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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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12414 |
1sy4 ![]() ![]() |
cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H5* G 1 1H5* G 1 -13.309 -12.189 5.266 2 2H5* G 1 2H5* G 1 -12.277 -10.770 5.000 3 H4* G 1 H4* G 1 -12.300 -11.512 7.380 4 H3* G 1 H3* G 1 -9.812 -11.354 5.707 5 H2* G 1 H2* G 1 -8.455 -12.447 7.297 6 2HO* G 1 2HO* G 1 -10.327 -12.663 9.333 7 H1* G 1 H1* G 1 -10.137 -14.397 8.107 8 H8 G 1 H8 G 1 -11.016 -14.152 4.537 9 H1 G 1 H1 G 1 -5.178 -16.615 5.273 10 1H2 G 1 1H2 G 1 -4.497 -16.321 7.370 11 2H2 G 1 2H2 G 1 -5.452 -15.462 8.556 12 H5T G 1 H5T G 1 -10.613 -12.399 4.431 13 1H5* G 2 1H5* G 2 -8.499 -8.828 9.232 14 2H5* G 2 2H5* G 2 -7.325 -7.686 8.548 15 H4* G 2 H4* G 2 -6.445 -9.519 10.160 16 H3* G 2 H3* G 2 -5.306 -8.704 7.486 17 H2* G 2 H2* G 2 -3.696 -10.432 7.536 18 2HO* G 2 2HO* G 2 -4.381 -10.809 10.292 19 H1* G 2 H1* G 2 -5.243 -12.438 8.546 20 H8 G 2 H8 G 2 -7.570 -10.742 6.252 21 H1 G 2 H1 G 2 -3.001 -13.804 3.024 22 1H2 G 2 1H2 G 2 -1.390 -14.438 4.423 23 2H2 G 2 2H2 G 2 -1.324 -13.873 6.076 24 1H5* U 3 1H5* U 3 -1.913 -8.661 10.047 25 2H5* U 3 2H5* U 3 -1.272 -7.015 10.226 26 H4* U 3 H4* U 3 0.635 -8.303 9.713 27 H3* U 3 H3* U 3 -0.515 -6.908 7.283 28 H2* U 3 H2* U 3 1.123 -7.906 5.890 29 2HO* U 3 2HO* U 3 2.660 -9.351 7.479 30 H1* U 3 H1* U 3 1.056 -10.416 6.938 31 H3 U 3 H3 U 3 -1.009 -10.675 2.904 32 H5 U 3 H5 U 3 -3.873 -8.873 5.419 33 H6 U 3 H6 U 3 -2.181 -8.757 7.152 34 1H5* U 4 1H5* U 4 3.547 -6.318 6.650 35 2H5* U 4 2H5* U 4 3.736 -4.830 5.706 36 H4* U 4 H4* U 4 4.178 -7.100 4.524 37 H3* U 4 H3* U 4 2.396 -4.876 3.459 38 H2* U 4 H2* U 4 2.019 -6.166 1.528 39 2HO* U 4 2HO* U 4 3.465 -8.145 1.271 40 H1* U 4 H1* U 4 2.103 -8.692 2.751 41 H3 U 4 H3 U 4 -1.859 -8.087 0.531 42 H5 U 4 H5 U 4 -2.354 -6.208 4.268 43 H6 U 4 H6 U 4 0.034 -6.468 4.641 44 1H5* C 5 1H5* C 5 4.739 -6.451 0.681 45 2H5* C 5 2H5* C 5 6.219 -5.491 0.497 46 H4* C 5 H4* C 5 6.098 -6.097 -1.686 47 H3* C 5 H3* C 5 4.081 -3.870 -1.391 48 H2* C 5 H2* C 5 3.184 -4.276 -3.541 49 2HO* C 5 2HO* C 5 5.135 -4.473 -4.683 50 H1* C 5 H1* C 5 3.181 -6.997 -3.494 51 1H4 C 5 1H4 C 5 -2.582 -5.269 -1.440 52 2H4 C 5 2H4 C 5 -1.926 -4.772 0.104 53 H5 C 5 H5 C 5 0.438 -4.717 0.577 54 H6 C 5 H6 C 5 2.674 -5.229 -0.290 55 1H5* C 6 1H5* C 6 6.505 -3.109 -4.605 56 2H5* C 6 2H5* C 6 6.581 -1.518 -5.389 57 H4* C 6 H4* C 6 4.890 -3.266 -6.314 58 H3* C 6 H3* C 6 4.296 -0.365 -5.640 59 H2* C 6 H2* C 6 2.047 -0.676 -6.309 60 2HO* C 6 2HO* C 6 1.410 -2.375 -7.650 61 H1* C 6 H1* C 6 1.739 -3.296 -5.383 62 1H4 C 6 1H4 C 6 -0.994 0.803 -1.251 63 2H4 C 6 2H4 C 6 0.303 0.387 -0.156 64 H5 C 6 H5 C 6 2.320 -0.711 -0.880 65 H6 C 6 H6 C 6 3.396 -1.921 -2.718 66 1H5* C 7 1H5* C 7 2.974 -0.340 -8.785 67 2H5* C 7 2H5* C 7 3.672 0.215 -10.320 68 H4* C 7 H4* C 7 1.789 1.480 -10.468 69 H3* C 7 H3* C 7 3.486 2.984 -8.441 70 H2* C 7 H2* C 7 1.704 4.488 -8.106 71 2HO* C 7 2HO* C 7 1.085 3.736 -10.722 72 H1* C 7 H1* C 7 -0.391 2.655 -8.468 73 1H4 C 7 1H4 C 7 -0.148 3.905 -2.238 74 2H4 C 7 2H4 C 7 1.076 2.673 -2.044 75 H5 C 7 H5 C 7 2.178 1.620 -3.901 76 H6 C 7 H6 C 7 2.313 1.475 -6.342 77 1H5* C 8 1H5* C 8 2.812 6.267 -11.421 78 2H5* C 8 2H5* C 8 4.078 7.447 -11.028 79 H4* C 8 H4* C 8 1.620 8.039 -10.425 80 H3* C 8 H3* C 8 4.003 8.244 -8.545 81 H2* C 8 H2* C 8 2.575 9.047 -6.864 82 2HO* C 8 2HO* C 8 0.248 9.573 -7.882 83 H1* C 8 H1* C 8 0.251 7.647 -7.644 84 1H4 C 8 1H4 C 8 2.348 5.312 -2.088 85 2H4 C 8 2H4 C 8 3.503 4.312 -2.942 86 H5 C 8 H5 C 8 4.036 4.637 -5.274 87 H6 C 8 H6 C 8 3.352 5.737 -7.356 88 1H5* U 9 1H5* U 9 1.993 12.297 -9.194 89 2H5* U 9 2H5* U 9 3.043 13.615 -8.635 90 H4* U 9 H4* U 9 0.747 13.282 -7.457 91 H3* U 9 H3* U 9 3.429 13.624 -6.065 92 H2* U 9 H2* U 9 2.320 13.517 -3.976 93 2HO* U 9 2HO* U 9 -0.180 13.734 -5.341 94 H1* U 9 H1* U 9 0.464 11.574 -4.643 95 H3 U 9 H3 U 9 3.229 9.963 -1.391 96 H5 U 9 H5 U 9 5.362 9.456 -4.981 97 H6 U 9 H6 U 9 3.651 10.762 -6.107 98 1H5* G 10 1H5* G 10 1.839 17.637 -4.292 99 2H5* G 10 2H5* G 10 3.461 18.208 -3.851 100 H4* G 10 H4* G 10 1.738 17.386 -1.999 101 H3* G 10 H3* G 10 4.734 17.118 -2.185 102 H2* G 10 H2* G 10 4.827 15.651 -0.308 103 2HO* G 10 2HO* G 10 2.698 15.239 0.814 104 H1* G 10 H1* G 10 2.812 14.017 -0.971 105 H8 G 10 H8 G 10 4.018 15.023 -4.319 106 H1 G 10 H1 G 10 8.113 11.047 -1.490 107 1H2 G 10 1H2 G 10 7.652 10.898 0.670 108 2H2 G 10 2H2 G 10 6.356 11.806 1.419 109 1H5* C 11 1H5* C 11 4.678 20.750 0.808 110 2H5* C 11 2H5* C 11 5.924 21.755 0.043 111 H4* C 11 H4* C 11 7.643 20.489 0.860 112 H3* C 11 H3* C 11 6.124 18.310 -0.206 113 H2* C 11 H2* C 11 5.555 17.047 1.639 114 2HO* C 11 2HO* C 11 8.185 17.702 2.529 115 H1* C 11 H1* C 11 6.142 18.587 3.861 116 1H4 C 11 1H4 C 11 -0.220 18.469 3.550 117 2H4 C 11 2H4 C 11 -0.189 19.768 2.380 118 H5 C 11 H5 C 11 1.713 18.566 0.754 119 H6 C 11 H6 C 11 4.157 18.454 0.737 120 1H5* A 12 1H5* A 12 10.378 17.482 1.785 121 2H5* A 12 2H5* A 12 11.045 15.870 1.460 122 H4* A 12 H4* A 12 11.038 16.546 3.897 123 H3* A 12 H3* A 12 10.549 14.039 2.776 124 H2* A 12 H2* A 12 8.195 14.066 3.050 125 2HO* A 12 2HO* A 12 7.922 13.302 5.461 126 H1* A 12 H1* A 12 8.493 15.492 5.690 127 H8 A 12 H8 A 12 6.299 14.945 2.563 128 1H6 A 12 1H6 A 12 1.796 16.264 5.605 129 2H6 A 12 2H6 A 12 2.141 17.769 4.783 130 H2 A 12 H2 A 12 5.607 17.682 8.297 131 1H5* U 13 1H5* U 13 14.132 12.849 6.638 132 2H5* U 13 2H5* U 13 13.497 11.210 6.392 133 H4* U 13 H4* U 13 12.295 11.882 8.272 134 H3* U 13 H3* U 13 10.740 12.566 5.767 135 H2* U 13 H2* U 13 9.137 13.708 7.016 136 2HO* U 13 2HO* U 13 9.919 12.251 9.342 137 H1* U 13 H1* U 13 10.762 14.304 9.306 138 H3 U 13 H3 U 13 8.076 17.771 7.651 139 H5 U 13 H5 U 13 11.881 18.093 5.866 140 H6 U 13 H6 U 13 12.409 15.894 6.749 141 1H5* A 14 1H5* A 14 8.194 8.538 7.267 142 2H5* A 14 2H5* A 14 6.767 8.789 6.244 143 H4* A 14 H4* A 14 7.358 9.815 8.937 144 H3* A 14 H3* A 14 5.198 8.616 7.684 145 H2* A 14 H2* A 14 4.172 10.324 6.522 146 2HO* A 14 2HO* A 14 3.824 11.765 8.924 147 H1* A 14 H1* A 14 5.197 12.721 7.756 148 H8 A 14 H8 A 14 7.470 11.158 5.222 149 1H6 A 14 1H6 A 14 4.133 13.823 0.804 150 2H6 A 14 2H6 A 14 5.518 12.809 1.141 151 H2 A 14 H2 A 14 2.027 14.467 4.686 152 1H5* A 15 1H5* A 15 1.757 9.979 9.443 153 2H5* A 15 2H5* A 15 0.906 8.438 9.211 154 H4* A 15 H4* A 15 0.501 10.344 7.489 155 H3* A 15 H3* A 15 1.182 7.461 6.777 156 H2* A 15 H2* A 15 1.026 8.053 4.521 157 2HO* A 15 2HO* A 15 -1.153 8.937 4.894 158 H1* A 15 H1* A 15 1.642 10.842 4.873 159 H8 A 15 H8 A 15 4.293 8.254 5.741 160 1H6 A 15 1H6 A 15 5.927 8.424 -0.205 161 2H6 A 15 2H6 A 15 6.427 7.921 1.397 162 H2 A 15 H2 A 15 2.197 10.867 0.304 163 1H5* G 16 1H5* G 16 -2.793 9.303 6.041 164 2H5* G 16 2H5* G 16 -4.244 8.295 5.876 165 H4* G 16 H4* G 16 -4.266 9.985 4.126 166 H3* G 16 H3* G 16 -3.676 7.137 3.263 167 H2* G 16 H2* G 16 -3.559 7.870 1.006 168 2HO* G 16 2HO* G 16 -4.187 10.051 0.454 169 H1* G 16 H1* G 16 -2.104 10.131 1.436 170 H8 G 16 H8 G 16 -0.875 7.444 3.770 171 H1 G 16 H1 G 16 1.194 6.646 -2.217 172 1H2 G 16 1H2 G 16 0.259 8.203 -3.522 173 2H2 G 16 2H2 G 16 -1.202 9.026 -3.027 174 1H5* G 17 1H5* G 17 -8.615 7.429 2.175 175 2H5* G 17 2H5* G 17 -8.819 5.688 1.900 176 H4* G 17 H4* G 17 -9.344 7.300 -0.064 177 H3* G 17 H3* G 17 -7.665 4.783 -0.172 178 H2* G 17 H2* G 17 -7.158 5.172 -2.472 179 2HO* G 17 2HO* G 17 -8.222 7.317 -3.297 180 H1* G 17 H1* G 17 -6.450 7.740 -2.244 181 H8 G 17 H8 G 17 -5.587 6.371 1.096 182 H1 G 17 H1 G 17 -1.580 4.221 -3.363 183 1H2 G 17 1H2 G 17 -2.351 4.717 -5.382 184 2H2 G 17 2H2 G 17 -3.856 5.576 -5.629 185 1H5* A 18 1H5* A 18 -10.976 3.798 -3.109 186 2H5* A 18 2H5* A 18 -11.164 2.036 -3.111 187 H4* A 18 H4* A 18 -10.259 3.186 -5.263 188 H3* A 18 H3* A 18 -9.023 0.768 -3.900 189 H2* A 18 H2* A 18 -7.439 0.675 -5.679 190 2HO* A 18 2HO* A 18 -7.730 2.017 -7.564 191 H1* A 18 H1* A 18 -6.991 3.381 -5.870 192 H8 A 18 H8 A 18 -6.964 3.026 -2.268 193 1H6 A 18 1H6 A 18 -1.562 0.106 -2.561 194 2H6 A 18 2H6 A 18 -2.616 1.069 -1.551 195 H2 A 18 H2 A 18 -3.380 0.106 -6.680 196 1H5* U 19 1H5* U 19 -10.170 -0.328 -7.461 197 2H5* U 19 2H5* U 19 -11.065 -1.783 -7.945 198 H4* U 19 H4* U 19 -8.969 -2.185 -8.886 199 H3* U 19 H3* U 19 -9.098 -3.397 -6.104 200 H2* U 19 H2* U 19 -6.868 -4.144 -6.333 201 2HO* U 19 2HO* U 19 -6.560 -5.014 -8.263 202 H1* U 19 H1* U 19 -5.857 -1.924 -7.622 203 H3 U 19 H3 U 19 -3.818 -1.590 -3.628 204 H5 U 19 H5 U 19 -7.894 -1.051 -2.690 205 H6 U 19 H6 U 19 -8.416 -1.540 -5.009 206 1H5* G 20 1H5* G 20 -9.463 -7.108 -9.499 207 2H5* G 20 2H5* G 20 -9.535 -8.558 -8.477 208 H4* G 20 H4* G 20 -7.662 -8.414 -10.271 209 H3* G 20 H3* G 20 -7.354 -9.203 -7.363 210 H2* G 20 H2* G 20 -5.007 -9.424 -7.630 211 2HO* G 20 2HO* G 20 -5.438 -10.428 -9.854 212 H1* G 20 H1* G 20 -4.566 -7.196 -9.126 213 H8 G 20 H8 G 20 -7.264 -6.454 -6.580 214 H1 G 20 H1 G 20 -1.395 -6.336 -4.086 215 1H2 G 20 1H2 G 20 0.090 -6.890 -5.684 216 2H2 G 20 2H2 G 20 -0.421 -7.819 -7.073 217 1H5* A 21 1H5* A 21 -5.235 -12.279 -9.159 218 2H5* A 21 2H5* A 21 -5.229 -13.706 -8.104 219 H4* A 21 H4* A 21 -3.058 -12.273 -8.260 220 H3* A 21 H3* A 21 -4.394 -13.219 -5.698 221 H2* A 21 H2* A 21 -2.748 -12.132 -4.442 222 2HO* A 21 2HO* A 21 -0.794 -11.405 -5.981 223 H1* A 21 H1* A 21 -2.170 -10.047 -6.286 224 H8 A 21 H8 A 21 -5.699 -9.621 -5.561 225 1H6 A 21 1H6 A 21 -4.267 -7.488 0.040 226 2H6 A 21 2H6 A 21 -5.541 -7.649 -1.148 227 H2 A 21 H2 A 21 -0.620 -9.473 -1.672 228 1H5* A 22 1H5* A 22 -0.074 -13.929 -6.259 229 2H5* A 22 2H5* A 22 0.063 -15.683 -6.481 230 H4* A 22 H4* A 22 2.082 -15.348 -5.447 231 H3* A 22 H3* A 22 0.015 -15.614 -3.257 232 H2* A 22 H2* A 22 1.589 -14.997 -1.591 233 2HO* A 22 2HO* A 22 3.720 -14.997 -3.463 234 H1* A 22 H1* A 22 2.790 -12.952 -2.892 235 H8 A 22 H8 A 22 -0.800 -12.890 -3.895 236 1H6 A 22 1H6 A 22 -2.170 -10.419 1.575 237 2H6 A 22 2H6 A 22 -2.776 -10.783 -0.024 238 H2 A 22 H2 A 22 2.100 -11.829 1.698 239 1H5* C 23 1H5* C 23 2.806 -18.724 -1.737 240 2H5* C 23 2H5* C 23 1.763 -19.822 -0.812 241 H4* C 23 H4* C 23 3.411 -18.251 0.480 242 H3* C 23 H3* C 23 0.493 -18.787 1.115 243 H2* C 23 H2* C 23 0.570 -17.252 2.919 244 2HO* C 23 2HO* C 23 3.392 -17.537 2.644 245 H1* C 23 H1* C 23 2.037 -15.287 1.686 246 1H4 C 23 1H4 C 23 -4.168 -13.980 0.997 247 2H4 C 23 2H4 C 23 -4.020 -14.485 -0.671 248 H5 C 23 H5 C 23 -2.077 -15.596 -1.541 249 H6 C 23 H6 C 23 0.157 -16.459 -1.007 250 1H5* C 24 1H5* C 24 2.462 -20.706 4.839 251 2H5* C 24 2H5* C 24 1.297 -21.956 5.322 252 H4* C 24 H4* C 24 1.626 -19.927 6.902 253 H3* C 24 H3* C 24 -1.001 -21.032 5.902 254 H2* C 24 H2* C 24 -2.208 -19.403 7.087 255 2HO* C 24 2HO* C 24 -0.729 -17.903 8.458 256 H1* C 24 H1* C 24 -0.592 -17.276 6.523 257 1H4 C 24 1H4 C 24 -5.313 -17.486 2.214 258 2H4 C 24 2H4 C 24 -4.238 -18.331 1.124 259 H5 C 24 H5 C 24 -2.038 -19.083 1.757 260 H6 C 24 H6 C 24 -0.402 -19.203 3.575 261 H3T C 24 H3T C 24 -0.745 -22.189 7.660 Start of MODEL 2 1 1H5* G 1 1H5* G 1 -12.982 -10.908 1.268 2 2H5* G 1 2H5* G 1 -12.310 -9.267 1.360 3 H4* G 1 H4* G 1 -12.861 -9.772 3.596 4 H3* G 1 H3* G 1 -9.965 -10.028 2.903 5 H2* G 1 H2* G 1 -9.360 -11.204 4.855 6 2HO* G 1 2HO* G 1 -10.591 -9.755 6.251 7 H1* G 1 H1* G 1 -11.427 -12.905 5.075 8 H8 G 1 H8 G 1 -11.197 -12.659 1.411 9 H1 G 1 H1 G 1 -6.131 -15.728 3.777 10 1H2 G 1 1H2 G 1 -6.031 -15.434 5.977 11 2H2 G 1 2H2 G 1 -7.217 -14.496 6.855 12 H5T G 1 H5T G 1 -11.023 -10.648 0.089 13 1H5* G 2 1H5* G 2 -9.603 -7.648 6.676 14 2H5* G 2 2H5* G 2 -8.250 -6.531 6.410 15 H4* G 2 H4* G 2 -7.906 -8.311 8.213 16 H3* G 2 H3* G 2 -6.046 -7.680 5.932 17 H2* G 2 H2* G 2 -4.634 -9.511 6.393 18 2HO* G 2 2HO* G 2 -4.301 -10.170 8.391 19 H1* G 2 H1* G 2 -6.500 -11.391 7.029 20 H8 G 2 H8 G 2 -8.065 -9.560 4.216 21 H1 G 2 H1 G 2 -3.207 -13.185 2.230 22 1H2 G 2 1H2 G 2 -2.082 -13.955 3.990 23 2H2 G 2 2H2 G 2 -2.329 -13.307 5.596 24 1H5* U 3 1H5* U 3 -3.265 -7.435 9.674 25 2H5* U 3 2H5* U 3 -2.506 -5.848 9.437 26 H4* U 3 H4* U 3 -0.780 -7.534 9.817 27 H3* U 3 H3* U 3 -1.019 -6.306 7.058 28 H2* U 3 H2* U 3 0.779 -7.640 6.271 29 2HO* U 3 2HO* U 3 2.308 -8.428 7.577 30 H1* U 3 H1* U 3 0.053 -9.989 7.432 31 H3 U 3 H3 U 3 -0.844 -10.319 2.978 32 H5 U 3 H5 U 3 -4.033 -8.039 4.532 33 H6 U 3 H6 U 3 -2.875 -7.993 6.660 34 1H5* U 4 1H5* U 4 3.103 -5.393 7.498 35 2H5* U 4 2H5* U 4 3.354 -3.972 6.469 36 H4* U 4 H4* U 4 4.219 -6.279 5.632 37 H3* U 4 H3* U 4 2.542 -4.324 4.013 38 H2* U 4 H2* U 4 2.721 -5.786 2.164 39 2HO* U 4 2HO* U 4 4.274 -7.504 2.154 40 H1* U 4 H1* U 4 2.551 -8.174 3.584 41 H3 U 4 H3 U 4 -0.905 -7.658 0.599 42 H5 U 4 H5 U 4 -2.136 -5.748 4.147 43 H6 U 4 H6 U 4 0.135 -5.983 4.984 44 1H5* C 5 1H5* C 5 5.229 -5.764 1.570 45 2H5* C 5 2H5* C 5 6.645 -4.700 1.655 46 H4* C 5 H4* C 5 6.852 -5.127 -0.560 47 H3* C 5 H3* C 5 4.661 -3.063 -0.374 48 H2* C 5 H2* C 5 4.011 -3.378 -2.623 49 2HO* C 5 2HO* C 5 6.113 -5.124 -3.267 50 H1* C 5 H1* C 5 4.230 -6.086 -2.782 51 1H4 C 5 1H4 C 5 -1.840 -5.040 -1.225 52 2H4 C 5 2H4 C 5 -1.385 -4.520 0.380 53 H5 C 5 H5 C 5 0.900 -4.291 1.096 54 H6 C 5 H6 C 5 3.249 -4.563 0.448 55 1H5* C 6 1H5* C 6 7.225 -1.739 -3.443 56 2H5* C 6 2H5* C 6 7.026 -0.044 -3.933 57 H4* C 6 H4* C 6 5.880 -1.880 -5.370 58 H3* C 6 H3* C 6 4.659 0.694 -4.357 59 H2* C 6 H2* C 6 2.538 0.116 -5.241 60 2HO* C 6 2HO* C 6 2.365 -1.756 -6.679 61 H1* C 6 H1* C 6 2.517 -2.530 -4.573 62 1H4 C 6 1H4 C 6 -0.364 0.711 0.128 63 2H4 C 6 2H4 C 6 1.118 0.587 1.048 64 H5 C 6 H5 C 6 3.214 -0.104 0.075 65 H6 C 6 H6 C 6 4.289 -1.026 -1.924 66 1H5* C 7 1H5* C 7 3.694 0.385 -7.885 67 2H5* C 7 2H5* C 7 4.093 1.397 -9.289 68 H4* C 7 H4* C 7 1.779 1.438 -9.397 69 H3* C 7 H3* C 7 2.696 3.728 -7.626 70 H2* C 7 H2* C 7 0.447 4.318 -7.230 71 2HO* C 7 2HO* C 7 -0.952 2.674 -8.826 72 H1* C 7 H1* C 7 -0.616 1.753 -7.146 73 1H4 C 7 1H4 C 7 -0.045 3.947 -1.177 74 2H4 C 7 2H4 C 7 1.591 3.335 -1.116 75 H5 C 7 H5 C 7 2.842 3.001 -3.183 76 H6 C 7 H6 C 7 2.633 2.280 -5.513 77 1H5* C 8 1H5* C 8 0.377 5.875 -10.525 78 2H5* C 8 2H5* C 8 1.322 7.249 -11.132 79 H4* C 8 H4* C 8 -0.689 8.161 -10.194 80 H3* C 8 H3* C 8 1.773 8.476 -8.446 81 H2* C 8 H2* C 8 0.473 9.591 -6.822 82 2HO* C 8 2HO* C 8 -1.929 9.925 -7.766 83 H1* C 8 H1* C 8 -1.840 8.092 -7.074 84 1H4 C 8 1H4 C 8 1.206 6.004 -1.889 85 2H4 C 8 2H4 C 8 2.381 5.169 -2.882 86 H5 C 8 H5 C 8 2.478 5.387 -5.278 87 H6 C 8 H6 C 8 1.394 6.346 -7.257 88 1H5* U 9 1H5* U 9 -0.016 12.712 -9.134 89 2H5* U 9 2H5* U 9 1.296 13.830 -8.703 90 H4* U 9 H4* U 9 -0.884 13.870 -7.273 91 H3* U 9 H3* U 9 1.954 13.730 -6.188 92 H2* U 9 H2* U 9 1.064 13.826 -3.987 93 2HO* U 9 2HO* U 9 -1.081 15.015 -5.321 94 H1* U 9 H1* U 9 -1.102 12.174 -4.423 95 H3 U 9 H3 U 9 1.654 9.992 -1.556 96 H5 U 9 H5 U 9 3.546 9.611 -5.305 97 H6 U 9 H6 U 9 1.887 11.129 -6.221 98 1H5* G 10 1H5* G 10 1.358 17.876 -4.218 99 2H5* G 10 2H5* G 10 3.097 18.201 -4.092 100 H4* G 10 H4* G 10 1.692 17.653 -1.928 101 H3* G 10 H3* G 10 4.478 16.774 -2.692 102 H2* G 10 H2* G 10 4.620 15.304 -0.809 103 2HO* G 10 2HO* G 10 3.186 15.408 0.896 104 H1* G 10 H1* G 10 2.246 14.110 -1.074 105 H8 G 10 H8 G 10 2.906 14.889 -4.609 106 H1 G 10 H1 G 10 6.827 10.317 -2.539 107 1H2 G 10 1H2 G 10 6.812 10.255 -0.324 108 2H2 G 10 2H2 G 10 5.829 11.335 0.638 109 1H5* C 11 1H5* C 11 6.461 20.771 -0.740 110 2H5* C 11 2H5* C 11 7.805 20.193 -1.745 111 H4* C 11 H4* C 11 8.445 18.961 0.040 112 H3* C 11 H3* C 11 5.991 17.512 -0.950 113 H2* C 11 H2* C 11 5.739 16.325 1.031 114 2HO* C 11 2HO* C 11 8.553 16.675 1.244 115 H1* C 11 H1* C 11 7.060 18.092 2.822 116 1H4 C 11 1H4 C 11 0.781 19.402 3.872 117 2H4 C 11 2H4 C 11 0.697 17.658 3.973 118 H5 C 11 H5 C 11 1.876 17.933 1.234 119 H6 C 11 H6 C 11 4.201 17.797 0.470 120 1H5* A 12 1H5* A 12 10.353 15.477 -0.086 121 2H5* A 12 2H5* A 12 10.332 13.704 -0.167 122 H4* A 12 H4* A 12 11.321 14.857 1.956 123 H3* A 12 H3* A 12 10.198 12.340 1.549 124 H2* A 12 H2* A 12 8.050 12.828 2.436 125 2HO* A 12 2HO* A 12 8.395 12.526 4.924 126 H1* A 12 H1* A 12 9.261 14.593 4.552 127 H8 A 12 H8 A 12 6.414 14.406 1.925 128 1H6 A 12 1H6 A 12 2.775 15.958 5.774 129 2H6 A 12 2H6 A 12 3.196 17.558 5.207 130 H2 A 12 H2 A 12 7.171 16.564 7.892 131 1H5* U 13 1H5* U 13 14.263 11.597 4.761 132 2H5* U 13 2H5* U 13 14.268 9.860 4.394 133 H4* U 13 H4* U 13 12.892 9.518 6.138 134 H3* U 13 H3* U 13 11.101 11.136 4.340 135 H2* U 13 H2* U 13 9.613 11.644 6.094 136 2HO* U 13 2HO* U 13 9.490 10.419 7.965 137 H1* U 13 H1* U 13 11.404 11.996 8.138 138 H3 U 13 H3 U 13 9.309 15.917 6.888 139 H5 U 13 H5 U 13 12.787 15.631 4.522 140 H6 U 13 H6 U 13 13.083 13.362 5.352 141 1H5* A 14 1H5* A 14 8.270 7.751 6.019 142 2H5* A 14 2H5* A 14 6.722 8.220 5.290 143 H4* A 14 H4* A 14 7.958 9.091 7.817 144 H3* A 14 H3* A 14 5.453 8.218 7.014 145 H2* A 14 H2* A 14 4.461 10.069 6.062 146 2HO* A 14 2HO* A 14 4.750 10.904 8.767 147 H1* A 14 H1* A 14 6.016 12.284 7.059 148 H8 A 14 H8 A 14 7.545 10.496 4.147 149 1H6 A 14 1H6 A 14 3.788 13.626 0.431 150 2H6 A 14 2H6 A 14 5.049 12.418 0.504 151 H2 A 14 H2 A 14 2.566 14.467 4.643 152 1H5* A 15 1H5* A 15 2.619 9.951 9.387 153 2H5* A 15 2H5* A 15 1.560 8.527 9.336 154 H4* A 15 H4* A 15 1.065 10.488 7.705 155 H3* A 15 H3* A 15 1.262 7.556 6.898 156 H2* A 15 H2* A 15 0.753 8.198 4.709 157 2HO* A 15 2HO* A 15 -0.368 10.627 5.718 158 H1* A 15 H1* A 15 1.728 10.901 4.935 159 H8 A 15 H8 A 15 4.187 8.011 5.258 160 1H6 A 15 1H6 A 15 4.700 8.192 -0.884 161 2H6 A 15 2H6 A 15 5.426 7.592 0.591 162 H2 A 15 H2 A 15 1.425 11.010 0.337 163 1H5* G 16 1H5* G 16 -3.328 9.473 6.894 164 2H5* G 16 2H5* G 16 -4.357 8.040 6.696 165 H4* G 16 H4* G 16 -4.971 9.903 5.144 166 H3* G 16 H3* G 16 -3.999 7.239 4.061 167 H2* G 16 H2* G 16 -4.411 8.063 1.849 168 2HO* G 16 2HO* G 16 -5.257 10.593 2.461 169 H1* G 16 H1* G 16 -3.187 10.444 2.172 170 H8 G 16 H8 G 16 -1.340 7.993 4.335 171 H1 G 16 H1 G 16 -0.048 7.246 -1.867 172 1H2 G 16 1H2 G 16 -1.315 8.673 -3.046 173 2H2 G 16 2H2 G 16 -2.817 9.265 -2.372 174 1H5* G 17 1H5* G 17 -8.897 6.485 3.568 175 2H5* G 17 2H5* G 17 -8.764 4.722 3.409 176 H4* G 17 H4* G 17 -9.689 6.087 1.390 177 H3* G 17 H3* G 17 -7.588 3.903 1.323 178 H2* G 17 H2* G 17 -7.310 4.215 -1.031 179 2HO* G 17 2HO* G 17 -9.843 5.206 -0.828 180 H1* G 17 H1* G 17 -7.059 6.876 -0.987 181 H8 G 17 H8 G 17 -5.646 6.116 2.310 182 H1 G 17 H1 G 17 -1.844 3.880 -2.294 183 1H2 G 17 1H2 G 17 -2.910 3.897 -4.239 184 2H2 G 17 2H2 G 17 -4.576 4.408 -4.391 185 1H5* A 18 1H5* A 18 -10.830 2.458 -1.408 186 2H5* A 18 2H5* A 18 -10.812 0.687 -1.499 187 H4* A 18 H4* A 18 -10.206 2.043 -3.638 188 H3* A 18 H3* A 18 -8.633 -0.288 -2.495 189 H2* A 18 H2* A 18 -7.121 -0.100 -4.327 190 2HO* A 18 2HO* A 18 -9.192 1.474 -5.488 191 H1* A 18 H1* A 18 -6.990 2.638 -4.402 192 H8 A 18 H8 A 18 -6.767 2.146 -0.821 193 1H6 A 18 1H6 A 18 -1.043 0.002 -1.469 194 2H6 A 18 2H6 A 18 -2.168 0.770 -0.373 195 H2 A 18 H2 A 18 -3.036 -0.077 -5.506 196 1H5* U 19 1H5* U 19 -9.737 -1.228 -6.063 197 2H5* U 19 2H5* U 19 -10.470 -2.727 -6.669 198 H4* U 19 H4* U 19 -8.359 -2.800 -7.659 199 H3* U 19 H3* U 19 -8.341 -4.280 -5.014 200 H2* U 19 H2* U 19 -6.038 -4.702 -5.226 201 2HO* U 19 2HO* U 19 -5.723 -3.754 -7.824 202 H1* U 19 H1* U 19 -5.288 -2.318 -6.434 203 H3 U 19 H3 U 19 -3.137 -1.945 -2.510 204 H5 U 19 H5 U 19 -7.202 -2.024 -1.384 205 H6 U 19 H6 U 19 -7.757 -2.441 -3.711 206 1H5* G 20 1H5* G 20 -7.807 -7.023 -9.260 207 2H5* G 20 2H5* G 20 -7.800 -8.681 -8.624 208 H4* G 20 H4* G 20 -6.041 -8.223 -10.379 209 H3* G 20 H3* G 20 -5.479 -9.279 -7.614 210 H2* G 20 H2* G 20 -3.135 -9.147 -7.902 211 2HO* G 20 2HO* G 20 -3.275 -8.378 -10.604 212 H1* G 20 H1* G 20 -2.973 -6.743 -9.126 213 H8 G 20 H8 G 20 -5.812 -6.407 -6.716 214 H1 G 20 H1 G 20 -0.156 -6.196 -3.794 215 1H2 G 20 1H2 G 20 1.463 -6.685 -5.236 216 2H2 G 20 2H2 G 20 1.131 -7.242 -6.860 217 1H5* A 21 1H5* A 21 -3.215 -12.272 -9.434 218 2H5* A 21 2H5* A 21 -3.357 -13.678 -8.361 219 H4* A 21 H4* A 21 -1.157 -12.289 -8.292 220 H3* A 21 H3* A 21 -2.797 -13.165 -5.885 221 H2* A 21 H2* A 21 -1.287 -12.081 -4.463 222 2HO* A 21 2HO* A 21 0.856 -11.419 -5.685 223 H1* A 21 H1* A 21 -0.454 -10.042 -6.260 224 H8 A 21 H8 A 21 -4.044 -9.549 -5.959 225 1H6 A 21 1H6 A 21 -3.202 -7.222 -0.318 226 2H6 A 21 2H6 A 21 -4.348 -7.442 -1.622 227 H2 A 21 H2 A 21 0.563 -9.369 -1.524 228 1H5* A 22 1H5* A 22 1.647 -13.927 -5.748 229 2H5* A 22 2H5* A 22 1.669 -15.689 -5.944 230 H4* A 22 H4* A 22 3.480 -15.519 -4.551 231 H3* A 22 H3* A 22 1.015 -15.592 -2.811 232 H2* A 22 H2* A 22 2.250 -15.048 -0.862 233 2HO* A 22 2HO* A 22 4.481 -15.261 -0.753 234 H1* A 22 H1* A 22 3.871 -13.140 -1.894 235 H8 A 22 H8 A 22 0.613 -12.741 -3.642 236 1H6 A 22 1H6 A 22 -1.646 -10.041 1.410 237 2H6 A 22 2H6 A 22 -1.957 -10.430 -0.267 238 H2 A 22 H2 A 22 2.303 -11.916 2.465 239 1H5* C 23 1H5* C 23 3.086 -18.901 -0.722 240 2H5* C 23 2H5* C 23 1.741 -19.860 -0.077 241 H4* C 23 H4* C 23 3.170 -18.415 1.572 242 H3* C 23 H3* C 23 0.144 -18.636 1.464 243 H2* C 23 H2* C 23 -0.054 -17.070 3.234 244 2HO* C 23 2HO* C 23 1.474 -17.731 4.686 245 H1* C 23 H1* C 23 1.849 -15.293 2.375 246 1H4 C 23 1H4 C 23 -3.848 -13.440 0.202 247 2H4 C 23 2H4 C 23 -3.354 -14.006 -1.378 248 H5 C 23 H5 C 23 -1.381 -15.316 -1.746 249 H6 C 23 H6 C 23 0.571 -16.364 -0.686 250 1H5* C 24 1H5* C 24 0.784 -20.731 5.555 251 2H5* C 24 2H5* C 24 -0.613 -21.825 5.620 252 H4* C 24 H4* C 24 -0.539 -19.852 7.298 253 H3* C 24 H3* C 24 -2.853 -20.608 5.506 254 H2* C 24 H2* C 24 -4.154 -18.844 6.353 255 2HO* C 24 2HO* C 24 -2.198 -18.145 8.280 256 H1* C 24 H1* C 24 -2.197 -16.941 6.383 257 1H4 C 24 1H4 C 24 -5.433 -16.594 0.865 258 2H4 C 24 2H4 C 24 -4.174 -17.545 0.109 259 H5 C 24 H5 C 24 -2.360 -18.550 1.335 260 H6 C 24 H6 C 24 -1.359 -18.858 3.548 261 H3T C 24 H3T C 24 -2.826 -20.585 8.323 Start of MODEL 3 1 1H5* G 1 1H5* G 1 -13.209 -12.150 4.023 2 2H5* G 1 2H5* G 1 -12.649 -10.466 3.980 3 H4* G 1 H4* G 1 -12.617 -11.076 6.278 4 H3* G 1 H3* G 1 -9.966 -10.950 4.888 5 H2* G 1 H2* G 1 -8.771 -12.020 6.618 6 2HO* G 1 2HO* G 1 -10.256 -12.465 8.642 7 H1* G 1 H1* G 1 -10.489 -13.980 7.264 8 H8 G 1 H8 G 1 -11.069 -13.582 3.616 9 H1 G 1 H1 G 1 -5.441 -16.349 4.781 10 1H2 G 1 1H2 G 1 -4.923 -16.128 6.929 11 2H2 G 1 2H2 G 1 -5.990 -15.358 8.079 12 H5T G 1 H5T G 1 -11.719 -12.198 2.486 13 1H5* G 2 1H5* G 2 -8.988 -8.423 8.622 14 2H5* G 2 2H5* G 2 -7.798 -7.265 7.998 15 H4* G 2 H4* G 2 -7.009 -8.975 9.778 16 H3* G 2 H3* G 2 -5.652 -8.190 7.210 17 H2* G 2 H2* G 2 -4.028 -9.891 7.369 18 2HO* G 2 2HO* G 2 -3.797 -11.085 9.399 19 H1* G 2 H1* G 2 -5.572 -11.936 8.299 20 H8 G 2 H8 G 2 -7.782 -10.188 5.892 21 H1 G 2 H1 G 2 -3.187 -13.452 2.912 22 1H2 G 2 1H2 G 2 -1.677 -14.145 4.393 23 2H2 G 2 2H2 G 2 -1.657 -13.551 6.038 24 1H5* U 3 1H5* U 3 -2.174 -8.056 10.136 25 2H5* U 3 2H5* U 3 -1.593 -6.390 9.944 26 H4* U 3 H4* U 3 0.276 -7.940 9.687 27 H3* U 3 H3* U 3 -0.697 -6.433 7.246 28 H2* U 3 H2* U 3 0.923 -7.503 5.888 29 2HO* U 3 2HO* U 3 2.524 -8.929 7.036 30 H1* U 3 H1* U 3 0.679 -10.024 6.892 31 H3 U 3 H3 U 3 -1.246 -10.138 2.788 32 H5 U 3 H5 U 3 -4.070 -8.130 5.190 33 H6 U 3 H6 U 3 -2.451 -8.152 6.996 34 1H5* U 4 1H5* U 4 3.381 -5.687 6.863 35 2H5* U 4 2H5* U 4 3.567 -4.212 5.896 36 H4* U 4 H4* U 4 4.046 -6.504 4.759 37 H3* U 4 H3* U 4 2.275 -4.305 3.623 38 H2* U 4 H2* U 4 1.944 -5.630 1.711 39 2HO* U 4 2HO* U 4 4.162 -7.239 2.525 40 H1* U 4 H1* U 4 2.032 -8.136 2.979 41 H3 U 4 H3 U 4 -1.851 -7.578 0.604 42 H5 U 4 H5 U 4 -2.500 -5.681 4.307 43 H6 U 4 H6 U 4 -0.122 -5.927 4.773 44 1H5* C 5 1H5* C 5 4.813 -6.059 0.986 45 2H5* C 5 2H5* C 5 6.262 -5.046 0.829 46 H4* C 5 H4* C 5 6.305 -5.843 -1.300 47 H3* C 5 H3* C 5 4.247 -3.630 -1.324 48 H2* C 5 H2* C 5 3.527 -4.212 -3.505 49 2HO* C 5 2HO* C 5 5.287 -6.245 -4.060 50 H1* C 5 H1* C 5 3.521 -6.916 -3.238 51 1H4 C 5 1H4 C 5 -2.363 -5.032 -1.709 52 2H4 C 5 2H4 C 5 -1.802 -4.403 -0.177 53 H5 C 5 H5 C 5 0.501 -4.476 0.516 54 H6 C 5 H6 C 5 2.787 -5.053 -0.157 55 1H5* C 6 1H5* C 6 6.701 -2.968 -4.587 56 2H5* C 6 2H5* C 6 6.645 -1.370 -5.360 57 H4* C 6 H4* C 6 5.210 -3.279 -6.385 58 H3* C 6 H3* C 6 4.343 -0.447 -5.779 59 H2* C 6 H2* C 6 2.111 -0.919 -6.385 60 2HO* C 6 2HO* C 6 2.451 -1.915 -8.356 61 H1* C 6 H1* C 6 1.933 -3.510 -5.423 62 1H4 C 6 1H4 C 6 -0.724 0.518 -1.194 63 2H4 C 6 2H4 C 6 0.673 0.232 -0.180 64 H5 C 6 H5 C 6 2.646 -0.918 -0.945 65 H6 C 6 H6 C 6 3.667 -2.125 -2.817 66 1H5* C 7 1H5* C 7 2.984 -0.361 -9.268 67 2H5* C 7 2H5* C 7 3.796 0.654 -10.477 68 H4* C 7 H4* C 7 1.629 1.546 -10.445 69 H3* C 7 H3* C 7 3.464 3.069 -8.572 70 H2* C 7 H2* C 7 1.679 4.415 -7.856 71 2HO* C 7 2HO* C 7 1.044 4.390 -10.369 72 H1* C 7 H1* C 7 -0.383 2.523 -8.091 73 1H4 C 7 1H4 C 7 0.550 3.140 -1.847 74 2H4 C 7 2H4 C 7 2.024 2.207 -1.950 75 H5 C 7 H5 C 7 2.743 1.163 -4.000 76 H6 C 7 H6 C 7 2.554 1.214 -6.441 77 1H5* C 8 1H5* C 8 2.122 6.329 -11.231 78 2H5* C 8 2H5* C 8 3.357 7.602 -11.136 79 H4* C 8 H4* C 8 1.095 8.082 -9.998 80 H3* C 8 H3* C 8 3.814 8.353 -8.680 81 H2* C 8 H2* C 8 2.821 8.874 -6.646 82 2HO* C 8 2HO* C 8 0.315 9.552 -7.725 83 H1* C 8 H1* C 8 0.278 7.636 -7.113 84 1H4 C 8 1H4 C 8 2.842 4.961 -1.946 85 2H4 C 8 2H4 C 8 4.049 4.158 -2.925 86 H5 C 8 H5 C 8 4.285 4.520 -5.296 87 H6 C 8 H6 C 8 3.389 5.698 -7.251 88 1H5* U 9 1H5* U 9 0.708 12.258 -8.776 89 2H5* U 9 2H5* U 9 1.774 13.585 -8.273 90 H4* U 9 H4* U 9 -0.486 13.293 -7.028 91 H3* U 9 H3* U 9 2.241 13.667 -5.755 92 H2* U 9 H2* U 9 1.274 13.526 -3.600 93 2HO* U 9 2HO* U 9 -0.474 14.939 -3.967 94 H1* U 9 H1* U 9 -0.568 11.546 -4.117 95 H3 U 9 H3 U 9 2.546 9.901 -1.218 96 H5 U 9 H5 U 9 4.304 9.548 -5.028 97 H6 U 9 H6 U 9 2.469 10.870 -5.920 98 1H5* G 10 1H5* G 10 0.786 17.600 -3.840 99 2H5* G 10 2H5* G 10 2.430 18.239 -3.635 100 H4* G 10 H4* G 10 1.072 17.412 -1.537 101 H3* G 10 H3* G 10 3.992 17.033 -2.209 102 H2* G 10 H2* G 10 4.316 15.617 -0.305 103 2HO* G 10 2HO* G 10 1.735 15.647 0.657 104 H1* G 10 H1* G 10 2.203 14.025 -0.671 105 H8 G 10 H8 G 10 2.949 15.028 -4.162 106 H1 G 10 H1 G 10 7.278 10.903 -1.967 107 1H2 G 10 1H2 G 10 7.119 10.736 0.234 108 2H2 G 10 2H2 G 10 5.976 11.676 1.168 109 1H5* C 11 1H5* C 11 5.246 20.626 0.427 110 2H5* C 11 2H5* C 11 6.390 21.188 -0.808 111 H4* C 11 H4* C 11 7.992 19.707 -0.175 112 H3* C 11 H3* C 11 5.919 17.803 -0.632 113 H2* C 11 H2* C 11 5.522 16.853 1.430 114 2HO* C 11 2HO* C 11 7.955 16.889 2.605 115 H1* C 11 H1* C 11 6.904 18.377 3.289 116 1H4 C 11 1H4 C 11 1.016 20.477 4.440 117 2H4 C 11 2H4 C 11 0.475 19.927 2.869 118 H5 C 11 H5 C 11 1.977 19.098 1.175 119 H6 C 11 H6 C 11 4.287 18.460 0.679 120 1H5* A 12 1H5* A 12 9.660 17.098 1.017 121 2H5* A 12 2H5* A 12 10.836 15.834 0.607 122 H4* A 12 H4* A 12 11.064 16.174 2.948 123 H3* A 12 H3* A 12 10.263 13.678 1.978 124 H2* A 12 H2* A 12 8.031 13.738 2.714 125 2HO* A 12 2HO* A 12 9.032 12.114 3.993 126 H1* A 12 H1* A 12 8.741 15.304 5.174 127 H8 A 12 H8 A 12 6.180 14.746 2.338 128 1H6 A 12 1H6 A 12 2.095 16.916 6.289 129 2H6 A 12 2H6 A 12 2.392 17.030 4.567 130 H2 A 12 H2 A 12 6.241 17.598 8.060 131 1H5* U 13 1H5* U 13 13.607 12.041 5.720 132 2H5* U 13 2H5* U 13 12.772 10.526 6.116 133 H4* U 13 H4* U 13 12.279 11.774 8.003 134 H3* U 13 H3* U 13 10.122 12.078 5.942 135 H2* U 13 H2* U 13 9.307 14.037 6.847 136 2HO* U 13 2HO* U 13 9.897 13.593 9.503 137 H1* U 13 H1* U 13 11.442 14.474 8.817 138 H3 U 13 H3 U 13 9.263 18.374 7.371 139 H5 U 13 H5 U 13 12.508 17.631 4.783 140 H6 U 13 H6 U 13 12.736 15.440 5.802 141 1H5* A 14 1H5* A 14 7.900 7.854 6.924 142 2H5* A 14 2H5* A 14 7.220 8.974 5.726 143 H4* A 14 H4* A 14 7.813 9.564 8.651 144 H3* A 14 H3* A 14 5.561 8.384 7.480 145 H2* A 14 H2* A 14 4.437 10.140 6.507 146 2HO* A 14 2HO* A 14 4.044 10.331 9.131 147 H1* A 14 H1* A 14 5.705 12.472 7.633 148 H8 A 14 H8 A 14 7.584 10.918 4.799 149 1H6 A 14 1H6 A 14 3.759 13.741 0.901 150 2H6 A 14 2H6 A 14 5.172 12.720 1.034 151 H2 A 14 H2 A 14 2.185 14.335 5.025 152 1H5* A 15 1H5* A 15 2.341 9.752 9.744 153 2H5* A 15 2H5* A 15 1.407 8.258 9.512 154 H4* A 15 H4* A 15 0.882 10.327 8.002 155 H3* A 15 H3* A 15 1.268 7.459 7.041 156 H2* A 15 H2* A 15 0.779 8.207 4.870 157 2HO* A 15 2HO* A 15 -0.573 9.898 4.458 158 H1* A 15 H1* A 15 1.735 10.867 5.210 159 H8 A 15 H8 A 15 4.269 8.094 5.753 160 1H6 A 15 1H6 A 15 5.186 8.190 -0.351 161 2H6 A 15 2H6 A 15 5.798 7.587 1.175 162 H2 A 15 H2 A 15 1.635 10.759 0.589 163 1H5* G 16 1H5* G 16 -2.798 8.902 6.500 164 2H5* G 16 2H5* G 16 -4.128 7.728 6.530 165 H4* G 16 H4* G 16 -4.078 8.965 4.387 166 H3* G 16 H3* G 16 -3.432 5.995 4.382 167 H2* G 16 H2* G 16 -3.142 6.069 2.061 168 2HO* G 16 2HO* G 16 -4.183 8.577 1.551 169 H1* G 16 H1* G 16 -2.266 8.758 1.870 170 H8 G 16 H8 G 16 -0.276 6.496 4.170 171 H1 G 16 H1 G 16 1.364 5.934 -1.970 172 1H2 G 16 1H2 G 16 -0.217 6.893 -3.230 173 2H2 G 16 2H2 G 16 -1.289 8.094 -2.547 174 1H5* G 17 1H5* G 17 -8.175 6.977 2.398 175 2H5* G 17 2H5* G 17 -8.580 5.279 2.079 176 H4* G 17 H4* G 17 -9.042 6.932 0.180 177 H3* G 17 H3* G 17 -7.422 4.386 -0.083 178 H2* G 17 H2* G 17 -7.017 4.855 -2.385 179 2HO* G 17 2HO* G 17 -8.354 6.051 -3.551 180 H1* G 17 H1* G 17 -6.353 7.453 -2.116 181 H8 G 17 H8 G 17 -5.083 5.970 1.033 182 H1 G 17 H1 G 17 -1.574 4.113 -3.954 183 1H2 G 17 1H2 G 17 -2.638 4.588 -5.846 184 2H2 G 17 2H2 G 17 -4.141 5.483 -5.877 185 1H5* A 18 1H5* A 18 -10.803 3.582 -2.899 186 2H5* A 18 2H5* A 18 -11.075 1.830 -2.947 187 H4* A 18 H4* A 18 -10.136 2.989 -5.078 188 H3* A 18 H3* A 18 -9.020 0.480 -3.784 189 H2* A 18 H2* A 18 -7.401 0.363 -5.516 190 2HO* A 18 2HO* A 18 -8.848 2.384 -6.924 191 H1* A 18 H1* A 18 -6.910 3.079 -5.741 192 H8 A 18 H8 A 18 -6.750 2.721 -2.150 193 1H6 A 18 1H6 A 18 -1.399 -0.261 -2.641 194 2H6 A 18 2H6 A 18 -2.342 0.809 -1.630 195 H2 A 18 H2 A 18 -3.374 -0.247 -6.693 196 1H5* U 19 1H5* U 19 -9.983 -0.453 -7.338 197 2H5* U 19 2H5* U 19 -10.871 -1.866 -7.945 198 H4* U 19 H4* U 19 -8.705 -2.296 -8.709 199 H3* U 19 H3* U 19 -9.182 -3.614 -6.026 200 H2* U 19 H2* U 19 -6.961 -4.347 -5.927 201 2HO* U 19 2HO* U 19 -6.917 -3.929 -8.755 202 H1* U 19 H1* U 19 -5.743 -2.213 -7.262 203 H3 U 19 H3 U 19 -3.774 -1.899 -3.236 204 H5 U 19 H5 U 19 -7.858 -1.298 -2.368 205 H6 U 19 H6 U 19 -8.344 -1.762 -4.701 206 1H5* G 20 1H5* G 20 -8.761 -6.829 -9.914 207 2H5* G 20 2H5* G 20 -9.038 -8.404 -9.142 208 H4* G 20 H4* G 20 -7.028 -8.340 -10.659 209 H3* G 20 H3* G 20 -6.870 -9.054 -7.723 210 H2* G 20 H2* G 20 -4.520 -9.308 -7.855 211 2HO* G 20 2HO* G 20 -4.348 -8.901 -10.622 212 H1* G 20 H1* G 20 -3.967 -7.149 -9.429 213 H8 G 20 H8 G 20 -6.730 -6.240 -7.024 214 H1 G 20 H1 G 20 -0.966 -6.168 -4.291 215 1H2 G 20 1H2 G 20 0.530 -7.070 -5.666 216 2H2 G 20 2H2 G 20 0.122 -7.606 -7.278 217 1H5* A 21 1H5* A 21 -4.617 -12.003 -9.283 218 2H5* A 21 2H5* A 21 -4.604 -13.431 -8.227 219 H4* A 21 H4* A 21 -2.512 -11.885 -8.229 220 H3* A 21 H3* A 21 -3.980 -12.864 -5.748 221 H2* A 21 H2* A 21 -2.430 -11.717 -4.419 222 2HO* A 21 2HO* A 21 -0.358 -11.024 -5.434 223 H1* A 21 H1* A 21 -1.829 -9.638 -6.271 224 H8 A 21 H8 A 21 -5.390 -9.280 -5.689 225 1H6 A 21 1H6 A 21 -4.226 -7.056 -0.053 226 2H6 A 21 2H6 A 21 -5.442 -7.237 -1.297 227 H2 A 21 H2 A 21 -0.470 -8.971 -1.608 228 1H5* A 22 1H5* A 22 0.342 -13.490 -5.927 229 2H5* A 22 2H5* A 22 0.509 -15.222 -6.268 230 H4* A 22 H4* A 22 2.409 -15.058 -5.033 231 H3* A 22 H3* A 22 0.158 -15.267 -3.052 232 H2* A 22 H2* A 22 1.485 -14.574 -1.228 233 2HO* A 22 2HO* A 22 3.262 -15.975 -1.748 234 H1* A 22 H1* A 22 2.931 -12.611 -2.400 235 H8 A 22 H8 A 22 -0.448 -12.406 -3.923 236 1H6 A 22 1H6 A 22 -2.543 -9.863 1.282 237 2H6 A 22 2H6 A 22 -2.895 -10.172 -0.404 238 H2 A 22 H2 A 22 1.605 -11.428 2.049 239 1H5* C 23 1H5* C 23 2.922 -18.436 -1.365 240 2H5* C 23 2H5* C 23 1.847 -19.554 -0.502 241 H4* C 23 H4* C 23 3.457 -18.027 0.884 242 H3* C 23 H3* C 23 0.520 -18.568 1.405 243 H2* C 23 H2* C 23 0.514 -17.056 3.226 244 2HO* C 23 2HO* C 23 2.837 -17.946 3.739 245 H1* C 23 H1* C 23 2.031 -15.067 2.089 246 1H4 C 23 1H4 C 23 -4.106 -13.693 1.114 247 2H4 C 23 2H4 C 23 -3.887 -14.195 -0.546 248 H5 C 23 H5 C 23 -1.936 -15.350 -1.324 249 H6 C 23 H6 C 23 0.265 -16.244 -0.694 250 1H5* C 24 1H5* C 24 2.242 -20.764 5.153 251 2H5* C 24 2H5* C 24 1.009 -22.014 5.414 252 H4* C 24 H4* C 24 1.221 -20.129 7.181 253 H3* C 24 H3* C 24 -1.322 -21.059 5.837 254 H2* C 24 H2* C 24 -2.593 -19.495 7.049 255 2HO* C 24 2HO* C 24 -1.950 -18.636 8.933 256 H1* C 24 H1* C 24 -0.879 -17.384 6.804 257 1H4 C 24 1H4 C 24 -5.183 -17.150 2.071 258 2H4 C 24 2H4 C 24 -4.005 -17.897 1.016 259 H5 C 24 H5 C 24 -1.932 -18.834 1.807 260 H6 C 24 H6 C 24 -0.481 -19.139 3.756 261 H3T C 24 H3T C 24 -0.509 -22.473 7.333 Start of MODEL 4 1 1H5* G 1 1H5* G 1 -12.919 -12.509 5.029 2 2H5* G 1 2H5* G 1 -12.872 -10.761 5.338 3 H4* G 1 H4* G 1 -12.195 -11.468 7.411 4 H3* G 1 H3* G 1 -9.766 -11.260 5.644 5 H2* G 1 H2* G 1 -8.372 -12.367 7.198 6 2HO* G 1 2HO* G 1 -8.958 -11.313 9.086 7 H1* G 1 H1* G 1 -10.050 -14.336 7.992 8 H8 G 1 H8 G 1 -10.821 -13.865 4.376 9 H1 G 1 H1 G 1 -5.232 -16.815 5.232 10 1H2 G 1 1H2 G 1 -4.631 -16.685 7.369 11 2H2 G 1 2H2 G 1 -5.581 -15.826 8.561 12 H5T G 1 H5T G 1 -11.781 -11.247 3.435 13 1H5* G 2 1H5* G 2 -8.354 -8.754 9.166 14 2H5* G 2 2H5* G 2 -7.165 -7.642 8.457 15 H4* G 2 H4* G 2 -6.302 -9.498 10.054 16 H3* G 2 H3* G 2 -5.188 -8.716 7.357 17 H2* G 2 H2* G 2 -3.619 -10.484 7.392 18 2HO* G 2 2HO* G 2 -3.338 -9.971 9.842 19 H1* G 2 H1* G 2 -5.205 -12.448 8.429 20 H8 G 2 H8 G 2 -7.495 -10.653 6.156 21 H1 G 2 H1 G 2 -3.134 -13.980 2.901 22 1H2 G 2 1H2 G 2 -1.545 -14.688 4.283 23 2H2 G 2 2H2 G 2 -1.429 -14.120 5.932 24 1H5* U 3 1H5* U 3 -1.719 -8.201 10.028 25 2H5* U 3 2H5* U 3 -1.047 -6.570 9.835 26 H4* U 3 H4* U 3 0.729 -8.164 9.437 27 H3* U 3 H3* U 3 -0.385 -6.747 6.995 28 H2* U 3 H2* U 3 1.174 -7.899 5.618 29 2HO* U 3 2HO* U 3 3.022 -8.745 6.379 30 H1* U 3 H1* U 3 0.879 -10.364 6.732 31 H3 U 3 H3 U 3 -1.220 -10.448 2.696 32 H5 U 3 H5 U 3 -3.906 -8.414 5.229 33 H6 U 3 H6 U 3 -2.205 -8.454 6.957 34 1H5* U 4 1H5* U 4 3.703 -6.132 6.430 35 2H5* U 4 2H5* U 4 3.930 -4.688 5.428 36 H4* U 4 H4* U 4 4.362 -7.016 4.354 37 H3* U 4 H3* U 4 2.631 -4.822 3.145 38 H2* U 4 H2* U 4 2.328 -6.199 1.254 39 2HO* U 4 2HO* U 4 4.064 -8.238 1.799 40 H1* U 4 H1* U 4 2.345 -8.660 2.607 41 H3 U 4 H3 U 4 -1.496 -8.075 0.151 42 H5 U 4 H5 U 4 -2.177 -6.149 3.835 43 H6 U 4 H6 U 4 0.185 -6.424 4.342 44 1H5* C 5 1H5* C 5 4.930 -6.371 0.511 45 2H5* C 5 2H5* C 5 6.463 -5.509 0.274 46 H4* C 5 H4* C 5 6.251 -6.147 -1.892 47 H3* C 5 H3* C 5 4.362 -3.804 -1.605 48 H2* C 5 H2* C 5 3.426 -4.199 -3.737 49 2HO* C 5 2HO* C 5 4.631 -6.073 -4.959 50 H1* C 5 H1* C 5 3.338 -6.933 -3.663 51 1H4 C 5 1H4 C 5 -2.424 -5.033 -1.774 52 2H4 C 5 2H4 C 5 -1.783 -4.462 -0.251 53 H5 C 5 H5 C 5 0.562 -4.490 0.286 54 H6 C 5 H6 C 5 2.806 -5.065 -0.519 55 1H5* C 6 1H5* C 6 6.540 -3.204 -4.878 56 2H5* C 6 2H5* C 6 6.659 -1.622 -5.675 57 H4* C 6 H4* C 6 4.769 -3.249 -6.428 58 H3* C 6 H3* C 6 4.428 -0.312 -5.729 59 H2* C 6 H2* C 6 2.126 -0.479 -6.188 60 2HO* C 6 2HO* C 6 1.328 -2.346 -7.420 61 H1* C 6 H1* C 6 1.787 -3.173 -5.389 62 1H4 C 6 1H4 C 6 -0.974 0.787 -1.153 63 2H4 C 6 2H4 C 6 0.381 0.459 -0.098 64 H5 C 6 H5 C 6 2.347 -0.734 -0.809 65 H6 C 6 H6 C 6 3.415 -1.924 -2.665 66 1H5* C 7 1H5* C 7 2.710 -0.142 -8.537 67 2H5* C 7 2H5* C 7 3.261 0.417 -10.130 68 H4* C 7 H4* C 7 1.461 1.794 -10.038 69 H3* C 7 H3* C 7 3.431 3.137 -8.151 70 H2* C 7 H2* C 7 1.774 4.725 -7.614 71 2HO* C 7 2HO* C 7 1.196 4.495 -10.180 72 H1* C 7 H1* C 7 -0.448 3.009 -7.860 73 1H4 C 7 1H4 C 7 0.064 3.864 -1.609 74 2H4 C 7 2H4 C 7 1.606 3.042 -1.575 75 H5 C 7 H5 C 7 2.384 1.788 -3.500 76 H6 C 7 H6 C 7 2.354 1.694 -5.949 77 1H5* C 8 1H5* C 8 2.619 6.403 -11.036 78 2H5* C 8 2H5* C 8 3.961 7.553 -10.867 79 H4* C 8 H4* C 8 1.668 8.297 -9.961 80 H3* C 8 H3* C 8 4.264 8.346 -8.388 81 H2* C 8 H2* C 8 3.129 9.069 -6.491 82 2HO* C 8 2HO* C 8 0.971 10.137 -6.819 83 H1* C 8 H1* C 8 0.532 8.067 -7.185 84 1H4 C 8 1H4 C 8 2.245 5.452 -1.643 85 2H4 C 8 2H4 C 8 3.436 4.457 -2.450 86 H5 C 8 H5 C 8 4.087 4.801 -4.749 87 H6 C 8 H6 C 8 3.537 5.949 -6.844 88 1H5* U 9 1H5* U 9 1.576 12.425 -8.907 89 2H5* U 9 2H5* U 9 2.667 13.725 -8.390 90 H4* U 9 H4* U 9 0.305 13.612 -7.314 91 H3* U 9 H3* U 9 2.948 13.934 -5.872 92 H2* U 9 H2* U 9 1.850 13.933 -3.778 93 2HO* U 9 2HO* U 9 0.192 15.406 -4.345 94 H1* U 9 H1* U 9 -0.044 12.011 -4.312 95 H3 U 9 H3 U 9 2.808 10.349 -1.177 96 H5 U 9 H5 U 9 4.796 9.795 -4.847 97 H6 U 9 H6 U 9 3.072 11.145 -5.904 98 1H5* G 10 1H5* G 10 1.702 18.095 -4.316 99 2H5* G 10 2H5* G 10 3.381 18.569 -3.993 100 H4* G 10 H4* G 10 1.755 17.939 -2.002 101 H3* G 10 H3* G 10 4.690 17.351 -2.388 102 H2* G 10 H2* G 10 4.755 15.946 -0.456 103 2HO* G 10 2HO* G 10 2.613 15.798 0.761 104 H1* G 10 H1* G 10 2.550 14.510 -0.946 105 H8 G 10 H8 G 10 3.676 15.346 -4.380 106 H1 G 10 H1 G 10 7.378 10.888 -1.738 107 1H2 G 10 1H2 G 10 7.000 10.778 0.439 108 2H2 G 10 2H2 G 10 5.875 11.843 1.252 109 1H5* C 11 1H5* C 11 5.919 20.778 0.403 110 2H5* C 11 2H5* C 11 7.233 21.303 -0.668 111 H4* C 11 H4* C 11 8.641 19.667 0.053 112 H3* C 11 H3* C 11 6.471 17.967 -0.696 113 H2* C 11 H2* C 11 5.809 16.965 1.265 114 2HO* C 11 2HO* C 11 8.490 16.902 2.206 115 H1* C 11 H1* C 11 7.115 18.296 3.320 116 1H4 C 11 1H4 C 11 0.972 20.617 2.340 117 2H4 C 11 2H4 C 11 1.203 20.463 4.068 118 H5 C 11 H5 C 11 2.488 19.507 0.787 119 H6 C 11 H6 C 11 4.786 18.724 0.480 120 1H5* A 12 1H5* A 12 9.962 16.900 1.215 121 2H5* A 12 2H5* A 12 11.100 15.599 0.811 122 H4* A 12 H4* A 12 11.189 15.733 3.167 123 H3* A 12 H3* A 12 10.323 13.374 2.050 124 H2* A 12 H2* A 12 7.982 13.834 2.316 125 2HO* A 12 2HO* A 12 7.848 12.897 4.815 126 H1* A 12 H1* A 12 8.572 14.869 5.097 127 H8 A 12 H8 A 12 6.077 14.741 2.206 128 1H6 A 12 1H6 A 12 2.390 16.980 4.591 129 2H6 A 12 2H6 A 12 2.554 18.469 5.496 130 H2 A 12 H2 A 12 6.459 17.868 7.764 131 1H5* U 13 1H5* U 13 10.821 10.014 5.394 132 2H5* U 13 2H5* U 13 10.016 11.511 4.885 133 H4* U 13 H4* U 13 11.663 10.955 7.337 134 H3* U 13 H3* U 13 8.940 11.854 6.712 135 H2* U 13 H2* U 13 9.335 14.102 7.155 136 2HO* U 13 2HO* U 13 8.501 13.390 9.199 137 H1* U 13 H1* U 13 11.874 13.480 8.661 138 H3 U 13 H3 U 13 11.106 18.111 8.717 139 H5 U 13 H5 U 13 12.966 17.146 5.061 140 H6 U 13 H6 U 13 12.621 14.802 5.580 141 1H5* A 14 1H5* A 14 6.984 8.224 7.766 142 2H5* A 14 2H5* A 14 6.632 9.183 6.317 143 H4* A 14 H4* A 14 6.897 10.253 9.151 144 H3* A 14 H3* A 14 4.695 8.996 7.894 145 H2* A 14 H2* A 14 3.731 10.682 6.677 146 2HO* A 14 2HO* A 14 3.239 12.656 8.162 147 H1* A 14 H1* A 14 5.125 13.037 7.593 148 H8 A 14 H8 A 14 6.860 10.914 5.010 149 1H6 A 14 1H6 A 14 3.677 13.915 0.702 150 2H6 A 14 2H6 A 14 4.868 12.670 0.994 151 H2 A 14 H2 A 14 2.048 15.111 4.682 152 1H5* A 15 1H5* A 15 1.356 10.633 9.641 153 2H5* A 15 2H5* A 15 0.422 9.132 9.463 154 H4* A 15 H4* A 15 0.113 11.007 7.685 155 H3* A 15 H3* A 15 0.608 8.063 7.076 156 H2* A 15 H2* A 15 0.462 8.582 4.802 157 2HO* A 15 2HO* A 15 -0.991 10.937 5.528 158 H1* A 15 H1* A 15 1.233 11.339 5.050 159 H8 A 15 H8 A 15 3.770 8.628 5.935 160 1H6 A 15 1H6 A 15 5.289 8.641 -0.053 161 2H6 A 15 2H6 A 15 5.744 8.056 1.535 162 H2 A 15 H2 A 15 1.657 11.214 0.493 163 1H5* G 16 1H5* G 16 -4.011 9.438 6.195 164 2H5* G 16 2H5* G 16 -4.871 7.985 5.643 165 H4* G 16 H4* G 16 -4.864 10.036 4.065 166 H3* G 16 H3* G 16 -4.108 7.205 3.275 167 H2* G 16 H2* G 16 -3.783 7.959 1.041 168 2HO* G 16 2HO* G 16 -4.457 10.603 1.349 169 H1* G 16 H1* G 16 -2.453 10.265 1.639 170 H8 G 16 H8 G 16 -1.285 7.654 4.058 171 H1 G 16 H1 G 16 1.075 6.761 -1.805 172 1H2 G 16 1H2 G 16 0.212 8.330 -3.164 173 2H2 G 16 2H2 G 16 -1.336 9.047 -2.784 174 1H5* G 17 1H5* G 17 -9.030 7.462 1.993 175 2H5* G 17 2H5* G 17 -9.255 5.719 1.744 176 H4* G 17 H4* G 17 -9.777 7.252 -0.252 177 H3* G 17 H3* G 17 -7.998 4.805 -0.293 178 H2* G 17 H2* G 17 -7.446 5.172 -2.576 179 2HO* G 17 2HO* G 17 -8.995 5.928 -3.807 180 H1* G 17 H1* G 17 -6.946 7.813 -2.424 181 H8 G 17 H8 G 17 -5.870 6.604 0.910 182 H1 G 17 H1 G 17 -1.859 4.666 -3.656 183 1H2 G 17 1H2 G 17 -2.810 4.933 -5.652 184 2H2 G 17 2H2 G 17 -4.297 5.829 -5.860 185 1H5* A 18 1H5* A 18 -11.109 3.675 -3.274 186 2H5* A 18 2H5* A 18 -11.303 1.913 -3.239 187 H4* A 18 H4* A 18 -10.263 2.988 -5.365 188 H3* A 18 H3* A 18 -9.074 0.640 -3.843 189 H2* A 18 H2* A 18 -7.427 0.503 -5.563 190 2HO* A 18 2HO* A 18 -8.099 0.840 -7.539 191 H1* A 18 H1* A 18 -7.066 3.232 -5.879 192 H8 A 18 H8 A 18 -6.968 3.058 -2.287 193 1H6 A 18 1H6 A 18 -1.521 0.201 -2.505 194 2H6 A 18 2H6 A 18 -2.578 1.190 -1.526 195 H2 A 18 H2 A 18 -3.397 -0.039 -6.590 196 1H5* U 19 1H5* U 19 -10.069 -0.626 -7.344 197 2H5* U 19 2H5* U 19 -11.004 -2.057 -7.828 198 H4* U 19 H4* U 19 -8.910 -2.653 -8.623 199 H3* U 19 H3* U 19 -9.161 -3.583 -5.745 200 H2* U 19 H2* U 19 -6.946 -4.376 -5.792 201 2HO* U 19 2HO* U 19 -7.486 -4.600 -8.508 202 H1* U 19 H1* U 19 -5.843 -2.363 -7.356 203 H3 U 19 H3 U 19 -3.745 -1.593 -3.461 204 H5 U 19 H5 U 19 -7.807 -0.968 -2.511 205 H6 U 19 H6 U 19 -8.365 -1.683 -4.762 206 1H5* G 20 1H5* G 20 -9.380 -7.378 -9.168 207 2H5* G 20 2H5* G 20 -9.263 -8.846 -8.177 208 H4* G 20 H4* G 20 -7.684 -8.646 -10.212 209 H3* G 20 H3* G 20 -6.969 -9.449 -7.397 210 H2* G 20 H2* G 20 -4.652 -9.469 -7.864 211 2HO* G 20 2HO* G 20 -5.513 -9.569 -10.574 212 H1* G 20 H1* G 20 -4.478 -7.233 -9.387 213 H8 G 20 H8 G 20 -7.031 -6.419 -6.787 214 H1 G 20 H1 G 20 -1.122 -6.417 -4.398 215 1H2 G 20 1H2 G 20 0.294 -7.279 -5.875 216 2H2 G 20 2H2 G 20 -0.224 -7.875 -7.437 217 1H5* A 21 1H5* A 21 -4.929 -12.548 -9.265 218 2H5* A 21 2H5* A 21 -4.917 -13.938 -8.161 219 H4* A 21 H4* A 21 -2.736 -12.538 -8.405 220 H3* A 21 H3* A 21 -4.042 -13.387 -5.795 221 H2* A 21 H2* A 21 -2.389 -12.260 -4.587 222 2HO* A 21 2HO* A 21 -0.369 -11.631 -5.835 223 H1* A 21 H1* A 21 -1.808 -10.239 -6.497 224 H8 A 21 H8 A 21 -5.334 -9.770 -5.801 225 1H6 A 21 1H6 A 21 -3.903 -7.438 -0.278 226 2H6 A 21 2H6 A 21 -5.195 -7.705 -1.426 227 H2 A 21 H2 A 21 -0.274 -9.546 -1.890 228 1H5* A 22 1H5* A 22 0.368 -14.139 -6.134 229 2H5* A 22 2H5* A 22 0.378 -15.898 -6.357 230 H4* A 22 H4* A 22 2.323 -15.757 -5.164 231 H3* A 22 H3* A 22 0.062 -15.843 -3.180 232 H2* A 22 H2* A 22 1.431 -15.211 -1.364 233 2HO* A 22 2HO* A 22 3.137 -16.707 -1.914 234 H1* A 22 H1* A 22 2.965 -13.330 -2.554 235 H8 A 22 H8 A 22 -0.421 -12.974 -4.049 236 1H6 A 22 1H6 A 22 -2.304 -10.236 1.139 237 2H6 A 22 2H6 A 22 -2.724 -10.608 -0.518 238 H2 A 22 H2 A 22 1.758 -12.019 1.882 239 1H5* C 23 1H5* C 23 2.735 -19.139 -1.550 240 2H5* C 23 2H5* C 23 1.650 -20.222 -0.655 241 H4* C 23 H4* C 23 3.368 -18.771 0.681 242 H3* C 23 H3* C 23 0.429 -19.182 1.305 243 H2* C 23 H2* C 23 0.579 -17.705 3.153 244 2HO* C 23 2HO* C 23 3.308 -17.201 2.991 245 H1* C 23 H1* C 23 2.117 -15.768 1.960 246 1H4 C 23 1H4 C 23 -4.020 -14.192 1.290 247 2H4 C 23 2H4 C 23 -3.892 -14.673 -0.387 248 H5 C 23 H5 C 23 -2.005 -15.865 -1.271 249 H6 C 23 H6 C 23 0.191 -16.834 -0.753 250 1H5* C 24 1H5* C 24 2.153 -21.421 4.972 251 2H5* C 24 2H5* C 24 0.888 -22.624 5.295 252 H4* C 24 H4* C 24 1.229 -20.722 7.024 253 H3* C 24 H3* C 24 -1.395 -21.580 5.791 254 H2* C 24 H2* C 24 -2.560 -19.967 7.047 255 2HO* C 24 2HO* C 24 -1.227 -18.683 8.638 256 H1* C 24 H1* C 24 -0.792 -17.917 6.702 257 1H4 C 24 1H4 C 24 -5.288 -17.579 2.161 258 2H4 C 24 2H4 C 24 -4.200 -18.406 1.069 259 H5 C 24 H5 C 24 -2.101 -19.366 1.769 260 H6 C 24 H6 C 24 -0.574 -19.696 3.654 261 H3T C 24 H3T C 24 -1.582 -22.217 8.113 Start of MODEL 5 1 1H5* G 1 1H5* G 1 -13.574 -11.738 3.846 2 2H5* G 1 2H5* G 1 -12.227 -10.584 3.751 3 H4* G 1 H4* G 1 -12.600 -11.766 6.008 4 H3* G 1 H3* G 1 -10.001 -11.504 4.501 5 H2* G 1 H2* G 1 -8.848 -12.889 6.032 6 2HO* G 1 2HO* G 1 -11.019 -13.138 7.802 7 H1* G 1 H1* G 1 -10.730 -14.809 6.389 8 H8 G 1 H8 G 1 -11.025 -13.862 2.797 9 H1 G 1 H1 G 1 -5.773 -17.310 3.899 10 1H2 G 1 1H2 G 1 -5.412 -17.454 6.087 11 2H2 G 1 2H2 G 1 -6.470 -16.714 7.266 12 H5T G 1 H5T G 1 -12.208 -11.938 1.964 13 1H5* G 2 1H5* G 2 -8.853 -9.578 8.513 14 2H5* G 2 2H5* G 2 -7.535 -8.470 8.083 15 H4* G 2 H4* G 2 -6.970 -10.523 9.566 16 H3* G 2 H3* G 2 -5.481 -9.528 7.137 17 H2* G 2 H2* G 2 -4.012 -11.377 7.153 18 2HO* G 2 2HO* G 2 -4.716 -12.771 9.329 19 H1* G 2 H1* G 2 -5.803 -13.349 7.740 20 H8 G 2 H8 G 2 -7.687 -11.113 5.469 21 H1 G 2 H1 G 2 -3.230 -14.422 2.331 22 1H2 G 2 1H2 G 2 -1.879 -15.429 3.784 23 2H2 G 2 2H2 G 2 -1.904 -15.043 5.489 24 1H5* U 3 1H5* U 3 -2.379 -9.647 10.034 25 2H5* U 3 2H5* U 3 -1.713 -8.040 10.389 26 H4* U 3 H4* U 3 0.183 -9.325 9.824 27 H3* U 3 H3* U 3 -0.836 -7.697 7.477 28 H2* U 3 H2* U 3 0.894 -8.583 6.107 29 2HO* U 3 2HO* U 3 2.346 -8.494 8.195 30 H1* U 3 H1* U 3 0.702 -11.177 6.912 31 H3 U 3 H3 U 3 -1.114 -11.056 2.760 32 H5 U 3 H5 U 3 -4.046 -9.271 5.206 33 H6 U 3 H6 U 3 -2.481 -9.390 7.054 34 1H5* U 4 1H5* U 4 3.230 -6.918 7.432 35 2H5* U 4 2H5* U 4 3.584 -5.402 6.586 36 H4* U 4 H4* U 4 4.122 -7.647 5.386 37 H3* U 4 H3* U 4 2.571 -5.328 4.171 38 H2* U 4 H2* U 4 2.458 -6.535 2.148 39 2HO* U 4 2HO* U 4 3.877 -8.629 2.192 40 H1* U 4 H1* U 4 2.243 -9.096 3.279 41 H3 U 4 H3 U 4 -1.314 -8.164 0.546 42 H5 U 4 H5 U 4 -2.279 -6.496 4.292 43 H6 U 4 H6 U 4 0.010 -6.917 4.996 44 1H5* C 5 1H5* C 5 5.006 -6.682 1.458 45 2H5* C 5 2H5* C 5 6.525 -5.769 1.518 46 H4* C 5 H4* C 5 6.519 -6.003 -0.737 47 H3* C 5 H3* C 5 4.551 -3.777 -0.195 48 H2* C 5 H2* C 5 3.764 -3.802 -2.418 49 2HO* C 5 2HO* C 5 6.076 -5.378 -3.032 50 H1* C 5 H1* C 5 3.773 -6.506 -2.860 51 1H4 C 5 1H4 C 5 -2.181 -5.162 -1.122 52 2H4 C 5 2H4 C 5 -1.670 -4.748 0.498 53 H5 C 5 H5 C 5 0.631 -4.789 1.208 54 H6 C 5 H6 C 5 2.947 -5.192 0.507 55 1H5* C 6 1H5* C 6 7.269 -2.498 -3.167 56 2H5* C 6 2H5* C 6 7.309 -0.780 -3.608 57 H4* C 6 H4* C 6 5.886 -2.397 -5.069 58 H3* C 6 H3* C 6 5.023 0.290 -3.960 59 H2* C 6 H2* C 6 2.873 0.017 -4.931 60 2HO* C 6 2HO* C 6 2.665 -2.055 -6.311 61 H1* C 6 H1* C 6 2.515 -2.628 -4.327 62 1H4 C 6 1H4 C 6 -0.125 0.897 0.321 63 2H4 C 6 2H4 C 6 1.294 0.579 1.294 64 H5 C 6 H5 C 6 3.300 -0.424 0.408 65 H6 C 6 H6 C 6 4.324 -1.460 -1.565 66 1H5* C 7 1H5* C 7 3.903 0.106 -7.326 67 2H5* C 7 2H5* C 7 4.386 1.027 -8.765 68 H4* C 7 H4* C 7 2.095 1.311 -8.875 69 H3* C 7 H3* C 7 3.199 3.512 -7.093 70 H2* C 7 H2* C 7 1.002 4.310 -6.764 71 2HO* C 7 2HO* C 7 -0.491 2.790 -8.399 72 H1* C 7 H1* C 7 -0.284 1.838 -6.724 73 1H4 C 7 1H4 C 7 0.155 4.041 -0.749 74 2H4 C 7 2H4 C 7 1.745 3.329 -0.607 75 H5 C 7 H5 C 7 3.061 2.879 -2.606 76 H6 C 7 H6 C 7 2.921 2.174 -4.945 77 1H5* C 8 1H5* C 8 1.325 5.593 -10.280 78 2H5* C 8 2H5* C 8 2.141 7.087 -10.778 79 H4* C 8 H4* C 8 -0.048 7.642 -9.860 80 H3* C 8 H3* C 8 2.336 8.348 -8.100 81 H2* C 8 H2* C 8 0.811 9.391 -6.610 82 2HO* C 8 2HO* C 8 -0.376 10.388 -8.452 83 H1* C 8 H1* C 8 -1.204 7.501 -6.828 84 1H4 C 8 1H4 C 8 1.970 6.404 -1.409 85 2H4 C 8 2H4 C 8 3.268 5.643 -2.300 86 H5 C 8 H5 C 8 3.395 5.636 -4.704 87 H6 C 8 H6 C 8 2.241 6.239 -6.781 88 1H5* U 9 1H5* U 9 0.474 12.337 -9.095 89 2H5* U 9 2H5* U 9 1.710 13.573 -8.795 90 H4* U 9 H4* U 9 -0.394 13.521 -7.256 91 H3* U 9 H3* U 9 2.487 13.643 -6.268 92 H2* U 9 H2* U 9 1.647 13.804 -4.068 93 2HO* U 9 2HO* U 9 -0.201 14.799 -3.612 94 H1* U 9 H1* U 9 -0.627 12.186 -4.463 95 H3 U 9 H3 U 9 1.829 10.452 -1.033 96 H5 U 9 H5 U 9 3.790 9.181 -4.537 97 H6 U 9 H6 U 9 2.353 10.672 -5.803 98 1H5* G 10 1H5* G 10 2.136 18.201 -5.218 99 2H5* G 10 2H5* G 10 3.897 18.329 -5.034 100 H4* G 10 H4* G 10 2.293 18.261 -2.914 101 H3* G 10 H3* G 10 5.045 17.104 -3.348 102 H2* G 10 H2* G 10 4.981 15.926 -1.271 103 2HO* G 10 2HO* G 10 4.037 17.600 -0.017 104 H1* G 10 H1* G 10 2.529 14.876 -1.493 105 H8 G 10 H8 G 10 3.577 15.113 -5.049 106 H1 G 10 H1 G 10 6.601 10.391 -2.028 107 1H2 G 10 1H2 G 10 6.310 10.583 0.160 108 2H2 G 10 2H2 G 10 5.531 11.978 0.875 109 1H5* C 11 1H5* C 11 6.923 20.683 -0.914 110 2H5* C 11 2H5* C 11 8.224 20.921 -2.097 111 H4* C 11 H4* C 11 9.559 19.387 -1.104 112 H3* C 11 H3* C 11 7.372 17.665 -1.666 113 H2* C 11 H2* C 11 6.574 17.011 0.398 114 2HO* C 11 2HO* C 11 8.399 15.646 0.599 115 H1* C 11 H1* C 11 7.903 18.537 2.294 116 1H4 C 11 1H4 C 11 2.054 20.948 2.549 117 2H4 C 11 2H4 C 11 2.037 21.264 0.828 118 H5 C 11 H5 C 11 3.409 19.623 -0.506 119 H6 C 11 H6 C 11 5.665 18.681 -0.647 120 1H5* A 12 1H5* A 12 10.591 16.301 0.523 121 2H5* A 12 2H5* A 12 11.644 14.904 0.216 122 H4* A 12 H4* A 12 11.367 14.491 2.434 123 H3* A 12 H3* A 12 8.983 13.378 1.023 124 H2* A 12 H2* A 12 7.586 13.407 2.850 125 2HO* A 12 2HO* A 12 8.505 11.964 4.152 126 H1* A 12 H1* A 12 8.998 15.168 4.587 127 H8 A 12 H8 A 12 6.537 14.917 1.656 128 1H6 A 12 1H6 A 12 3.017 18.242 4.532 129 2H6 A 12 2H6 A 12 3.757 19.306 3.359 130 H2 A 12 H2 A 12 7.317 18.684 6.753 131 1H5* U 13 1H5* U 13 11.973 11.892 3.870 132 2H5* U 13 2H5* U 13 12.127 10.336 4.709 133 H4* U 13 H4* U 13 11.955 11.306 6.746 134 H3* U 13 H3* U 13 9.526 12.550 5.499 135 H2* U 13 H2* U 13 9.827 14.590 6.531 136 2HO* U 13 2HO* U 13 9.382 13.116 8.532 137 H1* U 13 H1* U 13 12.426 13.976 7.790 138 H3 U 13 H3 U 13 11.660 18.564 7.225 139 H5 U 13 H5 U 13 13.366 17.078 3.668 140 H6 U 13 H6 U 13 13.006 14.831 4.512 141 1H5* A 14 1H5* A 14 6.760 8.923 7.189 142 2H5* A 14 2H5* A 14 5.957 9.820 5.885 143 H4* A 14 H4* A 14 6.829 10.807 8.607 144 H3* A 14 H3* A 14 4.369 9.969 7.583 145 H2* A 14 H2* A 14 3.621 11.747 6.332 146 2HO* A 14 2HO* A 14 2.537 12.431 8.142 147 H1* A 14 H1* A 14 5.348 13.919 7.096 148 H8 A 14 H8 A 14 6.761 11.432 4.649 149 1H6 A 14 1H6 A 14 3.908 14.497 0.162 150 2H6 A 14 2H6 A 14 4.883 13.096 0.540 151 H2 A 14 H2 A 14 2.538 16.198 4.057 152 1H5* A 15 1H5* A 15 1.501 12.194 9.756 153 2H5* A 15 2H5* A 15 0.315 10.874 9.709 154 H4* A 15 H4* A 15 0.082 12.847 8.008 155 H3* A 15 H3* A 15 -0.047 9.887 7.276 156 H2* A 15 H2* A 15 -0.640 10.592 5.083 157 2HO* A 15 2HO* A 15 -1.808 12.596 6.420 158 H1* A 15 H1* A 15 1.049 12.831 5.036 159 H8 A 15 H8 A 15 2.668 9.609 6.252 160 1H6 A 15 1H6 A 15 3.922 8.394 0.337 161 2H6 A 15 2H6 A 15 4.193 7.887 1.991 162 H2 A 15 H2 A 15 1.188 11.943 0.491 163 1H5* G 16 1H5* G 16 -4.481 10.879 6.652 164 2H5* G 16 2H5* G 16 -5.217 9.265 6.711 165 H4* G 16 H4* G 16 -5.154 10.507 4.424 166 H3* G 16 H3* G 16 -4.238 7.641 4.887 167 H2* G 16 H2* G 16 -3.749 7.478 2.615 168 2HO* G 16 2HO* G 16 -5.198 9.763 1.852 169 H1* G 16 H1* G 16 -3.268 10.266 2.165 170 H8 G 16 H8 G 16 -0.961 8.515 4.600 171 H1 G 16 H1 G 16 0.546 7.436 -1.504 172 1H2 G 16 1H2 G 16 -1.003 8.331 -2.814 173 2H2 G 16 2H2 G 16 -2.512 8.951 -2.186 174 1H5* G 17 1H5* G 17 -9.033 7.420 2.860 175 2H5* G 17 2H5* G 17 -9.109 5.649 2.763 176 H4* G 17 H4* G 17 -9.757 6.973 0.650 177 H3* G 17 H3* G 17 -7.805 4.662 0.785 178 H2* G 17 H2* G 17 -7.356 4.865 -1.548 179 2HO* G 17 2HO* G 17 -9.761 5.466 -1.863 180 H1* G 17 H1* G 17 -7.000 7.523 -1.616 181 H8 G 17 H8 G 17 -5.737 6.906 1.753 182 H1 G 17 H1 G 17 -1.867 4.211 -2.537 183 1H2 G 17 1H2 G 17 -2.857 4.149 -4.521 184 2H2 G 17 2H2 G 17 -4.498 4.701 -4.771 185 1H5* A 18 1H5* A 18 -10.565 3.693 -2.401 186 2H5* A 18 2H5* A 18 -10.804 1.945 -2.560 187 H4* A 18 H4* A 18 -9.700 3.218 -4.539 188 H3* A 18 H3* A 18 -8.619 0.677 -3.270 189 H2* A 18 H2* A 18 -6.908 0.682 -4.920 190 2HO* A 18 2HO* A 18 -7.067 1.965 -6.802 191 H1* A 18 H1* A 18 -6.515 3.430 -5.001 192 H8 A 18 H8 A 18 -6.408 2.936 -1.440 193 1H6 A 18 1H6 A 18 -0.944 0.158 -1.940 194 2H6 A 18 2H6 A 18 -2.013 1.033 -0.868 195 H2 A 18 H2 A 18 -2.858 0.222 -6.010 196 1H5* U 19 1H5* U 19 -9.472 -0.167 -6.915 197 2H5* U 19 2H5* U 19 -10.328 -1.579 -7.570 198 H4* U 19 H4* U 19 -8.146 -1.974 -8.298 199 H3* U 19 H3* U 19 -8.611 -3.318 -5.620 200 H2* U 19 H2* U 19 -6.381 -4.051 -5.575 201 2HO* U 19 2HO* U 19 -5.104 -4.144 -7.479 202 H1* U 19 H1* U 19 -5.209 -1.852 -6.839 203 H3 U 19 H3 U 19 -3.254 -1.584 -2.805 204 H5 U 19 H5 U 19 -7.351 -1.080 -1.930 205 H6 U 19 H6 U 19 -7.827 -1.521 -4.269 206 1H5* G 20 1H5* G 20 -8.398 -6.595 -9.505 207 2H5* G 20 2H5* G 20 -8.451 -8.180 -8.706 208 H4* G 20 H4* G 20 -6.571 -7.793 -10.420 209 H3* G 20 H3* G 20 -6.265 -8.869 -7.616 210 H2* G 20 H2* G 20 -3.907 -8.935 -7.811 211 2HO* G 20 2HO* G 20 -4.125 -8.329 -10.593 212 H1* G 20 H1* G 20 -3.520 -6.564 -9.088 213 H8 G 20 H8 G 20 -6.306 -5.984 -6.656 214 H1 G 20 H1 G 20 -0.624 -6.213 -3.785 215 1H2 G 20 1H2 G 20 0.928 -6.883 -5.223 216 2H2 G 20 2H2 G 20 0.556 -7.308 -6.878 217 1H5* A 21 1H5* A 21 -4.134 -11.899 -9.536 218 2H5* A 21 2H5* A 21 -4.290 -13.377 -8.566 219 H4* A 21 H4* A 21 -2.044 -12.063 -8.461 220 H3* A 21 H3* A 21 -3.646 -13.075 -6.085 221 H2* A 21 H2* A 21 -2.091 -12.127 -4.622 222 2HO* A 21 2HO* A 21 -0.075 -11.616 -6.474 223 H1* A 21 H1* A 21 -1.215 -10.001 -6.299 224 H8 A 21 H8 A 21 -4.767 -9.387 -5.852 225 1H6 A 21 1H6 A 21 -3.664 -7.529 -0.079 226 2H6 A 21 2H6 A 21 -4.867 -7.627 -1.345 227 H2 A 21 H2 A 21 -0.033 -9.729 -1.564 228 1H5* A 22 1H5* A 22 0.596 -13.979 -6.213 229 2H5* A 22 2H5* A 22 0.707 -15.693 -6.660 230 H4* A 22 H4* A 22 2.580 -15.675 -5.372 231 H3* A 22 H3* A 22 0.276 -15.911 -3.446 232 H2* A 22 H2* A 22 1.624 -15.439 -1.565 233 2HO* A 22 2HO* A 22 3.790 -16.078 -3.306 234 H1* A 22 H1* A 22 3.184 -13.470 -2.590 235 H8 A 22 H8 A 22 -0.159 -12.917 -4.077 236 1H6 A 22 1H6 A 22 -2.121 -10.703 1.327 237 2H6 A 22 2H6 A 22 -2.503 -10.885 -0.371 238 H2 A 22 H2 A 22 1.893 -12.632 1.965 239 1H5* C 23 1H5* C 23 2.707 -19.510 -2.050 240 2H5* C 23 2H5* C 23 1.481 -20.607 -1.380 241 H4* C 23 H4* C 23 3.150 -19.434 0.256 242 H3* C 23 H3* C 23 0.148 -19.715 0.571 243 H2* C 23 H2* C 23 0.196 -18.449 2.572 244 2HO* C 23 2HO* C 23 1.918 -19.313 3.661 245 H1* C 23 H1* C 23 1.963 -16.509 1.760 246 1H4 C 23 1H4 C 23 -3.994 -14.473 0.718 247 2H4 C 23 2H4 C 23 -3.694 -14.712 -0.987 248 H5 C 23 H5 C 23 -1.815 -15.946 -1.825 249 H6 C 23 H6 C 23 0.276 -17.092 -1.228 250 1H5* C 24 1H5* C 24 1.336 -22.536 4.091 251 2H5* C 24 2H5* C 24 -0.049 -23.648 4.092 252 H4* C 24 H4* C 24 0.219 -22.033 6.103 253 H3* C 24 H3* C 24 -2.287 -22.482 4.473 254 H2* C 24 H2* C 24 -3.479 -20.942 5.788 255 2HO* C 24 2HO* C 24 -1.671 -20.136 7.606 256 H1* C 24 H1* C 24 -1.531 -19.035 5.952 257 1H4 C 24 1H4 C 24 -5.338 -17.648 1.006 258 2H4 C 24 2H4 C 24 -4.228 -18.488 -0.053 259 H5 C 24 H5 C 24 -2.283 -19.671 0.744 260 H6 C 24 H6 C 24 -1.044 -20.388 2.730 261 H3T C 24 H3T C 24 -2.456 -23.079 7.066 Start of MODEL 6 1 1H5* G 1 1H5* G 1 -13.500 -12.174 3.982 2 2H5* G 1 2H5* G 1 -12.447 -10.745 3.958 3 H4* G 1 H4* G 1 -12.584 -11.782 6.214 4 H3* G 1 H3* G 1 -10.005 -11.520 4.689 5 H2* G 1 H2* G 1 -8.778 -12.810 6.241 6 2HO* G 1 2HO* G 1 -10.492 -13.389 8.192 7 H1* G 1 H1* G 1 -10.560 -14.777 6.729 8 H8 G 1 H8 G 1 -11.118 -14.062 3.135 9 H1 G 1 H1 G 1 -5.537 -17.008 4.072 10 1H2 G 1 1H2 G 1 -5.041 -17.004 6.238 11 2H2 G 1 2H2 G 1 -6.053 -16.226 7.434 12 H5T G 1 H5T G 1 -10.766 -12.318 3.265 13 1H5* G 2 1H5* G 2 -8.876 -9.496 8.725 14 2H5* G 2 2H5* G 2 -7.639 -8.325 8.231 15 H4* G 2 H4* G 2 -6.932 -10.253 9.819 16 H3* G 2 H3* G 2 -5.519 -9.242 7.360 17 H2* G 2 H2* G 2 -3.944 -10.997 7.374 18 2HO* G 2 2HO* G 2 -3.305 -11.037 9.492 19 H1* G 2 H1* G 2 -5.567 -13.072 8.058 20 H8 G 2 H8 G 2 -7.640 -10.985 5.789 21 H1 G 2 H1 G 2 -3.112 -14.151 2.606 22 1H2 G 2 1H2 G 2 -1.646 -15.008 4.032 23 2H2 G 2 2H2 G 2 -1.710 -14.683 5.751 24 1H5* U 3 1H5* U 3 -2.292 -9.096 10.416 25 2H5* U 3 2H5* U 3 -1.721 -7.417 10.510 26 H4* U 3 H4* U 3 0.223 -8.766 10.147 27 H3* U 3 H3* U 3 -0.781 -7.297 7.694 28 H2* U 3 H2* U 3 0.973 -8.232 6.393 29 2HO* U 3 2HO* U 3 2.319 -8.111 8.648 30 H1* U 3 H1* U 3 0.825 -10.778 7.345 31 H3 U 3 H3 U 3 -0.948 -10.889 3.166 32 H5 U 3 H5 U 3 -3.977 -9.155 5.533 33 H6 U 3 H6 U 3 -2.412 -9.109 7.384 34 1H5* U 4 1H5* U 4 3.195 -6.542 7.417 35 2H5* U 4 2H5* U 4 3.461 -5.069 6.466 36 H4* U 4 H4* U 4 3.925 -7.363 5.337 37 H3* U 4 H3* U 4 2.231 -5.134 4.144 38 H2* U 4 H2* U 4 1.983 -6.446 2.202 39 2HO* U 4 2HO* U 4 3.439 -8.493 2.194 40 H1* U 4 H1* U 4 1.936 -8.947 3.473 41 H3 U 4 H3 U 4 -1.833 -8.169 0.943 42 H5 U 4 H5 U 4 -2.584 -6.462 4.721 43 H6 U 4 H6 U 4 -0.239 -6.795 5.265 44 1H5* C 5 1H5* C 5 4.566 -6.526 1.543 45 2H5* C 5 2H5* C 5 6.128 -5.702 1.371 46 H4* C 5 H4* C 5 5.940 -6.244 -0.823 47 H3* C 5 H3* C 5 4.082 -3.875 -0.492 48 H2* C 5 H2* C 5 3.245 -4.171 -2.686 49 2HO* C 5 2HO* C 5 4.641 -6.182 -3.712 50 H1* C 5 H1* C 5 3.108 -6.905 -2.704 51 1H4 C 5 1H4 C 5 -2.715 -4.961 -1.086 52 2H4 C 5 2H4 C 5 -2.146 -4.396 0.468 53 H5 C 5 H5 C 5 0.147 -4.583 1.176 54 H6 C 5 H6 C 5 2.421 -5.187 0.491 55 1H5* C 6 1H5* C 6 6.799 -3.066 -3.683 56 2H5* C 6 2H5* C 6 6.839 -1.419 -4.342 57 H4* C 6 H4* C 6 5.403 -3.209 -5.572 58 H3* C 6 H3* C 6 4.545 -0.401 -4.810 59 H2* C 6 H2* C 6 2.392 -0.801 -5.739 60 2HO* C 6 2HO* C 6 1.988 -2.561 -7.116 61 H1* C 6 H1* C 6 2.057 -3.368 -4.822 62 1H4 C 6 1H4 C 6 -0.664 0.739 -0.696 63 2H4 C 6 2H4 C 6 0.682 0.426 0.373 64 H5 C 6 H5 C 6 2.655 -0.766 -0.304 65 H6 C 6 H6 C 6 3.727 -2.011 -2.119 66 1H5* C 7 1H5* C 7 3.876 -0.213 -8.752 67 2H5* C 7 2H5* C 7 4.818 0.966 -9.687 68 H4* C 7 H4* C 7 2.498 1.481 -10.051 69 H3* C 7 H3* C 7 3.982 3.332 -8.168 70 H2* C 7 H2* C 7 2.024 4.547 -7.730 71 2HO* C 7 2HO* C 7 0.696 3.372 -9.952 72 H1* C 7 H1* C 7 0.157 2.473 -8.019 73 1H4 C 7 1H4 C 7 0.539 3.968 -1.828 74 2H4 C 7 2H4 C 7 1.577 2.578 -1.623 75 H5 C 7 H5 C 7 2.647 1.473 -3.475 76 H6 C 7 H6 C 7 2.786 1.318 -5.913 77 1H5* C 8 1H5* C 8 2.526 6.114 -11.010 78 2H5* C 8 2H5* C 8 3.611 7.516 -11.115 79 H4* C 8 H4* C 8 1.403 7.993 -9.976 80 H3* C 8 H3* C 8 4.079 8.396 -8.601 81 H2* C 8 H2* C 8 3.017 8.978 -6.620 82 2HO* C 8 2HO* C 8 0.486 9.535 -7.547 83 H1* C 8 H1* C 8 0.511 7.671 -7.112 84 1H4 C 8 1H4 C 8 2.893 5.316 -1.711 85 2H4 C 8 2H4 C 8 4.124 4.447 -2.600 86 H5 C 8 H5 C 8 4.491 4.729 -4.969 87 H6 C 8 H6 C 8 3.677 5.807 -7.016 88 1H5* U 9 1H5* U 9 0.990 12.339 -9.100 89 2H5* U 9 2H5* U 9 2.051 13.674 -8.606 90 H4* U 9 H4* U 9 -0.288 13.506 -7.493 91 H3* U 9 H3* U 9 2.362 13.878 -6.068 92 H2* U 9 H2* U 9 1.269 13.857 -3.973 93 2HO* U 9 2HO* U 9 -1.231 14.116 -5.333 94 H1* U 9 H1* U 9 -0.659 11.953 -4.541 95 H3 U 9 H3 U 9 2.075 10.339 -1.258 96 H5 U 9 H5 U 9 4.137 9.627 -4.859 97 H6 U 9 H6 U 9 2.471 10.978 -6.002 98 1H5* G 10 1H5* G 10 0.979 17.937 -4.414 99 2H5* G 10 2H5* G 10 2.634 18.533 -4.186 100 H4* G 10 H4* G 10 1.196 17.854 -2.095 101 H3* G 10 H3* G 10 4.115 17.355 -2.660 102 H2* G 10 H2* G 10 4.354 15.942 -0.752 103 2HO* G 10 2HO* G 10 2.071 15.820 0.468 104 H1* G 10 H1* G 10 2.143 14.457 -1.055 105 H8 G 10 H8 G 10 3.051 15.302 -4.562 106 H1 G 10 H1 G 10 6.893 10.844 -2.137 107 1H2 G 10 1H2 G 10 6.667 10.768 0.064 108 2H2 G 10 2H2 G 10 5.577 11.826 0.931 109 1H5* C 11 1H5* C 11 5.209 20.962 0.179 110 2H5* C 11 2H5* C 11 6.437 21.593 -0.936 111 H4* C 11 H4* C 11 8.047 20.216 -0.125 112 H3* C 11 H3* C 11 6.166 18.207 -0.878 113 H2* C 11 H2* C 11 5.617 17.149 1.093 114 2HO* C 11 2HO* C 11 8.385 17.159 1.237 115 H1* C 11 H1* C 11 6.664 18.691 3.144 116 1H4 C 11 1H4 C 11 0.583 20.876 3.125 117 2H4 C 11 2H4 C 11 0.190 19.259 2.584 118 H5 C 11 H5 C 11 1.973 19.197 0.488 119 H6 C 11 H6 C 11 4.365 18.736 0.242 120 1H5* A 12 1H5* A 12 10.245 17.166 0.853 121 2H5* A 12 2H5* A 12 10.986 15.599 0.471 122 H4* A 12 H4* A 12 11.178 16.084 2.870 123 H3* A 12 H3* A 12 10.234 13.686 1.781 124 H2* A 12 H2* A 12 7.968 13.948 2.377 125 2HO* A 12 2HO* A 12 7.928 13.268 4.825 126 H1* A 12 H1* A 12 8.715 15.370 4.922 127 H8 A 12 H8 A 12 6.159 15.015 2.058 128 1H6 A 12 1H6 A 12 2.616 17.885 4.141 129 2H6 A 12 2H6 A 12 2.231 17.606 5.825 130 H2 A 12 H2 A 12 6.417 18.053 7.679 131 1H5* U 13 1H5* U 13 14.228 12.085 5.073 132 2H5* U 13 2H5* U 13 13.406 10.539 4.778 133 H4* U 13 H4* U 13 12.467 11.208 6.814 134 H3* U 13 H3* U 13 10.747 12.129 4.503 135 H2* U 13 H2* U 13 9.387 13.351 5.940 136 2HO* U 13 2HO* U 13 8.808 11.474 7.139 137 H1* U 13 H1* U 13 11.256 13.579 8.134 138 H3 U 13 H3 U 13 8.700 17.385 7.205 139 H5 U 13 H5 U 13 12.243 17.633 4.937 140 H6 U 13 H6 U 13 12.717 15.329 5.546 141 1H5* A 14 1H5* A 14 7.906 8.579 6.470 142 2H5* A 14 2H5* A 14 6.387 8.979 5.643 143 H4* A 14 H4* A 14 7.455 9.958 8.207 144 H3* A 14 H3* A 14 5.023 8.995 7.284 145 H2* A 14 H2* A 14 4.020 10.806 6.267 146 2HO* A 14 2HO* A 14 3.029 12.172 7.670 147 H1* A 14 H1* A 14 5.477 13.077 7.275 148 H8 A 14 H8 A 14 7.171 11.226 4.491 149 1H6 A 14 1H6 A 14 3.558 14.192 0.505 150 2H6 A 14 2H6 A 14 4.917 13.107 0.682 151 H2 A 14 H2 A 14 2.128 15.160 4.623 152 1H5* A 15 1H5* A 15 2.089 10.697 9.726 153 2H5* A 15 2H5* A 15 1.040 9.268 9.613 154 H4* A 15 H4* A 15 0.518 11.317 8.096 155 H3* A 15 H3* A 15 0.697 8.430 7.135 156 H2* A 15 H2* A 15 -0.044 9.210 5.025 157 2HO* A 15 2HO* A 15 -0.649 11.783 6.032 158 H1* A 15 H1* A 15 1.289 11.679 5.119 159 H8 A 15 H8 A 15 3.397 8.599 5.898 160 1H6 A 15 1H6 A 15 4.499 8.261 -0.160 161 2H6 A 15 2H6 A 15 4.959 7.648 1.415 162 H2 A 15 H2 A 15 1.311 11.338 0.519 163 1H5* G 16 1H5* G 16 -2.829 10.056 6.377 164 2H5* G 16 2H5* G 16 -4.362 9.162 6.364 165 H4* G 16 H4* G 16 -3.922 10.062 4.133 166 H3* G 16 H3* G 16 -3.625 7.052 4.471 167 H2* G 16 H2* G 16 -3.092 6.883 2.204 168 2HO* G 16 2HO* G 16 -3.747 9.199 1.090 169 H1* G 16 H1* G 16 -2.058 9.538 1.892 170 H8 G 16 H8 G 16 -0.276 7.209 4.303 171 H1 G 16 H1 G 16 1.501 6.413 -1.773 172 1H2 G 16 1H2 G 16 0.052 7.464 -3.098 173 2H2 G 16 2H2 G 16 -1.025 8.693 -2.475 174 1H5* G 17 1H5* G 17 -8.116 8.170 2.047 175 2H5* G 17 2H5* G 17 -8.636 6.484 1.867 176 H4* G 17 H4* G 17 -8.821 7.917 -0.228 177 H3* G 17 H3* G 17 -7.299 5.299 -0.084 178 H2* G 17 H2* G 17 -6.678 5.514 -2.376 179 2HO* G 17 2HO* G 17 -8.964 6.922 -2.511 180 H1* G 17 H1* G 17 -5.895 8.087 -2.294 181 H8 G 17 H8 G 17 -5.069 6.808 1.106 182 H1 G 17 H1 G 17 -1.107 4.441 -3.285 183 1H2 G 17 1H2 G 17 -1.971 4.751 -5.323 184 2H2 G 17 2H2 G 17 -3.237 5.929 -5.592 185 1H5* A 18 1H5* A 18 -10.401 4.400 -3.199 186 2H5* A 18 2H5* A 18 -10.736 2.661 -3.143 187 H4* A 18 H4* A 18 -9.578 3.623 -5.266 188 H3* A 18 H3* A 18 -8.650 1.188 -3.705 189 H2* A 18 H2* A 18 -6.952 0.889 -5.345 190 2HO* A 18 2HO* A 18 -7.901 2.955 -7.002 191 H1* A 18 H1* A 18 -6.327 3.558 -5.683 192 H8 A 18 H8 A 18 -6.450 3.376 -2.067 193 1H6 A 18 1H6 A 18 -1.166 0.230 -2.048 194 2H6 A 18 2H6 A 18 -2.238 1.236 -1.101 195 H2 A 18 H2 A 18 -2.874 0.080 -6.208 196 1H5* U 19 1H5* U 19 -9.533 0.017 -7.234 197 2H5* U 19 2H5* U 19 -10.519 -1.355 -7.780 198 H4* U 19 H4* U 19 -8.403 -2.052 -8.442 199 H3* U 19 H3* U 19 -8.946 -3.029 -5.623 200 H2* U 19 H2* U 19 -6.790 -3.945 -5.496 201 2HO* U 19 2HO* U 19 -7.130 -4.147 -8.240 202 H1* U 19 H1* U 19 -5.438 -2.010 -6.979 203 H3 U 19 H3 U 19 -3.508 -1.439 -2.962 204 H5 U 19 H5 U 19 -7.560 -0.522 -2.231 205 H6 U 19 H6 U 19 -8.042 -1.185 -4.517 206 1H5* G 20 1H5* G 20 -9.188 -6.773 -9.093 207 2H5* G 20 2H5* G 20 -9.238 -8.255 -8.118 208 H4* G 20 H4* G 20 -7.477 -8.128 -9.998 209 H3* G 20 H3* G 20 -7.031 -8.958 -7.131 210 H2* G 20 H2* G 20 -4.691 -9.129 -7.443 211 2HO* G 20 2HO* G 20 -3.916 -9.778 -9.306 212 H1* G 20 H1* G 20 -4.286 -6.887 -8.908 213 H8 G 20 H8 G 20 -7.006 -6.039 -6.471 214 H1 G 20 H1 G 20 -1.269 -6.215 -3.702 215 1H2 G 20 1H2 G 20 0.229 -7.056 -5.113 216 2H2 G 20 2H2 G 20 -0.205 -7.640 -6.704 217 1H5* A 21 1H5* A 21 -4.949 -11.978 -9.008 218 2H5* A 21 2H5* A 21 -4.945 -13.441 -8.002 219 H4* A 21 H4* A 21 -2.768 -12.017 -8.112 220 H3* A 21 H3* A 21 -4.116 -13.041 -5.589 221 H2* A 21 H2* A 21 -2.488 -11.992 -4.280 222 2HO* A 21 2HO* A 21 -0.659 -11.386 -6.272 223 H1* A 21 H1* A 21 -1.877 -9.856 -6.049 224 H8 A 21 H8 A 21 -5.403 -9.387 -5.383 225 1H6 A 21 1H6 A 21 -4.115 -7.619 0.374 226 2H6 A 21 2H6 A 21 -5.305 -7.560 -0.905 227 H2 A 21 H2 A 21 -0.431 -9.534 -1.361 228 1H5* A 22 1H5* A 22 0.163 -13.768 -6.092 229 2H5* A 22 2H5* A 22 0.280 -15.491 -6.494 230 H4* A 22 H4* A 22 2.282 -15.346 -5.410 231 H3* A 22 H3* A 22 0.178 -15.701 -3.288 232 H2* A 22 H2* A 22 1.641 -15.129 -1.526 233 2HO* A 22 2HO* A 22 4.025 -14.785 -2.583 234 H1* A 22 H1* A 22 2.971 -13.066 -2.668 235 H8 A 22 H8 A 22 -0.514 -12.813 -3.927 236 1H6 A 22 1H6 A 22 -2.243 -10.632 1.567 237 2H6 A 22 2H6 A 22 -2.713 -10.832 -0.105 238 H2 A 22 H2 A 22 1.951 -12.215 1.937 239 1H5* C 23 1H5* C 23 2.888 -19.039 -1.934 240 2H5* C 23 2H5* C 23 1.773 -20.174 -1.148 241 H4* C 23 H4* C 23 3.427 -18.796 0.338 242 H3* C 23 H3* C 23 0.470 -19.265 0.818 243 H2* C 23 H2* C 23 0.525 -17.888 2.746 244 2HO* C 23 2HO* C 23 2.873 -18.886 3.110 245 H1* C 23 H1* C 23 2.111 -15.882 1.740 246 1H4 C 23 1H4 C 23 -4.016 -14.308 0.916 247 2H4 C 23 2H4 C 23 -3.751 -14.546 -0.796 248 H5 C 23 H5 C 23 -1.869 -15.769 -1.662 249 H6 C 23 H6 C 23 0.310 -16.762 -1.113 250 1H5* C 24 1H5* C 24 2.021 -21.724 4.446 251 2H5* C 24 2H5* C 24 0.721 -22.919 4.618 252 H4* C 24 H4* C 24 0.986 -21.135 6.478 253 H3* C 24 H3* C 24 -1.573 -21.857 5.039 254 H2* C 24 H2* C 24 -2.782 -20.309 6.339 255 2HO* C 24 2HO* C 24 -2.218 -19.994 8.349 256 H1* C 24 H1* C 24 -0.970 -18.275 6.210 257 1H4 C 24 1H4 C 24 -5.217 -17.655 1.455 258 2H4 C 24 2H4 C 24 -4.049 -18.379 0.371 259 H5 C 24 H5 C 24 -2.004 -19.408 1.134 260 H6 C 24 H6 C 24 -0.588 -19.860 3.078 261 H3T C 24 H3T C 24 -1.306 -23.387 6.483 Start of MODEL 7 1 1H5* G 1 1H5* G 1 -12.777 -11.876 4.115 2 2H5* G 1 2H5* G 1 -11.732 -10.447 3.979 3 H4* G 1 H4* G 1 -11.997 -11.041 6.330 4 H3* G 1 H3* G 1 -9.337 -11.251 4.978 5 H2* G 1 H2* G 1 -8.303 -12.475 6.703 6 2HO* G 1 2HO* G 1 -10.354 -11.325 8.250 7 H1* G 1 H1* G 1 -10.263 -14.188 7.356 8 H8 G 1 H8 G 1 -10.910 -13.961 3.763 9 H1 G 1 H1 G 1 -5.292 -16.794 4.809 10 1H2 G 1 1H2 G 1 -4.662 -16.463 6.914 11 2H2 G 1 2H2 G 1 -5.648 -15.592 8.066 12 H5T G 1 H5T G 1 -10.631 -11.632 2.665 13 1H5* G 2 1H5* G 2 -8.485 -9.223 8.639 14 2H5* G 2 2H5* G 2 -7.358 -7.862 8.495 15 H4* G 2 H4* G 2 -6.452 -9.674 9.929 16 H3* G 2 H3* G 2 -5.107 -8.835 7.366 17 H2* G 2 H2* G 2 -3.512 -10.567 7.488 18 2HO* G 2 2HO* G 2 -3.173 -11.749 9.434 19 H1* G 2 H1* G 2 -5.107 -12.595 8.366 20 H8 G 2 H8 G 2 -7.224 -10.715 5.958 21 H1 G 2 H1 G 2 -2.720 -14.116 2.992 22 1H2 G 2 1H2 G 2 -1.256 -14.885 4.478 23 2H2 G 2 2H2 G 2 -1.247 -14.336 6.139 24 1H5* U 3 1H5* U 3 -2.115 -9.059 9.735 25 2H5* U 3 2H5* U 3 -1.391 -7.595 10.429 26 H4* U 3 H4* U 3 0.539 -8.598 9.694 27 H3* U 3 H3* U 3 -0.610 -7.085 7.329 28 H2* U 3 H2* U 3 1.136 -7.918 5.948 29 2HO* U 3 2HO* U 3 2.354 -8.811 8.381 30 H1* U 3 H1* U 3 1.082 -10.496 6.813 31 H3 U 3 H3 U 3 -0.900 -10.719 2.761 32 H5 U 3 H5 U 3 -3.715 -8.653 5.124 33 H6 U 3 H6 U 3 -2.107 -8.673 6.938 34 1H5* U 4 1H5* U 4 3.368 -6.322 6.959 35 2H5* U 4 2H5* U 4 3.614 -4.863 5.979 36 H4* U 4 H4* U 4 4.050 -7.181 4.882 37 H3* U 4 H3* U 4 2.349 -4.960 3.680 38 H2* U 4 H2* U 4 2.049 -6.307 1.770 39 2HO* U 4 2HO* U 4 4.467 -7.466 2.642 40 H1* U 4 H1* U 4 2.033 -8.789 3.087 41 H3 U 4 H3 U 4 -1.783 -8.165 0.621 42 H5 U 4 H5 U 4 -2.467 -6.220 4.292 43 H6 U 4 H6 U 4 -0.111 -6.523 4.816 44 1H5* C 5 1H5* C 5 4.728 -6.586 1.065 45 2H5* C 5 2H5* C 5 6.260 -5.703 0.912 46 H4* C 5 H4* C 5 6.184 -6.364 -1.258 47 H3* C 5 H3* C 5 4.254 -4.042 -1.105 48 H2* C 5 H2* C 5 3.468 -4.467 -3.301 49 2HO* C 5 2HO* C 5 4.700 -6.331 -4.440 50 H1* C 5 H1* C 5 3.319 -7.179 -3.164 51 1H4 C 5 1H4 C 5 -2.446 -5.118 -1.449 52 2H4 C 5 2H4 C 5 -1.826 -4.524 0.074 53 H5 C 5 H5 C 5 0.489 -4.681 0.709 54 H6 C 5 H6 C 5 2.734 -5.334 -0.024 55 1H5* C 6 1H5* C 6 6.572 -3.414 -4.270 56 2H5* C 6 2H5* C 6 6.694 -1.820 -5.042 57 H4* C 6 H4* C 6 4.900 -3.485 -5.927 58 H3* C 6 H3* C 6 4.430 -0.572 -5.204 59 H2* C 6 H2* C 6 2.168 -0.800 -5.838 60 2HO* C 6 2HO* C 6 1.597 -2.885 -7.010 61 H1* C 6 H1* C 6 1.825 -3.462 -4.997 62 1H4 C 6 1H4 C 6 -1.019 0.544 -0.861 63 2H4 C 6 2H4 C 6 0.305 0.211 0.231 64 H5 C 6 H5 C 6 2.283 -0.994 -0.425 65 H6 C 6 H6 C 6 3.393 -2.192 -2.249 66 1H5* C 7 1H5* C 7 3.016 -0.451 -8.233 67 2H5* C 7 2H5* C 7 3.669 0.103 -9.787 68 H4* C 7 H4* C 7 1.817 1.414 -9.858 69 H3* C 7 H3* C 7 3.593 2.867 -7.858 70 H2* C 7 H2* C 7 1.842 4.405 -7.499 71 2HO* C 7 2HO* C 7 1.565 4.443 -9.974 72 H1* C 7 H1* C 7 -0.289 2.594 -7.889 73 1H4 C 7 1H4 C 7 -0.254 3.920 -1.686 74 2H4 C 7 2H4 C 7 0.994 2.722 -1.432 75 H5 C 7 H5 C 7 2.101 1.582 -3.231 76 H6 C 7 H6 C 7 2.305 1.377 -5.665 77 1H5* C 8 1H5* C 8 2.812 5.975 -10.881 78 2H5* C 8 2H5* C 8 4.077 7.213 -10.728 79 H4* C 8 H4* C 8 1.712 7.874 -9.956 80 H3* C 8 H3* C 8 4.235 8.149 -8.293 81 H2* C 8 H2* C 8 2.999 8.880 -6.469 82 2HO* C 8 2HO* C 8 1.328 10.249 -6.676 83 H1* C 8 H1* C 8 0.484 7.711 -7.188 84 1H4 C 8 1H4 C 8 2.260 5.486 -1.491 85 2H4 C 8 2H4 C 8 3.466 4.467 -2.242 86 H5 C 8 H5 C 8 4.083 4.658 -4.568 87 H6 C 8 H6 C 8 3.500 5.670 -6.725 88 1H5* U 9 1H5* U 9 1.671 12.313 -9.163 89 2H5* U 9 2H5* U 9 2.792 13.574 -8.608 90 H4* U 9 H4* U 9 0.369 13.582 -7.664 91 H3* U 9 H3* U 9 2.936 13.833 -6.071 92 H2* U 9 H2* U 9 1.693 13.956 -4.054 93 2HO* U 9 2HO* U 9 -0.666 14.165 -4.179 94 H1* U 9 H1* U 9 -0.175 12.040 -4.629 95 H3 U 9 H3 U 9 2.616 10.502 -1.346 96 H5 U 9 H5 U 9 4.592 9.665 -4.965 97 H6 U 9 H6 U 9 2.926 11.017 -6.109 98 1H5* G 10 1H5* G 10 1.378 17.781 -4.376 99 2H5* G 10 2H5* G 10 2.988 18.470 -4.085 100 H4* G 10 H4* G 10 1.526 17.752 -2.041 101 H3* G 10 H3* G 10 4.471 17.293 -2.514 102 H2* G 10 H2* G 10 4.664 15.934 -0.558 103 2HO* G 10 2HO* G 10 1.960 16.341 0.161 104 H1* G 10 H1* G 10 2.509 14.388 -0.943 105 H8 G 10 H8 G 10 3.486 15.182 -4.429 106 H1 G 10 H1 G 10 7.484 10.981 -1.797 107 1H2 G 10 1H2 G 10 7.175 10.912 0.396 108 2H2 G 10 2H2 G 10 6.067 11.988 1.217 109 1H5* C 11 1H5* C 11 5.322 20.976 0.185 110 2H5* C 11 2H5* C 11 6.551 21.692 -0.877 111 H4* C 11 H4* C 11 8.181 20.268 -0.168 112 H3* C 11 H3* C 11 6.270 18.276 -0.891 113 H2* C 11 H2* C 11 5.755 17.214 1.084 114 2HO* C 11 2HO* C 11 7.823 17.072 2.595 115 H1* C 11 H1* C 11 6.901 18.718 3.120 116 1H4 C 11 1H4 C 11 0.545 19.337 3.536 117 2H4 C 11 2H4 C 11 0.699 20.864 2.696 118 H5 C 11 H5 C 11 2.108 19.270 0.669 119 H6 C 11 H6 C 11 4.488 18.811 0.316 120 1H5* A 12 1H5* A 12 10.169 17.283 0.908 121 2H5* A 12 2H5* A 12 11.088 15.836 0.444 122 H4* A 12 H4* A 12 11.209 15.951 2.822 123 H3* A 12 H3* A 12 9.724 13.813 1.539 124 H2* A 12 H2* A 12 7.861 13.780 2.886 125 2HO* A 12 2HO* A 12 8.896 12.335 4.189 126 H1* A 12 H1* A 12 8.798 15.602 4.995 127 H8 A 12 H8 A 12 6.340 15.096 2.058 128 1H6 A 12 1H6 A 12 2.657 18.004 4.106 129 2H6 A 12 2H6 A 12 2.198 17.368 5.670 130 H2 A 12 H2 A 12 6.325 18.070 7.715 131 1H5* U 13 1H5* U 13 12.739 13.048 5.404 132 2H5* U 13 2H5* U 13 12.801 11.307 5.746 133 H4* U 13 H4* U 13 12.245 11.645 7.896 134 H3* U 13 H3* U 13 9.874 12.935 6.608 135 H2* U 13 H2* U 13 9.468 14.449 8.335 136 2HO* U 13 2HO* U 13 10.149 14.028 10.482 137 H1* U 13 H1* U 13 12.014 14.871 9.326 138 H3 U 13 H3 U 13 9.710 18.558 7.589 139 H5 U 13 H5 U 13 12.329 17.137 4.609 140 H6 U 13 H6 U 13 12.706 15.162 5.974 141 1H5* A 14 1H5* A 14 7.645 8.516 7.267 142 2H5* A 14 2H5* A 14 6.815 9.448 6.005 143 H4* A 14 H4* A 14 7.382 10.254 8.873 144 H3* A 14 H3* A 14 5.153 9.073 7.679 145 H2* A 14 H2* A 14 4.129 10.789 6.540 146 2HO* A 14 2HO* A 14 4.059 12.039 9.105 147 H1* A 14 H1* A 14 5.378 13.162 7.597 148 H8 A 14 H8 A 14 7.325 11.308 4.969 149 1H6 A 14 1H6 A 14 3.923 14.141 0.709 150 2H6 A 14 2H6 A 14 5.209 12.985 0.976 151 H2 A 14 H2 A 14 2.185 15.100 4.700 152 1H5* A 15 1H5* A 15 1.847 10.624 9.633 153 2H5* A 15 2H5* A 15 0.912 9.125 9.465 154 H4* A 15 H4* A 15 0.504 11.052 7.758 155 H3* A 15 H3* A 15 0.955 8.124 7.053 156 H2* A 15 H2* A 15 0.694 8.690 4.799 157 2HO* A 15 2HO* A 15 -0.788 10.106 4.141 158 H1* A 15 H1* A 15 1.505 11.434 5.053 159 H8 A 15 H8 A 15 4.060 8.721 5.818 160 1H6 A 15 1H6 A 15 5.292 8.658 -0.231 161 2H6 A 15 2H6 A 15 5.849 8.133 1.345 162 H2 A 15 H2 A 15 1.725 11.295 0.465 163 1H5* G 16 1H5* G 16 -3.744 9.565 6.369 164 2H5* G 16 2H5* G 16 -4.574 8.068 5.898 165 H4* G 16 H4* G 16 -4.774 10.121 4.320 166 H3* G 16 H3* G 16 -4.087 7.279 3.533 167 H2* G 16 H2* G 16 -3.844 7.940 1.269 168 2HO* G 16 2HO* G 16 -4.415 10.473 1.090 169 H1* G 16 H1* G 16 -2.517 10.283 1.673 170 H8 G 16 H8 G 16 -1.174 7.851 4.175 171 H1 G 16 H1 G 16 0.959 6.666 -1.725 172 1H2 G 16 1H2 G 16 -0.207 7.853 -3.182 173 2H2 G 16 2H2 G 16 -1.427 9.010 -2.701 174 1H5* G 17 1H5* G 17 -8.971 7.518 2.197 175 2H5* G 17 2H5* G 17 -9.160 5.771 1.949 176 H4* G 17 H4* G 17 -9.582 7.345 -0.073 177 H3* G 17 H3* G 17 -7.922 4.814 -0.037 178 H2* G 17 H2* G 17 -7.275 5.149 -2.309 179 2HO* G 17 2HO* G 17 -9.593 6.152 -2.646 180 H1* G 17 H1* G 17 -6.577 7.724 -2.107 181 H8 G 17 H8 G 17 -5.873 6.445 1.305 182 H1 G 17 H1 G 17 -1.663 4.185 -2.905 183 1H2 G 17 1H2 G 17 -2.349 4.609 -4.969 184 2H2 G 17 2H2 G 17 -3.822 5.491 -5.308 185 1H5* A 18 1H5* A 18 -10.890 3.944 -3.253 186 2H5* A 18 2H5* A 18 -11.183 2.196 -3.292 187 H4* A 18 H4* A 18 -9.998 3.295 -5.333 188 H3* A 18 H3* A 18 -9.047 0.804 -3.878 189 H2* A 18 H2* A 18 -7.301 0.628 -5.478 190 2HO* A 18 2HO* A 18 -9.142 1.647 -7.101 191 H1* A 18 H1* A 18 -6.776 3.343 -5.716 192 H8 A 18 H8 A 18 -6.826 3.039 -2.124 193 1H6 A 18 1H6 A 18 -1.539 -0.085 -2.248 194 2H6 A 18 2H6 A 18 -2.542 0.987 -1.298 195 H2 A 18 H2 A 18 -3.262 -0.085 -6.411 196 1H5* U 19 1H5* U 19 -9.803 -0.211 -7.474 197 2H5* U 19 2H5* U 19 -10.723 -1.590 -8.108 198 H4* U 19 H4* U 19 -8.568 -2.175 -8.748 199 H3* U 19 H3* U 19 -9.140 -3.316 -5.995 200 H2* U 19 H2* U 19 -6.955 -4.187 -5.890 201 2HO* U 19 2HO* U 19 -7.238 -4.872 -8.264 202 H1* U 19 H1* U 19 -5.638 -2.097 -7.154 203 H3 U 19 H3 U 19 -3.956 -1.718 -3.007 204 H5 U 19 H5 U 19 -8.073 -0.989 -2.451 205 H6 U 19 H6 U 19 -8.404 -1.507 -4.799 206 1H5* G 20 1H5* G 20 -9.150 -6.929 -9.567 207 2H5* G 20 2H5* G 20 -9.333 -8.423 -8.628 208 H4* G 20 H4* G 20 -7.379 -8.332 -10.293 209 H3* G 20 H3* G 20 -7.176 -9.089 -7.366 210 H2* G 20 H2* G 20 -4.833 -9.375 -7.566 211 2HO* G 20 2HO* G 20 -5.394 -9.462 -10.354 212 H1* G 20 H1* G 20 -4.298 -7.201 -9.133 213 H8 G 20 H8 G 20 -6.949 -6.265 -6.620 214 H1 G 20 H1 G 20 -1.098 -6.362 -4.089 215 1H2 G 20 1H2 G 20 0.332 -7.275 -5.521 216 2H2 G 20 2H2 G 20 -0.145 -7.797 -7.121 217 1H5* A 21 1H5* A 21 -5.153 -12.226 -9.177 218 2H5* A 21 2H5* A 21 -5.179 -13.679 -8.157 219 H4* A 21 H4* A 21 -2.967 -12.314 -8.305 220 H3* A 21 H3* A 21 -4.305 -13.286 -5.755 221 H2* A 21 H2* A 21 -2.631 -12.268 -4.481 222 2HO* A 21 2HO* A 21 -0.976 -12.164 -6.810 223 H1* A 21 H1* A 21 -1.996 -10.159 -6.282 224 H8 A 21 H8 A 21 -5.520 -9.687 -5.511 225 1H6 A 21 1H6 A 21 -3.967 -7.595 0.070 226 2H6 A 21 2H6 A 21 -5.261 -7.736 -1.100 227 H2 A 21 H2 A 21 -0.374 -9.633 -1.709 228 1H5* A 22 1H5* A 22 0.005 -14.111 -6.335 229 2H5* A 22 2H5* A 22 0.065 -15.857 -6.628 230 H4* A 22 H4* A 22 2.082 -15.690 -5.569 231 H3* A 22 H3* A 22 -0.012 -15.884 -3.410 232 H2* A 22 H2* A 22 1.518 -15.303 -1.701 233 2HO* A 22 2HO* A 22 3.187 -16.734 -2.935 234 H1* A 22 H1* A 22 2.872 -13.327 -2.959 235 H8 A 22 H8 A 22 -0.645 -13.038 -4.118 236 1H6 A 22 1H6 A 22 -2.112 -10.523 1.309 237 2H6 A 22 2H6 A 22 -2.651 -10.802 -0.332 238 H2 A 22 H2 A 22 2.039 -12.226 1.621 239 1H5* C 23 1H5* C 23 2.653 -19.139 -1.914 240 2H5* C 23 2H5* C 23 1.561 -20.222 -1.028 241 H4* C 23 H4* C 23 3.244 -18.747 0.323 242 H3* C 23 H3* C 23 0.306 -19.203 0.901 243 H2* C 23 H2* C 23 0.372 -17.686 2.718 244 2HO* C 23 2HO* C 23 3.225 -17.654 2.482 245 H1* C 23 H1* C 23 1.935 -15.746 1.559 246 1H4 C 23 1H4 C 23 -4.194 -14.216 0.695 247 2H4 C 23 2H4 C 23 -3.963 -14.606 -0.994 248 H5 C 23 H5 C 23 -2.080 -15.860 -1.797 249 H6 C 23 H6 C 23 0.101 -16.822 -1.205 250 1H5* C 24 1H5* C 24 2.105 -21.297 4.658 251 2H5* C 24 2H5* C 24 0.857 -22.498 5.045 252 H4* C 24 H4* C 24 1.208 -20.531 6.698 253 H3* C 24 H3* C 24 -1.418 -21.479 5.543 254 H2* C 24 H2* C 24 -2.602 -19.820 6.711 255 2HO* C 24 2HO* C 24 -0.383 -19.921 8.379 256 H1* C 24 H1* C 24 -0.863 -17.759 6.277 257 1H4 C 24 1H4 C 24 -5.351 -17.654 1.722 258 2H4 C 24 2H4 C 24 -4.271 -18.549 0.678 259 H5 C 24 H5 C 24 -2.164 -19.448 1.416 260 H6 C 24 H6 C 24 -0.632 -19.681 3.313 261 H3T C 24 H3T C 24 -1.472 -21.814 8.036 Start of MODEL 8 1 1H5* G 1 1H5* G 1 -13.342 -12.636 3.970 2 2H5* G 1 2H5* G 1 -12.565 -11.038 3.975 3 H4* G 1 H4* G 1 -12.661 -11.818 6.258 4 H3* G 1 H3* G 1 -10.004 -11.683 4.881 5 H2* G 1 H2* G 1 -8.849 -12.865 6.563 6 2HO* G 1 2HO* G 1 -9.520 -12.941 8.638 7 H1* G 1 H1* G 1 -10.633 -14.802 7.110 8 H8 G 1 H8 G 1 -11.138 -14.278 3.475 9 H1 G 1 H1 G 1 -5.557 -17.139 4.634 10 1H2 G 1 1H2 G 1 -5.067 -16.989 6.798 11 2H2 G 1 2H2 G 1 -6.152 -16.257 7.958 12 H5T G 1 H5T G 1 -11.892 -12.984 2.485 13 1H5* G 2 1H5* G 2 -8.958 -9.328 8.729 14 2H5* G 2 2H5* G 2 -7.754 -8.176 8.120 15 H4* G 2 H4* G 2 -6.979 -9.947 9.847 16 H3* G 2 H3* G 2 -5.638 -9.096 7.297 17 H2* G 2 H2* G 2 -4.046 -10.831 7.358 18 2HO* G 2 2HO* G 2 -4.593 -10.713 10.094 19 H1* G 2 H1* G 2 -5.602 -12.881 8.228 20 H8 G 2 H8 G 2 -7.832 -10.993 5.947 21 H1 G 2 H1 G 2 -3.338 -14.166 2.724 22 1H2 G 2 1H2 G 2 -1.784 -14.906 4.126 23 2H2 G 2 2H2 G 2 -1.776 -14.479 5.823 24 1H5* U 3 1H5* U 3 -2.129 -8.997 10.362 25 2H5* U 3 2H5* U 3 -1.541 -7.340 10.117 26 H4* U 3 H4* U 3 0.310 -8.960 9.968 27 H3* U 3 H3* U 3 -0.527 -7.401 7.511 28 H2* U 3 H2* U 3 1.119 -8.496 6.203 29 2HO* U 3 2HO* U 3 2.710 -9.868 7.262 30 H1* U 3 H1* U 3 0.752 -11.021 7.143 31 H3 U 3 H3 U 3 -1.043 -10.939 2.977 32 H5 U 3 H5 U 3 -3.882 -8.929 5.363 33 H6 U 3 H6 U 3 -2.324 -9.070 7.215 34 1H5* U 4 1H5* U 4 3.575 -6.599 7.228 35 2H5* U 4 2H5* U 4 3.719 -5.079 6.327 36 H4* U 4 H4* U 4 4.283 -7.303 5.099 37 H3* U 4 H3* U 4 2.445 -5.118 4.042 38 H2* U 4 H2* U 4 2.186 -6.367 2.061 39 2HO* U 4 2HO* U 4 4.428 -7.954 2.853 40 H1* U 4 H1* U 4 2.297 -8.917 3.225 41 H3 U 4 H3 U 4 -1.609 -8.283 0.902 42 H5 U 4 H5 U 4 -2.253 -6.598 4.708 43 H6 U 4 H6 U 4 0.123 -6.853 5.149 44 1H5* C 5 1H5* C 5 4.875 -6.390 1.366 45 2H5* C 5 2H5* C 5 6.379 -5.464 1.210 46 H4* C 5 H4* C 5 6.258 -6.032 -0.984 47 H3* C 5 H3* C 5 4.260 -3.779 -0.690 48 H2* C 5 H2* C 5 3.441 -4.144 -2.883 49 2HO* C 5 2HO* C 5 4.581 -5.356 -4.407 50 H1* C 5 H1* C 5 3.425 -6.872 -2.867 51 1H4 C 5 1H4 C 5 -2.434 -5.143 -1.112 52 2H4 C 5 2H4 C 5 -1.857 -4.639 0.461 53 H5 C 5 H5 C 5 0.467 -4.682 1.092 54 H6 C 5 H6 C 5 2.744 -5.191 0.344 55 1H5* C 6 1H5* C 6 6.766 -2.952 -3.892 56 2H5* C 6 2H5* C 6 6.796 -1.332 -4.618 57 H4* C 6 H4* C 6 5.254 -3.137 -5.689 58 H3* C 6 H3* C 6 4.458 -0.294 -4.969 59 H2* C 6 H2* C 6 2.276 -0.717 -5.801 60 2HO* C 6 2HO* C 6 3.605 -2.767 -7.209 61 H1* C 6 H1* C 6 2.027 -3.318 -4.875 62 1H4 C 6 1H4 C 6 -0.922 0.748 -0.859 63 2H4 C 6 2H4 C 6 0.342 0.364 0.288 64 H5 C 6 H5 C 6 2.386 -0.749 -0.340 65 H6 C 6 H6 C 6 3.549 -1.949 -2.133 66 1H5* C 7 1H5* C 7 3.382 -0.275 -8.381 67 2H5* C 7 2H5* C 7 4.182 0.511 -9.757 68 H4* C 7 H4* C 7 2.072 1.438 -9.948 69 H3* C 7 H3* C 7 3.752 3.175 -8.130 70 H2* C 7 H2* C 7 1.911 4.520 -7.586 71 2HO* C 7 2HO* C 7 0.220 4.848 -8.959 72 H1* C 7 H1* C 7 -0.113 2.594 -7.755 73 1H4 C 7 1H4 C 7 0.715 3.789 -1.561 74 2H4 C 7 2H4 C 7 1.967 2.572 -1.508 75 H5 C 7 H5 C 7 2.836 1.490 -3.472 76 H6 C 7 H6 C 7 2.748 1.389 -5.914 77 1H5* C 8 1H5* C 8 2.453 6.191 -11.062 78 2H5* C 8 2H5* C 8 3.673 7.482 -11.021 79 H4* C 8 H4* C 8 1.375 8.020 -9.991 80 H3* C 8 H3* C 8 4.051 8.407 -8.623 81 H2* C 8 H2* C 8 3.012 9.035 -6.643 82 2HO* C 8 2HO* C 8 1.873 10.758 -7.765 83 H1* C 8 H1* C 8 0.485 7.760 -7.084 84 1H4 C 8 1H4 C 8 2.924 5.359 -1.729 85 2H4 C 8 2H4 C 8 4.177 4.536 -2.632 86 H5 C 8 H5 C 8 4.469 4.775 -5.010 87 H6 C 8 H6 C 8 3.623 5.852 -7.043 88 1H5* U 9 1H5* U 9 0.996 12.355 -9.109 89 2H5* U 9 2H5* U 9 2.063 13.690 -8.629 90 H4* U 9 H4* U 9 -0.262 13.516 -7.487 91 H3* U 9 H3* U 9 2.406 13.916 -6.102 92 H2* U 9 H2* U 9 1.346 13.890 -3.989 93 2HO* U 9 2HO* U 9 -0.467 14.967 -3.877 94 H1* U 9 H1* U 9 -0.519 11.927 -4.487 95 H3 U 9 H3 U 9 2.419 10.359 -1.370 96 H5 U 9 H5 U 9 4.345 9.788 -5.072 97 H6 U 9 H6 U 9 2.579 11.092 -6.116 98 1H5* G 10 1H5* G 10 0.887 17.892 -4.369 99 2H5* G 10 2H5* G 10 2.518 18.552 -4.132 100 H4* G 10 H4* G 10 1.098 17.786 -2.055 101 H3* G 10 H3* G 10 4.041 17.433 -2.616 102 H2* G 10 H2* G 10 4.344 16.024 -0.716 103 2HO* G 10 2HO* G 10 3.148 17.111 0.828 104 H1* G 10 H1* G 10 2.212 14.434 -1.046 105 H8 G 10 H8 G 10 3.065 15.328 -4.549 106 H1 G 10 H1 G 10 7.196 11.132 -2.123 107 1H2 G 10 1H2 G 10 6.949 11.012 0.073 108 2H2 G 10 2H2 G 10 5.853 12.058 0.948 109 1H5* C 11 1H5* C 11 4.895 21.060 0.352 110 2H5* C 11 2H5* C 11 6.047 21.836 -0.749 111 H4* C 11 H4* C 11 7.802 20.716 0.128 112 H3* C 11 H3* C 11 6.360 18.480 -0.817 113 H2* C 11 H2* C 11 5.687 17.337 1.072 114 2HO* C 11 2HO* C 11 7.792 17.542 2.720 115 H1* C 11 H1* C 11 6.510 18.856 3.267 116 1H4 C 11 1H4 C 11 0.059 19.783 2.015 117 2H4 C 11 2H4 C 11 0.218 19.397 3.713 118 H5 C 11 H5 C 11 1.855 18.991 0.506 119 H6 C 11 H6 C 11 4.287 18.794 0.295 120 1H5* A 12 1H5* A 12 10.038 17.876 1.271 121 2H5* A 12 2H5* A 12 11.367 16.786 0.822 122 H4* A 12 H4* A 12 11.144 16.175 3.029 123 H3* A 12 H3* A 12 9.396 14.487 1.300 124 H2* A 12 H2* A 12 7.900 13.909 2.953 125 2HO* A 12 2HO* A 12 10.306 13.507 4.270 126 H1* A 12 H1* A 12 8.755 15.720 5.039 127 H8 A 12 H8 A 12 6.332 15.174 2.098 128 1H6 A 12 1H6 A 12 2.155 17.772 5.798 129 2H6 A 12 2H6 A 12 2.470 17.343 4.133 130 H2 A 12 H2 A 12 6.208 18.111 7.772 131 1H5* U 13 1H5* U 13 12.775 13.106 4.403 132 2H5* U 13 2H5* U 13 12.884 11.391 4.854 133 H4* U 13 H4* U 13 12.578 11.939 7.011 134 H3* U 13 H3* U 13 9.956 12.787 5.842 135 H2* U 13 H2* U 13 9.597 14.486 7.353 136 2HO* U 13 2HO* U 13 10.419 12.451 9.063 137 H1* U 13 H1* U 13 12.227 14.531 8.606 138 H3 U 13 H3 U 13 9.945 18.628 8.443 139 H5 U 13 H5 U 13 12.319 18.295 4.978 140 H6 U 13 H6 U 13 12.716 15.968 5.552 141 1H5* A 14 1H5* A 14 7.913 8.551 6.695 142 2H5* A 14 2H5* A 14 6.966 9.513 5.543 143 H4* A 14 H4* A 14 7.766 10.226 8.379 144 H3* A 14 H3* A 14 5.461 9.064 7.328 145 H2* A 14 H2* A 14 4.339 10.797 6.315 146 2HO* A 14 2HO* A 14 3.877 12.593 8.052 147 H1* A 14 H1* A 14 5.635 13.158 7.334 148 H8 A 14 H8 A 14 7.462 11.411 4.568 149 1H6 A 14 1H6 A 14 3.762 14.226 0.556 150 2H6 A 14 2H6 A 14 5.143 13.170 0.738 151 H2 A 14 H2 A 14 2.197 15.040 4.648 152 1H5* A 15 1H5* A 15 2.328 10.624 9.633 153 2H5* A 15 2H5* A 15 1.347 9.150 9.489 154 H4* A 15 H4* A 15 0.820 11.177 7.926 155 H3* A 15 H3* A 15 1.114 8.279 7.032 156 H2* A 15 H2* A 15 0.510 8.984 4.866 157 2HO* A 15 2HO* A 15 -1.008 10.751 6.289 158 H1* A 15 H1* A 15 1.635 11.576 5.042 159 H8 A 15 H8 A 15 4.016 8.698 5.739 160 1H6 A 15 1H6 A 15 5.008 8.507 -0.349 161 2H6 A 15 2H6 A 15 5.470 7.817 1.192 162 H2 A 15 H2 A 15 1.530 11.226 0.431 163 1H5* G 16 1H5* G 16 -3.055 9.589 6.494 164 2H5* G 16 2H5* G 16 -4.241 8.270 6.443 165 H4* G 16 H4* G 16 -4.089 9.592 4.299 166 H3* G 16 H3* G 16 -3.464 6.617 4.372 167 H2* G 16 H2* G 16 -3.080 6.667 2.062 168 2HO* G 16 2HO* G 16 -4.944 8.751 2.185 169 H1* G 16 H1* G 16 -2.181 9.352 1.894 170 H8 G 16 H8 G 16 -0.276 7.103 4.266 171 H1 G 16 H1 G 16 1.480 6.379 -1.818 172 1H2 G 16 1H2 G 16 -0.043 7.351 -3.134 173 2H2 G 16 2H2 G 16 -1.130 8.565 -2.500 174 1H5* G 17 1H5* G 17 -8.142 7.596 2.208 175 2H5* G 17 2H5* G 17 -8.540 5.891 1.918 176 H4* G 17 H4* G 17 -8.971 7.485 -0.029 177 H3* G 17 H3* G 17 -7.309 4.959 -0.194 178 H2* G 17 H2* G 17 -6.828 5.385 -2.488 179 2HO* G 17 2HO* G 17 -8.664 6.100 -3.410 180 H1* G 17 H1* G 17 -6.185 7.985 -2.250 181 H8 G 17 H8 G 17 -5.037 6.644 0.993 182 H1 G 17 H1 G 17 -1.413 4.461 -3.770 183 1H2 G 17 1H2 G 17 -2.389 4.885 -5.721 184 2H2 G 17 2H2 G 17 -3.905 5.748 -5.844 185 1H5* A 18 1H5* A 18 -10.627 4.024 -3.132 186 2H5* A 18 2H5* A 18 -10.811 2.260 -3.141 187 H4* A 18 H4* A 18 -9.913 3.418 -5.292 188 H3* A 18 H3* A 18 -8.692 0.991 -3.933 189 H2* A 18 H2* A 18 -7.083 0.898 -5.693 190 2HO* A 18 2HO* A 18 -7.926 2.993 -7.232 191 H1* A 18 H1* A 18 -6.582 3.584 -5.838 192 H8 A 18 H8 A 18 -6.719 3.228 -2.239 193 1H6 A 18 1H6 A 18 -1.367 0.203 -2.298 194 2H6 A 18 2H6 A 18 -2.468 1.148 -1.324 195 H2 A 18 H2 A 18 -3.010 0.228 -6.491 196 1H5* U 19 1H5* U 19 -9.937 -0.093 -7.575 197 2H5* U 19 2H5* U 19 -10.821 -1.571 -8.004 198 H4* U 19 H4* U 19 -8.720 -1.858 -9.037 199 H3* U 19 H3* U 19 -8.894 -3.265 -6.357 200 H2* U 19 H2* U 19 -6.661 -4.005 -6.579 201 2HO* U 19 2HO* U 19 -6.358 -3.057 -9.211 202 H1* U 19 H1* U 19 -5.601 -1.725 -7.707 203 H3 U 19 H3 U 19 -3.688 -1.860 -3.619 204 H5 U 19 H5 U 19 -7.714 -0.899 -2.815 205 H6 U 19 H6 U 19 -8.187 -1.235 -5.169 206 1H5* G 20 1H5* G 20 -9.004 -6.852 -9.790 207 2H5* G 20 2H5* G 20 -9.312 -8.282 -8.783 208 H4* G 20 H4* G 20 -7.125 -8.215 -10.187 209 H3* G 20 H3* G 20 -7.336 -8.907 -7.234 210 H2* G 20 H2* G 20 -4.994 -9.284 -7.179 211 2HO* G 20 2HO* G 20 -5.016 -9.122 -10.038 212 H1* G 20 H1* G 20 -4.248 -7.157 -8.760 213 H8 G 20 H8 G 20 -7.028 -6.245 -6.332 214 H1 G 20 H1 G 20 -1.230 -6.144 -3.673 215 1H2 G 20 1H2 G 20 0.245 -7.079 -5.057 216 2H2 G 20 2H2 G 20 -0.154 -7.465 -6.715 217 1H5* A 21 1H5* A 21 -5.122 -11.919 -8.967 218 2H5* A 21 2H5* A 21 -5.098 -13.431 -8.036 219 H4* A 21 H4* A 21 -2.950 -11.951 -8.058 220 H3* A 21 H3* A 21 -4.274 -13.119 -5.579 221 H2* A 21 H2* A 21 -2.625 -12.121 -4.254 222 2HO* A 21 2HO* A 21 -0.600 -11.378 -5.333 223 H1* A 21 H1* A 21 -2.084 -9.894 -5.945 224 H8 A 21 H8 A 21 -5.610 -9.586 -5.102 225 1H6 A 21 1H6 A 21 -4.027 -7.744 0.562 226 2H6 A 21 2H6 A 21 -5.340 -7.882 -0.586 227 H2 A 21 H2 A 21 -0.406 -9.576 -1.380 228 1H5* A 22 1H5* A 22 0.031 -13.790 -6.056 229 2H5* A 22 2H5* A 22 0.148 -15.495 -6.522 230 H4* A 22 H4* A 22 2.102 -15.450 -5.359 231 H3* A 22 H3* A 22 -0.058 -15.730 -3.275 232 H2* A 22 H2* A 22 1.427 -15.253 -1.495 233 2HO* A 22 2HO* A 22 3.288 -16.259 -1.698 234 H1* A 22 H1* A 22 2.848 -13.243 -2.616 235 H8 A 22 H8 A 22 -0.627 -12.816 -3.843 236 1H6 A 22 1H6 A 22 -2.184 -10.558 1.674 237 2H6 A 22 2H6 A 22 -2.702 -10.776 0.016 238 H2 A 22 H2 A 22 1.924 -12.364 1.997 239 1H5* C 23 1H5* C 23 2.630 -19.026 -1.899 240 2H5* C 23 2H5* C 23 1.561 -20.169 -1.061 241 H4* C 23 H4* C 23 3.233 -18.733 0.349 242 H3* C 23 H3* C 23 0.305 -19.260 0.927 243 H2* C 23 H2* C 23 0.373 -17.841 2.823 244 2HO* C 23 2HO* C 23 3.225 -17.858 2.544 245 H1* C 23 H1* C 23 1.885 -15.818 1.739 246 1H4 C 23 1H4 C 23 -4.270 -14.352 1.016 247 2H4 C 23 2H4 C 23 -4.062 -14.675 -0.689 248 H5 C 23 H5 C 23 -2.159 -15.842 -1.576 249 H6 C 23 H6 C 23 0.037 -16.806 -1.050 250 1H5* C 24 1H5* C 24 2.013 -21.452 4.624 251 2H5* C 24 2H5* C 24 0.790 -22.715 4.870 252 H4* C 24 H4* C 24 0.984 -20.846 6.657 253 H3* C 24 H3* C 24 -1.549 -21.793 5.303 254 H2* C 24 H2* C 24 -2.842 -20.257 6.523 255 2HO* C 24 2HO* C 24 -2.294 -19.648 8.482 256 H1* C 24 H1* C 24 -1.154 -18.122 6.310 257 1H4 C 24 1H4 C 24 -5.396 -17.800 1.543 258 2H4 C 24 2H4 C 24 -4.256 -18.627 0.506 259 H5 C 24 H5 C 24 -2.167 -19.526 1.293 260 H6 C 24 H6 C 24 -0.729 -19.855 3.249 261 H3T C 24 H3T C 24 -1.782 -22.818 7.277 Start of MODEL 9 1 1H5* G 1 1H5* G 1 -13.330 -12.861 3.234 2 2H5* G 1 2H5* G 1 -12.851 -11.178 3.536 3 H4* G 1 H4* G 1 -12.753 -12.164 5.670 4 H3* G 1 H3* G 1 -10.075 -11.954 4.306 5 H2* G 1 H2* G 1 -8.978 -13.214 5.980 6 2HO* G 1 2HO* G 1 -9.647 -12.569 7.916 7 H1* G 1 H1* G 1 -10.808 -15.167 6.333 8 H8 G 1 H8 G 1 -11.083 -14.472 2.705 9 H1 G 1 H1 G 1 -5.597 -17.422 4.080 10 1H2 G 1 1H2 G 1 -5.261 -17.397 6.279 11 2H2 G 1 2H2 G 1 -6.376 -16.638 7.392 12 H5T G 1 H5T G 1 -10.935 -11.529 2.613 13 1H5* G 2 1H5* G 2 -9.150 -9.753 8.227 14 2H5* G 2 2H5* G 2 -7.866 -8.619 7.767 15 H4* G 2 H4* G 2 -7.264 -10.539 9.402 16 H3* G 2 H3* G 2 -5.742 -9.626 6.965 17 H2* G 2 H2* G 2 -4.212 -11.419 7.097 18 2HO* G 2 2HO* G 2 -3.703 -11.372 9.273 19 H1* G 2 H1* G 2 -5.929 -13.430 7.751 20 H8 G 2 H8 G 2 -7.896 -11.410 5.366 21 H1 G 2 H1 G 2 -3.202 -14.553 2.407 22 1H2 G 2 1H2 G 2 -1.779 -15.369 3.902 23 2H2 G 2 2H2 G 2 -1.922 -15.035 5.613 24 1H5* U 3 1H5* U 3 -2.867 -9.468 10.069 25 2H5* U 3 2H5* U 3 -2.144 -7.873 10.369 26 H4* U 3 H4* U 3 -0.299 -9.316 9.985 27 H3* U 3 H3* U 3 -1.062 -7.649 7.573 28 H2* U 3 H2* U 3 0.643 -8.675 6.281 29 2HO* U 3 2HO* U 3 2.440 -8.868 7.433 30 H1* U 3 H1* U 3 0.257 -11.242 7.098 31 H3 U 3 H3 U 3 -1.364 -10.995 2.863 32 H5 U 3 H5 U 3 -4.326 -9.131 5.216 33 H6 U 3 H6 U 3 -2.839 -9.326 7.123 34 1H5* U 4 1H5* U 4 3.115 -6.886 7.465 35 2H5* U 4 2H5* U 4 3.276 -5.302 6.687 36 H4* U 4 H4* U 4 3.969 -7.416 5.341 37 H3* U 4 H3* U 4 2.136 -5.208 4.323 38 H2* U 4 H2* U 4 2.076 -6.313 2.233 39 2HO* U 4 2HO* U 4 3.714 -8.323 2.291 40 H1* U 4 H1* U 4 2.091 -8.928 3.232 41 H3 U 4 H3 U 4 -1.689 -8.159 0.779 42 H5 U 4 H5 U 4 -2.518 -6.668 4.631 43 H6 U 4 H6 U 4 -0.165 -6.958 5.177 44 1H5* C 5 1H5* C 5 4.704 -6.165 1.696 45 2H5* C 5 2H5* C 5 6.199 -5.213 1.728 46 H4* C 5 H4* C 5 6.219 -5.537 -0.516 47 H3* C 5 H3* C 5 4.189 -3.347 -0.077 48 H2* C 5 H2* C 5 3.395 -3.493 -2.292 49 2HO* C 5 2HO* C 5 5.882 -4.796 -2.767 50 H1* C 5 H1* C 5 3.506 -6.213 -2.629 51 1H4 C 5 1H4 C 5 -2.509 -5.054 -0.978 52 2H4 C 5 2H4 C 5 -2.029 -4.581 0.637 53 H5 C 5 H5 C 5 0.266 -4.523 1.367 54 H6 C 5 H6 C 5 2.600 -4.850 0.694 55 1H5* C 6 1H5* C 6 6.833 -2.295 -3.118 56 2H5* C 6 2H5* C 6 6.924 -0.635 -3.741 57 H4* C 6 H4* C 6 5.445 -2.357 -5.018 58 H3* C 6 H3* C 6 4.674 0.459 -4.208 59 H2* C 6 H2* C 6 2.508 0.157 -5.105 60 2HO* C 6 2HO* C 6 3.764 -1.927 -6.563 61 H1* C 6 H1* C 6 2.127 -2.478 -4.355 62 1H4 C 6 1H4 C 6 -0.821 1.258 -0.082 63 2H4 C 6 2H4 C 6 0.582 1.098 0.952 64 H5 C 6 H5 C 6 2.657 0.119 0.215 65 H6 C 6 H6 C 6 3.793 -1.022 -1.635 66 1H5* C 7 1H5* C 7 3.676 0.013 -7.650 67 2H5* C 7 2H5* C 7 4.247 0.793 -9.138 68 H4* C 7 H4* C 7 1.999 1.231 -9.359 69 H3* C 7 H3* C 7 3.144 3.434 -7.607 70 H2* C 7 H2* C 7 0.983 4.355 -7.388 71 2HO* C 7 2HO* C 7 -0.701 3.182 -8.888 72 H1* C 7 H1* C 7 -0.440 1.954 -7.334 73 1H4 C 7 1H4 C 7 -0.192 4.262 -1.403 74 2H4 C 7 2H4 C 7 1.428 3.636 -1.206 75 H5 C 7 H5 C 7 2.795 3.111 -3.145 76 H6 C 7 H6 C 7 2.723 2.291 -5.452 77 1H5* C 8 1H5* C 8 1.634 5.643 -10.616 78 2H5* C 8 2H5* C 8 2.611 7.001 -11.200 79 H4* C 8 H4* C 8 0.646 7.876 -10.068 80 H3* C 8 H3* C 8 3.292 8.164 -8.601 81 H2* C 8 H2* C 8 2.192 9.154 -6.804 82 2HO* C 8 2HO* C 8 0.046 9.826 -8.569 83 H1* C 8 H1* C 8 -0.391 8.004 -7.258 84 1H4 C 8 1H4 C 8 1.645 6.289 -1.474 85 2H4 C 8 2H4 C 8 2.782 5.164 -2.184 86 H5 C 8 H5 C 8 3.168 4.993 -4.558 87 H6 C 8 H6 C 8 2.502 5.822 -6.769 88 1H5* U 9 1H5* U 9 1.046 12.419 -9.459 89 2H5* U 9 2H5* U 9 2.308 13.604 -9.067 90 H4* U 9 H4* U 9 0.037 13.756 -7.805 91 H3* U 9 H3* U 9 2.796 13.811 -6.526 92 H2* U 9 H2* U 9 1.773 14.085 -4.405 93 2HO* U 9 2HO* U 9 0.088 15.353 -4.307 94 H1* U 9 H1* U 9 -0.354 12.370 -4.798 95 H3 U 9 H3 U 9 2.218 10.496 -1.571 96 H5 U 9 H5 U 9 4.341 9.772 -5.137 97 H6 U 9 H6 U 9 2.740 11.180 -6.300 98 1H5* G 10 1H5* G 10 1.689 17.958 -4.843 99 2H5* G 10 2H5* G 10 3.371 18.480 -4.621 100 H4* G 10 H4* G 10 1.880 17.933 -2.522 101 H3* G 10 H3* G 10 4.780 17.304 -3.051 102 H2* G 10 H2* G 10 4.954 15.963 -1.086 103 2HO* G 10 2HO* G 10 3.759 16.375 0.621 104 H1* G 10 H1* G 10 2.695 14.546 -1.362 105 H8 G 10 H8 G 10 3.661 15.226 -4.892 106 H1 G 10 H1 G 10 7.382 10.779 -2.254 107 1H2 G 10 1H2 G 10 7.117 10.777 -0.054 108 2H2 G 10 2H2 G 10 6.090 11.934 0.766 109 1H5* C 11 1H5* C 11 5.955 20.942 -0.321 110 2H5* C 11 2H5* C 11 7.218 21.524 -1.422 111 H4* C 11 H4* C 11 8.778 20.124 -0.563 112 H3* C 11 H3* C 11 6.893 18.142 -1.333 113 H2* C 11 H2* C 11 6.198 17.175 0.640 114 2HO* C 11 2HO* C 11 8.093 16.014 0.810 115 H1* C 11 H1* C 11 7.314 18.678 2.703 116 1H4 C 11 1H4 C 11 0.920 19.460 2.575 117 2H4 C 11 2H4 C 11 1.277 21.132 2.207 118 H5 C 11 H5 C 11 2.656 19.359 0.029 119 H6 C 11 H6 C 11 5.031 18.805 -0.209 120 1H5* A 12 1H5* A 12 10.936 16.668 0.474 121 2H5* A 12 2H5* A 12 11.421 15.009 0.066 122 H4* A 12 H4* A 12 11.535 15.291 2.478 123 H3* A 12 H3* A 12 9.576 13.448 1.227 124 H2* A 12 H2* A 12 8.023 13.498 2.919 125 2HO* A 12 2HO* A 12 8.620 12.780 4.858 126 H1* A 12 H1* A 12 9.250 15.503 4.636 127 H8 A 12 H8 A 12 6.659 15.002 1.803 128 1H6 A 12 1H6 A 12 3.277 18.764 4.325 129 2H6 A 12 2H6 A 12 2.785 17.200 4.936 130 H2 A 12 H2 A 12 7.019 18.148 7.353 131 1H5* U 13 1H5* U 13 12.578 12.795 4.755 132 2H5* U 13 2H5* U 13 12.927 11.090 5.101 133 H4* U 13 H4* U 13 12.346 11.280 7.294 134 H3* U 13 H3* U 13 10.023 12.782 6.180 135 H2* U 13 H2* U 13 9.867 14.339 7.904 136 2HO* U 13 2HO* U 13 9.815 13.503 9.834 137 H1* U 13 H1* U 13 12.485 14.521 8.763 138 H3 U 13 H3 U 13 10.398 18.377 7.080 139 H5 U 13 H5 U 13 12.886 16.783 4.074 140 H6 U 13 H6 U 13 13.135 14.786 5.433 141 1H5* A 14 1H5* A 14 7.545 8.566 6.983 142 2H5* A 14 2H5* A 14 6.804 9.515 5.680 143 H4* A 14 H4* A 14 7.520 10.428 8.483 144 H3* A 14 H3* A 14 5.150 9.388 7.414 145 H2* A 14 H2* A 14 4.240 11.134 6.235 146 2HO* A 14 2HO* A 14 3.773 11.602 8.771 147 H1* A 14 H1* A 14 5.750 13.425 7.116 148 H8 A 14 H8 A 14 7.387 11.268 4.508 149 1H6 A 14 1H6 A 14 4.088 14.213 0.248 150 2H6 A 14 2H6 A 14 5.311 12.996 0.529 151 H2 A 14 H2 A 14 2.626 15.525 4.261 152 1H5* A 15 1H5* A 15 2.082 11.359 9.365 153 2H5* A 15 2H5* A 15 0.994 9.957 9.305 154 H4* A 15 H4* A 15 0.734 11.823 7.501 155 H3* A 15 H3* A 15 0.869 8.830 6.941 156 H2* A 15 H2* A 15 0.609 9.308 4.668 157 2HO* A 15 2HO* A 15 -0.343 11.932 5.102 158 H1* A 15 H1* A 15 1.685 11.982 4.781 159 H8 A 15 H8 A 15 3.980 9.053 5.585 160 1H6 A 15 1H6 A 15 5.072 8.680 -0.476 161 2H6 A 15 2H6 A 15 5.640 8.192 1.106 162 H2 A 15 H2 A 15 1.812 11.695 0.183 163 1H5* G 16 1H5* G 16 -3.908 10.737 6.259 164 2H5* G 16 2H5* G 16 -4.678 9.169 5.944 165 H4* G 16 H4* G 16 -5.186 11.041 4.265 166 H3* G 16 H3* G 16 -4.121 8.302 3.517 167 H2* G 16 H2* G 16 -4.219 8.940 1.212 168 2HO* G 16 2HO* G 16 -5.997 10.831 2.212 169 H1* G 16 H1* G 16 -3.008 11.327 1.486 170 H8 G 16 H8 G 16 -1.463 9.153 4.115 171 H1 G 16 H1 G 16 0.479 7.607 -1.762 172 1H2 G 16 1H2 G 16 -0.921 8.513 -3.250 173 2H2 G 16 2H2 G 16 -1.916 9.884 -2.816 174 1H5* G 17 1H5* G 17 -9.023 7.624 2.603 175 2H5* G 17 2H5* G 17 -8.936 5.851 2.557 176 H4* G 17 H4* G 17 -9.703 7.110 0.410 177 H3* G 17 H3* G 17 -7.683 4.866 0.614 178 H2* G 17 H2* G 17 -7.201 5.025 -1.720 179 2HO* G 17 2HO* G 17 -9.707 6.157 -1.771 180 H1* G 17 H1* G 17 -6.887 7.678 -1.836 181 H8 G 17 H8 G 17 -5.725 7.172 1.587 182 H1 G 17 H1 G 17 -1.724 4.373 -2.516 183 1H2 G 17 1H2 G 17 -2.669 4.225 -4.517 184 2H2 G 17 2H2 G 17 -4.289 4.807 -4.837 185 1H5* A 18 1H5* A 18 -11.025 3.338 -2.130 186 2H5* A 18 2H5* A 18 -11.073 1.567 -2.074 187 H4* A 18 H4* A 18 -10.484 2.707 -4.334 188 H3* A 18 H3* A 18 -8.996 0.418 -3.024 189 H2* A 18 H2* A 18 -7.470 0.385 -4.847 190 2HO* A 18 2HO* A 18 -7.917 1.346 -6.810 191 H1* A 18 H1* A 18 -7.191 3.090 -5.159 192 H8 A 18 H8 A 18 -7.116 2.880 -1.536 193 1H6 A 18 1H6 A 18 -1.482 0.430 -1.793 194 2H6 A 18 2H6 A 18 -2.601 1.343 -0.806 195 H2 A 18 H2 A 18 -3.329 0.139 -5.888 196 1H5* U 19 1H5* U 19 -10.120 -0.733 -6.478 197 2H5* U 19 2H5* U 19 -10.940 -2.223 -6.992 198 H4* U 19 H4* U 19 -8.823 -2.511 -7.925 199 H3* U 19 H3* U 19 -8.941 -3.767 -5.171 200 H2* U 19 H2* U 19 -6.665 -4.321 -5.278 201 2HO* U 19 2HO* U 19 -7.253 -4.688 -7.871 202 H1* U 19 H1* U 19 -5.763 -2.122 -6.743 203 H3 U 19 H3 U 19 -3.512 -1.507 -2.905 204 H5 U 19 H5 U 19 -7.551 -1.241 -1.715 205 H6 U 19 H6 U 19 -8.177 -1.836 -3.983 206 1H5* G 20 1H5* G 20 -8.556 -6.793 -9.141 207 2H5* G 20 2H5* G 20 -8.592 -8.442 -8.481 208 H4* G 20 H4* G 20 -6.795 -8.023 -10.217 209 H3* G 20 H3* G 20 -6.320 -9.105 -7.448 210 H2* G 20 H2* G 20 -3.970 -9.030 -7.679 211 2HO* G 20 2HO* G 20 -4.459 -9.693 -10.140 212 H1* G 20 H1* G 20 -3.711 -6.644 -8.936 213 H8 G 20 H8 G 20 -6.552 -6.223 -6.529 214 H1 G 20 H1 G 20 -0.893 -6.109 -3.603 215 1H2 G 20 1H2 G 20 0.711 -6.685 -5.028 216 2H2 G 20 2H2 G 20 0.377 -7.156 -6.678 217 1H5* A 21 1H5* A 21 -4.059 -11.974 -9.430 218 2H5* A 21 2H5* A 21 -4.125 -13.472 -8.480 219 H4* A 21 H4* A 21 -1.955 -12.041 -8.370 220 H3* A 21 H3* A 21 -3.487 -13.158 -5.995 221 H2* A 21 H2* A 21 -1.968 -12.150 -4.532 222 2HO* A 21 2HO* A 21 0.124 -11.335 -5.754 223 H1* A 21 H1* A 21 -1.232 -9.953 -6.180 224 H8 A 21 H8 A 21 -4.816 -9.562 -5.729 225 1H6 A 21 1H6 A 21 -3.850 -7.754 0.083 226 2H6 A 21 2H6 A 21 -5.034 -7.887 -1.197 227 H2 A 21 H2 A 21 -0.078 -9.682 -1.432 228 1H5* A 22 1H5* A 22 0.867 -13.877 -6.080 229 2H5* A 22 2H5* A 22 0.972 -15.589 -6.530 230 H4* A 22 H4* A 22 2.824 -15.577 -5.204 231 H3* A 22 H3* A 22 0.466 -15.888 -3.369 232 H2* A 22 H2* A 22 1.692 -15.374 -1.422 233 2HO* A 22 2HO* A 22 3.582 -16.713 -2.591 234 H1* A 22 H1* A 22 3.261 -13.370 -2.342 235 H8 A 22 H8 A 22 -0.002 -12.917 -4.045 236 1H6 A 22 1H6 A 22 -2.327 -10.695 1.212 237 2H6 A 22 2H6 A 22 -2.608 -10.904 -0.502 238 H2 A 22 H2 A 22 1.686 -12.519 2.103 239 1H5* C 23 1H5* C 23 3.046 -19.346 -1.871 240 2H5* C 23 2H5* C 23 1.878 -20.503 -1.201 241 H4* C 23 H4* C 23 3.462 -19.220 0.438 242 H3* C 23 H3* C 23 0.475 -19.659 0.729 243 H2* C 23 H2* C 23 0.442 -18.375 2.722 244 2HO* C 23 2HO* C 23 2.488 -17.706 3.694 245 H1* C 23 H1* C 23 2.094 -16.347 1.895 246 1H4 C 23 1H4 C 23 -3.972 -14.710 0.780 247 2H4 C 23 2H4 C 23 -3.627 -14.915 -0.921 248 H5 C 23 H5 C 23 -1.685 -16.076 -1.727 249 H6 C 23 H6 C 23 0.459 -17.097 -1.094 250 1H5* C 24 1H5* C 24 1.720 -22.084 4.439 251 2H5* C 24 2H5* C 24 0.403 -23.271 4.521 252 H4* C 24 H4* C 24 0.547 -21.486 6.395 253 H3* C 24 H3* C 24 -1.908 -22.195 4.777 254 H2* C 24 H2* C 24 -3.197 -20.637 5.978 255 2HO* C 24 2HO* C 24 -2.443 -21.089 8.076 256 H1* C 24 H1* C 24 -1.362 -18.615 5.996 257 1H4 C 24 1H4 C 24 -5.226 -17.900 0.942 258 2H4 C 24 2H4 C 24 -4.007 -18.668 -0.051 259 H5 C 24 H5 C 24 -2.034 -19.717 0.853 260 H6 C 24 H6 C 24 -0.774 -20.200 2.895 261 H3T C 24 H3T C 24 -2.058 -23.613 6.341 Start of MODEL 10 1 1H5* G 1 1H5* G 1 -13.475 -11.767 3.518 2 2H5* G 1 2H5* G 1 -12.420 -10.350 3.698 3 H4* G 1 H4* G 1 -12.677 -11.582 5.833 4 H3* G 1 H3* G 1 -10.003 -11.304 4.469 5 H2* G 1 H2* G 1 -8.927 -12.709 6.038 6 2HO* G 1 2HO* G 1 -9.524 -12.394 8.046 7 H1* G 1 H1* G 1 -10.815 -14.638 6.273 8 H8 G 1 H8 G 1 -10.970 -13.652 2.687 9 H1 G 1 H1 G 1 -5.732 -17.065 3.955 10 1H2 G 1 1H2 G 1 -5.494 -17.293 6.154 11 2H2 G 1 2H2 G 1 -6.510 -16.443 7.297 12 H5T G 1 H5T G 1 -11.274 -11.167 2.174 13 1H5* G 2 1H5* G 2 -8.981 -9.415 8.507 14 2H5* G 2 2H5* G 2 -7.667 -8.290 8.107 15 H4* G 2 H4* G 2 -7.096 -10.361 9.559 16 H3* G 2 H3* G 2 -5.602 -9.299 7.166 17 H2* G 2 H2* G 2 -4.135 -11.145 7.107 18 2HO* G 2 2HO* G 2 -3.600 -11.230 9.300 19 H1* G 2 H1* G 2 -5.898 -13.146 7.678 20 H8 G 2 H8 G 2 -7.826 -10.900 5.452 21 H1 G 2 H1 G 2 -3.323 -14.077 2.244 22 1H2 G 2 1H2 G 2 -1.961 -15.097 3.675 23 2H2 G 2 2H2 G 2 -1.983 -14.736 5.386 24 1H5* U 3 1H5* U 3 -2.427 -9.612 10.188 25 2H5* U 3 2H5* U 3 -1.781 -7.984 10.484 26 H4* U 3 H4* U 3 0.123 -9.338 10.043 27 H3* U 3 H3* U 3 -0.770 -7.652 7.694 28 H2* U 3 H2* U 3 0.940 -8.568 6.331 29 2HO* U 3 2HO* U 3 2.204 -10.234 8.059 30 H1* U 3 H1* U 3 0.687 -11.169 7.081 31 H3 U 3 H3 U 3 -1.110 -10.938 2.931 32 H5 U 3 H5 U 3 -3.998 -9.096 5.390 33 H6 U 3 H6 U 3 -2.451 -9.298 7.244 34 1H5* U 4 1H5* U 4 3.326 -6.965 7.636 35 2H5* U 4 2H5* U 4 3.650 -5.413 6.842 36 H4* U 4 H4* U 4 4.187 -7.601 5.544 37 H3* U 4 H3* U 4 2.582 -5.259 4.452 38 H2* U 4 H2* U 4 2.444 -6.390 2.389 39 2HO* U 4 2HO* U 4 4.038 -8.530 2.710 40 H1* U 4 H1* U 4 2.294 -8.997 3.425 41 H3 U 4 H3 U 4 -1.335 -8.072 0.797 42 H5 U 4 H5 U 4 -2.236 -6.463 4.584 43 H6 U 4 H6 U 4 0.074 -6.870 5.234 44 1H5* C 5 1H5* C 5 5.117 -6.577 1.696 45 2H5* C 5 2H5* C 5 6.605 -5.617 1.818 46 H4* C 5 H4* C 5 6.700 -5.847 -0.434 47 H3* C 5 H3* C 5 4.636 -3.687 0.021 48 H2* C 5 H2* C 5 3.962 -3.733 -2.246 49 2HO* C 5 2HO* C 5 6.166 -3.781 -3.052 50 H1* C 5 H1* C 5 4.018 -6.431 -2.656 51 1H4 C 5 1H4 C 5 -1.983 -5.140 -1.012 52 2H4 C 5 2H4 C 5 -1.501 -4.745 0.621 53 H5 C 5 H5 C 5 0.783 -4.824 1.378 54 H6 C 5 H6 C 5 3.112 -5.197 0.712 55 1H5* C 6 1H5* C 6 7.297 -2.321 -2.908 56 2H5* C 6 2H5* C 6 7.273 -0.595 -3.324 57 H4* C 6 H4* C 6 5.960 -2.244 -4.844 58 H3* C 6 H3* C 6 4.962 0.382 -3.716 59 H2* C 6 H2* C 6 2.835 0.040 -4.724 60 2HO* C 6 2HO* C 6 4.205 -1.948 -6.238 61 H1* C 6 H1* C 6 2.545 -2.595 -4.104 62 1H4 C 6 1H4 C 6 -0.030 0.885 0.619 63 2H4 C 6 2H4 C 6 1.408 0.559 1.562 64 H5 C 6 H5 C 6 3.414 -0.383 0.616 65 H6 C 6 H6 C 6 4.404 -1.392 -1.385 66 1H5* C 7 1H5* C 7 3.840 0.233 -7.064 67 2H5* C 7 2H5* C 7 4.331 1.174 -8.488 68 H4* C 7 H4* C 7 2.046 1.435 -8.645 69 H3* C 7 H3* C 7 3.052 3.609 -6.772 70 H2* C 7 H2* C 7 0.823 4.357 -6.505 71 2HO* C 7 2HO* C 7 -0.393 4.373 -8.231 72 H1* C 7 H1* C 7 -0.391 1.865 -6.475 73 1H4 C 7 1H4 C 7 0.096 3.964 -0.463 74 2H4 C 7 2H4 C 7 1.735 3.368 -0.384 75 H5 C 7 H5 C 7 3.003 2.897 -2.390 76 H6 C 7 H6 C 7 2.832 2.203 -4.730 77 1H5* C 8 1H5* C 8 1.206 5.497 -10.059 78 2H5* C 8 2H5* C 8 2.035 6.860 -10.833 79 H4* C 8 H4* C 8 -0.071 7.729 -10.167 80 H3* C 8 H3* C 8 2.157 8.427 -8.222 81 H2* C 8 H2* C 8 0.589 9.636 -6.901 82 2HO* C 8 2HO* C 8 -0.816 9.692 -9.307 83 H1* C 8 H1* C 8 -1.433 7.813 -6.999 84 1H4 C 8 1H4 C 8 1.879 6.430 -1.737 85 2H4 C 8 2H4 C 8 3.217 5.835 -2.693 86 H5 C 8 H5 C 8 3.223 5.822 -5.097 87 H6 C 8 H6 C 8 2.004 6.484 -7.116 88 1H5* U 9 1H5* U 9 0.455 12.306 -9.191 89 2H5* U 9 2H5* U 9 1.667 13.555 -8.848 90 H4* U 9 H4* U 9 -0.423 13.388 -7.296 91 H3* U 9 H3* U 9 2.464 13.540 -6.331 92 H2* U 9 H2* U 9 1.646 13.581 -4.120 93 2HO* U 9 2HO* U 9 -0.878 14.311 -5.253 94 H1* U 9 H1* U 9 -0.631 11.970 -4.579 95 H3 U 9 H3 U 9 1.829 10.193 -1.165 96 H5 U 9 H5 U 9 3.777 8.968 -4.691 97 H6 U 9 H6 U 9 2.336 10.473 -5.933 98 1H5* G 10 1H5* G 10 1.981 18.032 -5.094 99 2H5* G 10 2H5* G 10 3.739 18.223 -4.938 100 H4* G 10 H4* G 10 2.185 18.022 -2.793 101 H3* G 10 H3* G 10 4.963 16.975 -3.324 102 H2* G 10 H2* G 10 4.983 15.723 -1.289 103 2HO* G 10 2HO* G 10 2.842 16.028 0.011 104 H1* G 10 H1* G 10 2.552 14.611 -1.490 105 H8 G 10 H8 G 10 3.529 14.980 -5.056 106 H1 G 10 H1 G 10 6.685 10.222 -2.229 107 1H2 G 10 1H2 G 10 6.476 10.377 -0.030 108 2H2 G 10 2H2 G 10 5.596 11.680 0.737 109 1H5* C 11 1H5* C 11 6.499 20.716 -1.022 110 2H5* C 11 2H5* C 11 7.858 21.042 -2.118 111 H4* C 11 H4* C 11 9.076 19.267 -1.353 112 H3* C 11 H3* C 11 6.631 17.827 -1.831 113 H2* C 11 H2* C 11 6.093 16.968 0.245 114 2HO* C 11 2HO* C 11 8.865 16.501 0.243 115 H1* C 11 H1* C 11 7.664 18.332 2.071 116 1H4 C 11 1H4 C 11 2.276 21.830 2.579 117 2H4 C 11 2H4 C 11 1.457 20.387 2.027 118 H5 C 11 H5 C 11 2.930 19.758 -0.130 119 H6 C 11 H6 C 11 5.111 18.740 -0.575 120 1H5* A 12 1H5* A 12 10.625 15.294 -0.681 121 2H5* A 12 2H5* A 12 10.358 13.544 -0.804 122 H4* A 12 H4* A 12 11.289 14.418 1.418 123 H3* A 12 H3* A 12 9.410 12.333 0.854 124 H2* A 12 H2* A 12 7.628 13.084 2.133 125 2HO* A 12 2HO* A 12 8.217 12.966 4.523 126 H1* A 12 H1* A 12 9.222 14.877 3.888 127 H8 A 12 H8 A 12 6.377 14.817 1.253 128 1H6 A 12 1H6 A 12 3.167 17.854 5.182 129 2H6 A 12 2H6 A 12 3.648 18.491 3.625 130 H2 A 12 H2 A 12 7.524 17.639 6.872 131 1H5* U 13 1H5* U 13 12.605 11.242 4.787 132 2H5* U 13 2H5* U 13 11.941 9.741 5.461 133 H4* U 13 H4* U 13 11.790 10.747 7.458 134 H3* U 13 H3* U 13 9.711 12.205 5.884 135 H2* U 13 H2* U 13 9.723 14.128 7.215 136 2HO* U 13 2HO* U 13 11.160 12.801 9.279 137 H1* U 13 H1* U 13 12.352 14.256 7.980 138 H3 U 13 H3 U 13 10.706 17.652 5.200 139 H5 U 13 H5 U 13 12.883 14.943 2.819 140 H6 U 13 H6 U 13 12.921 13.411 4.709 141 1H5* A 14 1H5* A 14 6.690 8.482 7.166 142 2H5* A 14 2H5* A 14 6.245 9.467 5.758 143 H4* A 14 H4* A 14 6.963 10.463 8.538 144 H3* A 14 H3* A 14 4.501 9.610 7.485 145 H2* A 14 H2* A 14 3.773 11.395 6.239 146 2HO* A 14 2HO* A 14 4.099 12.774 8.715 147 H1* A 14 H1* A 14 5.560 13.528 6.991 148 H8 A 14 H8 A 14 6.910 11.095 4.470 149 1H6 A 14 1H6 A 14 3.801 14.129 0.124 150 2H6 A 14 2H6 A 14 4.859 12.771 0.442 151 H2 A 14 H2 A 14 2.598 15.792 4.079 152 1H5* A 15 1H5* A 15 1.636 11.846 9.636 153 2H5* A 15 2H5* A 15 0.448 10.528 9.581 154 H4* A 15 H4* A 15 0.222 12.500 7.883 155 H3* A 15 H3* A 15 0.102 9.540 7.146 156 H2* A 15 H2* A 15 -0.485 10.248 4.957 157 2HO* A 15 2HO* A 15 -0.784 12.938 5.809 158 H1* A 15 H1* A 15 1.179 12.510 4.927 159 H8 A 15 H8 A 15 2.846 9.295 6.089 160 1H6 A 15 1H6 A 15 3.999 8.127 0.146 161 2H6 A 15 2H6 A 15 4.338 7.638 1.793 162 H2 A 15 H2 A 15 1.261 11.672 0.375 163 1H5* G 16 1H5* G 16 -4.333 10.622 6.603 164 2H5* G 16 2H5* G 16 -5.127 9.034 6.646 165 H4* G 16 H4* G 16 -5.089 10.305 4.384 166 H3* G 16 H3* G 16 -4.198 7.419 4.760 167 H2* G 16 H2* G 16 -3.758 7.307 2.471 168 2HO* G 16 2HO* G 16 -4.878 8.546 0.963 169 H1* G 16 H1* G 16 -3.260 10.107 2.085 170 H8 G 16 H8 G 16 -0.936 8.213 4.415 171 H1 G 16 H1 G 16 0.506 7.522 -1.761 172 1H2 G 16 1H2 G 16 -1.027 8.566 -2.991 173 2H2 G 16 2H2 G 16 -2.576 9.020 -2.317 174 1H5* G 17 1H5* G 17 -9.055 7.353 2.889 175 2H5* G 17 2H5* G 17 -9.210 5.584 2.854 176 H4* G 17 H4* G 17 -9.900 6.825 0.723 177 H3* G 17 H3* G 17 -7.944 4.518 0.855 178 H2* G 17 H2* G 17 -7.547 4.665 -1.486 179 2HO* G 17 2HO* G 17 -10.034 5.447 -1.595 180 H1* G 17 H1* G 17 -7.235 7.332 -1.647 181 H8 G 17 H8 G 17 -5.829 6.785 1.686 182 H1 G 17 H1 G 17 -2.074 4.148 -2.741 183 1H2 G 17 1H2 G 17 -3.162 3.999 -4.670 184 2H2 G 17 2H2 G 17 -4.790 4.604 -4.881 185 1H5* A 18 1H5* A 18 -10.599 3.662 -2.272 186 2H5* A 18 2H5* A 18 -10.880 1.936 -2.558 187 H4* A 18 H4* A 18 -9.629 3.298 -4.389 188 H3* A 18 H3* A 18 -8.716 0.638 -3.241 189 H2* A 18 H2* A 18 -6.876 0.693 -4.724 190 2HO* A 18 2HO* A 18 -8.455 2.558 -6.192 191 H1* A 18 H1* A 18 -6.511 3.477 -4.747 192 H8 A 18 H8 A 18 -6.335 2.894 -1.225 193 1H6 A 18 1H6 A 18 -0.851 0.187 -1.884 194 2H6 A 18 2H6 A 18 -1.942 0.964 -0.759 195 H2 A 18 H2 A 18 -2.871 0.255 -5.903 196 1H5* U 19 1H5* U 19 -9.102 0.138 -6.875 197 2H5* U 19 2H5* U 19 -9.898 -1.135 -7.823 198 H4* U 19 H4* U 19 -7.679 -1.625 -8.271 199 H3* U 19 H3* U 19 -8.503 -3.110 -5.756 200 H2* U 19 H2* U 19 -6.315 -3.945 -5.522 201 2HO* U 19 2HO* U 19 -6.011 -3.246 -8.276 202 H1* U 19 H1* U 19 -4.939 -1.704 -6.454 203 H3 U 19 H3 U 19 -3.521 -1.801 -2.194 204 H5 U 19 H5 U 19 -7.684 -1.243 -1.812 205 H6 U 19 H6 U 19 -7.860 -1.469 -4.221 206 1H5* G 20 1H5* G 20 -8.028 -6.185 -9.774 207 2H5* G 20 2H5* G 20 -8.215 -7.807 -9.078 208 H4* G 20 H4* G 20 -6.153 -7.424 -10.550 209 H3* G 20 H3* G 20 -6.125 -8.555 -7.742 210 H2* G 20 H2* G 20 -3.764 -8.721 -7.786 211 2HO* G 20 2HO* G 20 -3.613 -7.963 -10.509 212 H1* G 20 H1* G 20 -3.215 -6.341 -9.015 213 H8 G 20 H8 G 20 -6.083 -5.812 -6.637 214 H1 G 20 H1 G 20 -0.450 -6.034 -3.656 215 1H2 G 20 1H2 G 20 1.132 -6.684 -5.075 216 2H2 G 20 2H2 G 20 0.801 -7.031 -6.757 217 1H5* A 21 1H5* A 21 -3.883 -11.474 -9.647 218 2H5* A 21 2H5* A 21 -4.027 -13.005 -8.759 219 H4* A 21 H4* A 21 -1.822 -11.643 -8.519 220 H3* A 21 H3* A 21 -3.463 -12.797 -6.235 221 H2* A 21 H2* A 21 -1.946 -11.899 -4.696 222 2HO* A 21 2HO* A 21 -0.006 -11.565 -6.762 223 H1* A 21 H1* A 21 -1.084 -9.682 -6.261 224 H8 A 21 H8 A 21 -4.661 -9.160 -5.838 225 1H6 A 21 1H6 A 21 -3.658 -7.481 0.011 226 2H6 A 21 2H6 A 21 -4.839 -7.534 -1.280 227 H2 A 21 H2 A 21 0.037 -9.537 -1.512 228 1H5* A 22 1H5* A 22 0.938 -13.611 -6.290 229 2H5* A 22 2H5* A 22 0.992 -15.341 -6.678 230 H4* A 22 H4* A 22 2.832 -15.291 -5.318 231 H3* A 22 H3* A 22 0.423 -15.558 -3.513 232 H2* A 22 H2* A 22 1.740 -15.229 -1.571 233 2HO* A 22 2HO* A 22 4.219 -15.013 -2.221 234 H1* A 22 H1* A 22 3.317 -13.214 -2.463 235 H8 A 22 H8 A 22 -0.041 -12.654 -3.973 236 1H6 A 22 1H6 A 22 -1.998 -10.521 1.459 237 2H6 A 22 2H6 A 22 -2.406 -10.738 -0.227 238 H2 A 22 H2 A 22 2.022 -12.454 2.072 239 1H5* C 23 1H5* C 23 2.788 -19.095 -2.062 240 2H5* C 23 2H5* C 23 1.576 -20.211 -1.406 241 H4* C 23 H4* C 23 3.188 -18.981 0.246 242 H3* C 23 H3* C 23 0.189 -19.334 0.517 243 H2* C 23 H2* C 23 0.182 -18.059 2.514 244 2HO* C 23 2HO* C 23 2.673 -19.072 2.743 245 H1* C 23 H1* C 23 1.924 -16.089 1.718 246 1H4 C 23 1H4 C 23 -4.035 -14.105 0.615 247 2H4 C 23 2H4 C 23 -3.728 -14.372 -1.085 248 H5 C 23 H5 C 23 -1.830 -15.595 -1.900 249 H6 C 23 H6 C 23 0.252 -16.737 -1.274 250 1H5* C 24 1H5* C 24 1.408 -22.111 4.067 251 2H5* C 24 2H5* C 24 0.053 -23.258 4.061 252 H4* C 24 H4* C 24 0.263 -21.623 6.067 253 H3* C 24 H3* C 24 -2.212 -22.176 4.425 254 H2* C 24 H2* C 24 -3.471 -20.653 5.691 255 2HO* C 24 2HO* C 24 -1.476 -19.991 7.518 256 H1* C 24 H1* C 24 -1.581 -18.685 5.880 257 1H4 C 24 1H4 C 24 -5.358 -17.425 0.874 258 2H4 C 24 2H4 C 24 -4.176 -18.184 -0.166 259 H5 C 24 H5 C 24 -2.267 -19.395 0.667 260 H6 C 24 H6 C 24 -1.043 -20.081 2.672 261 H3T C 24 H3T C 24 -1.939 -22.632 7.179 Start of MODEL 11 1 1H5* G 1 1H5* G 1 -13.113 -12.155 1.837 2 2H5* G 1 2H5* G 1 -12.480 -10.534 2.187 3 H4* G 1 H4* G 1 -12.789 -11.490 4.320 4 H3* G 1 H3* G 1 -9.960 -11.500 3.328 5 H2* G 1 H2* G 1 -9.168 -12.950 5.009 6 2HO* G 1 2HO* G 1 -10.252 -13.267 6.940 7 H1* G 1 H1* G 1 -11.193 -14.717 5.139 8 H8 G 1 H8 G 1 -11.142 -13.938 1.530 9 H1 G 1 H1 G 1 -5.981 -17.293 3.203 10 1H2 G 1 1H2 G 1 -5.788 -17.322 5.419 11 2H2 G 1 2H2 G 1 -6.936 -16.535 6.473 12 H5T G 1 H5T G 1 -11.209 -11.408 0.616 13 1H5* G 2 1H5* G 2 -9.254 -9.744 7.560 14 2H5* G 2 2H5* G 2 -7.907 -8.632 7.246 15 H4* G 2 H4* G 2 -7.485 -10.633 8.839 16 H3* G 2 H3* G 2 -5.763 -9.633 6.590 17 H2* G 2 H2* G 2 -4.318 -11.491 6.642 18 2HO* G 2 2HO* G 2 -4.839 -13.027 8.610 19 H1* G 2 H1* G 2 -6.110 -13.487 7.093 20 H8 G 2 H8 G 2 -7.876 -11.198 4.766 21 H1 G 2 H1 G 2 -3.263 -14.456 1.807 22 1H2 G 2 1H2 G 2 -2.000 -15.502 3.306 23 2H2 G 2 2H2 G 2 -2.113 -15.148 5.016 24 1H5* U 3 1H5* U 3 -2.922 -9.733 10.014 25 2H5* U 3 2H5* U 3 -2.113 -8.158 10.133 26 H4* U 3 H4* U 3 -0.419 -9.882 9.916 27 H3* U 3 H3* U 3 -0.879 -8.084 7.518 28 H2* U 3 H2* U 3 0.814 -9.233 6.312 29 2HO* U 3 2HO* U 3 2.020 -10.955 7.570 30 H1* U 3 H1* U 3 0.129 -11.769 7.028 31 H3 U 3 H3 U 3 -1.128 -11.259 2.691 32 H5 U 3 H5 U 3 -4.098 -9.223 4.885 33 H6 U 3 H6 U 3 -2.782 -9.594 6.885 34 1H5* U 4 1H5* U 4 3.283 -7.551 7.882 35 2H5* U 4 2H5* U 4 3.682 -6.000 7.122 36 H4* U 4 H4* U 4 4.265 -8.190 5.846 37 H3* U 4 H3* U 4 2.798 -5.793 4.685 38 H2* U 4 H2* U 4 2.720 -6.897 2.604 39 2HO* U 4 2HO* U 4 4.137 -9.066 2.737 40 H1* U 4 H1* U 4 2.433 -9.507 3.578 41 H3 U 4 H3 U 4 -1.070 -8.398 0.842 42 H5 U 4 H5 U 4 -2.063 -6.870 4.640 43 H6 U 4 H6 U 4 0.208 -7.360 5.359 44 1H5* C 5 1H5* C 5 5.136 -6.895 1.996 45 2H5* C 5 2H5* C 5 6.648 -5.977 1.888 46 H4* C 5 H4* C 5 6.292 -6.057 -0.354 47 H3* C 5 H3* C 5 4.333 -3.931 0.583 48 H2* C 5 H2* C 5 3.467 -3.786 -1.617 49 2HO* C 5 2HO* C 5 4.874 -5.322 -3.167 50 H1* C 5 H1* C 5 3.589 -6.486 -2.235 51 1H4 C 5 1H4 C 5 -2.462 -5.395 -0.654 52 2H4 C 5 2H4 C 5 -2.014 -4.997 0.991 53 H5 C 5 H5 C 5 0.263 -4.994 1.776 54 H6 C 5 H6 C 5 2.610 -5.301 1.141 55 1H5* C 6 1H5* C 6 7.035 -2.417 -2.366 56 2H5* C 6 2H5* C 6 7.033 -0.692 -2.783 57 H4* C 6 H4* C 6 5.721 -2.336 -4.316 58 H3* C 6 H3* C 6 4.734 0.307 -3.213 59 H2* C 6 H2* C 6 2.625 -0.022 -4.253 60 2HO* C 6 2HO* C 6 2.367 -1.246 -6.016 61 H1* C 6 H1* C 6 2.332 -2.683 -3.705 62 1H4 C 6 1H4 C 6 -0.598 0.655 0.902 63 2H4 C 6 2H4 C 6 0.796 0.370 1.918 64 H5 C 6 H5 C 6 2.897 -0.454 1.061 65 H6 C 6 H6 C 6 4.030 -1.405 -0.894 66 1H5* C 7 1H5* C 7 4.079 0.080 -6.890 67 2H5* C 7 2H5* C 7 4.606 1.116 -8.233 68 H4* C 7 H4* C 7 2.284 1.094 -8.512 69 H3* C 7 H3* C 7 3.129 3.477 -6.831 70 H2* C 7 H2* C 7 0.872 4.130 -6.619 71 2HO* C 7 2HO* C 7 0.693 3.294 -9.080 72 H1* C 7 H1* C 7 -0.246 1.598 -6.427 73 1H4 C 7 1H4 C 7 0.043 4.126 -0.579 74 2H4 C 7 2H4 C 7 1.701 3.593 -0.423 75 H5 C 7 H5 C 7 3.009 2.903 -2.326 76 H6 C 7 H6 C 7 2.909 2.070 -4.624 77 1H5* C 8 1H5* C 8 1.289 5.188 -10.054 78 2H5* C 8 2H5* C 8 2.032 6.610 -10.813 79 H4* C 8 H4* C 8 -0.036 7.360 -9.866 80 H3* C 8 H3* C 8 2.376 8.065 -8.144 81 H2* C 8 H2* C 8 0.894 9.250 -6.716 82 2HO* C 8 2HO* C 8 -0.856 9.124 -8.952 83 H1* C 8 H1* C 8 -1.183 7.428 -6.813 84 1H4 C 8 1H4 C 8 2.021 6.508 -1.376 85 2H4 C 8 2H4 C 8 3.291 5.668 -2.240 86 H5 C 8 H5 C 8 3.376 5.511 -4.643 87 H6 C 8 H6 C 8 2.213 6.037 -6.737 88 1H5* U 9 1H5* U 9 0.645 12.107 -9.455 89 2H5* U 9 2H5* U 9 1.933 13.294 -9.172 90 H4* U 9 H4* U 9 -0.244 13.464 -7.751 91 H3* U 9 H3* U 9 2.590 13.515 -6.637 92 H2* U 9 H2* U 9 1.666 13.877 -4.489 93 2HO* U 9 2HO* U 9 -0.180 14.937 -4.187 94 H1* U 9 H1* U 9 -0.611 12.283 -4.828 95 H3 U 9 H3 U 9 1.765 10.616 -1.322 96 H5 U 9 H5 U 9 3.767 9.212 -4.752 97 H6 U 9 H6 U 9 2.371 10.684 -6.086 98 1H5* G 10 1H5* G 10 2.147 18.026 -5.587 99 2H5* G 10 2H5* G 10 3.899 18.231 -5.385 100 H4* G 10 H4* G 10 2.292 18.159 -3.279 101 H3* G 10 H3* G 10 5.070 17.058 -3.673 102 H2* G 10 H2* G 10 5.022 15.909 -1.582 103 2HO* G 10 2HO* G 10 3.351 17.909 -0.930 104 H1* G 10 H1* G 10 2.584 14.817 -1.778 105 H8 G 10 H8 G 10 3.662 15.004 -5.334 106 H1 G 10 H1 G 10 6.673 10.345 -2.207 107 1H2 G 10 1H2 G 10 6.409 10.604 -0.024 108 2H2 G 10 2H2 G 10 5.570 11.979 0.659 109 1H5* C 11 1H5* C 11 6.724 20.809 -1.339 110 2H5* C 11 2H5* C 11 8.056 21.083 -2.480 111 H4* C 11 H4* C 11 9.408 19.582 -1.449 112 H3* C 11 H3* C 11 7.235 17.816 -1.980 113 H2* C 11 H2* C 11 6.479 17.165 0.095 114 2HO* C 11 2HO* C 11 9.024 17.214 1.290 115 H1* C 11 H1* C 11 7.756 18.775 1.954 116 1H4 C 11 1H4 C 11 1.485 20.351 1.077 117 2H4 C 11 2H4 C 11 2.141 21.924 1.471 118 H5 C 11 H5 C 11 3.248 19.686 -0.896 119 H6 C 11 H6 C 11 5.528 18.798 -0.999 120 1H5* A 12 1H5* A 12 11.174 16.265 0.003 121 2H5* A 12 2H5* A 12 11.468 14.514 -0.016 122 H4* A 12 H4* A 12 11.779 15.549 2.244 123 H3* A 12 H3* A 12 10.568 13.118 1.655 124 H2* A 12 H2* A 12 8.328 13.899 1.871 125 2HO* A 12 2HO* A 12 7.971 13.636 4.394 126 H1* A 12 H1* A 12 9.180 15.559 4.246 127 H8 A 12 H8 A 12 6.636 15.111 1.391 128 1H6 A 12 1H6 A 12 3.095 18.793 4.542 129 2H6 A 12 2H6 A 12 3.547 18.818 2.853 130 H2 A 12 H2 A 12 7.309 19.006 6.413 131 1H5* U 13 1H5* U 13 13.628 11.528 5.796 132 2H5* U 13 2H5* U 13 12.380 10.283 6.009 133 H4* U 13 H4* U 13 11.774 11.804 7.660 134 H3* U 13 H3* U 13 10.316 12.506 5.097 135 H2* U 13 H2* U 13 9.454 14.432 6.091 136 2HO* U 13 2HO* U 13 8.562 13.079 7.837 137 H1* U 13 H1* U 13 11.471 14.756 8.115 138 H3 U 13 H3 U 13 10.230 18.682 5.939 139 H5 U 13 H5 U 13 13.370 16.954 3.720 140 H6 U 13 H6 U 13 13.133 14.950 5.069 141 1H5* A 14 1H5* A 14 6.842 8.988 6.739 142 2H5* A 14 2H5* A 14 5.771 9.868 5.632 143 H4* A 14 H4* A 14 6.970 10.746 8.236 144 H3* A 14 H3* A 14 4.410 10.149 7.385 145 H2* A 14 H2* A 14 3.771 11.955 6.102 146 2HO* A 14 2HO* A 14 3.374 13.902 7.326 147 H1* A 14 H1* A 14 5.634 14.029 6.829 148 H8 A 14 H8 A 14 7.008 11.560 4.396 149 1H6 A 14 1H6 A 14 4.017 14.492 -0.099 150 2H6 A 14 2H6 A 14 5.115 13.183 0.280 151 H2 A 14 H2 A 14 2.668 16.220 3.788 152 1H5* A 15 1H5* A 15 1.854 12.732 9.443 153 2H5* A 15 2H5* A 15 0.542 11.539 9.515 154 H4* A 15 H4* A 15 0.457 13.385 7.674 155 H3* A 15 H3* A 15 0.066 10.405 7.147 156 H2* A 15 H2* A 15 -0.508 11.010 4.927 157 2HO* A 15 2HO* A 15 -0.616 13.565 4.705 158 H1* A 15 H1* A 15 1.319 13.149 4.737 159 H8 A 15 H8 A 15 2.765 9.872 6.002 160 1H6 A 15 1H6 A 15 3.781 8.408 0.102 161 2H6 A 15 2H6 A 15 4.092 7.953 1.764 162 H2 A 15 H2 A 15 1.237 12.095 0.210 163 1H5* G 16 1H5* G 16 -4.315 11.504 6.504 164 2H5* G 16 2H5* G 16 -5.048 9.904 6.729 165 H4* G 16 H4* G 16 -5.005 10.907 4.330 166 H3* G 16 H3* G 16 -4.054 8.105 5.057 167 H2* G 16 H2* G 16 -3.606 7.737 2.797 168 2HO* G 16 2HO* G 16 -4.816 9.723 1.484 169 H1* G 16 H1* G 16 -3.184 10.490 2.094 170 H8 G 16 H8 G 16 -0.799 8.898 4.582 171 H1 G 16 H1 G 16 0.614 7.567 -1.494 172 1H2 G 16 1H2 G 16 -0.984 8.346 -2.812 173 2H2 G 16 2H2 G 16 -2.454 9.057 -2.190 174 1H5* G 17 1H5* G 17 -8.903 7.685 3.198 175 2H5* G 17 2H5* G 17 -9.001 5.920 3.346 176 H4* G 17 H4* G 17 -9.730 6.885 1.102 177 H3* G 17 H3* G 17 -7.627 4.729 1.443 178 H2* G 17 H2* G 17 -7.266 4.674 -0.916 179 2HO* G 17 2HO* G 17 -9.811 5.416 -1.016 180 H1* G 17 H1* G 17 -7.080 7.316 -1.314 181 H8 G 17 H8 G 17 -5.701 7.108 2.080 182 H1 G 17 H1 G 17 -1.772 4.277 -2.066 183 1H2 G 17 1H2 G 17 -2.807 3.968 -4.004 184 2H2 G 17 2H2 G 17 -4.461 4.468 -4.279 185 1H5* A 18 1H5* A 18 -10.741 3.270 -1.293 186 2H5* A 18 2H5* A 18 -10.860 1.504 -1.383 187 H4* A 18 H4* A 18 -10.104 2.804 -3.508 188 H3* A 18 H3* A 18 -8.776 0.345 -2.334 189 H2* A 18 H2* A 18 -7.170 0.408 -4.089 190 2HO* A 18 2HO* A 18 -7.994 2.490 -5.585 191 H1* A 18 H1* A 18 -6.782 3.115 -4.147 192 H8 A 18 H8 A 18 -6.832 2.605 -0.555 193 1H6 A 18 1H6 A 18 -1.273 -0.006 -0.866 194 2H6 A 18 2H6 A 18 -2.397 0.848 0.166 195 H2 A 18 H2 A 18 -3.019 0.073 -5.014 196 1H5* U 19 1H5* U 19 -9.788 -0.423 -5.959 197 2H5* U 19 2H5* U 19 -10.631 -1.827 -6.647 198 H4* U 19 H4* U 19 -8.484 -2.054 -7.549 199 H3* U 19 H3* U 19 -8.793 -3.655 -5.003 200 H2* U 19 H2* U 19 -6.532 -4.254 -5.013 201 2HO* U 19 2HO* U 19 -6.233 -3.383 -7.707 202 H1* U 19 H1* U 19 -5.461 -1.945 -6.163 203 H3 U 19 H3 U 19 -3.436 -1.859 -2.157 204 H5 U 19 H5 U 19 -7.529 -1.531 -1.185 205 H6 U 19 H6 U 19 -8.033 -1.856 -3.537 206 1H5* G 20 1H5* G 20 -8.297 -6.404 -9.240 207 2H5* G 20 2H5* G 20 -8.395 -8.072 -8.642 208 H4* G 20 H4* G 20 -6.473 -7.603 -10.233 209 H3* G 20 H3* G 20 -6.177 -8.786 -7.469 210 H2* G 20 H2* G 20 -3.814 -8.816 -7.653 211 2HO* G 20 2HO* G 20 -2.848 -9.053 -9.538 212 H1* G 20 H1* G 20 -3.459 -6.367 -8.755 213 H8 G 20 H8 G 20 -6.354 -6.003 -6.408 214 H1 G 20 H1 G 20 -0.786 -6.265 -3.320 215 1H2 G 20 1H2 G 20 0.841 -6.803 -4.734 216 2H2 G 20 2H2 G 20 0.541 -7.161 -6.418 217 1H5* A 21 1H5* A 21 -4.009 -11.726 -9.550 218 2H5* A 21 2H5* A 21 -4.161 -13.256 -8.661 219 H4* A 21 H4* A 21 -1.904 -11.969 -8.515 220 H3* A 21 H3* A 21 -3.485 -13.072 -6.165 221 H2* A 21 H2* A 21 -1.858 -12.246 -4.690 222 2HO* A 21 2HO* A 21 -0.200 -13.258 -6.262 223 H1* A 21 H1* A 21 -1.020 -10.027 -6.257 224 H8 A 21 H8 A 21 -4.590 -9.493 -5.727 225 1H6 A 21 1H6 A 21 -3.415 -7.822 0.088 226 2H6 A 21 2H6 A 21 -4.615 -7.833 -1.185 227 H2 A 21 H2 A 21 0.238 -9.870 -1.546 228 1H5* A 22 1H5* A 22 1.305 -14.054 -6.623 229 2H5* A 22 2H5* A 22 1.010 -15.800 -6.690 230 H4* A 22 H4* A 22 3.034 -15.638 -5.497 231 H3* A 22 H3* A 22 0.622 -15.958 -3.720 232 H2* A 22 H2* A 22 1.869 -15.597 -1.745 233 2HO* A 22 2HO* A 22 4.224 -15.901 -3.344 234 H1* A 22 H1* A 22 3.465 -13.572 -2.580 235 H8 A 22 H8 A 22 0.171 -12.981 -4.215 236 1H6 A 22 1H6 A 22 -1.996 -10.918 1.167 237 2H6 A 22 2H6 A 22 -2.306 -11.049 -0.549 238 H2 A 22 H2 A 22 1.977 -12.895 1.916 239 1H5* C 23 1H5* C 23 2.935 -19.550 -2.235 240 2H5* C 23 2H5* C 23 1.661 -20.637 -1.646 241 H4* C 23 H4* C 23 3.219 -19.453 0.094 242 H3* C 23 H3* C 23 0.198 -19.717 0.211 243 H2* C 23 H2* C 23 0.145 -18.468 2.228 244 2HO* C 23 2HO* C 23 2.728 -17.950 2.732 245 H1* C 23 H1* C 23 1.952 -16.530 1.506 246 1H4 C 23 1H4 C 23 -3.937 -14.487 0.157 247 2H4 C 23 2H4 C 23 -3.558 -14.743 -1.529 248 H5 C 23 H5 C 23 -1.646 -15.990 -2.267 249 H6 C 23 H6 C 23 0.403 -17.149 -1.561 250 1H5* C 24 1H5* C 24 1.062 -22.309 3.912 251 2H5* C 24 2H5* C 24 -0.308 -23.436 3.859 252 H4* C 24 H4* C 24 -0.218 -21.719 5.800 253 H3* C 24 H3* C 24 -2.579 -22.273 3.995 254 H2* C 24 H2* C 24 -3.885 -20.687 5.139 255 2HO* C 24 2HO* C 24 -3.569 -20.868 7.258 256 H1* C 24 H1* C 24 -1.968 -18.752 5.364 257 1H4 C 24 1H4 C 24 -5.415 -17.697 0.073 258 2H4 C 24 2H4 C 24 -4.158 -18.482 -0.857 259 H5 C 24 H5 C 24 -2.306 -19.654 0.150 260 H6 C 24 H6 C 24 -1.222 -20.259 2.260 261 H3T C 24 H3T C 24 -3.188 -22.927 6.351 Start of MODEL 12 1 1H5* G 1 1H5* G 1 -13.564 -12.000 2.948 2 2H5* G 1 2H5* G 1 -12.295 -10.762 3.032 3 H4* G 1 H4* G 1 -12.733 -12.073 5.183 4 H3* G 1 H3* G 1 -10.055 -11.662 3.859 5 H2* G 1 H2* G 1 -8.956 -13.096 5.384 6 2HO* G 1 2HO* G 1 -10.831 -12.187 7.057 7 H1* G 1 H1* G 1 -10.797 -15.081 5.530 8 H8 G 1 H8 G 1 -10.868 -13.905 1.979 9 H1 G 1 H1 G 1 -5.697 -17.432 3.222 10 1H2 G 1 1H2 G 1 -5.513 -17.750 5.414 11 2H2 G 1 2H2 G 1 -6.628 -17.047 6.563 12 H5T G 1 H5T G 1 -11.515 -11.765 1.379 13 1H5* G 2 1H5* G 2 -9.163 -9.875 7.958 14 2H5* G 2 2H5* G 2 -7.852 -8.721 7.644 15 H4* G 2 H4* G 2 -7.295 -10.859 9.005 16 H3* G 2 H3* G 2 -5.753 -9.705 6.674 17 H2* G 2 H2* G 2 -4.253 -11.529 6.656 18 2HO* G 2 2HO* G 2 -4.146 -13.002 8.431 19 H1* G 2 H1* G 2 -6.034 -13.554 7.139 20 H8 G 2 H8 G 2 -7.825 -11.306 4.806 21 H1 G 2 H1 G 2 -3.167 -14.517 1.864 22 1H2 G 2 1H2 G 2 -1.861 -15.496 3.369 23 2H2 G 2 2H2 G 2 -2.021 -15.187 5.083 24 1H5* U 3 1H5* U 3 -2.923 -10.064 9.842 25 2H5* U 3 2H5* U 3 -2.266 -8.515 10.406 26 H4* U 3 H4* U 3 -0.333 -9.799 10.066 27 H3* U 3 H3* U 3 -0.970 -8.079 7.657 28 H2* U 3 H2* U 3 0.867 -8.996 6.466 29 2HO* U 3 2HO* U 3 2.133 -8.971 8.621 30 H1* U 3 H1* U 3 0.505 -11.601 7.146 31 H3 U 3 H3 U 3 -0.875 -11.265 2.839 32 H5 U 3 H5 U 3 -3.987 -9.480 5.055 33 H6 U 3 H6 U 3 -2.615 -9.710 7.039 34 1H5* U 4 1H5* U 4 3.092 -7.307 8.043 35 2H5* U 4 2H5* U 4 3.461 -5.762 7.256 36 H4* U 4 H4* U 4 4.128 -7.963 6.038 37 H3* U 4 H3* U 4 2.620 -5.635 4.789 38 H2* U 4 H2* U 4 2.640 -6.787 2.729 39 2HO* U 4 2HO* U 4 4.690 -8.422 3.876 40 H1* U 4 H1* U 4 2.370 -9.375 3.762 41 H3 U 4 H3 U 4 -1.066 -8.379 0.911 42 H5 U 4 H5 U 4 -2.192 -6.793 4.649 43 H6 U 4 H6 U 4 0.062 -7.239 5.443 44 1H5* C 5 1H5* C 5 5.056 -6.657 2.235 45 2H5* C 5 2H5* C 5 6.580 -5.760 2.166 46 H4* C 5 H4* C 5 6.312 -5.905 -0.086 47 H3* C 5 H3* C 5 4.388 -3.700 0.720 48 H2* C 5 H2* C 5 3.536 -3.621 -1.486 49 2HO* C 5 2HO* C 5 5.095 -5.333 -2.843 50 H1* C 5 H1* C 5 3.629 -6.335 -2.036 51 1H4 C 5 1H4 C 5 -2.421 -5.082 -0.588 52 2H4 C 5 2H4 C 5 -2.005 -4.744 1.078 53 H5 C 5 H5 C 5 0.260 -4.763 1.903 54 H6 C 5 H6 C 5 2.614 -5.122 1.312 55 1H5* C 6 1H5* C 6 6.783 -2.592 -2.379 56 2H5* C 6 2H5* C 6 6.949 -0.924 -2.961 57 H4* C 6 H4* C 6 5.304 -2.510 -4.210 58 H3* C 6 H3* C 6 4.735 0.318 -3.277 59 H2* C 6 H2* C 6 2.525 0.159 -4.100 60 2HO* C 6 2HO* C 6 3.039 -2.292 -5.421 61 H1* C 6 H1* C 6 2.056 -2.499 -3.467 62 1H4 C 6 1H4 C 6 -0.759 1.150 0.963 63 2H4 C 6 2H4 C 6 0.634 0.886 1.988 64 H5 C 6 H5 C 6 2.690 -0.082 1.188 65 H6 C 6 H6 C 6 3.790 -1.171 -0.717 66 1H5* C 7 1H5* C 7 3.750 -0.088 -6.841 67 2H5* C 7 2H5* C 7 4.271 0.775 -8.304 68 H4* C 7 H4* C 7 1.960 1.065 -8.399 69 H3* C 7 H3* C 7 3.245 3.383 -6.928 70 H2* C 7 H2* C 7 1.140 4.309 -6.468 71 2HO* C 7 2HO* C 7 -0.503 2.762 -7.997 72 H1* C 7 H1* C 7 -0.327 1.924 -6.258 73 1H4 C 7 1H4 C 7 0.292 4.421 -0.424 74 2H4 C 7 2H4 C 7 1.846 3.638 -0.260 75 H5 C 7 H5 C 7 3.121 3.053 -2.249 76 H6 C 7 H6 C 7 2.924 2.230 -4.547 77 1H5* C 8 1H5* C 8 1.398 5.407 -9.891 78 2H5* C 8 2H5* C 8 2.319 6.705 -10.676 79 H4* C 8 H4* C 8 0.541 7.718 -9.372 80 H3* C 8 H3* C 8 3.353 7.981 -8.261 81 H2* C 8 H2* C 8 2.541 9.050 -6.367 82 2HO* C 8 2HO* C 8 0.473 9.914 -8.113 83 H1* C 8 H1* C 8 -0.134 8.017 -6.446 84 1H4 C 8 1H4 C 8 2.339 6.260 -0.879 85 2H4 C 8 2H4 C 8 3.575 5.307 -1.670 86 H5 C 8 H5 C 8 3.848 5.223 -4.066 87 H6 C 8 H6 C 8 2.971 6.007 -6.218 88 1H5* U 9 1H5* U 9 0.720 12.149 -9.298 89 2H5* U 9 2H5* U 9 1.974 13.394 -9.130 90 H4* U 9 H4* U 9 -0.219 13.852 -7.904 91 H3* U 9 H3* U 9 2.477 13.791 -6.496 92 H2* U 9 H2* U 9 1.382 14.444 -4.493 93 2HO* U 9 2HO* U 9 0.073 16.067 -5.686 94 H1* U 9 H1* U 9 -0.901 12.908 -4.839 95 H3 U 9 H3 U 9 1.344 11.388 -1.165 96 H5 U 9 H5 U 9 3.378 9.715 -4.454 97 H6 U 9 H6 U 9 2.022 11.108 -5.915 98 1H5* G 10 1H5* G 10 2.069 18.200 -5.451 99 2H5* G 10 2H5* G 10 3.818 18.486 -5.361 100 H4* G 10 H4* G 10 2.463 18.508 -3.150 101 H3* G 10 H3* G 10 5.076 17.090 -3.690 102 H2* G 10 H2* G 10 5.053 16.088 -1.514 103 2HO* G 10 2HO* G 10 2.827 16.883 -0.369 104 H1* G 10 H1* G 10 2.522 15.218 -1.540 105 H8 G 10 H8 G 10 3.468 15.197 -5.153 106 H1 G 10 H1 G 10 5.979 10.265 -2.000 107 1H2 G 10 1H2 G 10 5.809 10.595 0.182 108 2H2 G 10 2H2 G 10 5.089 12.040 0.857 109 1H5* C 11 1H5* C 11 7.654 20.360 -1.756 110 2H5* C 11 2H5* C 11 8.870 20.195 -3.041 111 H4* C 11 H4* C 11 9.831 18.385 -2.063 112 H3* C 11 H3* C 11 7.173 17.349 -2.240 113 H2* C 11 H2* C 11 6.542 16.987 -0.057 114 2HO* C 11 2HO* C 11 9.050 16.335 0.953 115 H1* C 11 H1* C 11 8.463 18.195 1.538 116 1H4 C 11 1H4 C 11 2.932 21.738 0.788 117 2H4 C 11 2H4 C 11 3.815 22.511 2.085 118 H5 C 11 H5 C 11 4.065 20.298 -0.812 119 H6 C 11 H6 C 11 5.980 18.805 -1.131 120 1H5* A 12 1H5* A 12 10.549 15.350 -0.476 121 2H5* A 12 2H5* A 12 10.897 13.615 -0.594 122 H4* A 12 H4* A 12 11.465 14.323 1.637 123 H3* A 12 H3* A 12 9.647 12.260 1.157 124 H2* A 12 H2* A 12 7.687 13.400 1.794 125 2HO* A 12 2HO* A 12 7.706 13.247 4.323 126 H1* A 12 H1* A 12 9.134 14.925 3.942 127 H8 A 12 H8 A 12 6.351 14.971 1.273 128 1H6 A 12 1H6 A 12 3.819 18.658 3.140 129 2H6 A 12 2H6 A 12 4.255 19.934 4.255 130 H2 A 12 H2 A 12 8.143 18.681 6.159 131 1H5* U 13 1H5* U 13 13.272 10.121 4.531 132 2H5* U 13 2H5* U 13 12.095 8.793 4.520 133 H4* U 13 H4* U 13 11.383 9.906 6.414 134 H3* U 13 H3* U 13 9.995 11.172 4.036 135 H2* U 13 H2* U 13 9.070 12.815 5.419 136 2HO* U 13 2HO* U 13 8.931 12.382 7.771 137 H1* U 13 H1* U 13 11.067 12.791 7.456 138 H3 U 13 H3 U 13 9.809 16.986 5.820 139 H5 U 13 H5 U 13 13.106 15.662 3.550 140 H6 U 13 H6 U 13 12.857 13.476 4.583 141 1H5* A 14 1H5* A 14 7.913 10.177 7.269 142 2H5* A 14 2H5* A 14 6.332 9.380 7.347 143 H4* A 14 H4* A 14 6.774 11.601 8.690 144 H3* A 14 H3* A 14 4.426 10.369 7.642 145 H2* A 14 H2* A 14 3.546 12.005 6.309 146 2HO* A 14 2HO* A 14 3.160 14.105 7.492 147 H1* A 14 H1* A 14 5.198 14.300 6.913 148 H8 A 14 H8 A 14 6.207 11.522 4.499 149 1H6 A 14 1H6 A 14 3.621 14.845 0.030 150 2H6 A 14 2H6 A 14 4.439 13.345 0.412 151 H2 A 14 H2 A 14 2.835 16.913 3.901 152 1H5* A 15 1H5* A 15 1.448 12.618 9.838 153 2H5* A 15 2H5* A 15 0.278 11.280 9.835 154 H4* A 15 H4* A 15 -0.032 13.255 8.138 155 H3* A 15 H3* A 15 -0.163 10.296 7.393 156 H2* A 15 H2* A 15 -0.871 11.029 5.242 157 2HO* A 15 2HO* A 15 -2.402 12.542 5.628 158 H1* A 15 H1* A 15 0.819 13.276 5.163 159 H8 A 15 H8 A 15 2.410 9.971 6.237 160 1H6 A 15 1H6 A 15 3.489 8.942 0.258 161 2H6 A 15 2H6 A 15 3.829 8.402 1.888 162 H2 A 15 H2 A 15 0.909 12.596 0.611 163 1H5* G 16 1H5* G 16 -4.537 11.319 6.651 164 2H5* G 16 2H5* G 16 -5.278 9.709 6.739 165 H4* G 16 H4* G 16 -5.208 10.903 4.427 166 H3* G 16 H3* G 16 -4.295 8.048 4.954 167 H2* G 16 H2* G 16 -3.776 7.834 2.689 168 2HO* G 16 2HO* G 16 -4.772 9.321 1.124 169 H1* G 16 H1* G 16 -3.269 10.604 2.182 170 H8 G 16 H8 G 16 -1.042 8.936 4.738 171 H1 G 16 H1 G 16 0.686 7.657 -1.262 172 1H2 G 16 1H2 G 16 -1.055 8.179 -2.626 173 2H2 G 16 2H2 G 16 -2.105 9.491 -2.145 174 1H5* G 17 1H5* G 17 -9.070 7.778 2.922 175 2H5* G 17 2H5* G 17 -9.171 6.006 2.902 176 H4* G 17 H4* G 17 -9.771 7.239 0.721 177 H3* G 17 H3* G 17 -7.827 4.928 0.974 178 H2* G 17 H2* G 17 -7.360 5.037 -1.362 179 2HO* G 17 2HO* G 17 -8.628 6.684 -2.625 180 H1* G 17 H1* G 17 -7.042 7.703 -1.545 181 H8 G 17 H8 G 17 -5.704 7.200 1.816 182 H1 G 17 H1 G 17 -1.902 4.421 -2.482 183 1H2 G 17 1H2 G 17 -2.949 4.268 -4.433 184 2H2 G 17 2H2 G 17 -4.591 4.823 -4.667 185 1H5* A 18 1H5* A 18 -11.021 3.592 -1.878 186 2H5* A 18 2H5* A 18 -11.167 1.826 -1.897 187 H4* A 18 H4* A 18 -10.362 3.019 -4.064 188 H3* A 18 H3* A 18 -9.087 0.598 -2.758 189 H2* A 18 H2* A 18 -7.447 0.554 -4.475 190 2HO* A 18 2HO* A 18 -7.721 1.617 -6.429 191 H1* A 18 H1* A 18 -7.053 3.265 -4.701 192 H8 A 18 H8 A 18 -7.106 2.915 -1.083 193 1H6 A 18 1H6 A 18 -1.497 0.392 -1.284 194 2H6 A 18 2H6 A 18 -2.664 1.214 -0.272 195 H2 A 18 H2 A 18 -3.243 0.263 -5.428 196 1H5* U 19 1H5* U 19 -9.691 -0.204 -6.262 197 2H5* U 19 2H5* U 19 -10.454 -1.572 -7.096 198 H4* U 19 H4* U 19 -8.249 -1.882 -7.733 199 H3* U 19 H3* U 19 -8.726 -3.360 -5.128 200 H2* U 19 H2* U 19 -6.460 -3.990 -5.050 201 2HO* U 19 2HO* U 19 -5.292 -3.247 -7.249 202 H1* U 19 H1* U 19 -5.358 -1.663 -6.087 203 H3 U 19 H3 U 19 -3.752 -1.518 -1.893 204 H5 U 19 H5 U 19 -7.926 -1.247 -1.346 205 H6 U 19 H6 U 19 -8.185 -1.594 -3.735 206 1H5* G 20 1H5* G 20 -8.094 -6.319 -9.252 207 2H5* G 20 2H5* G 20 -8.078 -7.955 -8.565 208 H4* G 20 H4* G 20 -6.214 -7.393 -10.233 209 H3* G 20 H3* G 20 -5.865 -8.590 -7.486 210 H2* G 20 H2* G 20 -3.505 -8.491 -7.632 211 2HO* G 20 2HO* G 20 -2.495 -7.936 -9.687 212 H1* G 20 H1* G 20 -3.246 -6.027 -8.721 213 H8 G 20 H8 G 20 -6.186 -5.708 -6.451 214 H1 G 20 H1 G 20 -0.709 -5.985 -3.208 215 1H2 G 20 1H2 G 20 0.952 -6.567 -4.572 216 2H2 G 20 2H2 G 20 0.711 -6.823 -6.285 217 1H5* A 21 1H5* A 21 -3.601 -11.491 -9.534 218 2H5* A 21 2H5* A 21 -3.779 -13.030 -8.670 219 H4* A 21 H4* A 21 -1.537 -11.734 -8.420 220 H3* A 21 H3* A 21 -3.200 -12.878 -6.147 221 H2* A 21 H2* A 21 -1.664 -12.040 -4.598 222 2HO* A 21 2HO* A 21 0.136 -12.359 -6.749 223 H1* A 21 H1* A 21 -0.750 -9.817 -6.121 224 H8 A 21 H8 A 21 -4.303 -9.204 -5.719 225 1H6 A 21 1H6 A 21 -3.336 -7.722 0.186 226 2H6 A 21 2H6 A 21 -4.498 -7.710 -1.121 227 H2 A 21 H2 A 21 0.320 -9.849 -1.344 228 1H5* A 22 1H5* A 22 1.071 -13.826 -6.297 229 2H5* A 22 2H5* A 22 1.142 -15.525 -6.801 230 H4* A 22 H4* A 22 3.019 -15.567 -5.508 231 H3* A 22 H3* A 22 0.691 -15.908 -3.627 232 H2* A 22 H2* A 22 2.022 -15.561 -1.705 233 2HO* A 22 2HO* A 22 3.795 -16.798 -2.014 234 H1* A 22 H1* A 22 3.571 -13.520 -2.582 235 H8 A 22 H8 A 22 0.225 -12.969 -4.101 236 1H6 A 22 1H6 A 22 -1.808 -10.961 1.354 237 2H6 A 22 2H6 A 22 -2.182 -11.112 -0.348 238 H2 A 22 H2 A 22 2.220 -12.872 1.966 239 1H5* C 23 1H5* C 23 3.053 -19.478 -2.265 240 2H5* C 23 2H5* C 23 1.816 -20.604 -1.671 241 H4* C 23 H4* C 23 3.383 -19.423 0.059 242 H3* C 23 H3* C 23 0.376 -19.767 0.227 243 H2* C 23 H2* C 23 0.304 -18.527 2.244 244 2HO* C 23 2HO* C 23 1.882 -18.933 3.599 245 H1* C 23 H1* C 23 2.074 -16.545 1.543 246 1H4 C 23 1H4 C 23 -3.869 -14.604 0.235 247 2H4 C 23 2H4 C 23 -3.461 -14.783 -1.457 248 H5 C 23 H5 C 23 -1.527 -15.983 -2.215 249 H6 C 23 H6 C 23 0.546 -17.107 -1.527 250 1H5* C 24 1H5* C 24 1.449 -22.690 3.744 251 2H5* C 24 2H5* C 24 0.064 -23.794 3.639 252 H4* C 24 H4* C 24 0.241 -22.255 5.719 253 H3* C 24 H3* C 24 -2.184 -22.641 3.957 254 H2* C 24 H2* C 24 -3.438 -21.143 5.264 255 2HO* C 24 2HO* C 24 -2.753 -20.447 7.304 256 H1* C 24 H1* C 24 -1.499 -19.247 5.586 257 1H4 C 24 1H4 C 24 -5.062 -17.703 0.504 258 2H4 C 24 2H4 C 24 -3.860 -18.451 -0.524 259 H5 C 24 H5 C 24 -1.979 -19.690 0.329 260 H6 C 24 H6 C 24 -0.847 -20.485 2.349 261 H3T C 24 H3T C 24 -1.675 -24.357 5.284
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