 H3* T 16 H3' T 16 -6.721 9.917 -2.145 369 1H2* T 16 2H2' T 16 -6.148 7.776 -2.788 370 2H2* T 16 1H2' T 16 -4.658 8.505 -3.454 371 H1* T 16 H1' T 16 -3.467 8.062 -1.395 372 H3 T 16 H3 T 16 -2.347 3.776 -1.850 373 1H5M T 16 1H5M T 16 -6.816 2.320 -1.905 374 2H5M T 16 2H5M T 16 -7.609 3.661 -1.071 375 3H5M T 16 3H5M T 16 -7.486 3.663 -2.843 376 H6 T 16 H6 T 16 -6.594 6.035 -1.632 377 1H5* G 17 1H5' G 17 -2.285 9.912 -3.303 378 2H5* G 17 2H5' G 17 -2.103 10.987 -4.705 379 H4* G 17 H4' G 17 -0.739 8.996 -5.062 380 H3* G 17 H3' G 17 -2.841 9.779 -6.917 381 H1* G 17 H1' G 17 -1.306 6.448 -6.078 382 H8 G 17 H8 G 17 -5.148 6.283 -5.557 383 H1 G 17 H1 G 17 -1.940 0.871 -4.213 384 1H2 G 17 1H2 G 17 0.254 1.261 -4.410 385 2H2 G 17 2H2 G 17 0.795 2.885 -4.859 386 H3T G 17 H3T G 17 -1.357 8.812 -8.384 387 2H2* G 17 1H2' G 17 -2.876 7.188 -7.821 388 1H2* G 17 2H2' G 17 -4.028 7.742 -6.564 Start of MODEL 13 1 1H5* C 1 1H5' C 1 2.292 -7.018 -2.861 2 2H5* C 1 2H5' C 1 3.759 -7.627 -2.077 3 H4* C 1 H4' C 1 4.288 -5.551 -3.202 4 H3* C 1 H3' C 1 4.815 -5.903 -0.420 5 H1* C 1 H1' C 1 3.877 -2.728 -2.231 6 1H4 C 1 1H4 C 1 -1.848 -0.370 0.120 7 2H4 C 1 2H4 C 1 -0.815 0.844 -0.683 8 H5 C 1 H5 C 1 -0.968 -2.719 0.246 9 H6 C 1 H6 C 1 0.957 -4.119 -0.365 10 H5T C 1 H5T C 1 1.937 -7.756 -0.724 11 2H2* C 1 1H2' C 1 4.484 -3.254 0.083 12 1H2* C 1 2H2' C 1 3.083 -4.367 0.214 13 1H5* A 2 1H5' A 2 6.231 -1.905 -2.577 14 2H5* A 2 2H5' A 2 7.816 -1.535 -1.870 15 H4* A 2 H4' A 2 6.613 0.556 -2.229 16 H3* A 2 H3' A 2 7.595 -0.251 0.369 17 H1* A 2 H1' A 2 4.619 1.893 -0.567 18 H8 A 2 H8 A 2 3.385 -1.451 1.053 19 1H6 A 2 1H6 A 2 -2.002 1.691 1.345 20 2H6 A 2 2H6 A 2 -1.303 0.113 1.779 21 H2 A 2 H2 A 2 0.818 4.250 -0.513 22 2H2* A 2 1H2' A 2 5.716 1.358 1.545 23 1H2* A 2 2H2' A 2 5.406 -0.387 1.291 24 1H5* C 3 1H5' C 3 6.244 4.305 -0.381 25 2H5* C 3 2H5' C 3 7.429 5.249 0.547 26 H4* C 3 H4' C 3 5.218 6.325 0.698 27 H3* C 3 H3' C 3 6.584 5.215 3.117 28 H1* C 3 H1' C 3 2.942 6.077 2.119 29 1H4 C 3 1H4 C 3 -0.154 0.419 3.666 30 2H4 C 3 2H4 C 3 -1.245 1.805 3.392 31 H5 C 3 H5 C 3 2.309 0.857 3.531 32 H6 C 3 H6 C 3 3.953 2.619 3.059 33 2H2* C 3 1H2' C 3 4.142 6.176 4.194 34 1H2* C 3 2H2' C 3 4.640 4.467 4.034 35 1H5* T 4 1H5' T 4 3.952 9.016 2.948 36 2H5* T 4 2H5' T 4 4.649 10.213 4.060 37 H4* T 4 H4' T 4 2.192 10.365 4.070 38 H3* T 4 H3' T 4 3.785 9.931 6.477 39 1H2* T 4 2H2' T 4 2.719 7.914 7.005 40 2H2* T 4 1H2' T 4 1.472 9.024 7.663 41 H1* T 4 H1' T 4 0.205 8.882 5.593 42 H3 T 4 H3 T 4 -1.799 5.010 6.786 43 1H5M T 4 1H5M T 4 2.023 2.473 5.709 44 2H5M T 4 2H5M T 4 2.565 3.479 4.355 45 3H5M T 4 3H5M T 4 3.296 3.673 5.963 46 H6 T 4 H6 T 4 2.625 6.120 5.248 47 1H5* A 5 1H5' A 5 -0.676 10.865 6.760 48 2H5* A 5 2H5' A 5 -0.773 12.266 7.843 49 H4* A 5 H4' A 5 -2.749 10.921 8.183 50 H3* A 5 H3' A 5 -0.875 11.464 10.346 51 H1* A 5 H1' A 5 -3.235 8.519 9.774 52 H8 A 5 H8 A 5 0.502 7.424 9.445 53 1H6 A 5 1H6 A 5 -0.429 2.527 10.026 54 2H6 A 5 2H6 A 5 -2.014 1.768 10.316 55 H2 A 5 H2 A 5 -5.174 4.564 10.485 56 2H2* A 5 1H2' A 5 -1.942 9.301 11.677 57 1H2* A 5 2H2' A 5 -0.428 9.190 10.732 58 1H5* C 6 1H5' C 6 -5.369 10.205 10.916 59 2H5* C 6 2H5' C 6 -5.968 11.157 12.292 60 H4* C 6 H4' C 6 -7.136 8.976 12.154 61 H3* C 6 H3' C 6 -5.684 9.897 14.535 62 H1* C 6 H1' C 6 -6.517 6.411 13.169 63 1H4 C 6 1H4 C 6 -1.795 2.406 13.704 64 2H4 C 6 2H4 C 6 -0.606 3.423 12.852 65 H5 C 6 H5 C 6 -1.242 5.736 12.224 66 H6 C 6 H6 C 6 -3.106 7.315 12.232 67 2H2* C 6 1H2' C 6 -5.845 7.260 15.352 68 1H2* C 6 2H2' C 6 -4.366 7.975 14.643 69 1H5* T 7 1H5' T 7 -8.609 6.360 14.724 70 2H5* T 7 2H5' T 7 -9.631 6.576 16.162 71 H4* T 7 H4' T 7 -9.083 4.193 15.848 72 H3* T 7 H3' T 7 -8.393 5.682 18.305 73 1H2* T 7 2H2' T 7 -6.191 4.956 18.285 74 2H2* T 7 1H2' T 7 -6.885 3.414 18.864 75 H1* T 7 H1' T 7 -6.958 2.557 16.594 76 H3 T 7 H3 T 7 -2.696 1.351 15.896 77 1H5M T 7 1H5M T 7 -2.616 6.614 15.565 78 2H5M T 7 2H5M T 7 -2.291 6.436 17.302 79 3H5M T 7 3H5M T 7 -1.147 5.795 16.113 80 H6 T 7 H6 T 7 -4.812 5.591 16.746 81 1H5* C 8 1H5' C 8 -9.806 1.079 18.243 82 2H5* C 8 2H5' C 8 -10.475 0.756 19.857 83 H4* C 8 H4' C 8 -9.321 -1.261 18.970 84 H3* C 8 H3' C 8 -7.966 0.160 21.308 85 H1* C 8 H1' C 8 -6.372 -2.021 18.520 86 1H4 C 8 1H4 C 8 -1.046 0.868 19.537 87 2H4 C 8 2H4 C 8 -1.756 2.472 19.806 88 H5 C 8 H5 C 8 -4.218 2.719 19.809 89 H6 C 8 H6 C 8 -6.308 1.461 19.594 90 2H2* C 8 1H2' C 8 -7.454 -2.695 20.431 91 1H2* C 8 2H2' C 8 -6.359 -1.592 21.314 92 1H5* T 9 1H5' T 9 -8.615 -3.856 20.823 93 2H5* T 9 2H5' T 9 -9.287 -4.759 22.196 94 H4* T 9 H4' T 9 -7.517 -6.039 20.952 95 H3* T 9 H3' T 9 -7.754 -5.894 23.754 96 1H2* T 9 2H2' T 9 -6.033 -4.227 23.969 97 2H2* T 9 1H2' T 9 -5.087 -5.733 24.194 98 H1* T 9 H1' T 9 -4.461 -5.742 21.847 99 H3 T 9 H3 T 9 -1.074 -2.799 21.782 100 1H5M T 9 1H5M T 9 -3.726 0.688 23.483 101 2H5M T 9 2H5M T 9 -5.296 0.192 22.835 102 3H5M T 9 3H5M T 9 -4.827 -0.268 24.487 103 H6 T 9 H6 T 9 -5.692 -2.454 23.092 104 1H5* T 10 1H5' T 10 -4.036 -7.853 21.896 105 2H5* T 10 2H5' T 10 -3.700 -9.369 22.759 106 H4* T 10 H4' T 10 -1.585 -8.290 22.126 107 H3* T 10 H3' T 10 -2.248 -9.000 24.862 108 1H2* T 10 2H2' T 10 -2.167 -6.748 25.592 109 2H2* T 10 1H2' T 10 -0.423 -7.134 25.711 110 H1* T 10 H1' T 10 -0.045 -6.255 23.460 111 H3 T 10 H3 T 10 0.508 -2.027 24.902 112 1H5M T 10 1H5M T 10 -4.532 -3.067 26.109 113 2H5M T 10 2H5M T 10 -4.103 -1.425 25.607 114 3H5M T 10 3H5M T 10 -4.711 -2.578 24.410 115 H6 T 10 H6 T 10 -3.328 -4.909 24.516 116 1H5* T 11 1H5' T 11 2.059 -7.617 23.699 117 2H5* T 11 2H5' T 11 3.118 -8.852 24.408 118 H4* T 11 H4' T 11 4.259 -6.691 24.477 119 H3* T 11 H3' T 11 3.799 -8.299 26.838 120 1H2* T 11 2H2' T 11 2.363 -6.668 27.806 121 2H2* T 11 1H2' T 11 3.947 -6.056 28.380 122 H1* T 11 H1' T 11 4.086 -4.547 26.456 123 H3 T 11 H3 T 11 1.749 -1.283 28.519 124 1H5M T 11 1H5M T 11 -1.826 -5.121 27.843 125 2H5M T 11 2H5M T 11 -2.358 -3.438 27.712 126 3H5M T 11 3H5M T 11 -1.910 -4.333 26.253 127 H6 T 11 H6 T 11 0.527 -5.508 26.558 128 1H5* G 12 1H5' G 12 6.772 -4.665 26.426 129 2H5* G 12 2H5' G 12 8.230 -5.348 27.168 130 H4* G 12 H4' G 12 8.330 -2.905 27.294 131 H3* G 12 H3' G 12 8.652 -4.593 29.578 132 H1* G 12 H1' G 12 7.104 -1.167 29.427 133 H8 G 12 H8 G 12 4.211 -3.768 29.843 134 H1 G 12 H1 G 12 2.656 2.345 31.085 135 1H2 G 12 1H2 G 12 5.997 2.867 30.365 136 2H2 G 12 2H2 G 12 4.469 3.621 30.842 137 2H2* G 12 1H2' G 12 7.569 -2.758 31.239 138 1H2* G 12 2H2' G 12 6.503 -3.974 30.465 139 1H5* T 13 1H5' T 13 9.094 0.024 29.473 140 2H5* T 13 2H5' T 13 10.703 0.260 30.181 141 H4* T 13 H4' T 13 9.354 2.311 30.367 142 H3* T 13 H3' T 13 10.780 1.103 32.527 143 1H2* T 13 2H2' T 13 8.793 0.373 33.617 144 2H2* T 13 1H2' T 13 8.981 1.997 34.357 145 H1* T 13 H1' T 13 7.436 2.946 32.717 146 H3 T 13 H3 T 13 3.843 1.729 35.191 147 1H5M T 13 1H5M T 13 4.800 -2.379 32.026 148 2H5M T 13 2H5M T 13 5.779 -2.863 33.426 149 3H5M T 13 3H5M T 13 4.024 -2.695 33.585 150 H6 T 13 H6 T 13 6.893 -0.662 32.342 151 1H5* A 14 1H5' A 14 8.756 5.296 32.744 152 2H5* A 14 2H5' A 14 9.923 6.352 33.564 153 H4* A 14 H4' A 14 7.612 7.141 33.936 154 H3* A 14 H3' A 14 9.517 6.656 36.050 155 H1* A 14 H1' A 14 5.735 6.321 36.070 156 H8 A 14 H8 A 14 7.364 2.760 36.224 157 1H6 A 14 1H6 A 14 1.660 1.184 38.212 158 2H6 A 14 2H6 A 14 3.251 0.458 37.875 159 H2 A 14 H2 A 14 1.598 5.354 37.468 160 2H2* A 14 1H2' A 14 7.457 6.236 37.793 161 1H2* A 14 2H2' A 14 8.253 4.861 36.962 162 1H5* G 15 1H5' G 15 5.424 8.727 36.987 163 2H5* G 15 2H5' G 15 5.888 10.185 37.888 164 H4* G 15 H4' G 15 3.699 9.354 38.673 165 H3* G 15 H3' G 15 5.950 9.858 40.429 166 H1* G 15 H1' G 15 3.068 7.458 40.697 167 H8 G 15 H8 G 15 6.357 5.393 40.194 168 H1 G 15 H1 G 15 1.193 2.070 42.115 169 1H2 G 15 1H2 G 15 -0.541 3.472 42.300 170 2H2 G 15 2H2 G 15 -0.295 5.184 41.918 171 2H2* G 15 1H2' G 15 4.870 8.122 42.233 172 1H2* G 15 2H2' G 15 6.095 7.560 41.051 173 1H5* T 16 1H5' T 16 1.428 9.279 42.080 174 2H5* T 16 2H5' T 16 1.364 10.520 43.348 175 H4* T 16 H4' T 16 -0.046 8.649 44.024 176 H3* T 16 H3' T 16 2.274 9.506 45.611 177 1H2* T 16 2H2' T 16 3.178 7.343 45.649 178 2H2* T 16 1H2' T 16 1.951 7.087 46.928 179 H1* T 16 H1' T 16 0.374 6.216 45.272 180 H3 T 16 H3 T 16 2.129 2.058 45.592 181 1H5M T 16 1H5M T 16 5.083 4.585 41.972 182 2H5M T 16 2H5M T 16 6.055 4.809 43.441 183 3H5M T 16 3H5M T 16 5.764 3.182 42.808 184 H6 T 16 H6 T 16 3.616 6.141 43.523 185 1H5* G 17 1H5' G 17 -0.894 6.795 47.783 186 2H5* G 17 2H5' G 17 -0.952 7.399 49.452 187 H4* G 17 H4' G 17 -0.836 4.984 49.558 188 H3* G 17 H3' G 17 1.285 6.637 50.705 189 H1* G 17 H1' G 17 1.188 3.114 49.391 190 H8 G 17 H8 G 17 4.060 5.051 47.670 191 H1 G 17 H1 G 17 3.073 -0.917 45.478 192 1H2 G 17 1H2 G 17 0.352 -0.747 47.612 193 2H2 G 17 2H2 G 17 1.239 -1.749 46.454 194 H3T G 17 H3T G 17 1.268 4.901 52.207 195 2H2* G 17 1H2' G 17 2.874 4.392 50.641 196 1H2* G 17 2H2' G 17 2.936 5.615 49.331 197 1H5* C 1 1H5' C 1 6.133 -8.401 44.389 198 2H5* C 1 2H5' C 1 4.936 -8.967 43.209 199 H4* C 1 H4' C 1 3.886 -8.601 45.394 200 H3* C 1 H3' C 1 3.044 -6.819 43.097 201 H1* C 1 H1' C 1 3.332 -5.242 46.593 202 1H4 C 1 1H4 C 1 4.784 -0.568 42.969 203 2H4 C 1 2H4 C 1 5.880 -1.461 41.883 204 H5 C 1 H5 C 1 6.076 -3.933 42.186 205 H6 C 1 H6 C 1 5.272 -5.802 43.558 206 H5T C 1 H5T C 1 6.295 -7.350 42.364 207 2H2* C 1 1H2' C 1 1.736 -6.809 45.836 208 1H2* C 1 2H2' C 1 1.602 -5.565 44.552 209 1H5* A 2 1H5' A 2 -0.256 -8.089 45.762 210 2H5* A 2 2H5' A 2 -1.676 -8.515 44.792 211 H4* A 2 H4' A 2 -2.192 -6.860 46.634 212 H3* A 2 H3' A 2 -3.193 -6.797 44.023 213 H1* A 2 H1' A 2 -1.900 -3.684 45.846 214 H8 A 2 H8 A 2 0.804 -5.083 43.390 215 1H6 A 2 1H6 A 2 2.721 0.853 43.395 216 2H6 A 2 2H6 A 2 3.101 -0.721 42.656 217 H2 A 2 H2 A 2 -0.560 0.618 46.071 218 2H2* A 2 1H2' A 2 -2.925 -4.122 43.702 219 1H2* A 2 2H2' A 2 -1.576 -5.209 43.239 220 1H5* C 3 1H5' C 3 -4.173 -2.931 46.487 221 2H5* C 3 2H5' C 3 -5.879 -2.564 46.158 222 H4* C 3 H4' C 3 -4.587 -0.480 46.218 223 H3* C 3 H3' C 3 -6.127 -1.310 43.862 224 H1* C 3 H1' C 3 -3.095 0.922 44.341 225 1H4 C 3 1H4 C 3 1.855 -1.323 40.576 226 2H4 C 3 2H4 C 3 1.782 0.456 40.698 227 H5 C 3 H5 C 3 0.034 -2.625 41.704 228 H6 C 3 H6 C 3 -2.012 -2.365 43.045 229 2H2* C 3 1H2' C 3 -4.653 0.579 42.489 230 1H2* C 3 2H2' C 3 -4.255 -1.167 42.455 231 1H5* T 4 1H5' T 4 -4.653 3.005 44.588 232 2H5* T 4 2H5' T 4 -5.952 4.123 44.122 233 H4* T 4 H4' T 4 -3.736 5.075 43.577 234 H3* T 4 H3' T 4 -5.861 4.717 41.583 235 1H2* T 4 2H2' T 4 -4.484 3.467 40.161 236 2H2* T 4 1H2' T 4 -3.850 5.086 39.718 237 H1* T 4 H1' T 4 -2.052 4.861 41.348 238 H3 T 4 H3 T 4 0.348 2.585 38.232 239 1H5M T 4 1H5M T 4 -1.604 -1.503 39.511 240 2H5M T 4 2H5M T 4 -2.068 -1.084 41.168 241 3H5M T 4 3H5M T 4 -3.243 -0.923 39.847 242 H6 T 4 H6 T 4 -3.161 1.372 41.297 243 1H5* A 5 1H5' A 5 -2.158 7.265 40.807 244 2H5* A 5 2H5' A 5 -2.696 8.801 40.098 245 H4* A 5 H4' A 5 -0.570 8.126 39.094 246 H3* A 5 H3' A 5 -3.043 8.403 37.454 247 H1* A 5 H1' A 5 0.299 6.534 37.096 248 H8 A 5 H8 A 5 -2.862 4.233 37.129 249 1H6 A 5 1H6 A 5 -0.589 0.300 35.016 250 2H6 A 5 2H6 A 5 1.105 0.204 34.474 251 H2 A 5 H2 A 5 3.251 3.775 35.129 252 2H2* A 5 1H2' A 5 -1.291 7.413 35.499 253 1H2* A 5 2H2' A 5 -2.617 6.490 36.268 254 1H5* C 6 1H5' C 6 1.316 9.459 36.089 255 2H5* C 6 2H5' C 6 1.227 10.780 34.904 256 H4* C 6 H4' C 6 3.039 9.181 34.329 257 H3* C 6 H3' C 6 0.742 9.707 32.485 258 H1* C 6 H1' C 6 3.287 6.834 33.010 259 1H4 C 6 1H4 C 6 -0.803 1.623 33.394 260 2H4 C 6 2H4 C 6 0.880 1.182 33.007 261 H5 C 6 H5 C 6 -1.348 4.048 33.623 262 H6 C 6 H6 C 6 -0.350 6.289 33.557 263 2H2* C 6 1H2' C 6 2.196 7.721 31.084 264 1H2* C 6 2H2' C 6 0.590 7.517 31.840 265 1H5* A 7 1H5' A 7 4.473 8.000 31.440 266 2H5* A 7 2H5' A 7 5.326 8.967 30.221 267 H4* A 7 H4' A 7 5.848 6.562 29.970 268 H3* A 7 H3' A 7 4.796 8.242 27.818 269 H1* A 7 H1' A 7 4.574 4.480 28.515 270 H8 A 7 H8 A 7 1.106 6.221 28.944 271 1H6 A 7 1H6 A 7 -1.000 0.426 27.952 272 2H6 A 7 2H6 A 7 -1.596 2.065 28.312 273 H2 A 7 H2 A 7 3.220 0.279 27.629 274 2H2* A 7 1H2' A 7 4.213 5.853 26.541 275 1H2* A 7 2H2' A 7 2.983 6.820 27.406 276 1H5* A 8 1H5' A 8 7.410 4.402 27.197 277 2H5* A 8 2H5' A 8 8.592 4.876 25.959 278 H4* A 8 H4' A 8 8.133 2.427 25.917 279 H3* A 8 H3' A 8 7.972 4.183 23.594 280 H1* A 8 H1' A 8 6.107 0.944 24.470 281 H8 A 8 H8 A 8 3.745 4.052 24.698 282 1H6 A 8 1H6 A 8 -0.635 -0.201 23.404 283 2H6 A 8 2H6 A 8 -0.461 1.538 23.744 284 H2 A 8 H2 A 8 3.085 -2.232 23.458 285 2H2* A 8 1H2' A 8 6.456 2.186 22.420 286 1H2* A 8 2H2' A 8 5.725 3.644 23.153 287 1H5* A 9 1H5' A 9 8.149 -0.463 23.121 288 2H5* A 9 2H5' A 9 9.425 -0.731 21.915 289 H4* A 9 H4' A 9 7.668 -2.455 21.710 290 H3* A 9 H3' A 9 8.486 -0.707 19.495 291 H1* A 9 H1' A 9 5.214 -2.540 20.295 292 H8 A 9 H8 A 9 4.890 1.348 20.078 293 1H6 A 9 1H6 A 9 -1.205 0.084 20.512 294 2H6 A 9 2H6 A 9 -0.097 1.462 20.301 295 H2 A 9 H2 A 9 0.831 -3.615 20.743 296 2H2* A 9 1H2' A 9 6.148 -1.569 18.280 297 1H2* A 9 2H2' A 9 6.306 0.021 19.086 298 1H5* G 10 1H5' G 10 6.479 -4.855 19.084 299 2H5* G 10 2H5' G 10 7.239 -5.701 17.722 300 H4* G 10 H4' G 10 4.858 -6.346 17.985 301 H3* G 10 H3' G 10 6.031 -5.457 15.490 302 H1* G 10 H1' G 10 2.498 -5.108 16.812 303 H8 G 10 H8 G 10 4.125 -1.617 16.189 304 H1 G 10 H1 G 10 -2.026 -1.500 18.059 305 1H2 G 10 1H2 G 10 -1.543 -4.919 18.297 306 2H2 G 10 2H2 G 10 -2.692 -3.588 18.497 307 2H2* G 10 1H2' G 10 3.545 -4.677 14.652 308 1H2* G 10 2H2' G 10 4.675 -3.509 15.406 309 1H5* A 11 1H5' A 11 1.950 -7.436 16.156 310 2H5* A 11 2H5' A 11 1.676 -8.623 14.867 311 H4* A 11 H4' A 11 -0.457 -7.698 15.782 312 H3* A 11 H3' A 11 0.186 -7.900 12.975 313 H1* A 11 H1' A 11 -1.936 -5.315 14.826 314 H8 A 11 H8 A 11 1.446 -3.805 13.608 315 1H6 A 11 1H6 A 11 -1.561 1.596 14.501 316 2H6 A 11 2H6 A 11 0.023 0.970 13.983 317 H2 A 11 H2 A 11 -4.269 -1.501 15.495 318 2H2* A 11 1H2' A 11 -1.550 -5.846 12.474 319 1H2* A 11 2H2' A 11 0.205 -5.549 12.673 320 1H5* G 12 1H5' G 12 -4.074 -6.872 14.584 321 2H5* G 12 2H5' G 12 -5.218 -7.830 13.621 322 H4* G 12 H4' G 12 -6.219 -5.669 14.331 323 H3* G 12 H3' G 12 -6.076 -6.560 11.535 324 H1* G 12 H1' G 12 -6.240 -3.123 13.189 325 H8 G 12 H8 G 12 -2.803 -3.704 11.415 326 H1 G 12 H1 G 12 -4.434 2.445 12.341 327 1H2 G 12 1H2 G 12 -7.250 1.016 13.750 328 2H2 G 12 2H2 G 12 -6.416 2.527 13.362 329 2H2* G 12 1H2' G 12 -6.658 -3.927 10.927 330 1H2* G 12 2H2' G 12 -5.003 -4.607 10.839 331 1H5* T 13 1H5' T 13 -8.907 -3.085 12.633 332 2H5* T 13 2H5' T 13 -10.396 -3.250 11.677 333 H4* T 13 H4' T 13 -9.643 -0.895 11.669 334 H3* T 13 H3' T 13 -9.522 -2.480 9.089 335 1H2* T 13 2H2' T 13 -8.073 -1.016 8.147 336 2H2* T 13 1H2' T 13 -9.090 0.374 8.613 337 H1* T 13 H1' T 13 -7.890 0.718 10.580 338 H3 T 13 H3 T 13 -3.845 1.987 9.126 339 1H5M T 13 1H5M T 13 -3.576 -3.271 9.308 340 2H5M T 13 2H5M T 13 -4.152 -3.083 7.639 341 3H5M T 13 3H5M T 13 -2.576 -2.432 8.112 342 H6 T 13 H6 T 13 -6.101 -2.264 9.298 343 1H5* A 14 1H5' A 14 -10.960 1.723 9.749 344 2H5* A 14 2H5' A 14 -12.401 2.047 8.764 345 H4* A 14 H4' A 14 -10.964 4.058 8.893 346 H3* A 14 H3' A 14 -11.956 2.939 6.449 347 H1* A 14 H1' A 14 -8.657 4.699 7.064 348 H8 A 14 H8 A 14 -8.097 0.930 6.220 349 1H6 A 14 1H6 A 14 -2.142 2.736 5.781 350 2H6 A 14 2H6 A 14 -3.172 1.305 5.536 351 H2 A 14 H2 A 14 -4.360 6.110 7.075 352 2H2* A 14 1H2' A 14 -9.790 3.857 5.075 353 1H2* A 14 2H2' A 14 -9.794 2.197 5.751 354 1H5* G 15 1H5' G 15 -9.690 7.191 6.287 355 2H5* G 15 2H5' G 15 -10.745 8.109 5.192 356 H4* G 15 H4' G 15 -8.445 8.819 4.820 357 H3* G 15 H3' G 15 -10.079 7.669 2.691 358 H1* G 15 H1' G 15 -6.341 7.801 3.252 359 H8 G 15 H8 G 15 -7.586 4.104 3.541 360 H1 G 15 H1 G 15 -1.275 4.847 2.549 361 1H2 G 15 1H2 G 15 -0.805 7.026 2.451 362 2H2 G 15 2H2 G 15 -2.124 8.193 2.628 363 2H2* G 15 1H2' G 15 -7.736 7.174 1.342 364 1H2* G 15 2H2' G 15 -8.539 5.908 2.325 365 1H5* T 16 1H5' T 16 -6.020 9.598 1.720 366 2H5* T 16 2H5' T 16 -6.308 10.686 0.346 367 H4* T 16 H4' T 16 -4.122 9.661 0.069 368 H3* T 16 H3' T 16 -6.315 9.079 -1.870 369 1H2* T 16 2H2' T 16 -5.723 6.850 -1.999 370 2H2* T 16 1H2' T 16 -4.271 7.418 -2.877 371 H1* T 16 H1' T 16 -3.005 7.494 -0.811 372 H3 T 16 H3 T 16 -1.877 3.169 -0.772 373 1H5M T 16 1H5M T 16 -7.142 3.021 -0.355 374 2H5M T 16 2H5M T 16 -6.192 1.788 0.485 375 3H5M T 16 3H5M T 16 -6.706 3.240 1.352 376 H6 T 16 H6 T 16 -6.034 5.484 -0.033 377 1H5* G 17 1H5' G 17 -1.882 8.928 -3.128 378 2H5* G 17 2H5' G 17 -1.785 9.695 -4.727 379 H4* G 17 H4' G 17 -0.327 7.739 -4.709 380 H3* G 17 H3' G 17 -2.520 8.016 -6.610 381 H1* G 17 H1' G 17 -0.765 5.018 -5.154 382 H8 G 17 H8 G 17 -4.584 4.748 -4.539 383 H1 G 17 H1 G 17 -1.058 -0.057 -2.117 384 1H2 G 17 1H2 G 17 1.557 1.930 -3.206 385 2H2 G 17 2H2 G 17 1.106 0.413 -2.416 386 H3T G 17 H3T G 17 -0.138 6.459 -6.668 387 2H2* G 17 1H2' G 17 -2.395 5.295 -6.972 388 1H2* G 17 2H2' G 17 -3.565 6.026 -5.827 Start of MODEL 14 1 1H5* C 1 1H5' C 1 3.438 -7.765 -2.272 2 2H5* C 1 2H5' C 1 1.941 -7.073 -1.617 3 H4* C 1 H4' C 1 3.724 -5.685 -3.676 4 H3* C 1 H3' C 1 4.291 -5.981 -0.860 5 H1* C 1 H1' C 1 3.172 -2.949 -2.820 6 1H4 C 1 1H4 C 1 -2.511 -0.713 -0.237 7 2H4 C 1 2H4 C 1 -1.515 0.538 -1.030 8 H5 C 1 H5 C 1 -1.584 -3.046 -0.177 9 H6 C 1 H6 C 1 0.351 -4.396 -0.863 10 H5T C 1 H5T C 1 1.612 -8.471 -3.405 11 2H2* C 1 1H2' C 1 3.928 -3.299 -0.512 12 1H2* C 1 2H2' C 1 2.582 -4.448 -0.231 13 1H5* A 2 1H5' A 2 5.520 -2.031 -3.098 14 2H5* A 2 2H5' A 2 7.157 -1.666 -2.514 15 H4* A 2 H4' A 2 5.931 0.426 -2.831 16 H3* A 2 H3' A 2 7.087 -0.354 -0.270 17 H1* A 2 H1' A 2 4.129 1.865 -1.143 18 H8 A 2 H8 A 2 2.928 -1.349 0.747 19 1H6 A 2 1H6 A 2 -2.298 2.012 1.358 20 2H6 A 2 2H6 A 2 -1.618 0.428 1.803 21 H2 A 2 H2 A 2 0.444 4.384 -0.836 22 2H2* A 2 1H2' A 2 5.394 1.474 0.902 23 1H2* A 2 2H2' A 2 5.004 -0.273 0.836 24 1H5* C 3 1H5' C 3 6.014 4.216 -1.216 25 2H5* C 3 2H5' C 3 7.294 5.144 -0.405 26 H4* C 3 H4' C 3 5.170 6.360 -0.219 27 H3* C 3 H3' C 3 6.611 5.356 2.181 28 H1* C 3 H1' C 3 2.967 6.311 1.377 29 1H4 C 3 1H4 C 3 -0.468 0.981 3.318 30 2H4 C 3 2H4 C 3 -1.444 2.467 3.160 31 H5 C 3 H5 C 3 1.985 1.171 2.869 32 H6 C 3 H6 C 3 3.734 2.767 2.214 33 2H2* C 3 1H2' C 3 4.266 6.287 3.415 34 1H2* C 3 2H2' C 3 4.689 4.568 3.161 35 1H5* T 4 1H5' T 4 3.938 9.146 2.092 36 2H5* T 4 2H5' T 4 4.703 10.370 3.126 37 H4* T 4 H4' T 4 2.253 10.504 3.307 38 H3* T 4 H3' T 4 4.006 10.081 5.621 39 1H2* T 4 2H2' T 4 2.895 8.148 6.303 40 2H2* T 4 1H2' T 4 1.696 9.319 6.940 41 H1* T 4 H1' T 4 0.354 9.097 4.932 42 H3 T 4 H3 T 4 -1.646 5.288 6.319 43 1H5M T 4 1H5M T 4 2.145 2.685 5.278 44 2H5M T 4 2H5M T 4 2.657 3.625 3.867 45 3H5M T 4 3H5M T 4 3.426 3.891 5.445 46 H6 T 4 H6 T 4 2.749 6.301 4.638 47 1H5* A 5 1H5' A 5 -0.384 11.146 6.143 48 2H5* A 5 2H5' A 5 -0.400 12.558 7.215 49 H4* A 5 H4' A 5 -2.359 11.240 7.697 50 H3* A 5 H3' A 5 -0.338 11.759 9.734 51 H1* A 5 H1' A 5 -2.785 8.858 9.318 52 H8 A 5 H8 A 5 0.911 7.699 8.808 53 1H6 A 5 1H6 A 5 -0.057 2.826 9.462 54 2H6 A 5 2H6 A 5 -1.634 2.085 9.831 55 H2 A 5 H2 A 5 -4.751 4.924 10.121 56 2H2* A 5 1H2' A 5 -1.367 9.625 11.139 57 1H2* A 5 2H2' A 5 0.085 9.481 10.107 58 1H5* C 6 1H5' C 6 -4.815 10.610 10.495 59 2H5* C 6 2H5' C 6 -5.341 11.564 11.898 60 H4* C 6 H4' C 6 -6.586 9.417 11.741 61 H3* C 6 H3' C 6 -5.120 10.294 14.120 62 H1* C 6 H1' C 6 -5.999 6.819 12.759 63 1H4 C 6 1H4 C 6 -1.300 2.770 13.229 64 2H4 C 6 2H4 C 6 -0.127 3.768 12.335 65 H5 C 6 H5 C 6 -0.750 6.088 11.721 66 H6 C 6 H6 C 6 -2.599 7.682 11.756 67 2H2* C 6 1H2' C 6 -5.282 7.659 14.929 68 1H2* C 6 2H2' C 6 -3.807 8.360 14.196 69 1H5* T 7 1H5' T 7 -8.014 6.759 14.260 70 2H5* T 7 2H5' T 7 -9.057 6.954 15.684 71 H4* T 7 H4' T 7 -8.500 4.577 15.351 72 H3* T 7 H3' T 7 -7.807 6.039 17.834 73 1H2* T 7 2H2' T 7 -5.638 5.246 17.855 74 2H2* T 7 1H2' T 7 -6.379 3.702 18.362 75 H1* T 7 H1' T 7 -6.406 2.918 16.072 76 H3 T 7 H3 T 7 -2.134 1.696 15.454 77 1H5M T 7 1H5M T 7 -2.062 6.966 15.120 78 2H5M T 7 2H5M T 7 -1.716 6.772 16.852 79 3H5M T 7 3H5M T 7 -0.587 6.140 15.642 80 H6 T 7 H6 T 7 -4.252 5.940 16.272 81 1H5* C 8 1H5' C 8 -9.347 1.484 17.657 82 2H5* C 8 2H5' C 8 -10.094 1.184 19.241 83 H4* C 8 H4' C 8 -9.009 -0.883 18.396 84 H3* C 8 H3' C 8 -7.664 0.474 20.778 85 H1* C 8 H1' C 8 -6.080 -1.784 18.047 86 1H4 C 8 1H4 C 8 -0.672 0.865 19.249 87 2H4 C 8 2H4 C 8 -1.316 2.502 19.493 88 H5 C 8 H5 C 8 -3.765 2.860 19.399 89 H6 C 8 H6 C 8 -5.899 1.695 19.118 90 2H2* C 8 1H2' C 8 -7.264 -2.404 19.916 91 1H2* C 8 2H2' C 8 -6.146 -1.356 20.838 92 1H5* T 9 1H5' T 9 -8.453 -3.499 20.296 93 2H5* T 9 2H5' T 9 -9.218 -4.367 21.643 94 H4* T 9 H4' T 9 -7.445 -5.723 20.489 95 H3* T 9 H3' T 9 -7.791 -5.536 23.279 96 1H2* T 9 2H2' T 9 -6.020 -3.933 23.550 97 2H2* T 9 1H2' T 9 -5.140 -5.471 23.826 98 H1* T 9 H1' T 9 -4.418 -5.525 21.508 99 H3 T 9 H3 T 9 -0.912 -2.727 21.671 100 1H5M T 9 1H5M T 9 -5.071 0.467 22.258 101 2H5M T 9 2H5M T 9 -4.777 0.040 23.958 102 3H5M T 9 3H5M T 9 -3.547 0.917 23.035 103 H6 T 9 H6 T 9 -5.604 -2.158 22.577 104 1H5* T 10 1H5' T 10 -4.110 -7.671 21.571 105 2H5* T 10 2H5' T 10 -3.873 -9.201 22.440 106 H4* T 10 H4' T 10 -1.692 -8.211 21.848 107 H3* T 10 H3' T 10 -2.437 -8.950 24.552 108 1H2* T 10 2H2' T 10 -2.285 -6.721 25.338 109 2H2* T 10 1H2' T 10 -0.560 -7.177 25.483 110 H1* T 10 H1' T 10 -0.098 -6.254 23.268 111 H3 T 10 H3 T 10 0.545 -2.064 24.779 112 1H5M T 10 1H5M T 10 -4.538 -3.075 25.943 113 2H5M T 10 2H5M T 10 -4.039 -1.410 25.613 114 3H5M T 10 3H5M T 10 -4.665 -2.415 24.298 115 H6 T 10 H6 T 10 -3.357 -4.850 24.341 116 1H5* T 11 1H5' T 11 1.932 -7.716 23.488 117 2H5* T 11 2H5' T 11 2.947 -8.980 24.211 118 H4* T 11 H4' T 11 4.132 -6.839 24.299 119 H3* T 11 H3' T 11 3.638 -8.462 26.637 120 1H2* T 11 2H2' T 11 2.198 -6.830 27.604 121 2H2* T 11 1H2' T 11 3.780 -6.248 28.214 122 H1* T 11 H1' T 11 3.973 -4.714 26.313 123 H3 T 11 H3 T 11 1.686 -1.467 28.450 124 1H5M T 11 1H5M T 11 -2.459 -3.471 27.478 125 2H5M T 11 2H5M T 11 -2.002 -4.392 26.038 126 3H5M T 11 3H5M T 11 -1.978 -5.167 27.636 127 H6 T 11 H6 T 11 0.394 -5.594 26.334 128 1H5* G 12 1H5' G 12 6.639 -4.834 26.311 129 2H5* G 12 2H5' G 12 8.081 -5.507 27.091 130 H4* G 12 H4' G 12 8.146 -3.061 27.227 131 H3* G 12 H3' G 12 8.432 -4.756 29.514 132 H1* G 12 H1' G 12 6.864 -1.337 29.328 133 H8 G 12 H8 G 12 3.992 -3.967 29.687 134 H1 G 12 H1 G 12 2.357 2.119 30.961 135 1H2 G 12 1H2 G 12 5.703 2.682 30.298 136 2H2 G 12 2H2 G 12 4.161 3.414 30.761 137 2H2* G 12 1H2' G 12 7.309 -2.920 31.151 138 1H2* G 12 2H2' G 12 6.265 -4.145 30.361 139 1H5* T 13 1H5' T 13 8.810 -0.142 29.415 140 2H5* T 13 2H5' T 13 10.430 0.087 30.101 141 H4* T 13 H4' T 13 9.102 2.150 30.291 142 H3* T 13 H3' T 13 10.545 0.950 32.438 143 1H2* T 13 2H2' T 13 8.568 0.215 33.546 144 2H2* T 13 1H2' T 13 8.769 1.835 34.291 145 H1* T 13 H1' T 13 7.199 2.793 32.680 146 H3 T 13 H3 T 13 3.634 1.524 35.175 147 1H5M T 13 1H5M T 13 3.825 -2.877 33.500 148 2H5M T 13 2H5M T 13 4.572 -2.524 31.935 149 3H5M T 13 3H5M T 13 5.578 -3.031 33.307 150 H6 T 13 H6 T 13 6.669 -0.805 32.262 151 1H5* A 14 1H5' A 14 8.374 5.022 32.784 152 2H5* A 14 2H5' A 14 9.547 6.131 33.525 153 H4* A 14 H4' A 14 7.237 6.814 34.067 154 H3* A 14 H3' A 14 9.301 6.326 36.064 155 H1* A 14 H1' A 14 5.514 6.009 36.228 156 H8 A 14 H8 A 14 7.179 2.466 36.462 157 1H6 A 14 1H6 A 14 1.603 0.967 38.838 158 2H6 A 14 2H6 A 14 3.185 0.238 38.471 159 H2 A 14 H2 A 14 1.456 5.084 37.848 160 2H2* A 14 1H2' A 14 7.284 6.018 37.900 161 1H2* A 14 2H2' A 14 8.067 4.612 37.113 162 1H5* G 15 1H5' G 15 5.324 8.529 37.101 163 2H5* G 15 2H5' G 15 5.843 9.987 37.970 164 H4* G 15 H4' G 15 3.655 9.224 38.815 165 H3* G 15 H3' G 15 5.972 9.654 40.525 166 H1* G 15 H1' G 15 2.965 7.405 40.842 167 H8 G 15 H8 G 15 6.135 5.183 40.270 168 H1 G 15 H1 G 15 0.981 2.141 42.625 169 1H2 G 15 1H2 G 15 -0.410 5.301 42.414 170 2H2 G 15 2H2 G 15 -0.682 3.611 42.865 171 2H2* G 15 1H2' G 15 4.788 8.032 42.373 172 1H2* G 15 2H2' G 15 5.990 7.382 41.214 173 1H5* T 16 1H5' T 16 1.510 9.280 42.061 174 2H5* T 16 2H5' T 16 1.359 10.548 43.293 175 H4* T 16 H4' T 16 -0.115 8.641 43.819 176 H3* T 16 H3' T 16 1.910 9.668 45.680 177 1H2* T 16 2H2' T 16 2.903 7.554 45.931 178 2H2* T 16 1H2' T 16 1.523 7.286 47.041 179 H1* T 16 H1' T 16 0.232 6.273 45.227 180 H3 T 16 H3 T 16 2.232 2.294 46.146 181 1H5M T 16 1H5M T 16 5.790 3.271 43.214 182 2H5M T 16 2H5M T 16 5.006 4.498 42.208 183 3H5M T 16 3H5M T 16 5.983 4.986 43.606 184 H6 T 16 H6 T 16 3.512 6.193 43.635 185 1H5* G 17 1H5' G 17 -1.337 6.775 47.091 186 2H5* G 17 2H5' G 17 -2.040 7.468 48.566 187 H4* G 17 H4' G 17 -1.912 5.044 48.819 188 H3* G 17 H3' G 17 -0.612 6.869 50.674 189 H1* G 17 H1' G 17 0.156 3.325 49.662 190 H8 G 17 H8 G 17 3.150 5.626 48.670 191 H1 G 17 H1 G 17 4.155 -0.700 48.077 192 1H2 G 17 1H2 G 17 0.850 -0.857 49.077 193 2H2 G 17 2H2 G 17 2.286 -1.785 48.622 194 H3T G 17 H3T G 17 -1.407 4.147 50.916 195 2H2* G 17 1H2' G 17 1.046 4.811 51.406 196 1H2* G 17 2H2' G 17 1.546 5.997 50.159 197 1H5* C 1 1H5' C 1 6.074 -6.894 45.395 198 2H5* C 1 2H5' C 1 7.102 -7.178 46.812 199 H4* C 1 H4' C 1 5.174 -8.170 48.023 200 H3* C 1 H3' C 1 3.894 -8.545 45.572 201 H1* C 1 H1' C 1 2.821 -5.821 48.057 202 1H4 C 1 1H4 C 1 4.510 0.027 45.441 203 2H4 C 1 2H4 C 1 2.943 0.033 46.295 204 H5 C 1 H5 C 1 5.710 -2.188 45.275 205 H6 C 1 H6 C 1 5.520 -4.552 45.888 206 H5T C 1 H5T C 1 5.736 -9.165 45.323 207 2H2* C 1 1H2' C 1 2.060 -6.589 45.885 208 1H2* C 1 2H2' C 1 3.638 -6.179 45.154 209 1H5* A 2 1H5' A 2 0.935 -6.884 48.605 210 2H5* A 2 2H5' A 2 -0.602 -7.770 48.465 211 H4* A 2 H4' A 2 -1.116 -5.395 48.611 212 H3* A 2 H3' A 2 -1.878 -6.943 46.270 213 H1* A 2 H1' A 2 -0.986 -3.252 46.639 214 H8 A 2 H8 A 2 1.446 -5.135 44.222 215 1H6 A 2 1H6 A 2 3.953 -1.034 42.815 216 2H6 A 2 2H6 A 2 3.751 0.618 43.450 217 H2 A 2 H2 A 2 0.735 0.884 46.399 218 2H2* A 2 1H2' A 2 -2.007 -4.572 44.875 219 1H2* A 2 2H2' A 2 -0.574 -5.639 44.801 220 1H5* C 3 1H5' C 3 -3.508 -2.772 47.427 221 2H5* C 3 2H5' C 3 -5.223 -2.653 46.981 222 H4* C 3 H4' C 3 -4.074 -0.463 46.756 223 H3* C 3 H3' C 3 -5.528 -1.768 44.552 224 H1* C 3 H1' C 3 -2.635 0.746 44.687 225 1H4 C 3 1H4 C 3 2.259 -2.019 41.170 226 2H4 C 3 2H4 C 3 2.344 -0.239 41.268 227 H5 C 3 H5 C 3 0.290 -3.135 42.244 228 H6 C 3 H6 C 3 -1.731 -2.681 43.564 229 2H2* C 3 1H2' C 3 -4.237 0.122 42.973 230 1H2* C 3 2H2' C 3 -3.731 -1.591 43.087 231 1H5* T 4 1H5' T 4 -4.582 2.731 44.784 232 2H5* T 4 2H5' T 4 -6.033 3.624 44.280 233 H4* T 4 H4' T 4 -3.956 4.807 43.601 234 H3* T 4 H3' T 4 -6.114 4.103 41.752 235 1H2* T 4 2H2' T 4 -4.690 2.857 40.366 236 2H2* T 4 1H2' T 4 -4.268 4.485 39.741 237 H1* T 4 H1' T 4 -2.361 4.602 41.258 238 H3 T 4 H3 T 4 -0.044 2.312 38.064 239 1H5M T 4 1H5M T 4 -2.876 -1.439 40.377 240 2H5M T 4 2H5M T 4 -1.174 -1.803 40.055 241 3H5M T 4 3H5M T 4 -1.668 -1.253 41.663 242 H6 T 4 H6 T 4 -2.982 1.031 41.655 243 1H5* A 5 1H5' A 5 -2.671 6.806 40.732 244 2H5* A 5 2H5' A 5 -3.289 8.284 39.966 245 H4* A 5 H4' A 5 -1.111 7.678 39.007 246 H3* A 5 H3' A 5 -3.583 7.793 37.341 247 H1* A 5 H1' A 5 -0.147 6.071 37.067 248 H8 A 5 H8 A 5 -3.192 3.630 37.217 249 1H6 A 5 1H6 A 5 -0.820 -0.209 35.050 250 2H6 A 5 2H6 A 5 0.849 -0.229 34.428 251 H2 A 5 H2 A 5 2.839 3.458 34.943 252 2H2* A 5 1H2' A 5 -1.726 6.878 35.434 253 1H2* A 5 2H2' A 5 -3.034 5.907 36.172 254 1H5* C 6 1H5' C 6 0.717 9.110 35.975 255 2H5* C 6 2H5' C 6 0.539 10.407 34.774 256 H4* C 6 H4' C 6 2.444 8.917 34.205 257 H3* C 6 H3' C 6 0.101 9.266 32.375 258 H1* C 6 H1' C 6 2.832 6.570 32.921 259 1H4 C 6 1H4 C 6 -0.937 1.132 33.418 260 2H4 C 6 2H4 C 6 0.770 0.785 33.041 261 H5 C 6 H5 C 6 -1.629 3.524 33.586 262 H6 C 6 H6 C 6 -0.769 5.820 33.469 263 2H2* C 6 1H2' C 6 1.701 7.375 30.990 264 1H2* C 6 2H2' C 6 0.105 7.071 31.735 265 1H5* A 7 1H5' A 7 3.926 7.838 31.338 266 2H5* A 7 2H5' A 7 4.725 8.862 30.128 267 H4* A 7 H4' A 7 5.420 6.487 29.918 268 H3* A 7 H3' A 7 4.432 8.112 27.732 269 H1* A 7 H1' A 7 4.219 4.357 28.348 270 H8 A 7 H8 A 7 0.692 5.985 28.776 271 1H6 A 7 1H6 A 7 -1.867 1.742 28.041 272 2H6 A 7 2H6 A 7 -1.196 0.133 27.676 273 H2 A 7 H2 A 7 3.022 0.130 27.444 274 2H2* A 7 1H2' A 7 3.777 5.786 26.418 275 1H2* A 7 2H2' A 7 2.566 6.714 27.354 276 1H5* A 8 1H5' A 8 7.209 4.365 27.275 277 2H5* A 8 2H5' A 8 8.415 4.874 26.075 278 H4* A 8 H4' A 8 8.132 2.386 26.162 279 H3* A 8 H3' A 8 8.110 3.983 23.751 280 H1* A 8 H1' A 8 6.217 0.752 24.574 281 H8 A 8 H8 A 8 3.806 3.835 24.555 282 1H6 A 8 1H6 A 8 -0.318 1.216 23.483 283 2H6 A 8 2H6 A 8 -0.441 -0.542 23.224 284 H2 A 8 H2 A 8 3.281 -2.511 23.588 285 2H2* A 8 1H2' A 8 6.652 1.989 22.535 286 1H2* A 8 2H2' A 8 5.866 3.442 23.222 287 1H5* A 9 1H5' A 9 8.253 -0.691 23.445 288 2H5* A 9 2H5' A 9 9.590 -1.010 22.321 289 H4* A 9 H4' A 9 7.815 -2.709 22.064 290 H3* A 9 H3' A 9 8.859 -1.115 19.865 291 H1* A 9 H1' A 9 5.431 -2.687 20.420 292 H8 A 9 H8 A 9 5.297 1.205 20.167 293 1H6 A 9 1H6 A 9 -0.864 0.227 20.335 294 2H6 A 9 2H6 A 9 0.315 1.549 20.150 295 H2 A 9 H2 A 9 0.988 -3.555 20.730 296 2H2* A 9 1H2' A 9 6.542 -1.688 18.498 297 1H2* A 9 2H2' A 9 6.758 -0.152 19.393 298 1H5* G 10 1H5' G 10 6.654 -5.223 19.475 299 2H5* G 10 2H5' G 10 7.441 -6.105 18.151 300 H4* G 10 H4' G 10 5.046 -6.740 18.398 301 H3* G 10 H3' G 10 6.290 -6.027 15.910 302 H1* G 10 H1' G 10 2.736 -5.411 17.042 303 H8 G 10 H8 G 10 4.622 -2.037 16.514 304 H1 G 10 H1 G 10 -1.648 -1.511 17.835 305 1H2 G 10 1H2 G 10 -1.399 -4.946 18.172 306 2H2 G 10 2H2 G 10 -2.477 -3.544 18.247 307 2H2* G 10 1H2' G 10 3.933 -5.068 14.943 308 1H2* G 10 2H2' G 10 5.090 -3.966 15.757 309 1H5* A 11 1H5' A 11 2.024 -7.546 16.519 310 2H5* A 11 2H5' A 11 1.652 -8.746 15.265 311 H4* A 11 H4' A 11 -0.387 -7.562 16.073 312 H3* A 11 H3' A 11 0.333 -7.889 13.284 313 H1* A 11 H1' A 11 -1.594 -5.093 15.050 314 H8 A 11 H8 A 11 1.969 -3.913 14.005 315 1H6 A 11 1H6 A 11 -0.629 1.746 14.480 316 2H6 A 11 2H6 A 11 0.933 0.971 14.119 317 H2 A 11 H2 A 11 -3.670 -1.081 15.316 318 2H2* A 11 1H2' A 11 -1.235 -5.711 12.716 319 1H2* A 11 2H2' A 11 0.537 -5.561 12.928 320 1H5* G 12 1H5' G 12 -3.800 -6.511 14.843 321 2H5* G 12 2H5' G 12 -5.016 -7.442 13.944 322 H4* G 12 H4' G 12 -5.889 -5.216 14.630 323 H3* G 12 H3' G 12 -5.902 -6.202 11.862 324 H1* G 12 H1' G 12 -5.845 -2.708 13.401 325 H8 G 12 H8 G 12 -2.447 -3.510 11.649 326 H1 G 12 H1 G 12 -3.970 2.728 11.964 327 1H2 G 12 1H2 G 12 -6.813 1.493 13.498 328 2H2 G 12 2H2 G 12 -5.951 2.944 12.966 329 2H2* G 12 1H2' G 12 -6.395 -3.566 11.191 330 1H2* G 12 2H2' G 12 -4.778 -4.322 11.056 331 1H5* T 13 1H5' T 13 -8.467 -2.542 12.958 332 2H5* T 13 2H5' T 13 -10.026 -2.689 12.116 333 H4* T 13 H4' T 13 -9.215 -0.367 11.954 334 H3* T 13 H3' T 13 -9.262 -2.056 9.436 335 1H2* T 13 2H2' T 13 -7.880 -0.625 8.347 336 2H2* T 13 1H2' T 13 -8.840 0.789 8.859 337 H1* T 13 H1' T 13 -7.486 1.160 10.711 338 H3 T 13 H3 T 13 -3.573 2.270 8.809 339 1H5M T 13 1H5M T 13 -3.291 -2.936 9.552 340 2H5M T 13 2H5M T 13 -3.959 -2.935 7.906 341 3H5M T 13 3H5M T 13 -2.359 -2.243 8.216 342 H6 T 13 H6 T 13 -5.815 -1.924 9.568 343 1H5* A 14 1H5' A 14 -10.558 2.173 9.985 344 2H5* A 14 2H5' A 14 -12.072 2.479 9.111 345 H4* A 14 H4' A 14 -10.608 4.468 9.024 346 H3* A 14 H3' A 14 -11.783 3.232 6.710 347 H1* A 14 H1' A 14 -8.465 5.033 7.027 348 H8 A 14 H8 A 14 -7.917 1.227 6.330 349 1H6 A 14 1H6 A 14 -3.066 1.632 5.207 350 2H6 A 14 2H6 A 14 -2.058 3.098 5.284 351 H2 A 14 H2 A 14 -4.223 6.503 6.551 352 2H2* A 14 1H2' A 14 -9.732 4.131 5.150 353 1H2* A 14 2H2' A 14 -9.676 2.491 5.872 354 1H5* G 15 1H5' G 15 -9.544 7.429 6.160 355 2H5* G 15 2H5' G 15 -10.700 8.332 5.159 356 H4* G 15 H4' G 15 -8.438 8.980 4.513 357 H3* G 15 H3' G 15 -10.332 7.843 2.618 358 H1* G 15 H1' G 15 -6.550 7.803 2.727 359 H8 G 15 H8 G 15 -8.002 4.193 3.047 360 H1 G 15 H1 G 15 -1.654 4.552 2.059 361 1H2 G 15 1H2 G 15 -1.048 6.706 2.026 362 2H2 G 15 2H2 G 15 -2.294 7.944 2.250 363 2H2* G 15 1H2' G 15 -8.198 7.165 1.034 364 1H2* G 15 2H2' G 15 -8.928 5.985 2.168 365 1H5* T 16 1H5' T 16 -6.294 9.699 1.214 366 2H5* T 16 2H5' T 16 -6.706 10.708 -0.188 367 H4* T 16 H4' T 16 -4.524 9.714 -0.570 368 H3* T 16 H3' T 16 -6.832 8.974 -2.318 369 1H2* T 16 2H2' T 16 -6.166 6.763 -2.392 370 2H2* T 16 1H2' T 16 -4.794 7.338 -3.385 371 H1* T 16 H1' T 16 -3.405 7.555 -1.412 372 H3 T 16 H3 T 16 -2.143 3.265 -1.396 373 1H5M T 16 1H5M T 16 -7.347 3.132 -0.168 374 2H5M T 16 2H5M T 16 -6.282 1.801 0.295 375 3H5M T 16 3H5M T 16 -6.522 3.156 1.406 376 H6 T 16 H6 T 16 -6.248 5.492 -0.220 377 1H5* G 17 1H5' G 17 -2.516 8.794 -3.777 378 2H5* G 17 2H5' G 17 -2.471 9.445 -5.428 379 H4* G 17 H4' G 17 -1.017 7.486 -5.316 380 H3* G 17 H3' G 17 -3.238 7.664 -7.178 381 H1* G 17 H1' G 17 -1.553 4.713 -5.561 382 H8 G 17 H8 G 17 -5.347 4.637 -4.785 383 H1 G 17 H1 G 17 -1.904 -0.081 -2.090 384 1H2 G 17 1H2 G 17 0.738 1.698 -3.442 385 2H2 G 17 2H2 G 17 0.262 0.279 -2.497 386 H3T G 17 H3T G 17 -0.989 7.489 -7.679 387 2H2* G 17 1H2' G 17 -3.256 4.927 -7.321 388 1H2* G 17 2H2' G 17 -4.339 5.792 -6.185 Start of MODEL 15 1 1H5* C 1 1H5' C 1 -0.082 -5.969 -3.047 2 2H5* C 1 2H5' C 1 -0.175 -6.209 -4.802 3 H4* C 1 H4' C 1 2.142 -5.358 -5.056 4 H3* C 1 H3' C 1 2.533 -5.868 -2.315 5 H1* C 1 H1' C 1 2.357 -2.432 -3.868 6 1H4 C 1 1H4 C 1 -2.967 0.808 -1.619 7 2H4 C 1 2H4 C 1 -1.696 1.852 -2.312 8 H5 C 1 H5 C 1 -2.521 -1.664 -1.578 9 H6 C 1 H6 C 1 -0.865 -3.359 -2.224 10 H5T C 1 H5T C 1 0.389 -8.111 -3.680 11 2H2* C 1 1H2' C 1 2.674 -3.271 -1.596 12 1H2* C 1 2H2' C 1 1.066 -4.065 -1.639 13 1H5* A 2 1H5' A 2 4.772 -2.056 -4.087 14 2H5* A 2 2H5' A 2 6.379 -2.089 -3.333 15 H4* A 2 H4' A 2 5.645 0.233 -3.491 16 H3* A 2 H3' A 2 6.405 -0.987 -1.004 17 H1* A 2 H1' A 2 3.860 1.730 -1.638 18 H8 A 2 H8 A 2 2.015 -1.523 -0.485 19 1H6 A 2 1H6 A 2 -2.761 2.446 0.157 20 2H6 A 2 2H6 A 2 -2.353 0.730 0.400 21 H2 A 2 H2 A 2 0.506 4.683 -1.349 22 2H2* A 2 1H2' A 2 4.772 0.698 0.382 23 1H2* A 2 2H2' A 2 4.175 -0.907 -0.143 24 1H5* C 3 1H5' C 3 5.709 3.747 -1.187 25 2H5* C 3 2H5' C 3 6.958 4.428 -0.122 26 H4* C 3 H4' C 3 4.877 5.734 0.116 27 H3* C 3 H3' C 3 5.650 3.946 2.458 28 H1* C 3 H1' C 3 2.365 5.581 1.156 29 1H4 C 3 1H4 C 3 -0.922 0.200 3.041 30 2H4 C 3 2H4 C 3 -1.879 1.701 3.158 31 H5 C 3 H5 C 3 1.490 0.418 2.421 32 H6 C 3 H6 C 3 3.207 2.062 1.806 33 2H2* C 3 1H2' C 3 3.720 6.193 2.886 34 1H2* C 3 2H2' C 3 3.717 4.540 3.557 35 1H5* T 4 1H5' T 4 4.774 8.279 2.533 36 2H5* T 4 2H5' T 4 5.653 9.160 3.800 37 H4* T 4 H4' T 4 3.308 9.942 3.605 38 H3* T 4 H3' T 4 4.543 9.159 6.086 39 1H2* T 4 2H2' T 4 3.158 7.252 6.358 40 2H2* T 4 1H2' T 4 2.095 8.495 7.099 41 H1* T 4 H1' T 4 0.905 8.786 4.995 42 H3 T 4 H3 T 4 -1.926 5.313 5.344 43 1H5M T 4 1H5M T 4 1.533 2.166 4.762 44 2H5M T 4 2H5M T 4 2.277 3.036 3.411 45 3H5M T 4 3H5M T 4 2.982 3.132 5.040 46 H6 T 4 H6 T 4 2.834 5.636 4.722 47 1H5* A 5 1H5' A 5 0.216 10.746 6.108 48 2H5* A 5 2H5' A 5 0.266 12.116 7.234 49 H4* A 5 H4' A 5 -1.930 11.059 7.347 50 H3* A 5 H3' A 5 -0.229 11.428 9.659 51 H1* A 5 H1' A 5 -2.794 8.663 8.945 52 H8 A 5 H8 A 5 0.893 7.371 8.994 53 1H6 A 5 1H6 A 5 -1.913 1.835 9.584 54 2H6 A 5 2H6 A 5 -0.291 2.562 9.480 55 H2 A 5 H2 A 5 -4.985 4.746 9.301 56 2H2* A 5 1H2' A 5 -1.578 9.386 10.914 57 1H2* A 5 2H2' A 5 -0.017 9.123 10.084 58 1H5* C 6 1H5' C 6 -4.817 10.495 9.992 59 2H5* C 6 2H5' C 6 -5.441 11.471 11.338 60 H4* C 6 H4' C 6 -6.654 9.317 11.178 61 H3* C 6 H3' C 6 -5.428 10.298 13.590 62 H1* C 6 H1' C 6 -5.820 6.690 12.400 63 1H4 C 6 1H4 C 6 0.350 4.307 11.850 64 2H4 C 6 2H4 C 6 -0.912 3.051 11.836 65 H5 C 6 H5 C 6 -0.384 6.676 12.105 66 H6 C 6 H6 C 6 -2.376 8.097 12.263 67 2H2* C 6 1H2' C 6 -5.107 7.742 14.486 68 1H2* C 6 2H2' C 6 -3.783 8.591 13.627 69 1H5* T 7 1H5' T 7 -8.366 6.563 13.645 70 2H5* T 7 2H5' T 7 -9.399 6.859 15.058 71 H4* T 7 H4' T 7 -9.084 4.434 14.690 72 H3* T 7 H3' T 7 -8.509 5.777 17.214 73 1H2* T 7 2H2' T 7 -6.256 5.126 17.216 74 2H2* T 7 1H2' T 7 -6.948 3.605 17.854 75 H1* T 7 H1' T 7 -6.986 2.647 15.618 76 H3 T 7 H3 T 7 -2.702 1.380 15.144 77 1H5M T 7 1H5M T 7 -1.135 5.821 15.162 78 2H5M T 7 2H5M T 7 -2.577 6.619 14.517 79 3H5M T 7 3H5M T 7 -2.318 6.530 16.271 80 H6 T 7 H6 T 7 -4.823 5.668 15.669 81 1H5* C 8 1H5' C 8 -9.776 1.126 16.966 82 2H5* C 8 2H5' C 8 -10.551 0.776 18.526 83 H4* C 8 H4' C 8 -9.301 -1.215 17.725 84 H3* C 8 H3' C 8 -8.116 0.241 20.133 85 H1* C 8 H1' C 8 -6.313 -1.914 17.456 86 1H4 C 8 1H4 C 8 -1.141 1.079 18.928 87 2H4 C 8 2H4 C 8 -1.906 2.663 19.174 88 H5 C 8 H5 C 8 -4.360 2.864 18.946 89 H6 C 8 H6 C 8 -6.399 1.566 18.547 90 2H2* C 8 1H2' C 8 -7.507 -2.609 19.292 91 1H2* C 8 2H2' C 8 -6.484 -1.489 20.241 92 1H5* T 9 1H5' T 9 -8.449 -3.743 19.730 93 2H5* T 9 2H5' T 9 -9.220 -4.649 21.047 94 H4* T 9 H4' T 9 -7.241 -5.847 20.075 95 H3* T 9 H3' T 9 -7.816 -5.612 22.823 96 1H2* T 9 2H2' T 9 -6.233 -3.833 23.165 97 2H2* T 9 1H2' T 9 -5.232 -5.267 23.559 98 H1* T 9 H1' T 9 -4.325 -5.305 21.308 99 H3 T 9 H3 T 9 -1.158 -2.159 21.901 100 1H5M T 9 1H5M T 9 -4.322 1.309 22.175 101 2H5M T 9 2H5M T 9 -5.671 0.562 21.308 102 3H5M T 9 3H5M T 9 -5.570 0.435 23.077 103 H6 T 9 H6 T 9 -5.969 -2.015 21.851 104 1H5* T 10 1H5' T 10 -3.824 -7.330 21.488 105 2H5* T 10 2H5' T 10 -3.560 -8.868 22.336 106 H4* T 10 H4' T 10 -1.411 -7.714 21.969 107 H3* T 10 H3' T 10 -2.361 -8.565 24.591 108 1H2* T 10 2H2' T 10 -2.309 -6.373 25.456 109 2H2* T 10 1H2' T 10 -0.578 -6.770 25.675 110 H1* T 10 H1' T 10 -0.042 -5.762 23.517 111 H3 T 10 H3 T 10 0.364 -1.594 25.155 112 1H5M T 10 1H5M T 10 -4.284 -1.093 25.673 113 2H5M T 10 2H5M T 10 -4.838 -2.241 24.445 114 3H5M T 10 3H5M T 10 -4.681 -2.753 26.139 115 H6 T 10 H6 T 10 -3.403 -4.511 24.466 116 1H5* T 11 1H5' T 11 2.090 -7.333 23.716 117 2H5* T 11 2H5' T 11 3.036 -8.630 24.474 118 H4* T 11 H4' T 11 4.312 -6.550 24.592 119 H3* T 11 H3' T 11 3.660 -8.121 26.918 120 1H2* T 11 2H2' T 11 2.221 -6.435 27.799 121 2H2* T 11 1H2' T 11 3.787 -5.906 28.492 122 H1* T 11 H1' T 11 4.134 -4.383 26.605 123 H3 T 11 H3 T 11 1.793 -1.128 28.710 124 1H5M T 11 1H5M T 11 -2.312 -2.886 27.222 125 2H5M T 11 2H5M T 11 -1.741 -3.707 25.763 126 3H5M T 11 3H5M T 11 -1.919 -4.610 27.282 127 H6 T 11 H6 T 11 0.550 -5.090 26.274 128 1H5* G 12 1H5' G 12 6.814 -4.615 26.737 129 2H5* G 12 2H5' G 12 8.193 -5.375 27.550 130 H4* G 12 H4' G 12 8.386 -2.937 27.722 131 H3* G 12 H3' G 12 8.525 -4.676 29.985 132 H1* G 12 H1' G 12 7.109 -1.188 29.830 133 H8 G 12 H8 G 12 4.118 -3.700 30.004 134 H1 G 12 H1 G 12 2.693 2.405 31.425 135 1H2 G 12 1H2 G 12 6.082 2.846 30.892 136 2H2 G 12 2H2 G 12 4.556 3.630 31.327 137 2H2* G 12 1H2' G 12 7.426 -2.833 31.626 138 1H2* G 12 2H2' G 12 6.357 -3.993 30.772 139 1H5* T 13 1H5' T 13 9.094 -0.083 30.008 140 2H5* T 13 2H5' T 13 10.684 0.086 30.777 141 H4* T 13 H4' T 13 9.399 2.175 30.966 142 H3* T 13 H3' T 13 10.697 0.864 33.147 143 1H2* T 13 2H2' T 13 8.647 0.181 34.144 144 2H2* T 13 1H2' T 13 8.862 1.780 34.930 145 H1* T 13 H1' T 13 7.411 2.819 33.258 146 H3 T 13 H3 T 13 3.719 1.635 35.608 147 1H5M T 13 1H5M T 13 3.798 -2.732 33.839 148 2H5M T 13 2H5M T 13 4.594 -2.371 32.300 149 3H5M T 13 3H5M T 13 5.548 -2.947 33.683 150 H6 T 13 H6 T 13 6.755 -0.744 32.735 151 1H5* A 14 1H5' A 14 8.694 5.004 33.488 152 2H5* A 14 2H5' A 14 9.870 6.057 34.300 153 H4* A 14 H4' A 14 7.551 6.807 34.730 154 H3* A 14 H3' A 14 9.522 6.340 36.791 155 H1* A 14 H1' A 14 5.751 5.968 36.901 156 H8 A 14 H8 A 14 7.366 2.395 36.946 157 1H6 A 14 1H6 A 14 1.815 0.878 39.368 158 2H6 A 14 2H6 A 14 3.372 0.137 38.924 159 H2 A 14 H2 A 14 1.730 5.042 38.600 160 2H2* A 14 1H2' A 14 7.513 5.894 38.584 161 1H2* A 14 2H2' A 14 8.303 4.530 37.730 162 1H5* G 15 1H5' G 15 5.419 8.317 37.735 163 2H5* G 15 2H5' G 15 5.863 9.824 38.562 164 H4* G 15 H4' G 15 3.674 9.008 39.371 165 H3* G 15 H3' G 15 5.892 9.669 41.104 166 H1* G 15 H1' G 15 3.095 7.191 41.529 167 H8 G 15 H8 G 15 6.440 5.216 41.036 168 H1 G 15 H1 G 15 1.482 1.814 43.322 169 1H2 G 15 1H2 G 15 -0.303 3.153 43.481 170 2H2 G 15 2H2 G 15 -0.140 4.849 43.003 171 2H2* G 15 1H2' G 15 4.898 7.991 42.999 172 1H2* G 15 2H2' G 15 6.119 7.402 41.825 173 1H5* T 16 1H5' T 16 1.397 9.029 42.597 174 2H5* T 16 2H5' T 16 1.185 10.328 43.788 175 H4* T 16 H4' T 16 -0.227 8.398 44.379 176 H3* T 16 H3' T 16 1.772 9.542 46.190 177 1H2* T 16 2H2' T 16 2.855 7.480 46.484 178 2H2* T 16 1H2' T 16 1.503 7.187 47.622 179 H1* T 16 H1' T 16 0.233 6.062 45.861 180 H3 T 16 H3 T 16 2.412 2.181 46.784 181 1H5M T 16 1H5M T 16 6.148 5.031 44.467 182 2H5M T 16 2H5M T 16 5.972 3.354 43.926 183 3H5M T 16 3H5M T 16 5.224 4.659 42.997 184 H6 T 16 H6 T 16 3.553 6.154 44.320 185 1H5* G 17 1H5' G 17 -1.497 6.684 47.959 186 2H5* G 17 2H5' G 17 -1.928 7.362 49.542 187 H4* G 17 H4' G 17 -1.740 4.955 49.786 188 H3* G 17 H3' G 17 -0.041 6.764 51.311 189 H1* G 17 H1' G 17 0.413 3.210 50.164 190 H8 G 17 H8 G 17 3.385 5.362 48.909 191 H1 G 17 H1 G 17 3.453 -0.794 47.040 192 1H2 G 17 1H2 G 17 0.370 -0.820 48.612 193 2H2 G 17 2H2 G 17 1.565 -1.777 47.724 194 H3T G 17 H3T G 17 -1.656 5.322 52.121 195 2H2* G 17 1H2' G 17 1.689 4.663 51.681 196 1H2* G 17 2H2' G 17 1.941 5.845 50.357 197 1H5* C 1 1H5' C 1 6.939 -8.084 46.091 198 2H5* C 1 2H5' C 1 5.912 -8.695 44.783 199 H4* C 1 H4' C 1 4.594 -8.358 46.819 200 H3* C 1 H3' C 1 3.977 -6.577 44.446 201 H1* C 1 H1' C 1 3.744 -5.094 47.982 202 1H4 C 1 1H4 C 1 6.562 -0.957 43.740 203 2H4 C 1 2H4 C 1 5.259 -0.217 44.710 204 H5 C 1 H5 C 1 6.896 -3.442 43.985 205 H6 C 1 H6 C 1 6.071 -5.407 45.200 206 H5T C 1 H5T C 1 7.307 -7.037 44.091 207 2H2* C 1 1H2' C 1 2.338 -6.709 47.000 208 1H2* C 1 2H2' C 1 2.291 -5.441 45.732 209 1H5* A 2 1H5' A 2 0.417 -8.101 46.596 210 2H5* A 2 2H5' A 2 -0.825 -8.580 45.427 211 H4* A 2 H4' A 2 -1.676 -7.012 47.231 212 H3* A 2 H3' A 2 -2.360 -6.954 44.521 213 H1* A 2 H1' A 2 -1.505 -3.804 46.539 214 H8 A 2 H8 A 2 1.509 -4.960 44.328 215 1H6 A 2 1H6 A 2 3.116 1.046 44.780 216 2H6 A 2 2H6 A 2 3.638 -0.472 44.010 217 H2 A 2 H2 A 2 -0.388 0.535 47.115 218 2H2* A 2 1H2' A 2 -2.251 -4.257 44.288 219 1H2* A 2 2H2' A 2 -0.786 -5.235 43.958 220 1H5* C 3 1H5' C 3 -3.937 -3.218 46.877 221 2H5* C 3 2H5' C 3 -5.640 -3.057 46.403 222 H4* C 3 H4' C 3 -4.603 -0.834 46.609 223 H3* C 3 H3' C 3 -5.935 -1.753 44.184 224 H1* C 3 H1' C 3 -3.151 0.749 44.769 225 1H4 C 3 1H4 C 3 2.260 -0.999 41.412 226 2H4 C 3 2H4 C 3 1.842 0.726 41.227 227 H5 C 3 H5 C 3 0.660 -2.438 42.690 228 H6 C 3 H6 C 3 -1.471 -2.381 43.915 229 2H2* C 3 1H2' C 3 -4.550 0.206 42.836 230 1H2* C 3 2H2' C 3 -3.981 -1.493 42.881 231 1H5* T 4 1H5' T 4 -4.822 2.687 44.854 232 2H5* T 4 2H5' T 4 -6.198 3.679 44.328 233 H4* T 4 H4' T 4 -4.043 4.787 43.807 234 H3* T 4 H3' T 4 -6.115 4.256 41.805 235 1H2* T 4 2H2' T 4 -4.654 3.043 40.430 236 2H2* T 4 1H2' T 4 -4.127 4.686 39.937 237 H1* T 4 H1' T 4 -2.320 4.630 41.571 238 H3 T 4 H3 T 4 0.098 2.396 38.402 239 1H5M T 4 1H5M T 4 -1.265 -1.751 40.170 240 2H5M T 4 2H5M T 4 -1.812 -1.238 41.773 241 3H5M T 4 3H5M T 4 -2.968 -1.344 40.430 242 H6 T 4 H6 T 4 -3.079 1.081 41.770 243 1H5* A 5 1H5' A 5 -2.549 6.955 41.127 244 2H5* A 5 2H5' A 5 -3.105 8.478 40.401 245 H4* A 5 H4' A 5 -0.886 7.872 39.532 246 H3* A 5 H3' A 5 -3.254 8.178 37.762 247 H1* A 5 H1' A 5 0.106 6.321 37.520 248 H8 A 5 H8 A 5 -3.022 3.981 37.456 249 1H6 A 5 1H6 A 5 -0.698 0.149 35.228 250 2H6 A 5 2H6 A 5 0.997 0.088 34.684 251 H2 A 5 H2 A 5 3.100 3.666 35.458 252 2H2* A 5 1H2' A 5 -1.424 7.215 35.872 253 1H2* A 5 2H2' A 5 -2.773 6.273 36.573 254 1H5* C 6 1H5' C 6 1.170 9.312 36.626 255 2H5* C 6 2H5' C 6 1.106 10.673 35.485 256 H4* C 6 H4' C 6 2.974 9.124 34.941 257 H3* C 6 H3' C 6 0.783 9.734 33.012 258 H1* C 6 H1' C 6 3.277 6.817 33.504 259 1H4 C 6 1H4 C 6 -0.834 1.605 33.607 260 2H4 C 6 2H4 C 6 0.859 1.171 33.260 261 H5 C 6 H5 C 6 -1.382 4.024 33.884 262 H6 C 6 H6 C 6 -0.377 6.262 33.927 263 2H2* C 6 1H2' C 6 2.212 7.767 31.587 264 1H2* C 6 2H2' C 6 0.596 7.555 32.322 265 1H5* A 7 1H5' A 7 4.541 7.983 32.098 266 2H5* A 7 2H5' A 7 5.469 8.975 30.956 267 H4* A 7 H4' A 7 5.977 6.562 30.678 268 H3* A 7 H3' A 7 5.128 8.329 28.517 269 H1* A 7 H1' A 7 4.725 4.558 29.053 270 H8 A 7 H8 A 7 1.298 6.419 29.301 271 1H6 A 7 1H6 A 7 -0.943 0.733 28.018 272 2H6 A 7 2H6 A 7 -1.502 2.388 28.362 273 H2 A 7 H2 A 7 3.279 0.421 28.030 274 2H2* A 7 1H2' A 7 4.515 6.024 27.120 275 1H2* A 7 2H2' A 7 3.278 7.002 27.964 276 1H5* A 8 1H5' A 8 7.648 4.415 27.900 277 2H5* A 8 2H5' A 8 8.875 4.839 26.689 278 H4* A 8 H4' A 8 8.267 2.416 26.619 279 H3* A 8 H3' A 8 8.250 4.200 24.298 280 H1* A 8 H1' A 8 6.214 1.046 25.146 281 H8 A 8 H8 A 8 4.031 4.287 25.244 282 1H6 A 8 1H6 A 8 -0.568 0.271 23.960 283 2H6 A 8 2H6 A 8 -0.297 2.003 24.273 284 H2 A 8 H2 A 8 3.026 -1.970 24.095 285 2H2* A 8 1H2' A 8 6.714 2.225 23.094 286 1H2* A 8 2H2' A 8 6.019 3.731 23.761 287 1H5* A 9 1H5' A 9 8.255 -0.414 23.955 288 2H5* A 9 2H5' A 9 9.564 -0.795 22.818 289 H4* A 9 H4' A 9 7.739 -2.460 22.656 290 H3* A 9 H3' A 9 8.822 -1.002 20.392 291 H1* A 9 H1' A 9 5.327 -2.398 21.006 292 H8 A 9 H8 A 9 5.364 1.498 20.737 293 1H6 A 9 1H6 A 9 -0.832 0.777 20.717 294 2H6 A 9 2H6 A 9 0.409 2.048 20.578 295 H2 A 9 H2 A 9 0.849 -3.082 21.147 296 2H2* A 9 1H2' A 9 6.474 -1.493 19.057 297 1H2* A 9 2H2' A 9 6.761 0.053 19.914 298 1H5* G 10 1H5' G 10 6.583 -5.107 20.223 299 2H5* G 10 2H5' G 10 7.368 -6.052 18.942 300 H4* G 10 H4' G 10 4.989 -6.722 19.277 301 H3* G 10 H3' G 10 6.184 -6.175 16.734 302 H1* G 10 H1' G 10 2.633 -5.470 17.841 303 H8 G 10 H8 G 10 4.603 -2.121 17.382 304 H1 G 10 H1 G 10 -1.774 -1.525 17.931 305 1H2 G 10 1H2 G 10 -1.601 -4.958 18.347 306 2H2 G 10 2H2 G 10 -2.665 -3.546 18.279 307 2H2* G 10 1H2' G 10 3.831 -5.261 15.727 308 1H2* G 10 2H2' G 10 4.991 -4.116 16.471 309 1H5* A 11 1H5' A 11 1.899 -7.518 17.461 310 2H5* A 11 2H5' A 11 1.508 -8.828 16.330 311 H4* A 11 H4' A 11 -0.512 -7.528 16.988 312 H3* A 11 H3' A 11 0.222 -8.169 14.270 313 H1* A 11 H1' A 11 -1.617 -5.122 15.657 314 H8 A 11 H8 A 11 2.033 -4.168 14.683 315 1H6 A 11 1H6 A 11 -0.400 1.574 14.374 316 2H6 A 11 2H6 A 11 1.154 0.723 14.203 317 H2 A 11 H2 A 11 -3.577 -1.063 15.320 318 2H2* A 11 1H2' A 11 -1.192 -5.990 13.412 319 1H2* A 11 2H2' A 11 0.576 -5.896 13.689 320 1H5* G 12 1H5' G 12 -3.940 -6.399 15.471 321 2H5* G 12 2H5' G 12 -5.129 -7.385 14.594 322 H4* G 12 H4' G 12 -5.974 -5.084 14.896 323 H3* G 12 H3' G 12 -5.627 -6.334 12.240 324 H1* G 12 H1' G 12 -5.735 -2.726 13.520 325 H8 G 12 H8 G 12 -2.163 -3.673 12.272 326 H1 G 12 H1 G 12 -3.644 2.572 11.864 327 1H2 G 12 1H2 G 12 -5.768 2.857 12.513 328 2H2 G 12 2H2 G 12 -6.704 1.441 13.019 329 2H2* G 12 1H2' G 12 -6.120 -3.740 11.350 330 1H2* G 12 2H2' G 12 -4.498 -4.498 11.387 331 1H5* T 13 1H5' T 13 -8.679 -2.782 12.490 332 2H5* T 13 2H5' T 13 -10.012 -3.218 11.396 333 H4* T 13 H4' T 13 -9.367 -0.880 10.975 334 H3* T 13 H3' T 13 -8.694 -2.954 8.868 335 1H2* T 13 2H2' T 13 -7.211 -1.579 7.855 336 2H2* T 13 1H2' T 13 -8.361 -0.214 7.870 337 H1* T 13 H1' T 13 -7.511 0.608 9.876 338 H3 T 13 H3 T 13 -3.362 1.858 8.737 339 1H5M T 13 1H5M T 13 -1.768 -2.562 8.737 340 2H5M T 13 2H5M T 13 -2.844 -3.225 9.976 341 3H5M T 13 3H5M T 13 -3.243 -3.411 8.254 342 H6 T 13 H6 T 13 -5.416 -2.431 9.488 343 1H5* A 14 1H5' A 14 -10.680 1.144 7.924 344 2H5* A 14 2H5' A 14 -11.706 0.914 6.494 345 H4* A 14 H4' A 14 -10.491 3.024 6.258 346 H3* A 14 H3' A 14 -10.431 0.995 4.260 347 H1* A 14 H1' A 14 -7.740 3.382 5.203 348 H8 A 14 H8 A 14 -6.351 -0.167 5.927 349 1H6 A 14 1H6 A 14 -1.218 3.085 7.364 350 2H6 A 14 2H6 A 14 -1.778 1.406 7.175 351 H2 A 14 H2 A 14 -4.283 5.903 6.563 352 2H2* A 14 1H2' A 14 -7.876 1.555 3.548 353 1H2* A 14 2H2' A 14 -8.151 0.367 4.864 354 1H5* G 15 1H5' G 15 -10.238 5.576 5.311 355 2H5* G 15 2H5' G 15 -11.431 6.714 4.654 356 H4* G 15 H4' G 15 -9.278 7.846 4.656 357 H3* G 15 H3' G 15 -10.724 7.516 2.240 358 H1* G 15 H1' G 15 -6.951 7.301 2.623 359 H8 G 15 H8 G 15 -8.470 3.909 1.533 360 H1 G 15 H1 G 15 -2.106 3.818 2.450 361 1H2 G 15 1H2 G 15 -2.667 7.064 3.501 362 2H2 G 15 2H2 G 15 -1.456 5.803 3.232 363 2H2* G 15 1H2' G 15 -8.493 7.164 0.738 364 1H2* G 15 2H2' G 15 -9.296 5.737 1.468 365 1H5* T 16 1H5' T 16 -6.483 9.408 1.906 366 2H5* T 16 2H5' T 16 -6.661 10.822 0.846 367 H4* T 16 H4' T 16 -4.517 9.752 0.387 368 H3* T 16 H3' T 16 -6.648 9.826 -1.710 369 1H2* T 16 2H2' T 16 -6.121 7.711 -2.447 370 2H2* T 16 1H2' T 16 -4.580 8.408 -3.027 371 H1* T 16 H1' T 16 -3.478 7.819 -0.961 372 H3 T 16 H3 T 16 -2.563 3.494 -1.491 373 1H5M T 16 1H5M T 16 -7.648 3.715 -2.744 374 2H5M T 16 2H5M T 16 -7.092 2.288 -1.858 375 3H5M T 16 3H5M T 16 -7.852 3.620 -0.981 376 H6 T 16 H6 T 16 -6.692 5.971 -1.411 377 1H5* G 17 1H5' G 17 -2.173 9.807 -2.796 378 2H5* G 17 2H5' G 17 -1.966 10.936 -4.151 379 H4* G 17 H4' G 17 -0.595 8.954 -4.554 380 H3* G 17 H3' G 17 -2.643 9.833 -6.423 381 H1* G 17 H1' G 17 -1.174 6.441 -5.694 382 H8 G 17 H8 G 17 -5.027 6.346 -5.245 383 H1 G 17 H1 G 17 -1.976 0.805 -4.076 384 1H2 G 17 1H2 G 17 0.824 2.772 -4.586 385 2H2 G 17 2H2 G 17 0.227 1.150 -4.210 386 H3T G 17 H3T G 17 -0.368 8.155 -6.750 387 2H2* G 17 1H2' G 17 -2.687 7.282 -7.436 388 1H2* G 17 2H2' G 17 -3.862 7.798 -6.185 Start of MODEL 16 1 1H5* C 1 1H5' C 1 2.907 -6.459 -2.106 2 2H5* C 1 2H5' C 1 2.767 -6.645 -3.865 3 H4* C 1 H4' C 1 4.708 -5.131 -4.191 4 H3* C 1 H3' C 1 5.398 -5.605 -1.492 5 H1* C 1 H1' C 1 4.184 -2.342 -2.911 6 1H4 C 1 1H4 C 1 -1.618 -0.605 -0.239 7 2H4 C 1 2H4 C 1 -0.707 0.736 -0.986 8 H5 C 1 H5 C 1 -0.557 -2.882 -0.297 9 H6 C 1 H6 C 1 1.432 -4.089 -1.087 10 H5T C 1 H5T C 1 3.946 -8.336 -2.890 11 2H2* C 1 1H2' C 1 4.854 -3.090 -0.676 12 1H2* C 1 2H2' C 1 3.533 -4.303 -0.664 13 1H5* A 2 1H5' A 2 6.293 -1.309 -3.305 14 2H5* A 2 2H5' A 2 7.884 -0.857 -2.661 15 H4* A 2 H4' A 2 6.496 1.144 -2.756 16 H3* A 2 H3' A 2 7.665 0.180 -0.279 17 H1* A 2 H1' A 2 4.508 2.176 -0.927 18 H8 A 2 H8 A 2 3.646 -1.286 0.675 19 1H6 A 2 1H6 A 2 -2.032 1.282 1.070 20 2H6 A 2 2H6 A 2 -1.162 -0.209 1.504 21 H2 A 2 H2 A 2 0.466 4.102 -0.870 22 2H2* A 2 1H2' A 2 5.748 1.593 1.089 23 1H2* A 2 2H2' A 2 5.549 -0.152 0.736 24 1H5* C 3 1H5' C 3 6.102 4.679 -0.807 25 2H5* C 3 2H5' C 3 7.242 5.651 0.148 26 H4* C 3 H4' C 3 5.005 6.656 0.291 27 H3* C 3 H3' C 3 6.389 5.574 2.697 28 H1* C 3 H1' C 3 2.717 6.286 1.729 29 1H4 C 3 1H4 C 3 -0.198 0.460 3.003 30 2H4 C 3 2H4 C 3 -1.335 1.813 2.755 31 H5 C 3 H5 C 3 2.250 0.991 2.919 32 H6 C 3 H6 C 3 3.835 2.826 2.534 33 2H2* C 3 1H2' C 3 3.905 6.258 3.829 34 1H2* C 3 2H2' C 3 4.486 4.597 3.513 35 1H5* T 4 1H5' T 4 3.471 9.172 2.597 36 2H5* T 4 2H5' T 4 4.137 10.402 3.692 37 H4* T 4 H4' T 4 1.676 10.472 3.727 38 H3* T 4 H3' T 4 3.311 10.083 6.123 39 1H2* T 4 2H2' T 4 2.265 8.080 6.706 40 2H2* T 4 1H2' T 4 0.991 9.183 7.321 41 H1* T 4 H1' T 4 -0.262 8.945 5.256 42 H3 T 4 H3 T 4 -2.083 4.996 6.548 43 1H5M T 4 1H5M T 4 2.317 3.687 4.005 44 2H5M T 4 2H5M T 4 3.022 3.833 5.628 45 3H5M T 4 3H5M T 4 1.787 2.610 5.306 46 H6 T 4 H6 T 4 2.250 6.284 4.894 47 1H5* A 5 1H5' A 5 -1.141 10.968 6.430 48 2H5* A 5 2H5' A 5 -1.250 12.387 7.487 49 H4* A 5 H4' A 5 -3.205 11.031 7.872 50 H3* A 5 H3' A 5 -1.319 11.617 10.009 51 H1* A 5 H1' A 5 -3.641 8.633 9.498 52 H8 A 5 H8 A 5 0.106 7.588 9.118 53 1H6 A 5 1H6 A 5 -2.294 1.901 10.090 54 2H6 A 5 2H6 A 5 -0.734 2.698 9.770 55 H2 A 5 H2 A 5 -5.510 4.649 10.262 56 2H2* A 5 1H2' A 5 -2.322 9.446 11.373 57 1H2* A 5 2H2' A 5 -0.826 9.351 10.398 58 1H5* C 6 1H5' C 6 -5.784 10.284 10.652 59 2H5* C 6 2H5' C 6 -6.380 11.229 12.033 60 H4* C 6 H4' C 6 -7.510 9.026 11.915 61 H3* C 6 H3' C 6 -6.053 9.979 14.277 62 H1* C 6 H1' C 6 -6.829 6.474 12.930 63 1H4 C 6 1H4 C 6 -2.017 2.574 13.458 64 2H4 C 6 2H4 C 6 -0.856 3.610 12.590 65 H5 C 6 H5 C 6 -1.547 5.903 11.948 66 H6 C 6 H6 C 6 -3.446 7.439 11.952 67 2H2* C 6 1H2' C 6 -6.143 7.341 15.100 68 1H2* C 6 2H2' C 6 -4.690 8.085 14.368 69 1H5* T 7 1H5' T 7 -8.888 6.366 14.522 70 2H5* T 7 2H5' T 7 -9.892 6.563 15.974 71 H4* T 7 H4' T 7 -9.287 4.193 15.658 72 H3* T 7 H3' T 7 -8.585 5.704 18.105 73 1H2* T 7 2H2' T 7 -6.385 4.991 18.074 74 2H2* T 7 1H2' T 7 -7.060 3.434 18.635 75 H1* T 7 H1' T 7 -7.126 2.601 16.361 76 H3 T 7 H3 T 7 -2.840 1.482 15.660 77 1H5M T 7 1H5M T 7 -2.553 6.597 16.991 78 2H5M T 7 2H5M T 7 -1.392 5.961 15.815 79 3H5M T 7 3H5M T 7 -2.879 6.736 15.250 80 H6 T 7 H6 T 7 -5.048 5.682 16.471 81 1H5* C 8 1H5' C 8 -9.871 1.107 17.942 82 2H5* C 8 2H5' C 8 -10.555 0.716 19.534 83 H4* C 8 H4' C 8 -9.356 -1.250 18.600 84 H3* C 8 H3' C 8 -8.051 0.125 20.993 85 H1* C 8 H1' C 8 -6.396 -1.947 18.154 86 1H4 C 8 1H4 C 8 -1.123 1.011 19.223 87 2H4 C 8 2H4 C 8 -1.860 2.594 19.548 88 H5 C 8 H5 C 8 -4.327 2.793 19.573 89 H6 C 8 H6 C 8 -6.393 1.501 19.335 90 2H2* C 8 1H2' C 8 -7.470 -2.692 20.041 91 1H2* C 8 2H2' C 8 -6.404 -1.589 20.961 92 1H5* T 9 1H5' T 9 -8.515 -3.878 20.414 93 2H5* T 9 2H5' T 9 -9.196 -4.830 21.750 94 H4* T 9 H4' T 9 -7.335 -6.026 20.569 95 H3* T 9 H3' T 9 -7.656 -5.880 23.367 96 1H2* T 9 2H2' T 9 -6.000 -4.155 23.624 97 2H2* T 9 1H2' T 9 -5.007 -5.627 23.872 98 H1* T 9 H1' T 9 -4.325 -5.610 21.540 99 H3 T 9 H3 T 9 -1.026 -2.569 21.648 100 1H5M T 9 1H5M T 9 -5.385 0.323 22.310 101 2H5M T 9 2H5M T 9 -5.050 -0.090 24.006 102 3H5M T 9 3H5M T 9 -3.889 0.873 23.081 103 H6 T 9 H6 T 9 -5.728 -2.342 22.651 104 1H5* T 10 1H5' T 10 -3.843 -7.719 21.610 105 2H5* T 10 2H5' T 10 -3.497 -9.237 22.464 106 H4* T 10 H4' T 10 -1.391 -8.102 21.883 107 H3* T 10 H3' T 10 -2.089 -8.886 24.589 108 1H2* T 10 2H2' T 10 -2.069 -6.649 25.370 109 2H2* T 10 1H2' T 10 -0.319 -7.001 25.513 110 H1* T 10 H1' T 10 0.079 -6.064 23.289 111 H3 T 10 H3 T 10 0.514 -1.858 24.831 112 1H5M T 10 1H5M T 10 -4.119 -1.386 25.505 113 2H5M T 10 2H5M T 10 -4.666 -2.450 24.201 114 3H5M T 10 3H5M T 10 -4.550 -3.064 25.864 115 H6 T 10 H6 T 10 -3.251 -4.812 24.307 116 1H5* T 11 1H5' T 11 2.272 -7.488 23.467 117 2H5* T 11 2H5' T 11 3.280 -8.775 24.160 118 H4* T 11 H4' T 11 4.518 -6.673 24.262 119 H3* T 11 H3' T 11 4.010 -8.299 26.576 120 1H2* T 11 2H2' T 11 2.526 -6.684 27.528 121 2H2* T 11 1H2' T 11 4.091 -6.125 28.202 122 H1* T 11 H1' T 11 4.353 -4.548 26.345 123 H3 T 11 H3 T 11 2.004 -1.307 28.424 124 1H5M T 11 1H5M T 11 -1.620 -5.039 27.451 125 2H5M T 11 2H5M T 11 -2.111 -3.340 27.390 126 3H5M T 11 3H5M T 11 -1.629 -4.169 25.903 127 H6 T 11 H6 T 11 0.772 -5.430 26.264 128 1H5* G 12 1H5' G 12 7.086 -4.652 26.432 129 2H5* G 12 2H5' G 12 8.478 -5.429 27.207 130 H4* G 12 H4' G 12 8.662 -3.011 27.506 131 H3* G 12 H3' G 12 8.758 -4.846 29.690 132 H1* G 12 H1' G 12 7.342 -1.363 29.671 133 H8 G 12 H8 G 12 4.335 -3.867 29.705 134 H1 G 12 H1 G 12 2.907 2.232 31.154 135 1H2 G 12 1H2 G 12 6.312 2.654 30.715 136 2H2 G 12 2H2 G 12 4.782 3.445 31.119 137 2H2* G 12 1H2' G 12 7.608 -3.091 31.392 138 1H2* G 12 2H2' G 12 6.564 -4.207 30.455 139 1H5* T 13 1H5' T 13 9.451 -0.182 30.095 140 2H5* T 13 2H5' T 13 11.014 -0.185 30.935 141 H4* T 13 H4' T 13 9.848 1.923 31.374 142 H3* T 13 H3' T 13 10.900 0.217 33.411 143 1H2* T 13 2H2' T 13 8.743 -0.444 34.171 144 2H2* T 13 1H2' T 13 9.002 1.007 35.194 145 H1* T 13 H1' T 13 7.764 2.384 33.595 146 H3 T 13 H3 T 13 3.748 1.338 35.353 147 1H5M T 13 1H5M T 13 4.782 -2.580 31.980 148 2H5M T 13 2H5M T 13 5.518 -3.266 33.444 149 3H5M T 13 3H5M T 13 3.777 -2.945 33.391 150 H6 T 13 H6 T 13 6.946 -1.103 32.716 151 1H5* A 14 1H5' A 14 9.198 4.495 34.825 152 2H5* A 14 2H5' A 14 10.502 5.027 35.907 153 H4* A 14 H4' A 14 8.407 5.821 36.837 154 H3* A 14 H3' A 14 10.212 4.204 38.336 155 H1* A 14 H1' A 14 6.515 4.325 38.536 156 H8 A 14 H8 A 14 7.352 0.686 37.500 157 1H6 A 14 1H6 A 14 1.182 0.056 38.238 158 2H6 A 14 2H6 A 14 2.643 -0.920 37.954 159 H2 A 14 H2 A 14 2.063 4.193 38.603 160 2H2* A 14 1H2' A 14 8.225 2.962 39.697 161 1H2* A 14 2H2' A 14 8.742 2.261 38.129 162 1H5* G 15 1H5' G 15 6.898 7.541 38.195 163 2H5* G 15 2H5' G 15 7.265 9.182 38.762 164 H4* G 15 H4' G 15 4.996 8.763 39.450 165 H3* G 15 H3' G 15 7.006 9.104 41.483 166 H1* G 15 H1' G 15 3.867 7.017 41.528 167 H8 G 15 H8 G 15 6.991 4.683 41.711 168 H1 G 15 H1 G 15 1.306 1.744 42.348 169 1H2 G 15 1H2 G 15 -0.325 3.254 42.097 170 2H2 G 15 2H2 G 15 0.115 4.941 41.784 171 2H2* G 15 1H2' G 15 5.587 7.553 43.206 172 1H2* G 15 2H2' G 15 6.843 6.811 42.165 173 1H5* T 16 1H5' T 16 2.186 9.505 42.484 174 2H5* T 16 2H5' T 16 2.209 10.596 43.886 175 H4* T 16 H4' T 16 0.334 9.061 44.162 176 H3* T 16 H3' T 16 2.727 8.390 45.941 177 1H2* T 16 2H2' T 16 1.257 6.817 47.014 178 2H2* T 16 1H2' T 16 -0.190 7.603 46.318 179 H1* T 16 H1' T 16 -0.014 6.025 44.640 180 H3 T 16 H3 T 16 2.099 2.225 45.709 181 1H5M T 16 1H5M T 16 6.332 4.176 45.055 182 2H5M T 16 2H5M T 16 5.889 5.578 44.073 183 3H5M T 16 3H5M T 16 5.999 5.727 45.841 184 H6 T 16 H6 T 16 3.599 6.707 44.795 185 1H5* G 17 1H5' G 17 -0.706 8.032 47.686 186 2H5* G 17 2H5' G 17 -0.859 8.779 49.290 187 H4* G 17 H4' G 17 -1.549 6.412 49.398 188 H3* G 17 H3' G 17 0.383 7.568 51.154 189 H1* G 17 H1' G 17 0.286 4.050 49.803 190 H8 G 17 H8 G 17 3.497 5.850 48.559 191 H1 G 17 H1 G 17 2.893 -0.268 46.671 192 1H2 G 17 1H2 G 17 -0.168 0.022 48.251 193 2H2 G 17 2H2 G 17 0.921 -1.049 47.359 194 H3T G 17 H3T G 17 -0.843 5.002 51.246 195 2H2* G 17 1H2' G 17 1.754 5.230 51.371 196 1H2* G 17 2H2' G 17 2.209 6.404 50.093 197 1H5* C 1 1H5' C 1 5.957 -7.054 44.972 198 2H5* C 1 2H5' C 1 6.160 -7.713 46.605 199 H4* C 1 H4' C 1 3.690 -7.587 46.961 200 H3* C 1 H3' C 1 3.703 -6.414 44.152 201 H1* C 1 H1' C 1 2.969 -4.382 47.372 202 1H4 C 1 1H4 C 1 4.921 0.372 44.091 203 2H4 C 1 2H4 C 1 6.305 -0.446 43.320 204 H5 C 1 H5 C 1 6.585 -2.901 43.714 205 H6 C 1 H6 C 1 5.605 -4.809 44.894 206 H5T C 1 H5T C 1 4.845 -9.467 45.974 207 2H2* C 1 1H2' C 1 1.610 -5.893 46.285 208 1H2* C 1 2H2' C 1 1.971 -4.901 44.842 209 1H5* A 2 1H5' A 2 -0.205 -7.557 46.191 210 2H5* A 2 2H5' A 2 -1.358 -8.120 44.969 211 H4* A 2 H4' A 2 -2.378 -6.477 46.578 212 H3* A 2 H3' A 2 -2.775 -6.516 43.806 213 H1* A 2 H1' A 2 -2.183 -3.316 45.805 214 H8 A 2 H8 A 2 1.170 -4.447 44.140 215 1H6 A 2 1H6 A 2 2.520 1.626 44.620 216 2H6 A 2 2H6 A 2 3.229 0.094 44.054 217 H2 A 2 H2 A 2 -1.383 1.105 46.187 218 2H2* A 2 1H2' A 2 -2.643 -3.833 43.489 219 1H2* A 2 2H2' A 2 -1.141 -4.805 43.370 220 1H5* C 3 1H5' C 3 -4.472 -2.786 45.980 221 2H5* C 3 2H5' C 3 -6.148 -2.598 45.428 222 H4* C 3 H4' C 3 -5.070 -0.391 45.738 223 H3* C 3 H3' C 3 -6.366 -1.238 43.267 224 H1* C 3 H1' C 3 -3.518 1.197 43.933 225 1H4 C 3 1H4 C 3 1.762 -0.832 40.481 226 2H4 C 3 2H4 C 3 1.492 0.929 40.392 227 H5 C 3 H5 C 3 0.055 -2.198 41.709 228 H6 C 3 H6 C 3 -2.056 -2.023 42.954 229 2H2* C 3 1H2' C 3 -4.926 0.729 41.992 230 1H2* C 3 2H2' C 3 -4.403 -0.984 42.003 231 1H5* T 4 1H5' T 4 -5.117 3.065 44.075 232 2H5* T 4 2H5' T 4 -6.405 4.174 43.560 233 H4* T 4 H4' T 4 -4.164 5.141 43.124 234 H3* T 4 H3' T 4 -6.227 4.842 41.070 235 1H2* T 4 2H2' T 4 -4.852 3.531 39.696 236 2H2* T 4 1H2' T 4 -4.189 5.134 39.236 237 H1* T 4 H1' T 4 -2.409 4.901 40.886 238 H3 T 4 H3 T 4 -0.171 2.527 37.677 239 1H5M T 4 1H5M T 4 -3.603 -0.954 39.643 240 2H5M T 4 2H5M T 4 -1.962 -1.515 39.282 241 3H5M T 4 3H5M T 4 -2.375 -1.009 40.926 242 H6 T 4 H6 T 4 -3.465 1.423 41.010 243 1H5* A 5 1H5' A 5 -2.421 7.234 40.531 244 2H5* A 5 2H5' A 5 -2.807 8.794 39.775 245 H4* A 5 H4' A 5 -0.635 7.987 38.974 246 H3* A 5 H3' A 5 -2.935 8.387 37.111 247 H1* A 5 H1' A 5 0.336 6.346 37.082 248 H8 A 5 H8 A 5 -2.945 4.243 36.819 249 1H6 A 5 1H6 A 5 -0.758 0.215 34.805 250 2H6 A 5 2H6 A 5 0.960 0.028 34.372 251 H2 A 5 H2 A 5 3.255 3.465 35.226 252 2H2* A 5 1H2' A 5 -0.990 7.364 35.345 253 1H2* A 5 2H2' A 5 -2.452 6.505 35.914 254 1H5* C 6 1H5' C 6 1.543 9.263 36.184 255 2H5* C 6 2H5' C 6 1.639 10.616 35.036 256 H4* C 6 H4' C 6 3.393 8.927 34.558 257 H3* C 6 H3' C 6 1.271 9.610 32.561 258 H1* C 6 H1' C 6 3.617 6.601 33.214 259 1H4 C 6 1H4 C 6 -0.749 1.606 33.120 260 2H4 C 6 2H4 C 6 0.943 1.081 32.924 261 H5 C 6 H5 C 6 -1.197 4.056 33.290 262 H6 C 6 H6 C 6 -0.086 6.244 33.361 263 2H2* C 6 1H2' C 6 2.740 7.584 31.229 264 1H2* C 6 2H2' C 6 1.066 7.449 31.842 265 1H5* A 7 1H5' A 7 5.032 7.789 31.653 266 2H5* A 7 2H5' A 7 5.953 8.758 30.486 267 H4* A 7 H4' A 7 6.388 6.346 30.160 268 H3* A 7 H3' A 7 5.422 8.127 28.047 269 H1* A 7 H1' A 7 5.066 4.355 28.632 270 H8 A 7 H8 A 7 1.650 6.218 28.984 271 1H6 A 7 1H6 A 7 -1.180 2.154 28.236 272 2H6 A 7 2H6 A 7 -0.615 0.500 27.895 273 H2 A 7 H2 A 7 3.593 0.206 27.727 274 2H2* A 7 1H2' A 7 4.794 5.791 26.691 275 1H2* A 7 2H2' A 7 3.579 6.777 27.556 276 1H5* A 8 1H5' A 8 7.870 4.197 27.287 277 2H5* A 8 2H5' A 8 9.055 4.643 26.041 278 H4* A 8 H4' A 8 8.441 2.232 25.917 279 H3* A 8 H3' A 8 8.278 4.095 23.656 280 H1* A 8 H1' A 8 6.349 0.879 24.528 281 H8 A 8 H8 A 8 4.116 4.070 24.834 282 1H6 A 8 1H6 A 8 -0.458 0.017 23.573 283 2H6 A 8 2H6 A 8 -0.207 1.740 23.943 284 H2 A 8 H2 A 8 3.178 -2.157 23.479 285 2H2* A 8 1H2' A 8 6.733 2.103 22.478 286 1H2* A 8 2H2' A 8 6.041 3.583 23.205 287 1H5* A 9 1H5' A 9 8.324 -0.502 23.140 288 2H5* A 9 2H5' A 9 9.591 -0.814 21.936 289 H4* A 9 H4' A 9 7.789 -2.491 21.742 290 H3* A 9 H3' A 9 8.669 -0.789 19.523 291 H1* A 9 H1' A 9 5.327 -2.492 20.306 292 H8 A 9 H8 A 9 5.143 1.406 20.127 293 1H6 A 9 1H6 A 9 -0.999 0.356 20.435 294 2H6 A 9 2H6 A 9 0.161 1.695 20.259 295 H2 A 9 H2 A 9 0.901 -3.415 20.672 296 2H2* A 9 1H2' A 9 6.300 -1.533 18.300 297 1H2* A 9 2H2' A 9 6.518 0.039 19.127 298 1H5* G 10 1H5' G 10 6.542 -4.891 19.149 299 2H5* G 10 2H5' G 10 7.299 -5.759 17.798 300 H4* G 10 H4' G 10 4.916 -6.393 18.063 301 H3* G 10 H3' G 10 6.102 -5.538 15.566 302 H1* G 10 H1' G 10 2.563 -5.130 16.857 303 H8 G 10 H8 G 10 4.279 -1.664 16.319 304 H1 G 10 H1 G 10 -1.953 -1.440 17.890 305 1H2 G 10 1H2 G 10 -1.550 -4.870 18.116 306 2H2 G 10 2H2 G 10 -2.679 -3.518 18.274 307 2H2* G 10 1H2' G 10 3.639 -4.720 14.707 308 1H2* G 10 2H2' G 10 4.777 -3.567 15.470 309 1H5* A 11 1H5' A 11 1.984 -7.375 16.222 310 2H5* A 11 2H5' A 11 1.682 -8.586 14.960 311 H4* A 11 H4' A 11 -0.427 -7.574 15.833 312 H3* A 11 H3' A 11 0.245 -7.834 13.028 313 H1* A 11 H1' A 11 -1.845 -5.201 14.851 314 H8 A 11 H8 A 11 1.571 -3.741 13.671 315 1H6 A 11 1H6 A 11 -1.441 1.693 14.315 316 2H6 A 11 2H6 A 11 0.157 1.048 13.868 317 H2 A 11 H2 A 11 -4.195 -1.370 15.298 318 2H2* A 11 1H2' A 11 -1.484 -5.773 12.503 319 1H2* A 11 2H2' A 11 0.276 -5.494 12.684 320 1H5* G 12 1H5' G 12 -4.001 -6.770 14.629 321 2H5* G 12 2H5' G 12 -5.145 -7.756 13.695 322 H4* G 12 H4' G 12 -6.163 -5.601 14.389 323 H3* G 12 H3' G 12 -6.045 -6.522 11.601 324 H1* G 12 H1' G 12 -6.249 -3.075 13.228 325 H8 G 12 H8 G 12 -2.806 -3.605 11.457 326 H1 G 12 H1 G 12 -4.656 2.517 12.107 327 1H2 G 12 1H2 G 12 -7.411 1.056 13.600 328 2H2 G 12 2H2 G 12 -6.634 2.576 13.135 329 2H2* G 12 1H2' G 12 -6.691 -3.904 10.981 330 1H2* G 12 2H2' G 12 -5.026 -4.553 10.868 331 1H5* T 13 1H5' T 13 -8.907 -3.059 12.669 332 2H5* T 13 2H5' T 13 -10.404 -3.273 11.735 333 H4* T 13 H4' T 13 -9.694 -0.909 11.656 334 H3* T 13 H3' T 13 -9.541 -2.550 9.111 335 1H2* T 13 2H2' T 13 -8.177 -1.038 8.118 336 2H2* T 13 1H2' T 13 -9.225 0.323 8.607 337 H1* T 13 H1' T 13 -7.981 0.714 10.533 338 H3 T 13 H3 T 13 -4.036 2.054 8.866 339 1H5M T 13 1H5M T 13 -3.599 -3.187 9.357 340 2H5M T 13 2H5M T 13 -4.157 -3.085 7.673 341 3H5M T 13 3H5M T 13 -2.606 -2.371 8.140 342 H6 T 13 H6 T 13 -6.125 -2.257 9.354 343 1H5* A 14 1H5' A 14 -11.232 1.604 9.681 344 2H5* A 14 2H5' A 14 -12.673 1.822 8.668 345 H4* A 14 H4' A 14 -11.351 3.912 8.771 346 H3* A 14 H3' A 14 -12.250 2.700 6.340 347 H1* A 14 H1' A 14 -9.048 4.630 6.951 348 H8 A 14 H8 A 14 -8.292 0.866 6.235 349 1H6 A 14 1H6 A 14 -2.422 2.934 5.853 350 2H6 A 14 2H6 A 14 -3.381 1.447 5.649 351 H2 A 14 H2 A 14 -4.827 6.252 6.953 352 2H2* A 14 1H2' A 14 -10.110 3.679 4.972 353 1H2* A 14 2H2' A 14 -10.043 2.040 5.694 354 1H5* G 15 1H5' G 15 -10.069 6.957 6.071 355 2H5* G 15 2H5' G 15 -11.135 7.847 4.965 356 H4* G 15 H4' G 15 -8.842 8.557 4.556 357 H3* G 15 H3' G 15 -10.492 7.363 2.470 358 H1* G 15 H1' G 15 -6.750 7.493 2.979 359 H8 G 15 H8 G 15 -8.004 3.806 3.345 360 H1 G 15 H1 G 15 -1.694 4.513 2.322 361 1H2 G 15 1H2 G 15 -1.220 6.691 2.176 362 2H2 G 15 2H2 G 15 -2.537 7.863 2.336 363 2H2* G 15 1H2' G 15 -8.175 6.804 1.110 364 1H2* G 15 2H2' G 15 -8.964 5.576 2.151 365 1H5* T 16 1H5' T 16 -6.416 9.410 1.451 366 2H5* T 16 2H5' T 16 -6.799 10.464 0.074 367 H4* T 16 H4' T 16 -4.549 9.611 -0.229 368 H3* T 16 H3' T 16 -6.713 8.853 -2.134 369 1H2* T 16 2H2' T 16 -5.982 6.661 -2.218 370 2H2* T 16 1H2' T 16 -4.599 7.306 -3.154 371 H1* T 16 H1' T 16 -3.284 7.528 -1.123 372 H3 T 16 H3 T 16 -1.913 3.263 -1.387 373 1H5M T 16 1H5M T 16 -6.171 2.975 1.615 374 2H5M T 16 2H5M T 16 -7.037 2.924 0.063 375 3H5M T 16 3H5M T 16 -5.907 1.635 0.491 376 H6 T 16 H6 T 16 -6.010 5.339 0.063 377 1H5* G 17 1H5' G 17 -2.297 8.928 -3.466 378 2H5* G 17 2H5' G 17 -2.277 9.685 -5.072 379 H4* G 17 H4' G 17 -0.703 7.821 -5.062 380 H3* G 17 H3' G 17 -2.919 7.965 -6.942 381 H1* G 17 H1' G 17 -1.001 5.077 -5.499 382 H8 G 17 H8 G 17 -4.781 4.545 -4.835 383 H1 G 17 H1 G 17 -0.884 0.030 -2.423 384 1H2 G 17 1H2 G 17 1.563 2.226 -3.504 385 2H2 G 17 2H2 G 17 1.237 0.678 -2.711 386 H3T G 17 H3T G 17 -1.374 6.875 -8.241 387 2H2* G 17 1H2' G 17 -2.695 5.251 -7.275 388 1H2* G 17 2H2' G 17 -3.866 5.939 -6.105 Start of MODEL 17 1 1H5* C 1 1H5' C 1 2.592 -6.943 -1.594 2 2H5* C 1 2H5' C 1 2.501 -7.386 -3.309 3 H4* C 1 H4' C 1 4.427 -5.903 -3.808 4 H3* C 1 H3' C 1 5.050 -5.965 -1.052 5 H1* C 1 H1' C 1 3.809 -2.951 -2.965 6 1H4 C 1 1H4 C 1 -2.103 -1.099 -0.610 7 2H4 C 1 2H4 C 1 -1.164 0.211 -1.377 8 H5 C 1 H5 C 1 -1.025 -3.366 -0.501 9 H6 C 1 H6 C 1 1.010 -4.592 -1.126 10 H5T C 1 H5T C 1 4.629 -8.203 -3.121 11 2H2* C 1 1H2' C 1 4.471 -3.356 -0.645 12 1H2* C 1 2H2' C 1 3.167 -4.572 -0.463 13 1H5* A 2 1H5' A 2 5.969 -1.902 -3.292 14 2H5* A 2 2H5' A 2 7.575 -1.419 -2.707 15 H4* A 2 H4' A 2 6.197 0.578 -2.964 16 H3* A 2 H3' A 2 7.371 -0.182 -0.398 17 H1* A 2 H1' A 2 4.281 1.835 -1.299 18 H8 A 2 H8 A 2 3.270 -1.466 0.558 19 1H6 A 2 1H6 A 2 -1.436 -0.013 1.477 20 2H6 A 2 2H6 A 2 -2.197 1.524 0.994 21 H2 A 2 H2 A 2 0.436 4.082 -1.091 22 2H2* A 2 1H2' A 2 5.534 1.517 0.764 23 1H2* A 2 2H2' A 2 5.274 -0.253 0.677 24 1H5* C 3 1H5' C 3 5.930 4.263 -1.367 25 2H5* C 3 2H5' C 3 7.138 5.300 -0.578 26 H4* C 3 H4' C 3 4.932 6.371 -0.446 27 H3* C 3 H3' C 3 6.439 5.578 1.985 28 H1* C 3 H1' C 3 2.724 6.202 1.178 29 1H4 C 3 1H4 C 3 -0.222 0.614 3.224 30 2H4 C 3 2H4 C 3 -1.349 1.960 2.904 31 H5 C 3 H5 C 3 2.219 1.056 2.894 32 H6 C 3 H6 C 3 3.815 2.801 2.234 33 2H2* C 3 1H2' C 3 4.032 6.316 3.212 34 1H2* C 3 2H2' C 3 4.594 4.634 2.979 35 1H5* T 4 1H5' T 4 3.479 9.197 1.725 36 2H5* T 4 2H5' T 4 4.184 10.490 2.716 37 H4* T 4 H4' T 4 1.730 10.548 2.862 38 H3* T 4 H3' T 4 3.465 10.313 5.202 39 1H2* T 4 2H2' T 4 2.482 8.315 5.923 40 2H2* T 4 1H2' T 4 1.227 9.431 6.553 41 H1* T 4 H1' T 4 -0.121 9.098 4.559 42 H3 T 4 H3 T 4 -1.914 5.226 6.055 43 1H5M T 4 1H5M T 4 2.439 3.736 3.568 44 2H5M T 4 2H5M T 4 3.203 4.059 5.138 45 3H5M T 4 3H5M T 4 1.980 2.791 4.995 46 H6 T 4 H6 T 4 2.403 6.422 4.296 47 1H5* A 5 1H5' A 5 -0.995 11.128 5.656 48 2H5* A 5 2H5' A 5 -1.117 12.559 6.695 49 H4* A 5 H4' A 5 -2.995 11.114 7.170 50 H3* A 5 H3' A 5 -1.056 11.840 9.227 51 H1* A 5 H1' A 5 -3.292 8.759 8.851 52 H8 A 5 H8 A 5 0.492 7.868 8.457 53 1H6 A 5 1H6 A 5 -0.115 2.958 9.279 54 2H6 A 5 2H6 A 5 -1.639 2.117 9.657 55 H2 A 5 H2 A 5 -4.962 4.715 9.800 56 2H2* A 5 1H2' A 5 -1.997 9.692 10.684 57 1H2* A 5 2H2' A 5 -0.503 9.614 9.706 58 1H5* C 6 1H5' C 6 -5.453 10.438 9.960 59 2H5* C 6 2H5' C 6 -6.078 11.403 11.314 60 H4* C 6 H4' C 6 -7.149 9.164 11.241 61 H3* C 6 H3' C 6 -5.721 10.211 13.590 62 H1* C 6 H1' C 6 -6.424 6.658 12.306 63 1H4 C 6 1H4 C 6 -1.509 2.905 13.014 64 2H4 C 6 2H4 C 6 -0.381 3.938 12.103 65 H5 C 6 H5 C 6 -1.127 6.185 11.381 66 H6 C 6 H6 C 6 -3.063 7.674 11.331 67 2H2* C 6 1H2' C 6 -5.823 7.583 14.471 68 1H2* C 6 2H2' C 6 -4.357 8.333 13.773 69 1H5* T 7 1H5' T 7 -8.539 6.593 13.882 70 2H5* T 7 2H5' T 7 -9.567 6.823 15.311 71 H4* T 7 H4' T 7 -8.962 4.447 15.064 72 H3* T 7 H3' T 7 -8.303 6.015 17.482 73 1H2* T 7 2H2' T 7 -6.090 5.329 17.486 74 2H2* T 7 1H2' T 7 -6.755 3.786 18.096 75 H1* T 7 H1' T 7 -6.802 2.876 15.849 76 H3 T 7 H3 T 7 -2.499 1.762 15.222 77 1H5M T 7 1H5M T 7 -1.086 6.253 15.226 78 2H5M T 7 2H5M T 7 -2.585 7.012 14.671 79 3H5M T 7 3H5M T 7 -2.232 6.902 16.408 80 H6 T 7 H6 T 7 -4.741 5.969 15.886 81 1H5* C 8 1H5' C 8 -9.711 1.413 17.495 82 2H5* C 8 2H5' C 8 -10.428 1.150 19.099 83 H4* C 8 H4' C 8 -9.317 -0.924 18.280 84 H3* C 8 H3' C 8 -8.000 0.501 20.636 85 H1* C 8 H1' C 8 -6.344 -1.758 17.945 86 1H4 C 8 1H4 C 8 -1.041 1.116 19.124 87 2H4 C 8 2H4 C 8 -1.751 2.731 19.321 88 H5 C 8 H5 C 8 -4.205 2.996 19.195 89 H6 C 8 H6 C 8 -6.294 1.748 18.930 90 2H2* C 8 1H2' C 8 -7.520 -2.377 19.820 91 1H2* C 8 2H2' C 8 -6.432 -1.283 20.724 92 1H5* T 9 1H5' T 9 -8.667 -3.497 20.190 93 2H5* T 9 2H5' T 9 -9.400 -4.382 21.543 94 H4* T 9 H4' T 9 -7.581 -5.679 20.382 95 H3* T 9 H3' T 9 -7.947 -5.523 23.168 96 1H2* T 9 2H2' T 9 -6.237 -3.856 23.458 97 2H2* T 9 1H2' T 9 -5.305 -5.361 23.734 98 H1* T 9 H1' T 9 -4.563 -5.378 21.421 99 H3 T 9 H3 T 9 -1.176 -2.433 21.584 100 1H5M T 9 1H5M T 9 -5.177 0.096 23.958 101 2H5M T 9 2H5M T 9 -3.931 1.044 23.135 102 3H5M T 9 3H5M T 9 -5.411 0.604 22.271 103 H6 T 9 H6 T 9 -5.876 -2.082 22.558 104 1H5* T 10 1H5' T 10 -4.173 -7.504 21.460 105 2H5* T 10 2H5' T 10 -3.870 -9.021 22.333 106 H4* T 10 H4' T 10 -1.736 -7.937 21.741 107 H3* T 10 H3' T 10 -2.440 -8.723 24.435 108 1H2* T 10 2H2' T 10 -2.433 -6.481 25.220 109 2H2* T 10 1H2' T 10 -0.691 -6.848 25.400 110 H1* T 10 H1' T 10 -0.235 -5.910 23.187 111 H3 T 10 H3 T 10 0.218 -1.731 24.807 112 1H5M T 10 1H5M T 10 -4.423 -1.213 25.385 113 2H5M T 10 2H5M T 10 -4.934 -2.192 24.001 114 3H5M T 10 3H5M T 10 -4.907 -2.896 25.633 115 H6 T 10 H6 T 10 -3.572 -4.618 24.121 116 1H5* T 11 1H5' T 11 1.865 -7.293 23.295 117 2H5* T 11 2H5' T 11 2.924 -8.547 23.972 118 H4* T 11 H4' T 11 4.089 -6.386 23.999 119 H3* T 11 H3' T 11 3.776 -8.047 26.320 120 1H2* T 11 2H2' T 11 2.274 -6.506 27.365 121 2H2* T 11 1H2' T 11 3.848 -5.887 27.963 122 H1* T 11 H1' T 11 3.944 -4.282 26.116 123 H3 T 11 H3 T 11 1.578 -1.230 28.459 124 1H5M T 11 1H5M T 11 -2.507 -3.300 27.392 125 2H5M T 11 2H5M T 11 -2.039 -3.996 25.833 126 3H5M T 11 3H5M T 11 -1.979 -4.987 27.307 127 H6 T 11 H6 T 11 0.399 -5.253 26.093 128 1H5* G 12 1H5' G 12 6.607 -4.206 26.103 129 2H5* G 12 2H5' G 12 8.086 -4.923 26.765 130 H4* G 12 H4' G 12 8.151 -2.514 27.153 131 H3* G 12 H3' G 12 8.472 -4.421 29.250 132 H1* G 12 H1' G 12 6.859 -1.030 29.456 133 H8 G 12 H8 G 12 4.028 -3.727 29.610 134 H1 G 12 H1 G 12 2.281 2.253 31.202 135 1H2 G 12 1H2 G 12 5.603 2.918 30.511 136 2H2 G 12 2H2 G 12 4.052 3.598 31.021 137 2H2* G 12 1H2' G 12 7.319 -2.803 31.084 138 1H2* G 12 2H2' G 12 6.290 -3.943 30.159 139 1H5* T 13 1H5' T 13 8.977 0.268 29.836 140 2H5* T 13 2H5' T 13 10.594 0.274 30.569 141 H4* T 13 H4' T 13 9.418 2.317 31.207 142 H3* T 13 H3' T 13 10.607 0.510 33.075 143 1H2* T 13 2H2' T 13 8.512 -0.234 33.916 144 2H2* T 13 1H2' T 13 8.800 1.163 35.004 145 H1* T 13 H1' T 13 7.444 2.598 33.561 146 H3 T 13 H3 T 13 3.511 1.382 35.387 147 1H5M T 13 1H5M T 13 5.339 -3.103 33.263 148 2H5M T 13 2H5M T 13 3.590 -2.828 33.277 149 3H5M T 13 3H5M T 13 4.538 -2.388 31.848 150 H6 T 13 H6 T 13 6.680 -0.874 32.556 151 1H5* A 14 1H5' A 14 9.182 4.815 34.838 152 2H5* A 14 2H5' A 14 10.567 5.200 35.882 153 H4* A 14 H4' A 14 8.552 6.046 36.960 154 H3* A 14 H3' A 14 10.357 4.288 38.273 155 H1* A 14 H1' A 14 6.656 4.431 38.658 156 H8 A 14 H8 A 14 7.495 0.911 37.295 157 1H6 A 14 1H6 A 14 1.338 0.135 37.980 158 2H6 A 14 2H6 A 14 2.811 -0.789 37.595 159 H2 A 14 H2 A 14 2.163 4.230 38.729 160 2H2* A 14 1H2' A 14 8.409 2.984 39.624 161 1H2* A 14 2H2' A 14 8.844 2.398 37.986 162 1H5* G 15 1H5' G 15 7.332 7.823 38.581 163 2H5* G 15 2H5' G 15 7.693 9.357 39.399 164 H4* G 15 H4' G 15 5.417 8.731 39.991 165 H3* G 15 H3' G 15 7.431 8.996 42.043 166 H1* G 15 H1' G 15 4.383 6.793 41.873 167 H8 G 15 H8 G 15 7.580 4.549 41.922 168 H1 G 15 H1 G 15 1.973 1.414 42.251 169 1H2 G 15 1H2 G 15 0.691 4.610 41.938 170 2H2 G 15 2H2 G 15 0.307 2.892 42.114 171 2H2* G 15 1H2' G 15 6.056 7.249 43.623 172 1H2* G 15 2H2' G 15 7.357 6.654 42.543 173 1H5* T 16 1H5' T 16 2.691 9.469 42.809 174 2H5* T 16 2H5' T 16 2.667 10.684 44.102 175 H4* T 16 H4' T 16 0.618 9.293 44.156 176 H3* T 16 H3' T 16 2.308 9.763 46.440 177 1H2* T 16 2H2' T 16 2.991 7.480 46.559 178 2H2* T 16 1H2' T 16 1.491 7.392 47.535 179 H1* T 16 H1' T 16 0.211 6.726 45.555 180 H3 T 16 H3 T 16 1.119 2.327 45.831 181 1H5M T 16 1H5M T 16 5.542 4.462 43.843 182 2H5M T 16 2H5M T 16 5.905 4.509 45.582 183 3H5M T 16 3H5M T 16 5.662 2.957 44.767 184 H6 T 16 H6 T 16 3.834 6.204 44.957 185 1H5* G 17 1H5' G 17 -1.222 7.066 47.066 186 2H5* G 17 2H5' G 17 -2.148 7.674 48.453 187 H4* G 17 H4' G 17 -2.113 5.226 48.509 188 H3* G 17 H3' G 17 -1.163 6.858 50.720 189 H1* G 17 H1' G 17 -0.270 3.383 49.574 190 H8 G 17 H8 G 17 2.897 5.659 49.411 191 H1 G 17 H1 G 17 3.887 -0.600 48.307 192 1H2 G 17 1H2 G 17 0.445 -0.735 48.621 193 2H2 G 17 2H2 G 17 1.924 -1.661 48.326 194 H3T G 17 H3T G 17 -2.958 5.398 50.705 195 2H2* G 17 1H2' G 17 0.291 4.695 51.576 196 1H2* G 17 2H2' G 17 1.040 5.961 50.552 197 1H5* C 1 1H5' C 1 6.603 -8.787 46.714 198 2H5* C 1 2H5' C 1 6.571 -7.281 45.762 199 H4* C 1 H4' C 1 4.986 -7.862 48.310 200 H3* C 1 H3' C 1 4.263 -8.213 45.519 201 H1* C 1 H1' C 1 3.089 -5.646 48.106 202 1H4 C 1 1H4 C 1 4.683 0.352 45.785 203 2H4 C 1 2H4 C 1 2.994 0.255 46.354 204 H5 C 1 H5 C 1 6.016 -1.780 45.770 205 H6 C 1 H6 C 1 5.880 -4.164 46.313 206 H5T C 1 H5T C 1 7.080 -6.300 47.889 207 2H2* C 1 1H2' C 1 2.323 -6.299 45.869 208 1H2* C 1 2H2' C 1 3.923 -5.893 45.190 209 1H5* A 2 1H5' A 2 1.060 -6.947 48.384 210 2H5* A 2 2H5' A 2 -0.445 -7.853 48.104 211 H4* A 2 H4' A 2 -0.971 -5.491 48.541 212 H3* A 2 H3' A 2 -1.848 -6.872 46.163 213 H1* A 2 H1' A 2 -0.922 -3.202 46.627 214 H8 A 2 H8 A 2 1.461 -5.015 44.112 215 1H6 A 2 1H6 A 2 3.725 0.754 43.374 216 2H6 A 2 2H6 A 2 3.907 -0.893 42.723 217 H2 A 2 H2 A 2 0.799 0.955 46.439 218 2H2* A 2 1H2' A 2 -1.971 -4.471 44.843 219 1H2* A 2 2H2' A 2 -0.538 -5.536 44.713 220 1H5* C 3 1H5' C 3 -3.270 -2.713 47.507 221 2H5* C 3 2H5' C 3 -5.006 -2.529 47.180 222 H4* C 3 H4' C 3 -3.810 -0.366 46.944 223 H3* C 3 H3' C 3 -5.457 -1.556 44.822 224 H1* C 3 H1' C 3 -2.479 0.848 44.788 225 1H4 C 3 1H4 C 3 2.154 -1.977 40.979 226 2H4 C 3 2H4 C 3 2.268 -0.199 41.055 227 H5 C 3 H5 C 3 0.258 -3.067 42.190 228 H6 C 3 H6 C 3 -1.687 -2.590 43.611 229 2H2* C 3 1H2' C 3 -4.198 0.274 43.163 230 1H2* C 3 2H2' C 3 -3.737 -1.454 43.253 231 1H5* T 4 1H5' T 4 -4.327 2.897 45.032 232 2H5* T 4 2H5' T 4 -5.751 3.867 44.603 233 H4* T 4 H4' T 4 -3.650 4.928 43.802 234 H3* T 4 H3' T 4 -5.926 4.291 42.049 235 1H2* T 4 2H2' T 4 -4.612 3.086 40.552 236 2H2* T 4 1H2' T 4 -4.112 4.716 39.995 237 H1* T 4 H1' T 4 -2.152 4.641 41.429 238 H3 T 4 H3 T 4 -0.095 2.205 38.154 239 1H5M T 4 1H5M T 4 -1.588 -1.828 40.063 240 2H5M T 4 2H5M T 4 -1.831 -1.276 41.727 241 3H5M T 4 3H5M T 4 -3.195 -1.305 40.589 242 H6 T 4 H6 T 4 -3.046 1.129 41.803 243 1H5* A 5 1H5' A 5 -2.505 6.996 40.959 244 2H5* A 5 2H5' A 5 -3.130 8.485 40.219 245 H4* A 5 H4' A 5 -1.007 7.860 39.167 246 H3* A 5 H3' A 5 -3.549 7.948 37.600 247 H1* A 5 H1' A 5 -0.113 6.234 37.221 248 H8 A 5 H8 A 5 -3.189 3.830 37.412 249 1H6 A 5 1H6 A 5 -0.873 -0.064 35.290 250 2H6 A 5 2H6 A 5 0.801 -0.121 34.683 251 H2 A 5 H2 A 5 2.858 3.529 35.190 252 2H2* A 5 1H2' A 5 -1.736 7.047 35.636 253 1H2* A 5 2H2' A 5 -3.024 6.075 36.407 254 1H5* C 6 1H5' C 6 0.665 9.292 36.227 255 2H5* C 6 2H5' C 6 0.534 10.597 35.028 256 H4* C 6 H4' C 6 2.451 9.070 34.541 257 H3* C 6 H3' C 6 0.228 9.547 32.603 258 H1* C 6 H1' C 6 2.809 6.720 33.205 259 1H4 C 6 1H4 C 6 -1.184 1.426 33.423 260 2H4 C 6 2H4 C 6 0.512 1.020 33.055 261 H5 C 6 H5 C 6 -1.782 3.833 33.672 262 H6 C 6 H6 C 6 -0.828 6.094 33.665 263 2H2* C 6 1H2' C 6 1.761 7.593 31.250 264 1H2* C 6 2H2' C 6 0.136 7.352 31.953 265 1H5* A 7 1H5' A 7 4.062 7.946 31.681 266 2H5* A 7 2H5' A 7 4.930 8.965 30.516 267 H4* A 7 H4' A 7 5.539 6.570 30.261 268 H3* A 7 H3' A 7 4.644 8.284 28.096 269 H1* A 7 H1' A 7 4.307 4.520 28.626 270 H8 A 7 H8 A 7 0.829 6.270 28.978 271 1H6 A 7 1H6 A 7 -1.252 0.507 27.771 272 2H6 A 7 2H6 A 7 -1.856 2.141 28.137 273 H2 A 7 H2 A 7 2.980 0.348 27.639 274 2H2* A 7 1H2' A 7 3.982 5.994 26.714 275 1H2* A 7 2H2' A 7 2.764 6.943 27.621 276 1H5* A 8 1H5' A 8 7.250 4.399 27.476 277 2H5* A 8 2H5' A 8 8.473 4.902 26.291 278 H4* A 8 H4' A 8 8.012 2.451 26.184 279 H3* A 8 H3' A 8 7.974 4.247 23.896 280 H1* A 8 H1' A 8 6.007 1.028 24.602 281 H8 A 8 H8 A 8 3.707 4.188 24.799 282 1H6 A 8 1H6 A 8 -0.737 0.034 23.405 283 2H6 A 8 2H6 A 8 -0.531 1.768 23.752 284 H2 A 8 H2 A 8 2.937 -2.077 23.524 285 2H2* A 8 1H2' A 8 6.451 2.334 22.610 286 1H2* A 8 2H2' A 8 5.724 3.781 23.370 287 1H5* A 9 1H5' A 9 8.056 -0.383 23.385 288 2H5* A 9 2H5' A 9 9.372 -0.681 22.231 289 H4* A 9 H4' A 9 7.587 -2.374 21.980 290 H3* A 9 H3' A 9 8.590 -0.730 19.788 291 H1* A 9 H1' A 9 5.184 -2.353 20.394 292 H8 A 9 H8 A 9 5.037 1.544 20.190 293 1H6 A 9 1H6 A 9 -1.120 0.542 20.370 294 2H6 A 9 2H6 A 9 0.054 1.872 20.212 295 H2 A 9 H2 A 9 0.748 -3.242 20.667 296 2H2* A 9 1H2' A 9 6.263 -1.366 18.452 297 1H2* A 9 2H2' A 9 6.474 0.183 19.325 298 1H5* G 10 1H5' G 10 6.486 -4.878 19.381 299 2H5* G 10 2H5' G 10 7.291 -5.738 18.053 300 H4* G 10 H4' G 10 4.911 -6.426 18.290 301 H3* G 10 H3' G 10 6.138 -5.641 15.808 302 H1* G 10 H1' G 10 2.564 -5.143 16.969 303 H8 G 10 H8 G 10 4.381 -1.724 16.473 304 H1 G 10 H1 G 10 -1.904 -1.335 17.770 305 1H2 G 10 1H2 G 10 -1.589 -4.769 18.073 306 2H2 G 10 2H2 G 10 -2.694 -3.389 18.161 307 2H2* G 10 1H2' G 10 3.734 -4.771 14.862 308 1H2* G 10 2H2' G 10 4.863 -3.633 15.662 309 1H5* A 11 1H5' A 11 1.956 -7.357 16.411 310 2H5* A 11 2H5' A 11 1.650 -8.578 15.160 311 H4* A 11 H4' A 11 -0.454 -7.515 15.965 312 H3* A 11 H3' A 11 0.279 -7.810 13.185 313 H1* A 11 H1' A 11 -1.775 -5.080 14.914 314 H8 A 11 H8 A 11 1.754 -3.780 13.897 315 1H6 A 11 1H6 A 11 -1.041 1.789 14.304 316 2H6 A 11 2H6 A 11 0.547 1.065 13.953 317 H2 A 11 H2 A 11 -3.983 -1.132 15.166 318 2H2* A 11 1H2' A 11 -1.349 -5.690 12.589 319 1H2* A 11 2H2' A 11 0.412 -5.473 12.833 320 1H5* G 12 1H5' G 12 -3.957 -6.580 14.627 321 2H5* G 12 2H5' G 12 -5.116 -7.542 13.685 322 H4* G 12 H4' G 12 -6.057 -5.327 14.313 323 H3* G 12 H3' G 12 -5.929 -6.332 11.553 324 H1* G 12 H1' G 12 -6.009 -2.828 13.073 325 H8 G 12 H8 G 12 -2.544 -3.576 11.430 326 H1 G 12 H1 G 12 -4.141 2.642 11.776 327 1H2 G 12 1H2 G 12 -7.029 1.358 13.177 328 2H2 G 12 2H2 G 12 -6.163 2.824 12.697 329 2H2* G 12 1H2' G 12 -6.457 -3.710 10.849 330 1H2* G 12 2H2' G 12 -4.819 -4.432 10.781 331 1H5* T 13 1H5' T 13 -8.682 -2.768 12.569 332 2H5* T 13 2H5' T 13 -10.196 -2.963 11.658 333 H4* T 13 H4' T 13 -9.466 -0.609 11.550 334 H3* T 13 H3' T 13 -9.336 -2.282 9.024 335 1H2* T 13 2H2' T 13 -7.964 -0.796 8.004 336 2H2* T 13 1H2' T 13 -8.997 0.580 8.481 337 H1* T 13 H1' T 13 -7.737 0.987 10.390 338 H3 T 13 H3 T 13 -3.804 2.248 8.619 339 1H5M T 13 1H5M T 13 -3.363 -2.957 9.359 340 2H5M T 13 2H5M T 13 -3.953 -2.951 7.684 341 3H5M T 13 3H5M T 13 -2.395 -2.211 8.079 342 H6 T 13 H6 T 13 -5.907 -2.028 9.308 343 1H5* A 14 1H5' A 14 -10.811 1.870 9.525 344 2H5* A 14 2H5' A 14 -12.298 2.139 8.592 345 H4* A 14 H4' A 14 -10.874 4.169 8.584 346 H3* A 14 H3' A 14 -11.978 2.955 6.236 347 H1* A 14 H1' A 14 -8.682 4.764 6.621 348 H8 A 14 H8 A 14 -8.049 0.962 5.965 349 1H6 A 14 1H6 A 14 -3.194 1.481 4.875 350 2H6 A 14 2H6 A 14 -2.226 2.974 4.958 351 H2 A 14 H2 A 14 -4.484 6.323 6.204 352 2H2* A 14 1H2' A 14 -9.890 3.825 4.719 353 1H2* A 14 2H2' A 14 -9.843 2.196 5.466 354 1H5* G 15 1H5' G 15 -9.755 7.231 5.781 355 2H5* G 15 2H5' G 15 -10.887 8.079 4.708 356 H4* G 15 H4' G 15 -8.646 8.817 4.147 357 H3* G 15 H3' G 15 -10.353 7.483 2.195 358 H1* G 15 H1' G 15 -6.597 7.737 2.519 359 H8 G 15 H8 G 15 -7.738 4.043 3.105 360 H1 G 15 H1 G 15 -1.514 4.829 1.691 361 1H2 G 15 1H2 G 15 -1.088 7.007 1.463 362 2H2 G 15 2H2 G 15 -2.413 8.163 1.672 363 2H2* G 15 1H2' G 15 -8.086 6.917 0.758 364 1H2* G 15 2H2' G 15 -8.788 5.722 1.896 365 1H5* T 16 1H5' T 16 -6.371 9.375 0.989 366 2H5* T 16 2H5' T 16 -6.701 10.387 -0.433 367 H4* T 16 H4' T 16 -4.493 9.390 -0.677 368 H3* T 16 H3' T 16 -6.696 8.659 -2.566 369 1H2* T 16 2H2' T 16 -5.995 6.470 -2.672 370 2H2* T 16 1H2' T 16 -4.548 7.081 -3.526 371 H1* T 16 H1' T 16 -3.326 7.227 -1.448 372 H3 T 16 H3 T 16 -2.153 2.906 -1.470 373 1H5M T 16 1H5M T 16 -6.779 2.934 1.026 374 2H5M T 16 2H5M T 16 -7.388 2.760 -0.634 375 3H5M T 16 3H5M T 16 -6.366 1.503 0.074 376 H6 T 16 H6 T 16 -6.271 5.197 -0.477 377 1H5* G 17 1H5' G 17 -2.313 8.622 -3.773 378 2H5* G 17 2H5' G 17 -2.184 9.344 -5.391 379 H4* G 17 H4' G 17 -0.671 7.428 -5.247 380 H3* G 17 H3' G 17 -2.770 7.606 -7.258 381 H1* G 17 H1' G 17 -1.038 4.681 -5.642 382 H8 G 17 H8 G 17 -4.874 4.349 -5.195 383 H1 G 17 H1 G 17 -1.371 -0.321 -2.492 384 1H2 G 17 1H2 G 17 1.252 1.708 -3.484 385 2H2 G 17 2H2 G 17 0.796 0.195 -2.687 386 H3T G 17 H3T G 17 -1.181 6.443 -8.444 387 2H2* G 17 1H2' G 17 -2.593 4.879 -7.534 388 1H2* G 17 2H2' G 17 -3.822 5.623 -6.463 Start of MODEL 18 1 1H5* C 1 1H5' C 1 2.081 -7.023 -0.863 2 2H5* C 1 2H5' C 1 1.953 -7.376 -2.597 3 H4* C 1 H4' C 1 3.983 -6.011 -3.033 4 H3* C 1 H3' C 1 4.595 -6.233 -0.285 5 H1* C 1 H1' C 1 3.543 -3.056 -2.046 6 1H4 C 1 1H4 C 1 -2.291 -1.005 0.336 7 2H4 C 1 2H4 C 1 -1.297 0.276 -0.410 8 H5 C 1 H5 C 1 -1.302 -3.315 0.422 9 H6 C 1 H6 C 1 0.674 -4.616 -0.240 10 H5T C 1 H5T C 1 3.028 -9.020 -1.434 11 2H2* C 1 1H2' C 1 4.172 -3.618 0.247 12 1H2* C 1 2H2' C 1 2.796 -4.761 0.370 13 1H5* A 2 1H5' A 2 5.899 -2.238 -2.559 14 2H5* A 2 2H5' A 2 7.513 -1.881 -1.910 15 H4* A 2 H4' A 2 6.349 0.224 -2.320 16 H3* A 2 H3' A 2 7.354 -0.523 0.304 17 H1* A 2 H1' A 2 4.466 1.703 -0.727 18 H8 A 2 H8 A 2 3.119 -1.459 1.151 19 1H6 A 2 1H6 A 2 -2.126 1.929 1.271 20 2H6 A 2 2H6 A 2 -1.488 0.360 1.819 21 H2 A 2 H2 A 2 0.774 4.215 -0.805 22 2H2* A 2 1H2' A 2 5.595 1.282 1.393 23 1H2* A 2 2H2' A 2 5.198 -0.461 1.283 24 1H5* C 3 1H5' C 3 6.262 3.987 -0.804 25 2H5* C 3 2H5' C 3 7.520 4.950 -0.001 26 H4* C 3 H4' C 3 5.403 6.193 0.027 27 H3* C 3 H3' C 3 6.810 5.411 2.498 28 H1* C 3 H1' C 3 3.145 6.189 1.673 29 1H4 C 3 1H4 C 3 -0.209 0.827 3.694 30 2H4 C 3 2H4 C 3 -1.229 2.256 3.372 31 H5 C 3 H5 C 3 2.262 1.089 3.375 32 H6 C 3 H6 C 3 3.985 2.712 2.720 33 2H2* C 3 1H2' C 3 4.433 6.155 3.732 34 1H2* C 3 2H2' C 3 4.916 4.457 3.430 35 1H5* T 4 1H5' T 4 3.930 9.090 2.152 36 2H5* T 4 2H5' T 4 4.649 10.378 3.140 37 H4* T 4 H4' T 4 2.193 10.502 3.226 38 H3* T 4 H3' T 4 3.866 10.288 5.604 39 1H2* T 4 2H2' T 4 2.863 8.292 6.320 40 2H2* T 4 1H2' T 4 1.616 9.426 6.936 41 H1* T 4 H1' T 4 0.283 9.109 4.928 42 H3 T 4 H3 T 4 -1.661 5.287 6.321 43 1H5M T 4 1H5M T 4 2.813 3.671 4.164 44 2H5M T 4 2H5M T 4 3.494 4.036 5.761 45 3H5M T 4 3H5M T 4 2.264 2.778 5.592 46 H6 T 4 H6 T 4 2.783 6.381 4.826 47 1H5* A 5 1H5' A 5 -0.611 11.152 5.978 48 2H5* A 5 2H5' A 5 -0.740 12.571 7.034 49 H4* A 5 H4' A 5 -2.627 11.127 7.469 50 H3* A 5 H3' A 5 -0.703 11.803 9.563 51 H1* A 5 H1' A 5 -2.976 8.761 9.098 52 H8 A 5 H8 A 5 0.806 7.822 8.814 53 1H6 A 5 1H6 A 5 0.087 2.900 9.485 54 2H6 A 5 2H6 A 5 -1.467 2.079 9.777 55 H2 A 5 H2 A 5 -4.746 4.731 9.863 56 2H2* A 5 1H2' A 5 -1.711 9.652 10.971 57 1H2* A 5 2H2' A 5 -0.196 9.567 10.028 58 1H5* C 6 1H5' C 6 -5.144 10.474 10.174 59 2H5* C 6 2H5' C 6 -5.775 11.443 11.522 60 H4* C 6 H4' C 6 -6.913 9.243 11.404 61 H3* C 6 H3' C 6 -5.541 10.246 13.789 62 H1* C 6 H1' C 6 -6.235 6.702 12.511 63 1H4 C 6 1H4 C 6 -1.413 2.846 13.181 64 2H4 C 6 2H4 C 6 -0.249 3.866 12.301 65 H5 C 6 H5 C 6 -0.930 6.157 11.635 66 H6 C 6 H6 C 6 -2.837 7.683 11.580 67 2H2* C 6 1H2' C 6 -5.593 7.632 14.670 68 1H2* C 6 2H2' C 6 -4.141 8.380 13.941 69 1H5* T 7 1H5' T 7 -8.376 6.616 13.998 70 2H5* T 7 2H5' T 7 -9.427 6.842 15.412 71 H4* T 7 H4' T 7 -8.838 4.462 15.146 72 H3* T 7 H3' T 7 -8.199 6.000 17.595 73 1H2* T 7 2H2' T 7 -6.011 5.257 17.653 74 2H2* T 7 1H2' T 7 -6.724 3.715 18.206 75 H1* T 7 H1' T 7 -6.717 2.857 15.940 76 H3 T 7 H3 T 7 -2.411 1.716 15.372 77 1H5M T 7 1H5M T 7 -2.446 6.981 14.963 78 2H5M T 7 2H5M T 7 -2.117 6.819 16.701 79 3H5M T 7 3H5M T 7 -0.960 6.194 15.515 80 H6 T 7 H6 T 7 -4.628 5.926 16.101 81 1H5* C 8 1H5' C 8 -9.650 1.417 17.525 82 2H5* C 8 2H5' C 8 -10.405 1.142 19.109 83 H4* C 8 H4' C 8 -9.282 -0.928 18.326 84 H3* C 8 H3' C 8 -7.961 0.509 20.674 85 H1* C 8 H1' C 8 -6.335 -1.791 18.008 86 1H4 C 8 1H4 C 8 -0.983 0.975 19.223 87 2H4 C 8 2H4 C 8 -1.660 2.605 19.419 88 H5 C 8 H5 C 8 -4.110 2.922 19.267 89 H6 C 8 H6 C 8 -6.221 1.715 18.986 90 2H2* C 8 1H2' C 8 -7.527 -2.384 19.881 91 1H2* C 8 2H2' C 8 -6.425 -1.306 20.786 92 1H5* T 9 1H5' T 9 -8.697 -3.498 20.307 93 2H5* T 9 2H5' T 9 -9.451 -4.329 21.683 94 H4* T 9 H4' T 9 -7.661 -5.699 20.568 95 H3* T 9 H3' T 9 -8.026 -5.446 23.346 96 1H2* T 9 2H2' T 9 -6.285 -3.802 23.585 97 2H2* T 9 1H2' T 9 -5.382 -5.315 23.915 98 H1* T 9 H1' T 9 -4.632 -5.421 21.608 99 H3 T 9 H3 T 9 -1.186 -2.544 21.751 100 1H5M T 9 1H5M T 9 -3.929 1.084 22.937 101 2H5M T 9 2H5M T 9 -5.424 0.576 22.138 102 3H5M T 9 3H5M T 9 -5.162 0.211 23.857 103 H6 T 9 H6 T 9 -5.908 -2.048 22.543 104 1H5* T 10 1H5' T 10 -4.275 -7.527 21.740 105 2H5* T 10 2H5' T 10 -4.015 -9.033 22.645 106 H4* T 10 H4' T 10 -1.852 -8.003 22.065 107 H3* T 10 H3' T 10 -2.616 -8.709 24.772 108 1H2* T 10 2H2' T 10 -2.525 -6.461 25.514 109 2H2* T 10 1H2' T 10 -0.794 -6.876 25.694 110 H1* T 10 H1' T 10 -0.319 -5.992 23.464 111 H3 T 10 H3 T 10 0.243 -1.755 24.857 112 1H5M T 10 1H5M T 10 -4.960 -2.220 24.321 113 2H5M T 10 2H5M T 10 -4.833 -2.782 26.002 114 3H5M T 10 3H5M T 10 -4.362 -1.130 25.580 115 H6 T 10 H6 T 10 -3.613 -4.610 24.461 116 1H5* T 11 1H5' T 11 1.719 -7.503 23.581 117 2H5* T 11 2H5' T 11 2.775 -8.712 24.337 118 H4* T 11 H4' T 11 3.927 -6.541 24.223 119 H3* T 11 H3' T 11 3.631 -8.064 26.649 120 1H2* T 11 2H2' T 11 2.179 -6.442 27.626 121 2H2* T 11 1H2' T 11 3.771 -5.792 28.135 122 H1* T 11 H1' T 11 3.822 -4.323 26.173 123 H3 T 11 H3 T 11 1.553 -1.115 28.404 124 1H5M T 11 1H5M T 11 -2.583 -3.186 27.545 125 2H5M T 11 2H5M T 11 -2.156 -4.046 26.060 126 3H5M T 11 3H5M T 11 -2.074 -4.879 27.627 127 H6 T 11 H6 T 11 0.270 -5.259 26.316 128 1H5* G 12 1H5' G 12 6.464 -4.348 25.997 129 2H5* G 12 2H5' G 12 7.978 -4.969 26.676 130 H4* G 12 H4' G 12 8.000 -2.516 26.721 131 H3* G 12 H3' G 12 8.558 -4.120 29.008 132 H1* G 12 H1' G 12 6.832 -0.776 28.925 133 H8 G 12 H8 G 12 4.093 -3.509 29.487 134 H1 G 12 H1 G 12 2.351 2.500 30.961 135 1H2 G 12 1H2 G 12 5.611 3.192 30.040 136 2H2 G 12 2H2 G 12 4.086 3.863 30.634 137 2H2* G 12 1H2' G 12 7.486 -2.323 30.714 138 1H2* G 12 2H2' G 12 6.433 -3.598 30.019 139 1H5* T 13 1H5' T 13 8.582 0.537 28.908 140 2H5* T 13 2H5' T 13 10.237 0.869 29.455 141 H4* T 13 H4' T 13 8.813 2.824 29.848 142 H3* T 13 H3' T 13 10.469 1.604 31.836 143 1H2* T 13 2H2' T 13 8.617 0.767 33.071 144 2H2* T 13 1H2' T 13 8.797 2.379 33.837 145 H1* T 13 H1' T 13 7.077 3.296 32.360 146 H3 T 13 H3 T 13 3.765 1.816 35.087 147 1H5M T 13 1H5M T 13 4.626 -2.119 31.690 148 2H5M T 13 2H5M T 13 5.762 -2.604 32.966 149 3H5M T 13 3H5M T 13 4.025 -2.537 33.302 150 H6 T 13 H6 T 13 6.667 -0.312 31.896 151 1H5* A 14 1H5' A 14 8.346 5.707 32.573 152 2H5* A 14 2H5' A 14 9.558 6.747 33.350 153 H4* A 14 H4' A 14 7.285 7.334 34.107 154 H3* A 14 H3' A 14 9.464 6.627 35.930 155 H1* A 14 H1' A 14 5.675 6.342 36.225 156 H8 A 14 H8 A 14 7.360 2.802 36.176 157 1H6 A 14 1H6 A 14 3.386 0.394 38.026 158 2H6 A 14 2H6 A 14 1.804 1.095 38.450 159 H2 A 14 H2 A 14 1.620 5.261 37.771 160 2H2* A 14 1H2' A 14 7.506 6.220 37.824 161 1H2* A 14 2H2' A 14 8.247 4.871 36.907 162 1H5* G 15 1H5' G 15 5.576 8.743 37.263 163 2H5* G 15 2H5' G 15 6.106 10.128 38.240 164 H4* G 15 H4' G 15 3.927 9.287 39.044 165 H3* G 15 H3' G 15 6.270 9.584 40.758 166 H1* G 15 H1' G 15 3.246 7.326 40.918 167 H8 G 15 H8 G 15 6.441 5.181 40.214 168 H1 G 15 H1 G 15 1.318 1.930 42.350 169 1H2 G 15 1H2 G 15 -0.118 5.075 42.323 170 2H2 G 15 2H2 G 15 -0.366 3.357 42.667 171 2H2* G 15 1H2' G 15 5.059 7.851 42.495 172 1H2* G 15 2H2' G 15 6.268 7.279 41.304 173 1H5* T 16 1H5' T 16 1.841 9.048 42.348 174 2H5* T 16 2H5' T 16 1.719 10.212 43.683 175 H4* T 16 H4' T 16 0.306 8.259 44.149 176 H3* T 16 H3' T 16 2.511 9.081 45.936 177 1H2* T 16 2H2' T 16 3.379 6.917 46.034 178 2H2* T 16 1H2' T 16 2.001 6.616 47.135 179 H1* T 16 H1' T 16 0.653 5.804 45.276 180 H3 T 16 H3 T 16 2.668 1.763 45.938 181 1H5M T 16 1H5M T 16 6.207 4.572 43.175 182 2H5M T 16 2H5M T 16 6.066 2.837 42.854 183 3H5M T 16 3H5M T 16 5.161 3.993 41.863 184 H6 T 16 H6 T 16 3.804 5.736 43.476 185 1H5* G 17 1H5' G 17 -0.780 6.288 47.351 186 2H5* G 17 2H5' G 17 -1.390 6.952 48.881 187 H4* G 17 H4' G 17 -1.393 4.510 49.015 188 H3* G 17 H3' G 17 0.038 6.183 50.912 189 H1* G 17 H1' G 17 0.612 2.658 49.728 190 H8 G 17 H8 G 17 3.697 4.853 48.782 191 H1 G 17 H1 G 17 4.330 -1.469 47.776 192 1H2 G 17 1H2 G 17 1.034 -1.500 48.826 193 2H2 G 17 2H2 G 17 2.398 -2.477 48.264 194 H3T G 17 H3T G 17 -0.842 3.482 51.074 195 2H2* G 17 1H2' G 17 1.622 4.024 51.505 196 1H2* G 17 2H2' G 17 2.142 5.238 50.293 197 1H5* C 1 1H5' C 1 5.539 -10.109 45.733 198 2H5* C 1 2H5' C 1 5.986 -8.519 45.083 199 H4* C 1 H4' C 1 4.367 -8.921 47.642 200 H3* C 1 H3' C 1 3.423 -9.196 44.885 201 H1* C 1 H1' C 1 2.782 -6.575 47.595 202 1H4 C 1 1H4 C 1 3.217 -0.613 46.168 203 2H4 C 1 2H4 C 1 4.664 -0.736 45.135 204 H5 C 1 H5 C 1 5.585 -3.008 44.658 205 H6 C 1 H6 C 1 5.259 -5.384 45.146 206 H5T C 1 H5T C 1 6.656 -9.585 47.632 207 2H2* C 1 1H2' C 1 1.686 -7.137 45.472 208 1H2* C 1 2H2' C 1 3.220 -6.875 44.599 209 1H5* A 2 1H5' A 2 0.550 -7.666 47.983 210 2H5* A 2 2H5' A 2 -1.065 -8.368 47.739 211 H4* A 2 H4' A 2 -1.297 -5.980 48.208 212 H3* A 2 H3' A 2 -2.317 -7.168 45.768 213 H1* A 2 H1' A 2 -1.009 -3.656 46.452 214 H8 A 2 H8 A 2 1.189 -5.543 43.819 215 1H6 A 2 1H6 A 2 3.927 0.044 43.341 216 2H6 A 2 2H6 A 2 3.971 -1.582 42.618 217 H2 A 2 H2 A 2 1.009 0.351 46.411 218 2H2* A 2 1H2' A 2 -2.213 -4.679 44.603 219 1H2* A 2 2H2' A 2 -0.903 -5.878 44.376 220 1H5* C 3 1H5' C 3 -3.572 -2.917 47.357 221 2H5* C 3 2H5' C 3 -5.282 -2.669 46.943 222 H4* C 3 H4' C 3 -4.038 -0.537 46.814 223 H3* C 3 H3' C 3 -5.517 -1.668 44.530 224 H1* C 3 H1' C 3 -2.525 0.708 44.828 225 1H4 C 3 1H4 C 3 2.316 -2.059 41.246 226 2H4 C 3 2H4 C 3 2.445 -0.286 41.402 227 H5 C 3 H5 C 3 0.312 -3.158 42.267 228 H6 C 3 H6 C 3 -1.712 -2.698 43.579 229 2H2* C 3 1H2' C 3 -4.120 0.236 43.061 230 1H2* C 3 2H2' C 3 -3.690 -1.501 43.101 231 1H5* T 4 1H5' T 4 -4.380 2.773 44.944 232 2H5* T 4 2H5' T 4 -5.784 3.744 44.450 233 H4* T 4 H4' T 4 -3.658 4.854 43.813 234 H3* T 4 H3' T 4 -5.812 4.236 41.917 235 1H2* T 4 2H2' T 4 -4.393 3.032 40.500 236 2H2* T 4 1H2' T 4 -3.906 4.672 39.961 237 H1* T 4 H1' T 4 -2.035 4.661 41.521 238 H3 T 4 H3 T 4 0.360 2.424 38.365 239 1H5M T 4 1H5M T 4 -1.066 -1.730 40.050 240 2H5M T 4 2H5M T 4 -1.554 -1.244 41.681 241 3H5M T 4 3H5M T 4 -2.754 -1.303 40.374 242 H6 T 4 H6 T 4 -2.818 1.098 41.728 243 1H5* A 5 1H5' A 5 -2.379 7.044 40.910 244 2H5* A 5 2H5' A 5 -3.073 8.514 40.195 245 H4* A 5 H4' A 5 -0.937 7.997 39.116 246 H3* A 5 H3' A 5 -3.491 8.056 37.591 247 H1* A 5 H1' A 5 -0.046 6.425 37.089 248 H8 A 5 H8 A 5 -2.996 3.878 37.392 249 1H6 A 5 1H6 A 5 -0.573 0.095 35.185 250 2H6 A 5 2H6 A 5 1.078 0.120 34.516 251 H2 A 5 H2 A 5 2.972 3.865 34.951 252 2H2* A 5 1H2' A 5 -1.790 7.130 35.566 253 1H2* A 5 2H2' A 5 -2.993 6.134 36.439 254 1H5* C 6 1H5' C 6 0.702 9.469 36.035 255 2H5* C 6 2H5' C 6 0.455 10.759 34.837 256 H4* C 6 H4' C 6 2.394 9.320 34.231 257 H3* C 6 H3' C 6 0.013 9.634 32.450 258 H1* C 6 H1' C 6 2.792 6.974 32.915 259 1H4 C 6 1H4 C 6 -0.861 1.467 33.509 260 2H4 C 6 2H4 C 6 0.823 1.154 33.015 261 H5 C 6 H5 C 6 -1.572 3.843 33.782 262 H6 C 6 H6 C 6 -0.754 6.153 33.660 263 2H2* C 6 1H2' C 6 1.567 7.749 31.022 264 1H2* C 6 2H2' C 6 0.009 7.428 31.837 265 1H5* A 7 1H5' A 7 3.818 8.211 31.347 266 2H5* A 7 2H5' A 7 4.594 9.238 30.124 267 H4* A 7 H4' A 7 5.294 6.863 29.906 268 H3* A 7 H3' A 7 4.246 8.483 27.734 269 H1* A 7 H1' A 7 4.093 4.716 28.372 270 H8 A 7 H8 A 7 0.573 6.349 28.832 271 1H6 A 7 1H6 A 7 -2.012 2.121 28.118 272 2H6 A 7 2H6 A 7 -1.353 0.510 27.739 273 H2 A 7 H2 A 7 2.858 0.488 27.441 274 2H2* A 7 1H2' A 7 3.658 6.125 26.433 275 1H2* A 7 2H2' A 7 2.424 7.045 27.346 276 1H5* A 8 1H5' A 8 7.033 4.752 27.206 277 2H5* A 8 2H5' A 8 8.208 5.250 25.972 278 H4* A 8 H4' A 8 7.877 2.767 26.048 279 H3* A 8 H3' A 8 7.805 4.391 23.648 280 H1* A 8 H1' A 8 5.910 1.171 24.519 281 H8 A 8 H8 A 8 3.529 4.278 24.545 282 1H6 A 8 1H6 A 8 -0.803 -0.057 23.374 283 2H6 A 8 2H6 A 8 -0.642 1.698 23.621 284 H2 A 8 H2 A 8 2.920 -2.067 23.632 285 2H2* A 8 1H2' A 8 6.314 2.395 22.467 286 1H2* A 8 2H2' A 8 5.554 3.858 23.162 287 1H5* A 9 1H5' A 9 7.981 -0.269 23.430 288 2H5* A 9 2H5' A 9 9.313 -0.606 22.304 289 H4* A 9 H4' A 9 7.569 -2.356 22.155 290 H3* A 9 H3' A 9 8.572 -0.856 19.871 291 H1* A 9 H1' A 9 5.178 -2.467 20.528 292 H8 A 9 H8 A 9 4.967 1.410 20.109 293 1H6 A 9 1H6 A 9 -1.173 0.304 20.276 294 2H6 A 9 2H6 A 9 -0.023 1.645 20.046 295 H2 A 9 H2 A 9 0.755 -3.416 20.825 296 2H2* A 9 1H2' A 9 6.263 -1.554 18.549 297 1H2* A 9 2H2' A 9 6.451 0.034 19.355 298 1H5* G 10 1H5' G 10 6.415 -5.004 19.639 299 2H5* G 10 2H5' G 10 7.234 -5.934 18.369 300 H4* G 10 H4' G 10 4.840 -6.569 18.568 301 H3* G 10 H3' G 10 6.137 -5.896 16.088 302 H1* G 10 H1' G 10 2.553 -5.313 17.145 303 H8 G 10 H8 G 10 4.368 -1.929 16.478 304 H1 G 10 H1 G 10 -1.884 -1.460 17.907 305 1H2 G 10 1H2 G 10 -2.672 -3.493 18.399 306 2H2 G 10 2H2 G 10 -1.564 -4.873 18.355 307 2H2* G 10 1H2' G 10 3.775 -5.015 15.054 308 1H2* G 10 2H2' G 10 4.901 -3.869 15.848 309 1H5* A 11 1H5' A 11 1.895 -7.490 16.666 310 2H5* A 11 2H5' A 11 1.559 -8.718 15.431 311 H4* A 11 H4' A 11 -0.512 -7.561 16.184 312 H3* A 11 H3' A 11 0.253 -7.914 13.415 313 H1* A 11 H1' A 11 -1.735 -5.117 15.099 314 H8 A 11 H8 A 11 1.837 -3.893 14.139 315 1H6 A 11 1H6 A 11 0.731 0.991 14.248 316 2H6 A 11 2H6 A 11 -0.859 1.725 14.571 317 H2 A 11 H2 A 11 -3.872 -1.138 15.300 318 2H2* A 11 1H2' A 11 -1.306 -5.752 12.780 319 1H2* A 11 2H2' A 11 0.459 -5.585 13.039 320 1H5* G 12 1H5' G 12 -3.966 -6.560 14.829 321 2H5* G 12 2H5' G 12 -5.136 -7.509 13.888 322 H4* G 12 H4' G 12 -6.051 -5.279 14.499 323 H3* G 12 H3' G 12 -5.901 -6.287 11.737 324 H1* G 12 H1' G 12 -5.965 -2.786 13.274 325 H8 G 12 H8 G 12 -2.486 -3.563 11.678 326 H1 G 12 H1 G 12 -4.072 2.663 11.926 327 1H2 G 12 1H2 G 12 -6.106 2.861 12.832 328 2H2 G 12 2H2 G 12 -6.975 1.393 13.305 329 2H2* G 12 1H2' G 12 -6.428 -3.654 11.050 330 1H2* G 12 2H2' G 12 -4.796 -4.386 10.969 331 1H5* T 13 1H5' T 13 -8.646 -2.716 12.714 332 2H5* T 13 2H5' T 13 -10.153 -2.913 11.794 333 H4* T 13 H4' T 13 -9.412 -0.561 11.686 334 H3* T 13 H3' T 13 -9.313 -2.241 9.165 335 1H2* T 13 2H2' T 13 -7.896 -0.796 8.147 336 2H2* T 13 1H2' T 13 -8.919 0.600 8.582 337 H1* T 13 H1' T 13 -7.684 1.023 10.512 338 H3 T 13 H3 T 13 -3.719 2.258 8.791 339 1H5M T 13 1H5M T 13 -3.323 -2.947 9.556 340 2H5M T 13 2H5M T 13 -3.881 -2.943 7.870 341 3H5M T 13 3H5M T 13 -2.326 -2.211 8.292 342 H6 T 13 H6 T 13 -5.856 -2.005 9.462 343 1H5* A 14 1H5' A 14 -10.684 1.953 9.687 344 2H5* A 14 2H5' A 14 -12.161 2.258 8.750 345 H4* A 14 H4' A 14 -10.715 4.259 8.742 346 H3* A 14 H3' A 14 -11.767 3.025 6.371 347 H1* A 14 H1' A 14 -8.488 4.851 6.847 348 H8 A 14 H8 A 14 -7.855 1.062 6.136 349 1H6 A 14 1H6 A 14 -1.966 3.009 5.455 350 2H6 A 14 2H6 A 14 -2.959 1.539 5.301 351 H2 A 14 H2 A 14 -4.244 6.374 6.655 352 2H2* A 14 1H2' A 14 -9.651 3.935 4.911 353 1H2* A 14 2H2' A 14 -9.615 2.296 5.637 354 1H5* G 15 1H5' G 15 -9.558 7.270 5.972 355 2H5* G 15 2H5' G 15 -10.666 8.150 4.899 356 H4* G 15 H4' G 15 -8.391 8.857 4.394 357 H3* G 15 H3' G 15 -10.119 7.631 2.389 358 H1* G 15 H1' G 15 -6.349 7.759 2.755 359 H8 G 15 H8 G 15 -7.661 4.098 3.129 360 H1 G 15 H1 G 15 -1.339 4.669 2.102 361 1H2 G 15 1H2 G 15 -2.087 8.044 2.178 362 2H2 G 15 2H2 G 15 -0.812 6.832 1.992 363 2H2* G 15 1H2' G 15 -7.849 7.066 0.950 364 1H2* G 15 2H2' G 15 -8.603 5.848 2.027 365 1H5* T 16 1H5' T 16 -6.109 9.425 1.184 366 2H5* T 16 2H5' T 16 -6.389 10.444 -0.243 367 H4* T 16 H4' T 16 -4.254 9.315 -0.512 368 H3* T 16 H3' T 16 -6.526 8.650 -2.349 369 1H2* T 16 2H2' T 16 -5.915 6.434 -2.435 370 2H2* T 16 1H2' T 16 -4.449 6.972 -3.307 371 H1* T 16 H1' T 16 -3.207 7.095 -1.242 372 H3 T 16 H3 T 16 -2.157 2.767 -0.928 373 1H5M T 16 1H5M T 16 -6.504 1.549 0.398 374 2H5M T 16 2H5M T 16 -7.100 3.097 1.005 375 3H5M T 16 3H5M T 16 -7.393 2.632 -0.683 376 H6 T 16 H6 T 16 -6.292 5.185 -0.425 377 1H5* G 17 1H5' G 17 -2.126 8.533 -3.598 378 2H5* G 17 2H5' G 17 -1.996 9.121 -5.268 379 H4* G 17 H4' G 17 -0.509 7.196 -4.967 380 H3* G 17 H3' G 17 -2.581 7.265 -7.002 381 H1* G 17 H1' G 17 -0.975 4.410 -5.143 382 H8 G 17 H8 G 17 -4.814 4.204 -4.797 383 H1 G 17 H1 G 17 -1.542 -0.143 -1.365 384 1H2 G 17 1H2 G 17 1.167 1.717 -2.448 385 2H2 G 17 2H2 G 17 0.639 0.323 -1.496 386 H3T G 17 H3T G 17 -1.035 5.930 -8.063 387 2H2* G 17 1H2' G 17 -2.525 4.523 -7.046 388 1H2* G 17 2H2' G 17 -3.720 5.402 -6.039 Start of MODEL 19 1 1H5* C 1 1H5' C 1 0.740 -5.816 -3.133 2 2H5* C 1 2H5' C 1 0.630 -5.985 -4.895 3 H4* C 1 H4' C 1 2.862 -4.913 -5.141 4 H3* C 1 H3' C 1 3.304 -5.469 -2.407 5 H1* C 1 H1' C 1 2.836 -2.035 -3.905 6 1H4 C 1 1H4 C 1 -2.666 0.739 -1.467 7 2H4 C 1 2H4 C 1 -1.451 1.900 -2.068 8 H5 C 1 H5 C 1 -2.084 -1.700 -1.601 9 H6 C 1 H6 C 1 -0.324 -3.249 -2.334 10 H5T C 1 H5T C 1 2.513 -7.271 -4.806 11 2H2* C 1 1H2' C 1 3.259 -2.877 -1.647 12 1H2* C 1 2H2' C 1 1.720 -3.797 -1.679 13 1H5* A 2 1H5' A 2 5.279 -1.476 -4.136 14 2H5* A 2 2H5' A 2 6.877 -1.408 -3.366 15 H4* A 2 H4' A 2 5.991 0.856 -3.521 16 H3* A 2 H3' A 2 6.762 -0.337 -1.001 17 H1* A 2 H1' A 2 4.156 2.288 -1.771 18 H8 A 2 H8 A 2 2.360 -0.997 -0.617 19 1H6 A 2 1H6 A 2 -2.463 2.912 0.045 20 2H6 A 2 2H6 A 2 -2.039 1.197 0.269 21 H2 A 2 H2 A 2 0.794 5.204 -1.402 22 2H2* A 2 1H2' A 2 5.080 1.381 0.304 23 1H2* A 2 2H2' A 2 4.538 -0.264 -0.150 24 1H5* C 3 1H5' C 3 5.891 4.359 -1.271 25 2H5* C 3 2H5' C 3 7.124 5.095 -0.224 26 H4* C 3 H4' C 3 5.013 6.340 0.022 27 H3* C 3 H3' C 3 5.856 4.590 2.365 28 H1* C 3 H1' C 3 2.525 6.143 1.073 29 1H4 C 3 1H4 C 3 -0.722 0.736 2.955 30 2H4 C 3 2H4 C 3 -1.621 2.242 3.278 31 H5 C 3 H5 C 3 1.623 0.957 2.115 32 H6 C 3 H6 C 3 3.317 2.613 1.467 33 2H2* C 3 1H2' C 3 3.841 6.741 2.845 34 1H2* C 3 2H2' C 3 3.897 5.066 3.455 35 1H5* T 4 1H5' T 4 4.687 8.819 2.543 36 2H5* T 4 2H5' T 4 5.532 9.741 3.802 37 H4* T 4 H4' T 4 3.122 10.319 3.721 38 H3* T 4 H3' T 4 4.515 9.543 6.132 39 1H2* T 4 2H2' T 4 3.262 7.559 6.412 40 2H2* T 4 1H2' T 4 2.134 8.713 7.196 41 H1* T 4 H1' T 4 0.874 8.949 5.127 42 H3 T 4 H3 T 4 -1.664 5.260 5.555 43 1H5M T 4 1H5M T 4 2.641 3.402 3.342 44 2H5M T 4 2H5M T 4 3.350 3.442 4.972 45 3H5M T 4 3H5M T 4 1.967 2.399 4.635 46 H6 T 4 H6 T 4 3.014 5.965 4.676 47 1H5* A 5 1H5' A 5 0.110 10.807 6.318 48 2H5* A 5 2H5' A 5 0.091 12.146 7.482 49 H4* A 5 H4' A 5 -2.019 10.953 7.633 50 H3* A 5 H3' A 5 -0.252 11.305 9.906 51 H1* A 5 H1' A 5 -2.722 8.483 9.136 52 H8 A 5 H8 A 5 0.996 7.289 8.971 53 1H6 A 5 1H6 A 5 -1.663 1.668 9.530 54 2H6 A 5 2H6 A 5 -0.057 2.426 9.389 55 H2 A 5 H2 A 5 -4.799 4.517 9.481 56 2H2* A 5 1H2' A 5 -1.469 9.152 11.106 57 1H2* A 5 2H2' A 5 0.073 8.996 10.214 58 1H5* C 6 1H5' C 6 -4.774 10.164 10.216 59 2H5* C 6 2H5' C 6 -5.426 11.131 11.557 60 H4* C 6 H4' C 6 -6.649 8.985 11.338 61 H3* C 6 H3' C 6 -5.340 9.879 13.803 62 H1* C 6 H1' C 6 -6.134 6.396 12.411 63 1H4 C 6 1H4 C 6 -1.484 2.365 13.310 64 2H4 C 6 2H4 C 6 -0.249 3.333 12.466 65 H5 C 6 H5 C 6 -0.837 5.626 11.716 66 H6 C 6 H6 C 6 -2.682 7.222 11.590 67 2H2* C 6 1H2' C 6 -5.564 7.248 14.619 68 1H2* C 6 2H2' C 6 -4.042 7.944 13.984 69 1H5* T 7 1H5' T 7 -8.312 6.356 13.907 70 2H5* T 7 2H5' T 7 -9.390 6.613 15.295 71 H4* T 7 H4' T 7 -8.837 4.221 15.064 72 H3* T 7 H3' T 7 -8.240 5.767 17.514 73 1H2* T 7 2H2' T 7 -6.050 5.019 17.610 74 2H2* T 7 1H2' T 7 -6.783 3.494 18.185 75 H1* T 7 H1' T 7 -6.764 2.595 15.931 76 H3 T 7 H3 T 7 -2.491 1.332 15.438 77 1H5M T 7 1H5M T 7 -2.072 6.434 16.752 78 2H5M T 7 2H5M T 7 -0.903 5.759 15.606 79 3H5M T 7 3H5M T 7 -2.347 6.587 15.004 80 H6 T 7 H6 T 7 -4.592 5.610 16.112 81 1H5* C 8 1H5' C 8 -9.712 1.181 17.479 82 2H5* C 8 2H5' C 8 -10.464 0.906 19.065 83 H4* C 8 H4' C 8 -9.311 -1.153 18.284 84 H3* C 8 H3' C 8 -8.027 0.306 20.639 85 H1* C 8 H1' C 8 -6.373 -1.984 17.974 86 1H4 C 8 1H4 C 8 -1.017 0.802 19.107 87 2H4 C 8 2H4 C 8 -1.696 2.427 19.337 88 H5 C 8 H5 C 8 -4.150 2.733 19.244 89 H6 C 8 H6 C 8 -6.262 1.521 18.981 90 2H2* C 8 1H2' C 8 -7.528 -2.581 19.865 91 1H2* C 8 2H2' C 8 -6.449 -1.465 20.754 92 1H5* T 9 1H5' T 9 -8.661 -3.704 20.243 93 2H5* T 9 2H5' T 9 -9.421 -4.557 21.602 94 H4* T 9 H4' T 9 -7.596 -5.892 20.506 95 H3* T 9 H3' T 9 -8.002 -5.663 23.278 96 1H2* T 9 2H2' T 9 -6.299 -3.982 23.548 97 2H2* T 9 1H2' T 9 -5.372 -5.478 23.890 98 H1* T 9 H1' T 9 -4.582 -5.564 21.597 99 H3 T 9 H3 T 9 -1.199 -2.617 21.798 100 1H5M T 9 1H5M T 9 -5.246 0.079 23.823 101 2H5M T 9 2H5M T 9 -4.042 0.967 22.878 102 3H5M T 9 3H5M T 9 -5.527 0.403 22.099 103 H6 T 9 H6 T 9 -5.944 -2.215 22.496 104 1H5* T 10 1H5' T 10 -4.184 -7.713 21.734 105 2H5* T 10 2H5' T 10 -3.957 -9.222 22.642 106 H4* T 10 H4' T 10 -1.773 -8.201 22.115 107 H3* T 10 H3' T 10 -2.614 -8.911 24.803 108 1H2* T 10 2H2' T 10 -2.490 -6.675 25.565 109 2H2* T 10 1H2' T 10 -0.767 -7.118 25.763 110 H1* T 10 H1' T 10 -0.252 -6.225 23.547 111 H3 T 10 H3 T 10 0.345 -2.019 25.033 112 1H5M T 10 1H5M T 10 -4.272 -1.316 25.592 113 2H5M T 10 2H5M T 10 -4.872 -2.450 24.373 114 3H5M T 10 3H5M T 10 -4.748 -2.951 26.073 115 H6 T 10 H6 T 10 -3.543 -4.806 24.488 116 1H5* T 11 1H5' T 11 1.788 -7.726 23.787 117 2H5* T 11 2H5' T 11 2.774 -8.995 24.542 118 H4* T 11 H4' T 11 4.005 -6.877 24.587 119 H3* T 11 H3' T 11 3.473 -8.442 26.951 120 1H2* T 11 2H2' T 11 2.040 -6.775 27.873 121 2H2* T 11 1H2' T 11 3.622 -6.207 28.494 122 H1* T 11 H1' T 11 3.860 -4.703 26.574 123 H3 T 11 H3 T 11 1.572 -1.429 28.684 124 1H5M T 11 1H5M T 11 -2.135 -5.049 27.651 125 2H5M T 11 2H5M T 11 -2.575 -3.339 27.548 126 3H5M T 11 3H5M T 11 -2.085 -4.208 26.087 127 H6 T 11 H6 T 11 0.272 -5.507 26.481 128 1H5* G 12 1H5' G 12 6.518 -4.880 26.574 129 2H5* G 12 2H5' G 12 7.958 -5.559 27.352 130 H4* G 12 H4' G 12 8.047 -3.105 27.424 131 H3* G 12 H3' G 12 8.385 -4.748 29.738 132 H1* G 12 H1' G 12 6.814 -1.333 29.525 133 H8 G 12 H8 G 12 3.938 -3.947 29.958 134 H1 G 12 H1 G 12 2.356 2.155 31.220 135 1H2 G 12 1H2 G 12 5.695 2.695 30.505 136 2H2 G 12 2H2 G 12 4.165 3.438 30.990 137 2H2* G 12 1H2' G 12 7.300 -2.883 31.365 138 1H2* G 12 2H2' G 12 6.237 -4.122 30.622 139 1H5* T 13 1H5' T 13 8.727 -0.114 29.561 140 2H5* T 13 2H5' T 13 10.359 0.127 30.214 141 H4* T 13 H4' T 13 9.033 2.184 30.432 142 H3* T 13 H3' T 13 10.502 0.971 32.558 143 1H2* T 13 2H2' T 13 8.539 0.257 33.699 144 2H2* T 13 1H2' T 13 8.758 1.881 34.432 145 H1* T 13 H1' T 13 7.174 2.838 32.834 146 H3 T 13 H3 T 13 3.664 1.617 35.429 147 1H5M T 13 1H5M T 13 4.459 -2.438 32.153 148 2H5M T 13 2H5M T 13 5.481 -2.964 33.506 149 3H5M T 13 3H5M T 13 3.735 -2.779 33.732 150 H6 T 13 H6 T 13 6.584 -0.752 32.430 151 1H5* A 14 1H5' A 14 8.440 5.103 32.946 152 2H5* A 14 2H5' A 14 9.637 6.182 33.693 153 H4* A 14 H4' A 14 7.333 6.882 34.262 154 H3* A 14 H3' A 14 9.420 6.371 36.229 155 H1* A 14 H1' A 14 5.635 6.073 36.441 156 H8 A 14 H8 A 14 7.252 2.502 36.583 157 1H6 A 14 1H6 A 14 1.769 1.099 39.224 158 2H6 A 14 2H6 A 14 3.315 0.336 38.780 159 H2 A 14 H2 A 14 1.655 5.218 38.254 160 2H2* A 14 1H2' A 14 7.428 6.059 38.090 161 1H2* A 14 2H2' A 14 8.192 4.654 37.280 162 1H5* G 15 1H5' G 15 5.467 8.594 37.330 163 2H5* G 15 2H5' G 15 6.019 10.051 38.183 164 H4* G 15 H4' G 15 3.838 9.320 39.075 165 H3* G 15 H3' G 15 6.191 9.736 40.732 166 H1* G 15 H1' G 15 3.187 7.504 41.136 167 H8 G 15 H8 G 15 6.323 5.253 40.476 168 H1 G 15 H1 G 15 1.226 2.284 43.040 169 1H2 G 15 1H2 G 15 -0.144 5.454 42.833 170 2H2 G 15 2H2 G 15 -0.415 3.774 43.316 171 2H2* G 15 1H2' G 15 5.067 8.107 42.608 172 1H2* G 15 2H2' G 15 6.221 7.453 41.403 173 1H5* T 16 1H5' T 16 1.754 9.380 42.309 174 2H5* T 16 2H5' T 16 1.624 10.658 43.534 175 H4* T 16 H4' T 16 0.103 8.791 44.063 176 H3* T 16 H3' T 16 2.138 9.784 45.925 177 1H2* T 16 2H2' T 16 3.101 7.652 46.182 178 2H2* T 16 1H2' T 16 1.719 7.414 47.296 179 H1* T 16 H1' T 16 0.405 6.414 45.494 180 H3 T 16 H3 T 16 2.395 2.439 46.493 181 1H5M T 16 1H5M T 16 5.835 3.281 43.380 182 2H5M T 16 2H5M T 16 5.132 4.622 42.465 183 3H5M T 16 3H5M T 16 6.156 4.950 43.877 184 H6 T 16 H6 T 16 3.646 6.255 43.845 185 1H5* G 17 1H5' G 17 -1.078 6.909 47.385 186 2H5* G 17 2H5' G 17 -1.781 7.623 48.852 187 H4* G 17 H4' G 17 -1.622 5.200 49.139 188 H3* G 17 H3' G 17 -0.332 7.081 50.959 189 H1* G 17 H1' G 17 0.426 3.512 50.004 190 H8 G 17 H8 G 17 3.460 5.801 49.120 191 H1 G 17 H1 G 17 4.416 -0.518 48.391 192 1H2 G 17 1H2 G 17 1.071 -0.660 49.261 193 2H2 G 17 2H2 G 17 2.504 -1.595 48.812 194 H3T G 17 H3T G 17 -1.152 4.373 51.276 195 2H2* G 17 1H2' G 17 1.285 5.004 51.755 196 1H2* G 17 2H2' G 17 1.819 6.178 50.512 197 1H5* C 1 1H5' C 1 7.173 -7.860 47.753 198 2H5* C 1 2H5' C 1 6.280 -9.101 46.845 199 H4* C 1 H4' C 1 4.883 -7.859 48.571 200 H3* C 1 H3' C 1 4.126 -8.321 45.771 201 H1* C 1 H1' C 1 3.244 -5.604 48.322 202 1H4 C 1 1H4 C 1 4.900 0.217 45.659 203 2H4 C 1 2H4 C 1 3.358 0.253 46.557 204 H5 C 1 H5 C 1 6.038 -2.015 45.421 205 H6 C 1 H6 C 1 5.825 -4.378 46.012 206 H5T C 1 H5T C 1 6.455 -6.434 45.992 207 2H2* C 1 1H2' C 1 2.251 -6.330 46.207 208 1H2* C 1 2H2' C 1 3.797 -6.039 45.365 209 1H5* A 2 1H5' A 2 1.063 -6.863 48.714 210 2H5* A 2 2H5' A 2 -0.479 -7.719 48.485 211 H4* A 2 H4' A 2 -0.925 -5.340 48.882 212 H3* A 2 H3' A 2 -1.858 -6.723 46.522 213 H1* A 2 H1' A 2 -0.843 -3.079 46.964 214 H8 A 2 H8 A 2 1.512 -4.945 44.457 215 1H6 A 2 1H6 A 2 4.032 -0.854 43.058 216 2H6 A 2 2H6 A 2 3.857 0.793 43.712 217 H2 A 2 H2 A 2 0.901 1.052 46.725 218 2H2* A 2 1H2' A 2 -1.933 -4.328 45.186 219 1H2* A 2 2H2' A 2 -0.524 -5.425 45.053 220 1H5* C 3 1H5' C 3 -3.329 -2.500 47.818 221 2H5* C 3 2H5' C 3 -5.059 -2.357 47.439 222 H4* C 3 H4' C 3 -3.910 -0.184 47.147 223 H3* C 3 H3' C 3 -5.450 -1.490 45.018 224 H1* C 3 H1' C 3 -2.531 0.970 44.995 225 1H4 C 3 1H4 C 3 2.341 -1.801 41.464 226 2H4 C 3 2H4 C 3 2.413 -0.020 41.546 227 H5 C 3 H5 C 3 0.403 -2.924 42.578 228 H6 C 3 H6 C 3 -1.610 -2.479 43.915 229 2H2* C 3 1H2' C 3 -4.147 0.268 43.316 230 1H2* C 3 2H2' C 3 -3.651 -1.441 43.518 231 1H5* T 4 1H5' T 4 -4.436 3.035 45.090 232 2H5* T 4 2H5' T 4 -5.898 3.908 44.587 233 H4* T 4 H4' T 4 -3.842 5.079 43.838 234 H3* T 4 H3' T 4 -6.020 4.306 42.037 235 1H2* T 4 2H2' T 4 -4.601 3.043 40.662 236 2H2* T 4 1H2' T 4 -4.198 4.660 39.997 237 H1* T 4 H1' T 4 -2.278 4.827 41.491 238 H3 T 4 H3 T 4 0.073 2.487 38.367 239 1H5M T 4 1H5M T 4 -1.079 -1.601 40.398 240 2H5M T 4 2H5M T 4 -1.526 -1.024 42.012 241 3H5M T 4 3H5M T 4 -2.770 -1.225 40.762 242 H6 T 4 H6 T 4 -2.883 1.259 41.961 243 1H5* A 5 1H5' A 5 -2.617 7.036 40.948 244 2H5* A 5 2H5' A 5 -3.248 8.489 40.146 245 H4* A 5 H4' A 5 -1.051 7.873 39.223 246 H3* A 5 H3' A 5 -3.503 7.995 37.539 247 H1* A 5 H1' A 5 -0.089 6.231 37.291 248 H8 A 5 H8 A 5 -3.144 3.807 37.489 249 1H6 A 5 1H6 A 5 -0.811 -0.069 35.343 250 2H6 A 5 2H6 A 5 0.855 -0.104 34.712 251 H2 A 5 H2 A 5 2.873 3.570 35.187 252 2H2* A 5 1H2' A 5 -1.681 7.005 35.647 253 1H2* A 5 2H2' A 5 -2.987 6.062 36.423 254 1H5* C 6 1H5' C 6 0.832 9.211 36.198 255 2H5* C 6 2H5' C 6 0.683 10.511 34.996 256 H4* C 6 H4' C 6 2.588 9.006 34.460 257 H3* C 6 H3' C 6 0.303 9.424 32.587 258 H1* C 6 H1' C 6 2.937 6.641 33.139 259 1H4 C 6 1H4 C 6 -0.946 1.285 33.671 260 2H4 C 6 2H4 C 6 0.749 0.899 33.275 261 H5 C 6 H5 C 6 -1.584 3.691 33.841 262 H6 C 6 H6 C 6 -0.674 5.966 33.722 263 2H2* C 6 1H2' C 6 1.784 7.452 31.213 264 1H2* C 6 2H2' C 6 0.198 7.209 32.000 265 1H5* A 7 1H5' A 7 4.100 7.813 31.578 266 2H5* A 7 2H5' A 7 4.933 8.811 30.370 267 H4* A 7 H4' A 7 5.551 6.418 30.153 268 H3* A 7 H3' A 7 4.610 8.074 27.970 269 H1* A 7 H1' A 7 4.282 4.329 28.582 270 H8 A 7 H8 A 7 0.803 6.059 29.017 271 1H6 A 7 1H6 A 7 -1.877 1.886 28.305 272 2H6 A 7 2H6 A 7 -1.251 0.259 27.940 273 H2 A 7 H2 A 7 2.962 0.137 27.690 274 2H2* A 7 1H2' A 7 3.874 5.773 26.657 275 1H2* A 7 2H2' A 7 2.696 6.737 27.599 276 1H5* A 8 1H5' A 8 7.272 4.213 27.471 277 2H5* A 8 2H5' A 8 8.464 4.700 26.250 278 H4* A 8 H4' A 8 8.108 2.219 26.323 279 H3* A 8 H3' A 8 8.119 3.833 23.931 280 H1* A 8 H1' A 8 6.097 0.678 24.728 281 H8 A 8 H8 A 8 3.819 3.861 24.788 282 1H6 A 8 1H6 A 8 -0.645 -0.309 23.513 283 2H6 A 8 2H6 A 8 -0.426 1.437 23.784 284 H2 A 8 H2 A 8 3.002 -2.449 23.794 285 2H2* A 8 1H2' A 8 6.543 1.944 22.707 286 1H2* A 8 2H2' A 8 5.836 3.412 23.444 287 1H5* A 9 1H5' A 9 8.075 -0.842 23.650 288 2H5* A 9 2H5' A 9 9.401 -1.214 22.529 289 H4* A 9 H4' A 9 7.589 -2.885 22.325 290 H3* A 9 H3' A 9 8.665 -1.370 20.082 291 H1* A 9 H1' A 9 5.199 -2.856 20.681 292 H8 A 9 H8 A 9 5.171 1.033 20.342 293 1H6 A 9 1H6 A 9 -1.013 0.226 20.507 294 2H6 A 9 2H6 A 9 0.202 1.513 20.306 295 H2 A 9 H2 A 9 0.732 -3.598 20.956 296 2H2* A 9 1H2' A 9 6.338 -1.950 18.732 297 1H2* A 9 2H2' A 9 6.585 -0.388 19.572 298 1H5* G 10 1H5' G 10 6.377 -5.414 19.831 299 2H5* G 10 2H5' G 10 7.157 -6.376 18.561 300 H4* G 10 H4' G 10 4.752 -6.953 18.811 301 H3* G 10 H3' G 10 6.026 -6.360 16.301 302 H1* G 10 H1' G 10 2.471 -5.672 17.395 303 H8 G 10 H8 G 10 4.388 -2.333 16.745 304 H1 G 10 H1 G 10 -1.901 -1.716 17.933 305 1H2 G 10 1H2 G 10 -1.681 -5.139 18.406 306 2H2 G 10 2H2 G 10 -2.750 -3.729 18.411 307 2H2* G 10 1H2' G 10 3.670 -5.447 15.282 308 1H2* G 10 2H2' G 10 4.832 -4.311 16.037 309 1H5* A 11 1H5' A 11 1.748 -7.803 16.959 310 2H5* A 11 2H5' A 11 1.363 -9.058 15.765 311 H4* A 11 H4' A 11 -0.661 -7.801 16.493 312 H3* A 11 H3' A 11 0.089 -8.260 13.725 313 H1* A 11 H1' A 11 -1.829 -5.384 15.369 314 H8 A 11 H8 A 11 1.753 -4.253 14.347 315 1H6 A 11 1H6 A 11 -0.886 1.407 14.373 316 2H6 A 11 2H6 A 11 0.693 0.623 14.120 317 H2 A 11 H2 A 11 -3.942 -1.383 15.271 318 2H2* A 11 1H2' A 11 -1.481 -6.105 13.063 319 1H2* A 11 2H2' A 11 0.293 -5.955 13.262 320 1H5* G 12 1H5' G 12 -4.108 -6.734 15.058 321 2H5* G 12 2H5' G 12 -5.281 -7.709 14.147 322 H4* G 12 H4' G 12 -6.169 -5.440 14.579 323 H3* G 12 H3' G 12 -5.928 -6.599 11.889 324 H1* G 12 H1' G 12 -5.993 -3.032 13.221 325 H8 G 12 H8 G 12 -2.442 -3.892 11.835 326 H1 G 12 H1 G 12 -4.022 2.341 11.727 327 1H2 G 12 1H2 G 12 -6.984 1.145 13.052 328 2H2 G 12 2H2 G 12 -6.087 2.581 12.536 329 2H2* G 12 1H2' G 12 -6.325 -4.006 11.013 330 1H2* G 12 2H2' G 12 -4.709 -4.776 11.085 331 1H5* T 13 1H5' T 13 -8.715 -2.858 12.342 332 2H5* T 13 2H5' T 13 -10.103 -3.156 11.270 333 H4* T 13 H4' T 13 -9.327 -0.851 10.932 334 H3* T 13 H3' T 13 -8.809 -2.855 8.715 335 1H2* T 13 2H2' T 13 -7.293 -1.497 7.727 336 2H2* T 13 1H2' T 13 -8.374 -0.082 7.848 337 H1* T 13 H1' T 13 -7.436 0.587 9.871 338 H3 T 13 H3 T 13 -3.268 1.724 8.691 339 1H5M T 13 1H5M T 13 -3.341 -3.496 7.937 340 2H5M T 13 2H5M T 13 -1.843 -2.755 8.520 341 3H5M T 13 3H5M T 13 -2.985 -3.455 9.677 342 H6 T 13 H6 T 13 -5.482 -2.512 9.284 343 1H5* A 14 1H5' A 14 -10.627 1.361 7.970 344 2H5* A 14 2H5' A 14 -11.684 1.229 6.549 345 H4* A 14 H4' A 14 -10.368 3.276 6.346 346 H3* A 14 H3' A 14 -10.392 1.276 4.304 347 H1* A 14 H1' A 14 -7.636 3.570 5.299 348 H8 A 14 H8 A 14 -6.347 -0.040 5.903 349 1H6 A 14 1H6 A 14 -1.698 1.361 7.112 350 2H6 A 14 2H6 A 14 -1.099 3.024 7.339 351 H2 A 14 H2 A 14 -4.078 5.943 6.660 352 2H2* A 14 1H2' A 14 -7.830 1.807 3.582 353 1H2* A 14 2H2' A 14 -8.126 0.581 4.859 354 1H5* G 15 1H5' G 15 -10.186 5.900 5.302 355 2H5* G 15 2H5' G 15 -11.358 7.028 4.591 356 H4* G 15 H4' G 15 -9.193 8.131 4.561 357 H3* G 15 H3' G 15 -10.609 7.669 2.130 358 H1* G 15 H1' G 15 -6.845 7.540 2.641 359 H8 G 15 H8 G 15 -8.292 4.071 1.669 360 H1 G 15 H1 G 15 -1.917 4.190 2.495 361 1H2 G 15 1H2 G 15 -2.551 7.462 3.418 362 2H2 G 15 2H2 G 15 -1.309 6.225 3.180 363 2H2* G 15 1H2' G 15 -8.318 7.338 0.704 364 1H2* G 15 2H2' G 15 -9.124 5.915 1.438 365 1H5* T 16 1H5' T 16 -6.418 9.603 1.818 366 2H5* T 16 2H5' T 16 -6.614 11.012 0.755 367 H4* T 16 H4' T 16 -4.437 9.999 0.334 368 H3* T 16 H3' T 16 -6.527 10.052 -1.798 369 1H2* T 16 2H2' T 16 -5.989 7.920 -2.500 370 2H2* T 16 1H2' T 16 -4.465 8.634 -3.103 371 H1* T 16 H1' T 16 -3.338 8.091 -1.031 372 H3 T 16 H3 T 16 -2.315 3.799 -1.643 373 1H5M T 16 1H5M T 16 -7.486 3.894 -2.616 374 2H5M T 16 2H5M T 16 -6.815 2.458 -1.831 375 3H5M T 16 3H5M T 16 -7.551 3.729 -0.848 376 H6 T 16 H6 T 16 -6.509 6.151 -1.371 377 1H5* G 17 1H5' G 17 -2.018 10.047 -2.810 378 2H5* G 17 2H5' G 17 -1.800 11.160 -4.177 379 H4* G 17 H4' G 17 -0.416 9.191 -4.557 380 H3* G 17 H3' G 17 -2.471 10.011 -6.438 381 H1* G 17 H1' G 17 -0.978 6.651 -5.653 382 H8 G 17 H8 G 17 -4.825 6.472 -5.259 383 H1 G 17 H1 G 17 -1.658 1.077 -3.760 384 1H2 G 17 1H2 G 17 1.102 3.097 -4.271 385 2H2 G 17 2H2 G 17 0.535 1.476 -3.845 386 H3T G 17 H3T G 17 -0.200 8.323 -6.740 387 2H2* G 17 1H2' G 17 -2.526 7.442 -7.393 388 1H2* G 17 2H2' G 17 -3.686 7.977 -6.135 Start of MODEL 20 1 1H5* C 1 1H5' C 1 0.694 -5.695 -2.235 2 2H5* C 1 2H5' C 1 0.578 -5.977 -3.982 3 H4* C 1 H4' C 1 2.865 -5.050 -4.291 4 H3* C 1 H3' C 1 3.285 -5.456 -1.530 5 H1* C 1 H1' C 1 2.995 -2.095 -3.229 6 1H4 C 1 1H4 C 1 -1.126 2.155 -1.633 7 2H4 C 1 2H4 C 1 -2.380 1.060 -0.997 8 H5 C 1 H5 C 1 -1.922 -1.388 -1.006 9 H6 C 1 H6 C 1 -0.235 -3.059 -1.631 10 H5T C 1 H5T C 1 1.236 -7.832 -2.836 11 2H2* C 1 1H2' C 1 3.374 -2.827 -0.925 12 1H2* C 1 2H2' C 1 1.789 -3.663 -0.907 13 1H5* A 2 1H5' A 2 5.451 -1.653 -3.434 14 2H5* A 2 2H5' A 2 7.042 -1.602 -2.649 15 H4* A 2 H4' A 2 6.223 0.681 -2.895 16 H3* A 2 H3' A 2 6.937 -0.435 -0.329 17 H1* A 2 H1' A 2 4.393 2.212 -1.207 18 H8 A 2 H8 A 2 2.505 -1.002 0.000 19 1H6 A 2 1H6 A 2 -2.221 3.044 0.536 20 2H6 A 2 2H6 A 2 -1.846 1.324 0.802 21 H2 A 2 H2 A 2 1.101 5.217 -0.939 22 2H2* A 2 1H2' A 2 5.265 1.339 0.906 23 1H2* A 2 2H2' A 2 4.697 -0.306 0.483 24 1H5* C 3 1H5' C 3 6.108 4.276 -0.676 25 2H5* C 3 2H5' C 3 7.313 5.009 0.405 26 H4* C 3 H4' C 3 5.204 6.246 0.631 27 H3* C 3 H3' C 3 5.939 4.423 2.959 28 H1* C 3 H1' C 3 2.681 6.042 1.581 29 1H4 C 3 1H4 C 3 -0.670 0.646 3.287 30 2H4 C 3 2H4 C 3 -1.568 2.156 3.595 31 H5 C 3 H5 C 3 1.701 0.854 2.524 32 H6 C 3 H6 C 3 3.433 2.500 1.957 33 2H2* C 3 1H2' C 3 3.958 6.625 3.379 34 1H2* C 3 2H2' C 3 3.959 4.953 4.003 35 1H5* T 4 1H5' T 4 4.873 8.675 3.233 36 2H5* T 4 2H5' T 4 5.683 9.529 4.563 37 H4* T 4 H4' T 4 3.283 10.144 4.407 38 H3* T 4 H3' T 4 4.576 9.278 6.839 39 1H2* T 4 2H2' T 4 3.307 7.286 6.993 40 2H2* T 4 1H2' T 4 2.161 8.415 7.788 41 H1* T 4 H1' T 4 0.972 8.746 5.688 42 H3 T 4 H3 T 4 -1.629 5.086 5.809 43 1H5M T 4 1H5M T 4 2.745 3.192 3.834 44 2H5M T 4 2H5M T 4 3.420 3.244 5.476 45 3H5M T 4 3H5M T 4 2.042 2.201 5.122 46 H6 T 4 H6 T 4 3.108 5.748 5.275 47 1H5* A 5 1H5' A 5 0.178 10.581 6.873 48 2H5* A 5 2H5' A 5 0.121 11.886 8.074 49 H4* A 5 H4' A 5 -2.013 10.717 8.075 50 H3* A 5 H3' A 5 -0.379 11.019 10.445 51 H1* A 5 H1' A 5 -2.796 8.206 9.502 52 H8 A 5 H8 A 5 0.926 7.014 9.495 53 1H6 A 5 1H6 A 5 -1.754 1.381 9.732 54 2H6 A 5 2H6 A 5 -0.144 2.142 9.690 55 H2 A 5 H2 A 5 -4.885 4.232 9.626 56 2H2* A 5 1H2' A 5 -1.630 8.835 11.540 57 1H2* A 5 2H2' A 5 -0.051 8.702 10.712 58 1H5* C 6 1H5' C 6 -4.933 9.880 10.512 59 2H5* C 6 2H5' C 6 -5.625 10.844 11.835 60 H4* C 6 H4' C 6 -6.878 8.727 11.552 61 H3* C 6 H3' C 6 -5.661 9.581 14.067 62 H1* C 6 H1' C 6 -6.417 6.110 12.643 63 1H4 C 6 1H4 C 6 -1.840 2.013 13.561 64 2H4 C 6 2H4 C 6 -0.565 2.991 12.791 65 H5 C 6 H5 C 6 -1.099 5.318 12.102 66 H6 C 6 H6 C 6 -2.926 6.932 11.948 67 2H2* C 6 1H2' C 6 -5.870 6.954 14.865 68 1H2* C 6 2H2' C 6 -4.342 7.652 14.247 69 1H5* T 7 1H5' T 7 -8.677 6.048 14.062 70 2H5* T 7 2H5' T 7 -9.777 6.319 15.429 71 H4* T 7 H4' T 7 -9.256 3.920 15.211 72 H3* T 7 H3' T 7 -8.685 5.461 17.666 73 1H2* T 7 2H2' T 7 -6.498 4.704 17.794 74 2H2* T 7 1H2' T 7 -7.249 3.188 18.370 75 H1* T 7 H1' T 7 -7.209 2.272 16.123 76 H3 T 7 H3 T 7 -2.945 0.966 15.669 77 1H5M T 7 1H5M T 7 -1.306 5.371 15.925 78 2H5M T 7 2H5M T 7 -2.727 6.226 15.308 79 3H5M T 7 3H5M T 7 -2.488 6.044 17.059 80 H6 T 7 H6 T 7 -5.005 5.262 16.353 81 1H5* C 8 1H5' C 8 -10.081 0.839 17.680 82 2H5* C 8 2H5' C 8 -10.816 0.563 19.274 83 H4* C 8 H4' C 8 -9.579 -1.458 18.537 84 H3* C 8 H3' C 8 -8.345 0.106 20.850 85 H1* C 8 H1' C 8 -6.641 -2.190 18.217 86 1H4 C 8 1H4 C 8 -1.337 0.763 19.109 87 2H4 C 8 2H4 C 8 -2.048 2.369 19.365 88 H5 C 8 H5 C 8 -4.515 2.605 19.385 89 H6 C 8 H6 C 8 -6.599 1.331 19.204 90 2H2* C 8 1H2' C 8 -7.726 -2.774 20.149 91 1H2* C 8 2H2' C 8 -6.686 -1.586 20.988 92 1H5* T 9 1H5' T 9 -8.880 -3.953 20.547 93 2H5* T 9 2H5' T 9 -9.550 -4.809 21.950 94 H4* T 9 H4' T 9 -7.709 -6.084 20.805 95 H3* T 9 H3' T 9 -8.006 -5.802 23.598 96 1H2* T 9 2H2' T 9 -6.318 -4.097 23.758 97 2H2* T 9 1H2' T 9 -5.347 -5.573 24.062 98 H1* T 9 H1' T 9 -4.700 -5.680 21.719 99 H3 T 9 H3 T 9 -1.328 -2.721 21.667 100 1H5M T 9 1H5M T 9 -4.087 0.844 23.002 101 2H5M T 9 2H5M T 9 -5.621 0.288 22.317 102 3H5M T 9 3H5M T 9 -5.224 -0.058 24.015 103 H6 T 9 H6 T 9 -6.007 -2.338 22.726 104 1H5* T 10 1H5' T 10 -4.231 -7.772 21.862 105 2H5* T 10 2H5' T 10 -3.917 -9.262 22.775 106 H4* T 10 H4' T 10 -1.787 -8.220 22.121 107 H3* T 10 H3' T 10 -2.469 -8.869 24.862 108 1H2* T 10 2H2' T 10 -2.400 -6.601 25.546 109 2H2* T 10 1H2' T 10 -0.659 -6.987 25.700 110 H1* T 10 H1' T 10 -0.244 -6.151 23.439 111 H3 T 10 H3 T 10 0.273 -1.882 24.774 112 1H5M T 10 1H5M T 10 -4.341 -1.308 25.488 113 2H5M T 10 2H5M T 10 -4.937 -2.465 24.288 114 3H5M T 10 3H5M T 10 -4.767 -2.951 25.989 115 H6 T 10 H6 T 10 -3.542 -4.801 24.447 116 1H5* T 11 1H5' T 11 1.869 -7.542 23.686 117 2H5* T 11 2H5' T 11 2.902 -8.778 24.433 118 H4* T 11 H4' T 11 4.088 -6.642 24.447 119 H3* T 11 H3' T 11 3.598 -8.178 26.840 120 1H2* T 11 2H2' T 11 2.150 -6.517 27.748 121 2H2* T 11 1H2' T 11 3.730 -5.913 28.344 122 H1* T 11 H1' T 11 3.928 -4.442 26.394 123 H3 T 11 H3 T 11 1.613 -1.131 28.409 124 1H5M T 11 1H5M T 11 -2.517 -3.176 27.456 125 2H5M T 11 2H5M T 11 -2.043 -4.111 26.031 126 3H5M T 11 3H5M T 11 -2.035 -4.869 27.637 127 H6 T 11 H6 T 11 0.351 -5.324 26.407 128 1H5* G 12 1H5' G 12 6.636 -4.581 26.412 129 2H5* G 12 2H5' G 12 8.068 -5.277 27.190 130 H4* G 12 H4' G 12 8.204 -2.833 27.284 131 H3* G 12 H3' G 12 8.464 -4.493 29.594 132 H1* G 12 H1' G 12 6.964 -1.046 29.374 133 H8 G 12 H8 G 12 4.026 -3.604 29.732 134 H1 G 12 H1 G 12 2.545 2.528 30.976 135 1H2 G 12 1H2 G 12 4.391 3.775 30.793 136 2H2 G 12 2H2 G 12 5.912 2.987 30.345 137 2H2* G 12 1H2' G 12 7.380 -2.617 31.213 138 1H2* G 12 2H2' G 12 6.310 -3.830 30.440 139 1H5* T 13 1H5' T 13 9.023 0.149 29.491 140 2H5* T 13 2H5' T 13 10.637 0.303 30.210 141 H4* T 13 H4' T 13 9.394 2.411 30.434 142 H3* T 13 H3' T 13 10.718 1.076 32.584 143 1H2* T 13 2H2' T 13 8.676 0.424 33.621 144 2H2* T 13 1H2' T 13 8.939 2.015 34.410 145 H1* T 13 H1' T 13 7.476 3.091 32.770 146 H3 T 13 H3 T 13 3.812 2.006 35.199 147 1H5M T 13 1H5M T 13 3.753 -2.374 33.468 148 2H5M T 13 2H5M T 13 4.548 -2.056 31.919 149 3H5M T 13 3H5M T 13 5.496 -2.635 33.304 150 H6 T 13 H6 T 13 6.731 -0.465 32.283 151 1H5* A 14 1H5' A 14 8.790 5.270 33.045 152 2H5* A 14 2H5' A 14 10.008 6.272 33.860 153 H4* A 14 H4' A 14 7.724 7.048 34.397 154 H3* A 14 H3' A 14 9.735 6.399 36.389 155 H1* A 14 H1' A 14 5.946 6.204 36.528 156 H8 A 14 H8 A 14 7.446 2.580 36.528 157 1H6 A 14 1H6 A 14 1.835 1.207 38.901 158 2H6 A 14 2H6 A 14 3.372 0.423 38.462 159 H2 A 14 H2 A 14 1.882 5.379 38.179 160 2H2* A 14 1H2' A 14 7.714 6.029 38.198 161 1H2* A 14 2H2' A 14 8.442 4.650 37.316 162 1H5* G 15 1H5' G 15 5.781 8.649 37.539 163 2H5* G 15 2H5' G 15 6.364 10.041 38.474 164 H4* G 15 H4' G 15 4.157 9.338 39.309 165 H3* G 15 H3' G 15 6.507 9.564 41.007 166 H1* G 15 H1' G 15 3.411 7.435 41.252 167 H8 G 15 H8 G 15 6.476 5.113 40.513 168 H1 G 15 H1 G 15 1.218 2.175 42.769 169 1H2 G 15 1H2 G 15 -0.039 5.396 42.735 170 2H2 G 15 2H2 G 15 -0.378 3.698 43.100 171 2H2* G 15 1H2' G 15 5.291 7.882 42.777 172 1H2* G 15 2H2' G 15 6.436 7.250 41.551 173 1H5* T 16 1H5' T 16 2.028 9.360 42.643 174 2H5* T 16 2H5' T 16 2.015 10.569 43.943 175 H4* T 16 H4' T 16 0.423 8.751 44.436 176 H3* T 16 H3' T 16 2.609 9.509 46.248 177 1H2* T 16 2H2' T 16 3.411 7.311 46.383 178 2H2* T 16 1H2' T 16 2.036 7.101 47.511 179 H1* T 16 H1' T 16 0.632 6.282 45.691 180 H3 T 16 H3 T 16 2.382 2.125 46.290 181 1H5M T 16 1H5M T 16 5.898 3.052 43.292 182 2H5M T 16 2H5M T 16 5.240 4.469 42.461 183 3H5M T 16 3H5M T 16 6.279 4.676 43.886 184 H6 T 16 H6 T 16 3.858 6.089 43.999 185 1H5* G 17 1H5' G 17 -0.779 6.876 47.839 186 2H5* G 17 2H5' G 17 -1.326 7.630 49.351 187 H4* G 17 H4' G 17 -1.356 5.197 49.609 188 H3* G 17 H3' G 17 0.145 6.945 51.378 189 H1* G 17 H1' G 17 0.653 3.357 50.359 190 H8 G 17 H8 G 17 3.782 5.453 49.379 191 H1 G 17 H1 G 17 4.180 -0.853 48.175 192 1H2 G 17 1H2 G 17 0.896 -0.800 49.264 193 2H2 G 17 2H2 G 17 2.214 -1.807 48.646 194 H3T G 17 H3T G 17 -0.380 5.264 52.850 195 2H2* G 17 1H2' G 17 1.724 4.802 52.036 196 1H2* G 17 2H2' G 17 2.221 5.947 50.750 197 1H5* C 1 1H5' C 1 5.930 -9.207 46.790 198 2H5* C 1 2H5' C 1 6.349 -7.637 46.076 199 H4* C 1 H4' C 1 4.527 -7.973 48.504 200 H3* C 1 H3' C 1 3.848 -8.486 45.703 201 H1* C 1 H1' C 1 2.821 -5.752 48.159 202 1H4 C 1 1H4 C 1 2.963 0.128 46.384 203 2H4 C 1 2H4 C 1 4.554 0.078 45.583 204 H5 C 1 H5 C 1 5.711 -2.131 45.398 205 H6 C 1 H6 C 1 5.495 -4.497 45.981 206 H5T C 1 H5T C 1 6.815 -8.471 48.754 207 2H2* C 1 1H2' C 1 1.959 -6.502 45.988 208 1H2* C 1 2H2' C 1 3.551 -6.202 45.239 209 1H5* A 2 1H5' A 2 0.675 -6.892 48.466 210 2H5* A 2 2H5' A 2 -0.857 -7.753 48.197 211 H4* A 2 H4' A 2 -1.334 -5.374 48.473 212 H3* A 2 H3' A 2 -2.124 -6.826 46.113 213 H1* A 2 H1' A 2 -1.103 -3.170 46.449 214 H8 A 2 H8 A 2 1.344 -5.159 44.147 215 1H6 A 2 1H6 A 2 3.981 0.454 43.466 216 2H6 A 2 2H6 A 2 4.111 -1.215 42.860 217 H2 A 2 H2 A 2 0.855 0.891 46.302 218 2H2* A 2 1H2' A 2 -2.068 -4.502 44.664 219 1H2* A 2 2H2' A 2 -0.664 -5.613 44.690 220 1H5* C 3 1H5' C 3 -3.635 -2.574 47.233 221 2H5* C 3 2H5' C 3 -5.330 -2.401 46.732 222 H4* C 3 H4' C 3 -4.101 -0.248 46.546 223 H3* C 3 H3' C 3 -5.566 -1.485 44.326 224 H1* C 3 H1' C 3 -2.575 0.884 44.481 225 1H4 C 3 1H4 C 3 2.380 -2.028 41.182 226 2H4 C 3 2H4 C 3 2.558 -0.263 41.375 227 H5 C 3 H5 C 3 0.290 -3.076 42.080 228 H6 C 3 H6 C 3 -1.778 -2.568 43.305 229 2H2* C 3 1H2' C 3 -4.126 0.253 42.716 230 1H2* C 3 2H2' C 3 -3.694 -1.473 42.919 231 1H5* T 4 1H5' T 4 -4.484 3.029 44.575 232 2H5* T 4 2H5' T 4 -5.925 3.926 44.052 233 H4* T 4 H4' T 4 -3.827 5.125 43.455 234 H3* T 4 H3' T 4 -5.953 4.497 41.556 235 1H2* T 4 2H2' T 4 -4.528 3.237 40.175 236 2H2* T 4 1H2' T 4 -4.079 4.867 39.573 237 H1* T 4 H1' T 4 -2.190 4.947 41.113 238 H3 T 4 H3 T 4 0.178 2.676 37.952 239 1H5M T 4 1H5M T 4 -1.523 -0.917 41.479 240 2H5M T 4 2H5M T 4 -2.725 -1.083 40.184 241 3H5M T 4 3H5M T 4 -1.024 -1.454 39.869 242 H6 T 4 H6 T 4 -2.846 1.377 41.465 243 1H5* A 5 1H5' A 5 -2.467 7.283 40.665 244 2H5* A 5 2H5' A 5 -3.101 8.757 39.904 245 H4* A 5 H4' A 5 -0.880 8.206 38.999 246 H3* A 5 H3' A 5 -3.299 8.391 37.291 247 H1* A 5 H1' A 5 0.099 6.619 36.990 248 H8 A 5 H8 A 5 -2.952 4.180 37.108 249 1H6 A 5 1H6 A 5 -0.569 0.344 34.948 250 2H6 A 5 2H6 A 5 1.113 0.317 34.361 251 H2 A 5 H2 A 5 3.120 3.982 34.950 252 2H2* A 5 1H2' A 5 -1.527 7.395 35.371 253 1H2* A 5 2H2' A 5 -2.814 6.442 36.168 254 1H5* C 6 1H5' C 6 1.062 9.617 35.934 255 2H5* C 6 2H5' C 6 0.899 10.917 34.734 256 H4* C 6 H4' C 6 2.790 9.407 34.169 257 H3* C 6 H3' C 6 0.475 9.822 32.332 258 H1* C 6 H1' C 6 3.118 7.042 32.852 259 1H4 C 6 1H4 C 6 -0.764 1.684 33.399 260 2H4 C 6 2H4 C 6 0.929 1.301 32.997 261 H5 C 6 H5 C 6 -1.398 4.092 33.592 262 H6 C 6 H6 C 6 -0.487 6.368 33.471 263 2H2* C 6 1H2' C 6 1.938 7.850 30.939 264 1H2* C 6 2H2' C 6 0.363 7.608 31.748 265 1H5* A 7 1H5' A 7 4.267 8.209 31.227 266 2H5* A 7 2H5' A 7 5.049 9.196 29.977 267 H4* A 7 H4' A 7 5.653 6.806 29.741 268 H3* A 7 H3' A 7 4.554 8.437 27.596 269 H1* A 7 H1' A 7 4.362 4.685 28.289 270 H8 A 7 H8 A 7 0.875 6.369 28.816 271 1H6 A 7 1H6 A 7 -1.147 0.531 27.907 272 2H6 A 7 2H6 A 7 -1.765 2.162 28.264 273 H2 A 7 H2 A 7 3.069 0.455 27.512 274 2H2* A 7 1H2' A 7 3.877 6.073 26.345 275 1H2* A 7 2H2' A 7 2.694 7.027 27.290 276 1H5* A 8 1H5' A 8 7.201 4.604 26.966 277 2H5* A 8 2H5' A 8 8.342 5.089 25.694 278 H4* A 8 H4' A 8 7.959 2.620 25.739 279 H3* A 8 H3' A 8 7.806 4.284 23.373 280 H1* A 8 H1' A 8 5.895 1.087 24.277 281 H8 A 8 H8 A 8 3.565 4.221 24.512 282 1H6 A 8 1H6 A 8 -0.876 -0.005 23.347 283 2H6 A 8 2H6 A 8 -0.678 1.738 23.656 284 H2 A 8 H2 A 8 2.823 -2.075 23.383 285 2H2* A 8 1H2' A 8 6.215 2.346 22.230 286 1H2* A 8 2H2' A 8 5.520 3.807 22.995 287 1H5* A 9 1H5' A 9 7.899 -0.384 23.048 288 2H5* A 9 2H5' A 9 9.186 -0.701 21.866 289 H4* A 9 H4' A 9 7.432 -2.438 21.732 290 H3* A 9 H3' A 9 8.311 -0.835 19.447 291 H1* A 9 H1' A 9 4.992 -2.556 20.249 292 H8 A 9 H8 A 9 4.704 1.320 19.870 293 1H6 A 9 1H6 A 9 -1.406 0.120 20.252 294 2H6 A 9 2H6 A 9 -0.284 1.479 19.991 295 H2 A 9 H2 A 9 0.597 -3.577 20.701 296 2H2* A 9 1H2' A 9 5.969 -1.637 18.223 297 1H2* A 9 2H2' A 9 6.150 -0.038 19.006 298 1H5* G 10 1H5' G 10 6.266 -5.000 19.268 299 2H5* G 10 2H5' G 10 7.036 -5.917 17.958 300 H4* G 10 H4' G 10 4.667 -6.591 18.288 301 H3* G 10 H3' G 10 5.816 -5.888 15.734 302 H1* G 10 H1' G 10 2.280 -5.433 17.009 303 H8 G 10 H8 G 10 3.955 -1.989 16.255 304 H1 G 10 H1 G 10 -2.270 -1.737 17.840 305 1H2 G 10 1H2 G 10 -1.827 -5.143 18.272 306 2H2 G 10 2H2 G 10 -2.972 -3.797 18.355 307 2H2* G 10 1H2' G 10 3.348 -5.138 14.837 308 1H2* G 10 2H2' G 10 4.476 -3.932 15.530 309 1H5* A 11 1H5' A 11 1.689 -7.718 16.526 310 2H5* A 11 2H5' A 11 1.393 -8.989 15.324 311 H4* A 11 H4' A 11 -0.722 -7.946 16.138 312 H3* A 11 H3' A 11 -0.041 -8.347 13.358 313 H1* A 11 H1' A 11 -2.130 -5.610 15.017 314 H8 A 11 H8 A 11 1.307 -4.229 13.801 315 1H6 A 11 1H6 A 11 -1.673 1.249 14.157 316 2H6 A 11 2H6 A 11 -0.076 0.572 13.755 317 H2 A 11 H2 A 11 -4.457 -1.746 15.262 318 2H2* A 11 1H2' A 11 -1.740 -6.300 12.707 319 1H2* A 11 2H2' A 11 0.019 -6.023 12.899 320 1H5* G 12 1H5' G 12 -4.341 -7.080 14.725 321 2H5* G 12 2H5' G 12 -5.469 -8.065 13.770 322 H4* G 12 H4' G 12 -6.427 -5.833 14.215 323 H3* G 12 H3' G 12 -6.064 -6.907 11.501 324 H1* G 12 H1' G 12 -6.281 -3.389 12.945 325 H8 G 12 H8 G 12 -2.703 -4.088 11.526 326 H1 G 12 H1 G 12 -4.369 2.108 11.940 327 1H2 G 12 1H2 G 12 -7.309 0.766 13.168 328 2H2 G 12 2H2 G 12 -6.434 2.252 12.773 329 2H2* G 12 1H2' G 12 -6.516 -4.298 10.695 330 1H2* G 12 2H2' G 12 -4.880 -5.022 10.793 331 1H5* T 13 1H5' T 13 -8.942 -3.273 12.003 332 2H5* T 13 2H5' T 13 -10.288 -3.520 10.868 333 H4* T 13 H4' T 13 -9.501 -1.198 10.677 334 H3* T 13 H3' T 13 -8.906 -3.085 8.378 335 1H2* T 13 2H2' T 13 -7.379 -1.665 7.499 336 2H2* T 13 1H2' T 13 -8.463 -0.260 7.688 337 H1* T 13 H1' T 13 -7.561 0.286 9.760 338 H3 T 13 H3 T 13 -3.348 1.437 8.775 339 1H5M T 13 1H5M T 13 -3.479 -3.688 7.570 340 2H5M T 13 2H5M T 13 -1.988 -3.037 8.268 341 3H5M T 13 3H5M T 13 -3.179 -3.822 9.316 342 H6 T 13 H6 T 13 -5.634 -2.796 8.990 343 1H5* A 14 1H5' A 14 -10.691 1.175 7.778 344 2H5* A 14 2H5' A 14 -11.699 1.101 6.318 345 H4* A 14 H4' A 14 -10.393 3.156 6.237 346 H3* A 14 H3' A 14 -10.322 1.240 4.122 347 H1* A 14 H1' A 14 -7.617 3.504 5.307 348 H8 A 14 H8 A 14 -6.331 -0.118 5.840 349 1H6 A 14 1H6 A 14 -1.755 1.266 7.327 350 2H6 A 14 2H6 A 14 -1.180 2.924 7.634 351 H2 A 14 H2 A 14 -4.141 5.848 6.909 352 2H2* A 14 1H2' A 14 -7.735 1.799 3.525 353 1H2* A 14 2H2' A 14 -8.077 0.530 4.747 354 1H5* G 15 1H5' G 15 -10.088 5.830 5.277 355 2H5* G 15 2H5' G 15 -11.232 6.999 4.589 356 H4* G 15 H4' G 15 -9.051 8.066 4.618 357 H3* G 15 H3' G 15 -10.435 7.702 2.152 358 H1* G 15 H1' G 15 -6.686 7.506 2.721 359 H8 G 15 H8 G 15 -8.129 4.110 1.533 360 H1 G 15 H1 G 15 -1.817 4.064 2.758 361 1H2 G 15 1H2 G 15 -2.457 7.301 3.797 362 2H2 G 15 2H2 G 15 -1.225 6.047 3.596 363 2H2* G 15 1H2' G 15 -8.127 7.380 0.753 364 1H2* G 15 2H2' G 15 -8.964 5.947 1.430 365 1H5* T 16 1H5' T 16 -6.203 9.672 2.030 366 2H5* T 16 2H5' T 16 -6.372 11.086 0.969 367 H4* T 16 H4' T 16 -4.173 10.103 0.612 368 H3* T 16 H3' T 16 -6.197 10.120 -1.583 369 1H2* T 16 2H2' T 16 -5.612 7.993 -2.258 370 2H2* T 16 1H2' T 16 -4.080 8.724 -2.821 371 H1* T 16 H1' T 16 -3.008 8.208 -0.713 372 H3 T 16 H3 T 16 -1.893 3.933 -1.256 373 1H5M T 16 1H5M T 16 -7.198 3.831 -0.856 374 2H5M T 16 2H5M T 16 -6.948 3.924 -2.613 375 3H5M T 16 3H5M T 16 -6.356 2.528 -1.701 376 H6 T 16 H6 T 16 -6.129 6.222 -1.229 377 1H5* G 17 1H5' G 17 -1.671 10.151 -2.454 378 2H5* G 17 2H5' G 17 -1.412 11.241 -3.832 379 H4* G 17 H4' G 17 -0.007 9.268 -4.124 380 H3* G 17 H3' G 17 -1.993 10.054 -6.095 381 H1* G 17 H1' G 17 -0.524 6.706 -5.197 382 H8 G 17 H8 G 17 -4.388 6.581 -4.838 383 H1 G 17 H1 G 17 -1.306 1.109 -3.444 384 1H2 G 17 1H2 G 17 0.899 1.470 -3.555 385 2H2 G 17 2H2 G 17 1.479 3.091 -3.965 386 H3T G 17 H3T G 17 -0.436 9.095 -7.480 387 2H2* G 17 1H2' G 17 -1.998 7.469 -7.011 388 1H2* G 17 2H2' G 17 -3.210 8.020 -5.811
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