NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
9768 | 1oo7 | 5781 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H5* G 1 1H5* G 1 -10.836 -11.698 -6.087 2 2H5* G 1 2H5* G 1 -10.862 -10.063 -5.410 3 H4* G 1 H4* G 1 -11.437 -11.835 -3.789 4 H3* G 1 H3* G 1 -9.056 -10.130 -3.120 5 H2* G 1 H2* G 1 -9.027 -11.293 -1.000 6 2HO* G 1 2HO* G 1 -11.384 -11.396 -0.960 7 H1* G 1 H1* G 1 -9.327 -13.750 -2.034 8 H8 G 1 H8 G 1 -7.115 -12.187 -4.615 9 H1 G 1 H1 G 1 -4.200 -13.785 0.918 10 1H2 G 1 1H2 G 1 -5.868 -13.992 2.465 11 2H2 G 1 2H2 G 1 -7.578 -13.749 1.975 12 H5T G 1 H5T G 1 -8.652 -10.038 -5.418 13 1H5* A 2 1H5* A 2 -11.601 -9.710 0.326 14 2H5* A 2 2H5* A 2 -11.454 -8.028 0.849 15 H4* A 2 H4* A 2 -10.839 -9.639 2.602 16 H3* A 2 H3* A 2 -8.686 -7.776 1.689 17 H2* A 2 H2* A 2 -7.314 -8.713 3.440 18 2HO* A 2 2HO* A 2 -8.273 -9.390 5.158 19 H1* A 2 H1* A 2 -7.858 -11.276 2.875 20 H8 A 2 H8 A 2 -7.871 -9.448 -0.456 21 1H6 A 2 1H6 A 2 -1.743 -10.460 -0.210 22 2H6 A 2 2H6 A 2 -3.093 -9.984 -1.281 23 H2 A 2 H2 A 2 -3.342 -11.311 3.723 24 1H5* A 3 1H5* A 3 -8.758 -7.432 5.926 25 2H5* A 3 2H5* A 3 -8.435 -5.739 6.327 26 H4* A 3 H4* A 3 -6.854 -7.272 7.380 27 H3* A 3 H3* A 3 -5.656 -5.327 5.428 28 H2* A 3 H2* A 3 -3.510 -6.172 6.237 29 2HO* A 3 2HO* A 3 -4.425 -6.409 8.405 30 H1* A 3 H1* A 3 -4.153 -8.766 6.029 31 H8 A 3 H8 A 3 -5.948 -6.963 3.185 32 1H6 A 3 1H6 A 3 -0.465 -7.480 0.272 33 2H6 A 3 2H6 A 3 -2.190 -7.047 0.086 34 H2 A 3 H2 A 3 0.170 -8.505 4.449 35 1H5* G 4 1H5* G 4 -3.522 -4.844 9.121 36 2H5* G 4 2H5* G 4 -3.123 -3.127 9.292 37 H4* G 4 H4* G 4 -1.164 -4.622 9.364 38 H3* G 4 H3* G 4 -1.221 -2.590 7.147 39 H2* G 4 H2* G 4 1.057 -3.333 6.692 40 2HO* G 4 2HO* G 4 1.345 -3.602 9.056 41 H1* G 4 H1* G 4 0.506 -5.977 6.847 42 H8 G 4 H8 G 4 -2.503 -4.387 5.156 43 H1 G 4 H1 G 4 2.713 -5.047 1.412 44 1H2 G 4 1H2 G 4 4.480 -5.462 2.823 45 2H2 G 4 2H2 G 4 4.150 -5.699 4.570 46 1H5* A 5 1H5* A 5 2.470 -1.928 9.196 47 2H5* A 5 2H5* A 5 2.794 -0.190 9.168 48 H4* A 5 H4* A 5 4.580 -1.530 8.178 49 H3* A 5 H3* A 5 3.237 0.405 6.308 50 H2* A 5 H2* A 5 5.030 -0.218 4.743 51 2HO* A 5 2HO* A 5 6.477 -0.443 6.657 52 H1* A 5 H1* A 5 4.740 -2.843 5.055 53 H8 A 5 H8 A 5 1.236 -1.431 5.492 54 1H6 A 5 1H6 A 5 1.146 -1.533 -0.747 55 2H6 A 5 2H6 A 5 0.161 -1.381 0.736 56 H2 A 5 H2 A 5 5.258 -2.208 0.528 57 1H5* G 6 1H5* G 6 7.331 1.249 6.028 58 2H5* G 6 2H5* G 6 7.554 2.997 5.864 59 H4* G 6 H4* G 6 8.541 1.682 4.036 60 H3* G 6 H3* G 6 6.385 3.616 3.224 61 H2* G 6 H2* G 6 7.059 3.051 0.945 62 2HO* G 6 2HO* G 6 9.314 2.899 1.745 63 H1* G 6 H1* G 6 7.156 0.376 1.371 64 H8 G 6 H8 G 6 4.145 1.615 3.323 65 H1 G 6 H1 G 6 3.331 1.351 -3.073 66 1H2 G 6 1H2 G 6 5.428 1.097 -3.986 67 2H2 G 6 2H2 G 6 6.832 0.895 -2.888 68 1H5* A 7 1H5* A 7 9.878 4.648 0.893 69 2H5* A 7 2H5* A 7 9.869 6.401 0.656 70 H4* A 7 H4* A 7 9.908 5.089 -1.431 71 H3* A 7 H3* A 7 7.575 6.942 -1.054 72 H2* A 7 H2* A 7 6.978 6.336 -3.345 73 2HO* A 7 2HO* A 7 9.311 6.228 -3.853 74 H1* A 7 H1* A 7 7.278 3.683 -3.016 75 H8 A 7 H8 A 7 5.984 4.914 0.325 76 1H6 A 7 1H6 A 7 0.421 4.763 -2.461 77 2H6 A 7 2H6 A 7 1.282 4.821 -0.895 78 H2 A 7 H2 A 7 3.444 4.350 -5.561 79 1H5* A 8 1H5* A 8 9.277 7.900 -4.902 80 2H5* A 8 2H5* A 8 9.179 9.653 -5.118 81 H4* A 8 H4* A 8 8.068 8.365 -6.916 82 H3* A 8 H3* A 8 6.312 10.182 -5.293 83 H2* A 8 H2* A 8 4.579 9.641 -6.895 84 2HO* A 8 2HO* A 8 5.209 9.273 -8.846 85 H1* A 8 H1* A 8 5.031 6.974 -6.842 86 H8 A 8 H8 A 8 5.643 8.155 -3.040 87 1H6 A 8 1H6 A 8 -0.571 8.011 -2.814 88 2H6 A 8 2H6 A 8 0.975 8.141 -1.924 89 H2 A 8 H2 A 8 0.425 7.648 -7.038 90 1H5* G 9 1H5* G 9 5.856 11.131 -9.488 91 2H5* G 9 2H5* G 9 5.648 12.877 -9.692 92 H4* G 9 H4* G 9 3.812 11.523 -10.708 93 H3* G 9 H3* G 9 3.074 13.446 -8.519 94 H2* G 9 H2* G 9 0.765 12.818 -8.947 95 2HO* G 9 2HO* G 9 0.131 12.020 -10.772 96 H1* G 9 H1* G 9 1.222 10.171 -9.028 97 H8 G 9 H8 G 9 3.449 11.543 -6.262 98 H1 G 9 H1 G 9 -2.793 10.970 -4.752 99 1H2 G 9 1H2 G 9 -3.928 10.736 -6.716 100 2H2 G 9 2H2 G 9 -3.005 10.516 -8.228 101 1H5* C 10 1H5* C 10 0.212 14.046 -11.524 102 2H5* C 10 2H5* C 10 -0.015 15.775 -11.806 103 H4* C 10 H4* C 10 -2.159 14.754 -11.253 104 H3* C 10 H3* C 10 -1.058 16.539 -9.064 105 H2* C 10 H2* C 10 -3.164 16.283 -7.968 106 2HO* C 10 2HO* C 10 -4.165 16.220 -10.213 107 H1* C 10 H1* C 10 -3.290 13.581 -8.361 108 1H4 C 10 1H4 C 10 -0.909 14.321 -2.777 109 2H4 C 10 2H4 C 10 0.768 14.132 -3.347 110 H5 C 10 H5 C 10 1.254 14.495 -5.703 111 H6 C 10 H6 C 10 0.228 14.426 -7.894 112 H3T C 10 H3T C 10 -1.554 17.675 -10.876 113 1H5* G 1 1H5* G 1 -9.147 13.974 3.728 114 2H5* G 1 2H5* G 1 -9.975 12.432 3.997 115 H4* G 1 H4* G 1 -10.647 13.310 1.878 116 H3* G 1 H3* G 1 -9.685 10.735 2.144 117 H1* G 1 H1* G 1 -8.702 13.028 -0.803 118 H8 G 1 H8 G 1 -6.077 12.923 2.005 119 H1 G 1 H1 G 1 -3.880 14.311 -3.884 120 1H2 G 1 1H2 G 1 -5.620 13.984 -5.286 121 2H2 G 1 2H2 G 1 -7.226 13.522 -4.653 122 H5T G 1 H5T G 1 -7.884 12.046 4.583 123 2H2* G 1 2H2* G 1 -8.467 10.750 -0.288 124 1H2* G 1 1H2* G 1 -7.596 11.093 1.242 125 1H5* 5PC 2 1H5* 5PC 2 -11.765 10.684 -2.846 126 2H5* 5PC 2 2H5* 5PC 2 -10.593 11.824 -2.188 127 H4* 5PC 2 H4* 5PC 2 -10.290 11.251 -4.547 128 H3* 5PC 2 H3* 5PC 2 -10.434 8.517 -3.776 129 1H2* 5PC 2 1H2* 5PC 2 -7.960 8.217 -4.986 130 2H2* 5PC 2 2H2* 5PC 2 -8.190 8.317 -3.192 131 H1* 5PC 2 H1* 5PC 2 -7.507 10.482 -5.230 132 H41 5PC 2 1H4 5PC 2 -2.348 10.882 -1.908 133 H42 5PC 2 2H4 5PC 2 -3.319 10.490 -0.410 134 H6 5PC 2 H6 5PC 2 -7.317 9.744 -1.666 135 H91 5PC 2 1H9 5PC 2 -6.397 9.273 2.990 136 H92 5PC 2 2H9 5PC 2 -4.801 8.474 2.824 137 H93 5PC 2 3H9 5PC 2 -4.859 10.196 3.185 138 1H5* PDU 3 1H5* PDU 3 -9.188 7.949 -9.078 139 2H5* PDU 3 2H5* PDU 3 -8.442 9.136 -8.003 140 H4* PDU 3 H4* PDU 3 -6.935 8.153 -9.639 141 H3* PDU 3 H3* PDU 3 -7.858 5.572 -8.845 142 2H2* PDU 3 2H2* PDU 3 -6.395 5.356 -7.045 143 H1* PDU 3 H1* PDU 3 -4.391 7.159 -8.463 144 H6 PDU 3 H6 PDU 3 -6.270 6.586 -5.190 145 H3 PDU 3 H3 PDU 3 -1.568 7.828 -5.091 146 1H5M PDU 3 1H5M PDU 3 -7.207 7.576 -0.143 147 2H5M PDU 3 2H5M PDU 3 -8.009 6.118 -0.795 148 3H5M PDU 3 3H5M PDU 3 -6.459 6.002 0.127 149 1H2* PDU 3 1H2* PDU 3 -5.223 4.956 -8.354 150 1H5* PDU 4 1H5* PDU 4 -3.745 4.723 -12.361 151 2H5* PDU 4 2H5* PDU 4 -3.771 5.892 -11.042 152 H4* PDU 4 H4* PDU 4 -1.599 4.972 -11.602 153 H3* PDU 4 H3* PDU 4 -2.695 2.347 -11.325 154 2H2* PDU 4 2H2* PDU 4 -2.395 2.259 -9.015 155 H1* PDU 4 H1* PDU 4 -0.017 4.147 -9.243 156 H6 PDU 4 H6 PDU 4 -3.335 3.693 -7.419 157 H3 PDU 4 H3 PDU 4 0.731 4.637 -4.907 158 1H5M PDU 4 1H5M PDU 4 -6.918 4.441 -4.012 159 2H5M PDU 4 2H5M PDU 4 -6.818 2.699 -4.295 160 3H5M PDU 4 3H5M PDU 4 -6.152 3.412 -2.770 161 1H2* PDU 4 1H2* PDU 4 -0.697 1.873 -9.469 162 1H5* 5PC 5 1H5* 5PC 5 2.687 1.690 -12.271 163 2H5* 5PC 5 2H5* 5PC 5 1.943 2.849 -11.166 164 H4* 5PC 5 H4* 5PC 5 4.114 1.979 -10.371 165 H3* 5PC 5 H3* 5PC 5 2.983 -0.663 -10.819 166 1H2* 5PC 5 1H2* 5PC 5 3.945 -1.058 -8.224 167 2H2* 5PC 5 2H2* 5PC 5 2.195 -0.844 -8.649 168 H1* 5PC 5 H1* 5PC 5 4.253 1.248 -7.786 169 H41 5PC 5 1H4 5PC 5 0.431 1.357 -2.928 170 H42 5PC 5 2H4 5PC 5 -0.987 1.244 -4.075 171 H6 5PC 5 H6 5PC 5 0.637 0.944 -7.998 172 H91 5PC 5 1H9 5PC 5 -4.408 1.398 -6.575 173 H92 5PC 5 2H9 5PC 5 -4.084 -0.282 -7.021 174 H93 5PC 5 3H9 5PC 5 -4.204 0.197 -5.282 175 1H5* PDU 6 1H5* PDU 6 8.014 -1.524 -8.946 176 2H5* PDU 6 2H5* PDU 6 6.855 -0.359 -8.302 177 H4* PDU 6 H4* PDU 6 8.372 -1.367 -6.671 178 H3* PDU 6 H3* PDU 6 7.537 -3.934 -7.625 179 2H2* PDU 6 2H2* PDU 6 5.661 -4.059 -6.261 180 H1* PDU 6 H1* PDU 6 6.981 -2.250 -4.200 181 H6 PDU 6 H6 PDU 6 3.876 -2.506 -6.380 182 H3 PDU 6 H3 PDU 6 3.421 -1.839 -1.575 183 1H5M PDU 6 1H5M PDU 6 -0.912 -1.446 -7.888 184 2H5M PDU 6 2H5M PDU 6 -0.480 -3.125 -8.260 185 3H5M PDU 6 3H5M PDU 6 -1.536 -2.734 -6.839 186 1H2* PDU 6 1H2* PDU 6 6.877 -4.484 -4.996 187 1H5* 5PC 7 1H5* 5PC 7 10.687 -4.981 -3.257 188 2H5* 5PC 7 2H5* 5PC 7 9.434 -3.754 -3.429 189 H4* 5PC 7 H4* 5PC 7 9.537 -4.703 -1.164 190 H3* 5PC 7 H3* 5PC 7 9.352 -7.319 -2.469 191 1H2* 5PC 7 1H2* 5PC 7 7.442 -7.622 -0.401 192 2H2* 5PC 7 2H2* 5PC 7 7.050 -7.434 -2.162 193 H1* 5PC 7 H1* 5PC 7 7.314 -5.308 0.025 194 H41 5PC 7 1H4 5PC 7 1.262 -4.871 -1.065 195 H42 5PC 7 2H4 5PC 7 1.604 -4.960 -2.857 196 H6 5PC 7 H6 5PC 7 5.798 -5.668 -3.252 197 H91 5PC 7 1H9 5PC 7 2.515 -4.816 -7.144 198 H92 5PC 7 2H9 5PC 7 2.989 -6.513 -7.028 199 H93 5PC 7 3H9 5PC 7 1.338 -5.986 -6.511 200 1H5* PDU 8 1H5* PDU 8 9.929 -8.730 2.800 201 2H5* PDU 8 2H5* PDU 8 8.967 -7.371 2.222 202 H4* PDU 8 H4* PDU 8 8.046 -8.575 4.124 203 H3* PDU 8 H3* PDU 8 8.322 -10.996 2.618 204 2H2* PDU 8 2H2* PDU 8 6.286 -10.811 1.533 205 H1* PDU 8 H1* PDU 8 5.159 -9.174 3.838 206 H6 PDU 8 H6 PDU 8 5.679 -9.132 0.054 207 H3 PDU 8 H3 PDU 8 1.303 -8.115 1.928 208 1H5M PDU 8 1H5M PDU 8 5.474 -7.873 -4.616 209 2H5M PDU 8 2H5M PDU 8 5.723 -9.610 -4.395 210 3H5M PDU 8 3H5M PDU 8 4.146 -8.981 -5.026 211 1H2* PDU 8 1H2* PDU 8 5.623 -11.372 3.116 212 1H5* PDU 9 1H5* PDU 9 5.837 -12.447 7.298 213 2H5* PDU 9 2H5* PDU 9 5.473 -11.020 6.330 214 H4* PDU 9 H4* PDU 9 3.590 -11.962 7.515 215 H3* PDU 9 H3* PDU 9 4.216 -14.512 6.393 216 2H2* PDU 9 2H2* PDU 9 3.125 -14.115 4.396 217 H1* PDU 9 H1* PDU 9 1.190 -12.204 5.815 218 H6 PDU 9 H6 PDU 9 3.518 -12.419 2.807 219 H3 PDU 9 H3 PDU 9 -1.117 -11.065 2.204 220 1H5M PDU 9 1H5M PDU 9 5.899 -11.328 -1.151 221 2H5M PDU 9 2H5M PDU 9 5.711 -13.078 -1.101 222 3H5M PDU 9 3H5M PDU 9 4.854 -12.111 -2.367 223 1H2* PDU 9 1H2* PDU 9 1.650 -14.545 5.347 224 1H5* C 10 1H5* C 10 -0.111 -13.955 8.142 225 2H5* C 10 2H5* C 10 -0.414 -15.342 9.194 226 H4* C 10 H4* C 10 -2.490 -14.715 8.135 227 H3* C 10 H3* C 10 -1.321 -17.329 7.632 228 H1* C 10 H1* C 10 -3.560 -15.069 5.439 229 1H4 C 10 1H4 C 10 -1.469 -13.821 -0.270 230 2H4 C 10 2H4 C 10 0.247 -14.196 0.023 231 H5 C 10 H5 C 10 0.834 -15.188 2.202 232 H6 C 10 H6 C 10 -0.049 -15.715 4.434 233 H3T C 10 H3T C 10 -3.156 -17.045 8.924 234 2H2* C 10 2H2* C 10 -3.187 -17.411 5.552 235 1H2* C 10 1H2* C 10 -1.416 -17.232 5.387 Start of MODEL 2 1 1H5* G 1 1H5* G 1 -12.777 -11.244 -4.179 2 2H5* G 1 2H5* G 1 -12.594 -9.606 -3.538 3 H4* G 1 H4* G 1 -12.947 -11.332 -1.810 4 H3* G 1 H3* G 1 -10.402 -9.750 -1.618 5 H2* G 1 H2* G 1 -10.076 -10.868 0.506 6 2HO* G 1 2HO* G 1 -12.408 -10.886 0.921 7 H1* G 1 H1* G 1 -10.583 -13.319 -0.433 8 H8 G 1 H8 G 1 -8.892 -11.746 -3.397 9 H1 G 1 H1 G 1 -4.984 -13.232 1.521 10 1H2 G 1 1H2 G 1 -6.343 -13.527 3.331 11 2H2 G 1 2H2 G 1 -8.120 -13.337 3.160 12 H5T G 1 H5T G 1 -10.489 -9.621 -4.048 13 1H5* A 2 1H5* A 2 -12.164 -9.204 2.193 14 2H5* A 2 2H5* A 2 -11.858 -7.527 2.653 15 H4* A 2 H4* A 2 -11.029 -9.154 4.280 16 H3* A 2 H3* A 2 -8.982 -7.350 3.047 17 H2* A 2 H2* A 2 -7.418 -8.329 4.634 18 2HO* A 2 2HO* A 2 -9.071 -8.458 6.289 19 H1* A 2 H1* A 2 -8.125 -10.879 4.207 20 H8 A 2 H8 A 2 -8.509 -9.174 0.850 21 1H6 A 2 1H6 A 2 -2.352 -10.035 0.442 22 2H6 A 2 2H6 A 2 -3.822 -9.629 -0.493 23 H2 A 2 H2 A 2 -3.516 -10.937 4.509 24 1H5* A 3 1H5* A 3 -8.500 -6.807 7.332 25 2H5* A 3 2H5* A 3 -8.068 -5.103 7.535 26 H4* A 3 H4* A 3 -6.397 -6.648 8.462 27 H3* A 3 H3* A 3 -5.454 -4.874 6.230 28 H2* A 3 H2* A 3 -3.243 -5.699 6.797 29 2HO* A 3 2HO* A 3 -3.399 -5.796 9.005 30 H1* A 3 H1* A 3 -3.974 -8.297 6.908 31 H8 A 3 H8 A 3 -5.982 -6.583 4.152 32 1H6 A 3 1H6 A 3 -0.759 -7.186 0.805 33 2H6 A 3 2H6 A 3 -2.483 -6.719 0.756 34 H2 A 3 H2 A 3 0.720 -8.305 4.901 35 1H5* G 4 1H5* G 4 -2.987 -4.107 9.684 36 2H5* G 4 2H5* G 4 -2.468 -2.417 9.622 37 H4* G 4 H4* G 4 -0.599 -4.069 9.696 38 H3* G 4 H3* G 4 -0.730 -2.197 7.355 39 H2* G 4 H2* G 4 1.434 -3.087 6.752 40 2HO* G 4 2HO* G 4 2.558 -3.447 8.521 41 H1* G 4 H1* G 4 0.746 -5.681 7.124 42 H8 G 4 H8 G 4 -2.270 -4.025 5.530 43 H1 G 4 H1 G 4 2.766 -4.788 1.570 44 1H2 G 4 1H2 G 4 4.576 -5.274 2.900 45 2H2 G 4 2H2 G 4 4.324 -5.485 4.668 46 1H5* A 5 1H5* A 5 3.159 -1.793 9.116 47 2H5* A 5 2H5* A 5 3.592 -0.082 9.032 48 H4* A 5 H4* A 5 5.272 -1.542 8.002 49 H3* A 5 H3* A 5 3.941 0.476 6.220 50 H2* A 5 H2* A 5 5.598 -0.184 4.559 51 2HO* A 5 2HO* A 5 7.194 -0.484 6.284 52 H1* A 5 H1* A 5 5.253 -2.814 4.860 53 H8 A 5 H8 A 5 1.801 -1.323 5.400 54 1H6 A 5 1H6 A 5 1.625 -1.158 -0.845 55 2H6 A 5 2H6 A 5 0.659 -1.051 0.652 56 H2 A 5 H2 A 5 5.725 -2.027 0.350 57 1H5* G 6 1H5* G 6 8.071 1.231 5.780 58 2H5* G 6 2H5* G 6 8.273 2.982 5.621 59 H4* G 6 H4* G 6 9.170 1.686 3.731 60 H3* G 6 H3* G 6 6.982 3.639 3.070 61 H2* G 6 H2* G 6 7.599 3.175 0.758 62 2HO* G 6 2HO* G 6 9.869 2.995 1.467 63 H1* G 6 H1* G 6 7.726 0.482 1.091 64 H8 G 6 H8 G 6 4.732 1.636 3.088 65 H1 G 6 H1 G 6 3.938 1.642 -3.320 66 1H2 G 6 1H2 G 6 6.048 1.423 -4.217 67 2H2 G 6 2H2 G 6 7.447 1.215 3.103 68 1H5* A 7 1H5* A 7 10.371 4.800 0.632 69 2H5* A 7 2H5* A 7 10.356 6.568 0.580 70 H4* A 7 H4* A 7 10.350 5.557 -1.635 71 H3* A 7 H3* A 7 7.925 7.201 -0.967 72 H2* A 7 H2* A 7 7.354 6.915 -3.319 73 2HO* A 7 2HO* A 7 9.614 7.071 -3.916 74 H1* A 7 H1* A 7 7.869 4.262 -3.398 75 H8 A 7 H8 A 7 6.363 4.962 0.015 76 1H6 A 7 1H6 A 7 0.933 4.783 -3.081 77 2H6 A 7 2H6 A 7 1.692 4.665 -1.469 78 H2 A 7 H2 A 7 4.122 4.920 -6.016 79 1H5* A 8 1H5* A 8 9.572 8.902 -4.626 80 2H5* A 8 2H5* A 8 9.332 10.648 -4.482 81 H4* A 8 H4* A 8 8.357 9.720 -6.524 82 H3* A 8 H3* A 8 6.396 10.946 -4.598 83 H2* A 8 H2* A 8 4.793 10.679 -6.417 84 2HO* A 8 2HO* A 8 6.423 11.199 -8.008 85 H1* A 8 H1* A 8 5.511 8.133 -6.998 86 H8 A 8 H8 A 8 5.746 8.536 -3.223 87 1H6 A 8 1H6 A 8 -0.452 7.745 -3.379 88 2H6 A 8 2H6 A 8 0.986 7.802 -2.326 89 H2 A 8 H2 A 8 0.918 8.319 -7.470 90 1H5* G 9 1H5* G 9 5.989 12.984 -8.472 91 2H5* G 9 2H5* G 9 5.645 14.683 -8.115 92 H4* G 9 H4* G 9 3.982 13.633 -9.604 93 H3* G 9 H3* G 9 2.956 14.625 -6.946 94 H2* G 9 H2* G 9 0.729 14.104 -7.863 95 2HO* G 9 2HO* G 9 1.721 14.734 -10.041 96 H1* G 9 H1* G 9 1.427 11.683 -8.804 97 H8 G 9 H8 G 9 3.230 12.168 -5.463 98 H1 G 9 H1 G 9 -3.054 10.797 -5.039 99 1H2 G 9 1H2 G 9 -3.922 11.050 -7.153 100 2H2 G 9 2H2 G 9 -2.800 11.416 -8.510 101 1H5* C 10 1H5* C 10 0.380 16.336 -9.855 102 2H5* C 10 2H5* C 10 0.078 18.027 -9.420 103 H4* C 10 H4* C 10 -2.028 16.808 -9.659 104 H3* C 10 H3* C 10 -1.341 17.653 -6.840 105 H2* C 10 H2* C 10 -3.515 16.891 -6.193 106 2HO* C 10 2HO* C 10 -4.220 17.652 -8.472 107 H1* C 10 H1* C 10 -3.409 14.573 -7.661 108 1H4 C 10 1H4 C 10 -2.002 13.454 -1.759 109 2H4 C 10 2H4 C 10 -0.242 13.519 -2.036 110 H5 C 10 H5 C 10 0.588 14.544 -4.087 111 H6 C 10 H6 C 10 -0.065 15.159 -6.343 112 H3T C 10 H3T C 10 -2.309 19.431 -7.425 113 1H5* G 1 1H5* G 1 -12.494 11.158 2.251 114 2H5* G 1 2H5* G 1 -12.820 9.516 1.679 115 H4* G 1 H4* G 1 -12.304 11.024 -0.053 116 H3* G 1 H3* G 1 -10.610 8.654 0.229 117 H1* G 1 H1* G 1 -10.004 12.142 -1.517 118 H8 G 1 H8 G 1 -8.006 10.812 1.325 119 H1 G 1 H1 G 1 -4.709 13.704 -3.359 120 1H2 G 1 1H2 G 1 -6.160 13.773 -5.108 121 2H2 G 1 2H2 G 1 -7.857 13.238 -4.913 122 H5T G 1 H5T G 1 -11.003 8.811 2.640 123 2H2* G 1 2H2* G 1 -9.820 10.010 -2.249 124 1H2* G 1 1H2* G 1 -8.870 9.470 -0.853 125 1H5* 5PC 2 1H5* 5PC 2 -12.024 8.349 -4.898 126 2H5* 5PC 2 2H5* 5PC 2 -11.651 9.766 -3.907 127 H4* 5PC 2 H4* 5PC 2 -10.520 9.734 -5.991 128 H3* 5PC 2 H3* 5PC 2 -9.522 7.086 -5.245 129 1H2* 5PC 2 1H2* 5PC 2 -7.574 8.375 -6.986 130 2H2* 5PC 2 2H2* 5PC 2 -7.363 7.597 -5.387 131 H1* 5PC 2 H1* 5PC 2 -7.669 10.465 -6.118 132 H41 5PC 2 1H4 5PC 2 -2.964 10.076 -2.220 133 H42 5PC 2 2H4 5PC 2 -4.115 9.382 -0.981 134 H6 5PC 2 H6 5PC 2 -7.821 8.732 -2.965 135 H91 5PC 2 1H9 5PC 2 -5.709 7.733 2.082 136 H92 5PC 2 2H9 5PC 2 -7.347 8.450 2.001 137 H93 5PC 2 3H9 5PC 2 -7.102 6.800 1.424 138 1H5* PDU 3 1H5* PDU 3 -8.381 6.429 -10.438 139 2H5* PDU 3 2H5* PDU 3 -8.337 7.983 -9.583 140 H4* PDU 3 H4* PDU 3 -6.313 7.539 -10.755 141 H3* PDU 3 H3* PDU 3 -6.186 4.958 -9.334 142 2H2* PDU 3 2H2* PDU 3 -4.152 5.298 -8.523 143 H1* PDU 3 H1* PDU 3 -3.746 8.104 -9.378 144 H6 PDU 3 H6 PDU 3 -5.723 6.568 -6.714 145 H3 PDU 3 H3 PDU 3 -1.186 7.931 -5.684 146 1H5M PDU 3 1H5M PDU 3 -8.142 6.398 -2.517 147 2H5M PDU 3 2H5M PDU 3 -7.821 4.722 -2.938 148 3H5M PDU 3 3H5M PDU 3 -7.017 5.453 -1.498 149 1H2* PDU 3 1H2* PDU 3 -3.504 5.936 -10.055 150 1H5* PDU 4 1H5* PDU 4 -2.663 3.697 -13.169 151 2H5* PDU 4 2H5* PDU 4 -2.926 5.272 -12.400 152 H4* PDU 4 H4* PDU 4 -0.668 4.653 -12.375 153 H3* PDU 4 H3* PDU 4 -1.412 2.078 -11.198 154 2H2* PDU 4 2H2* PDU 4 -0.208 2.325 -9.365 155 H1* PDU 4 H1* PDU 4 0.940 5.021 -9.922 156 H6 PDU 4 H6 PDU 4 -2.229 3.908 -8.505 157 H3 PDU 4 H3 PDU 4 1.410 4.950 -5.465 158 1H5M PDU 4 1H5M PDU 4 -6.368 4.175 -5.971 159 2H5M PDU 4 2H5M PDU 4 -5.985 2.493 -6.314 160 3H5M PDU 4 3H5M PDU 4 -5.932 3.099 -4.612 161 1H2* PDU 4 1H2* PDU 4 1.269 2.786 -10.261 162 1H5* 5PC 5 1H5* 5PC 5 3.588 0.789 -12.561 163 2H5* 5PC 5 2H5* 5PC 5 2.960 2.318 -11.916 164 H4* 5PC 5 H4* 5PC 5 4.849 1.495 -10.621 165 H3* 5PC 5 H3* 5PC 5 3.261 -0.994 -10.317 166 1H2* 5PC 5 1H2* 5PC 5 5.154 -0.591 -8.097 167 2H2* 5PC 5 2H2* 5PC 5 3.399 -0.929 -8.070 168 H1* 5PC 5 H1* 5PC 5 4.922 1.668 -8.033 169 H41 5PC 5 1H4 5PC 5 1.034 1.695 -3.231 170 H42 5PC 5 2H4 5PC 5 -0.357 1.551 -4.403 171 H6 5PC 5 H6 5PC 5 1.422 0.922 -8.257 172 H91 5PC 5 1H9 5PC 5 -3.534 1.398 -7.692 173 H92 5PC 5 2H9 5PC 5 -3.135 -0.314 -7.638 174 H93 5PC 5 3H9 5PC 5 -3.674 0.521 -6.136 175 1H5* PDU 6 1H5* PDU 6 8.135 -3.030 -9.201 176 2H5* PDU 6 2H5* PDU 6 7.557 -1.375 -8.935 177 H4* PDU 6 H4* PDU 6 8.586 -2.262 -7.033 178 H3* PDU 6 H3* PDU 6 6.861 -4.615 -7.222 179 2H2* PDU 6 2H2* PDU 6 5.899 -4.347 -5.251 180 H1* PDU 6 H1* PDU 6 7.352 -1.891 -4.376 181 H6 PDU 6 H6 PDU 6 4.372 -2.415 -6.416 182 H3 PDU 6 H3 PDU 6 3.823 -1.547 -1.670 183 1H5M PDU 6 1H5M PDU 6 0.182 -1.430 -8.628 184 2H5M PDU 6 2H5M PDU 6 0.126 -3.161 -8.310 185 3H5M PDU 6 3H5M PDU 6 -1.011 -2.060 -7.449 186 1H2* PDU 6 1H2* PDU 6 7.450 -4.165 -4.391 187 1H5* 5PC 7 1H5* 5PC 7 10.373 -6.406 -3.636 188 2H5* 5PC 7 2H5* 5PC 7 9.638 -4.807 -3.841 189 H4* 5PC 7 H4* 5PC 7 9.403 -5.616 -1.566 190 H3* 5PC 7 H3* 5PC 7 8.154 -8.012 -2.783 191 1H2* 5PC 7 1H2* 5PC 7 7.188 -7.590 -0.046 192 2H2* 5PC 7 2H2* 5PC 7 6.275 -7.766 -1.576 193 H1* 5PC 7 H1* 5PC 7 7.305 -5.304 -0.158 194 H41 5PC 7 1H4 5PC 7 1.249 -4.321 -0.839 195 H42 5PC 7 2H4 5PC 7 1.493 -4.420 -2.646 196 H6 5PC 7 H6 5PC 7 5.514 -5.776 -3.232 197 H91 5PC 7 1H9 5PC 7 2.270 -4.753 -7.038 198 H92 5PC 7 2H9 5PC 7 2.267 -6.479 -6.684 199 H93 5PC 7 3H9 5PC 7 0.844 -5.467 -6.231 200 1H5* PDU 8 1H5* PDU 8 9.571 -10.283 1.906 201 2H5* PDU 8 2H5* PDU 8 9.188 -8.568 1.660 202 H4* PDU 8 H4* PDU 8 8.038 -9.548 3.498 203 H3* PDU 8 H3* PDU 8 7.010 -11.564 1.625 204 2H2* PDU 8 2H2* PDU 8 4.893 -11.079 1.942 205 H1* PDU 8 H1* PDU 8 5.197 -8.849 3.897 206 H6 PDU 8 H6 PDU 8 5.291 -9.131 0.232 207 H3 PDU 8 H3 PDU 8 1.101 -7.877 2.336 208 1H5M PDU 8 1H5M PDU 8 4.057 -7.746 -4.742 209 2H5M PDU 8 2H5M PDU 8 4.383 -9.482 -4.564 210 3H5M PDU 8 3H5M PDU 8 2.684 -8.859 -4.622 211 1H2* PDU 8 1H2* PDU 8 5.026 -11.151 3.725 212 1H5* PDU 9 1H5* PDU 9 5.847 -14.255 6.150 213 2H5* PDU 9 2H5* PDU 9 5.781 -12.497 5.926 214 H4* PDU 9 H4* PDU 9 3.798 -13.408 6.925 215 H3* PDU 9 H3* PDU 9 3.580 -15.142 4.549 216 2H2* PDU 9 2H2* PDU 9 1.586 -14.440 3.978 217 H1* PDU 9 H1* PDU 9 1.220 -12.288 6.000 218 H6 PDU 9 H6 PDU 9 3.010 -12.577 2.799 219 H3 PDU 9 H3 PDU 9 -1.500 -10.788 2.736 220 1H5M PDU 9 1H5M PDU 9 4.860 -11.218 -1.720 221 2H5M PDU 9 2H5M PDU 9 4.355 -12.891 -1.918 222 3H5M PDU 9 3H5M PDU 9 3.373 -11.569 -2.657 223 1H2* PDU 9 1H2* PDU 9 0.920 -14.543 5.646 224 1H5* C 10 1H5* C 10 0.452 -16.061 7.737 225 2H5* C 10 2H5* C 10 0.202 -17.813 7.767 226 H4* C 10 H4* C 10 -1.969 -16.786 7.642 227 H3* C 10 H3* C 10 -1.069 -17.942 5.005 228 H1* C 10 H1* C 10 -3.545 -15.007 5.714 229 1H4 C 10 1H4 C 10 -2.480 -13.082 -0.112 230 2H4 C 10 2H4 C 10 -0.767 -13.575 -0.194 231 H5 C 10 H5 C 10 0.092 -14.974 1.676 232 H6 C 10 H6 C 10 -0.497 -15.828 3.955 233 H3T C 10 H3T C 10 -1.544 -19.454 6.546 234 2H2* C 10 2H2* C 10 -3.942 -17.247 5.497 235 1H2* C 10 1H2* C 10 -2.957 -17.236 3.988 Start of MODEL 3 1 1H5* G 1 2H5* G 1 -11.369 -11.543 -5.670 2 2H5* G 1 1H5* G 1 -11.139 -9.841 -5.242 3 H4* G 1 H4* G 1 -11.959 -11.255 -3.386 4 H3* G 1 H3* G 1 -9.380 -9.782 -2.971 5 H2* G 1 1H2* G 1 -9.419 -10.624 -0.706 6 2HO* G 1 2HO* G 1 -11.764 -10.429 -0.596 7 H1* G 1 H1* G 1 -10.044 -13.150 -1.339 8 H8 G 1 H8 G 1 -7.758 -12.268 -4.170 9 H1 G 1 H1 G 1 -4.828 -13.316 1.487 10 1H2 G 1 1H2 G 1 -6.448 -13.118 3.077 11 2H2 G 1 2H2 G 1 -8.143 -12.777 2.598 12 H5T G 1 H5T G 1 -9.038 -10.030 -5.489 13 1H5* A 2 2H5* A 2 -11.779 -8.511 0.328 14 2H5* A 2 1H5* A 2 -11.369 -6.829 0.664 15 H4* A 2 H4* A 2 -10.969 -8.375 2.544 16 H3* A 2 H3* A 2 -8.637 -6.785 1.554 17 H2* A 2 1H2* A 2 -7.349 -7.796 3.355 18 2HO* A 2 2HO* A 2 -9.241 -7.737 4.770 19 H1* A 2 H1* A 2 -8.172 -10.310 2.972 20 H8 A 2 H8 A 2 -8.050 -8.853 -0.518 21 1H6 A 2 1H6 A 2 -2.007 -10.293 -0.178 22 2H6 A 2 2H6 A 2 -3.321 -9.811 -1.292 23 H2 A 2 H2 A 2 -3.634 -10.636 3.814 24 1H5* A 3 2H5* A 3 -8.665 -6.000 5.858 25 2H5* A 3 1H5* A 3 -8.158 -4.313 6.021 26 H4* A 3 H4* A 3 -6.697 -5.930 7.197 27 H3* A 3 H3* A 3 -5.425 -4.228 5.082 28 H2* A 3 1H2* A 3 -3.331 -5.199 5.814 29 2HO* A 3 2HO* A 3 -3.281 -5.548 7.881 30 H1* A 3 H1* A 3 -4.218 -7.745 5.900 31 H8 A 3 H8 A 3 -5.897 -6.081 2.930 32 1H6 A 3 1H6 A 3 -0.517 -7.306 0.025 33 2H6 A 3 2H6 A 3 -2.196 -6.737 -0.193 34 H2 A 3 H2 A 3 0.078 -8.070 4.258 35 1H5* G 4 2H5* G 4 -3.208 -3.735 8.746 36 2H5* G 4 1H5* G 4 -2.551 -2.096 8.809 37 H4* G 4 H4* G 4 -0.836 -3.897 8.968 38 H3* G 4 H3* G 4 -0.591 -1.927 6.722 39 H2* G 4 1H2* G 4 1.504 -3.016 6.204 40 2HO* G 4 2HO* G 4 2.511 -3.559 7.984 41 H1* G 4 H1* G 4 0.583 -5.554 6.480 42 H8 G 4 H8 G 4 -2.150 -3.644 4.702 43 H1 G 4 H1 G 4 2.926 -5.107 0.994 44 1H2 G 4 1H2 G 4 4.645 -5.651 2.401 45 2H2 G 4 2H2 G 4 4.319 -5.781 4.160 46 1H5* A 5 2H5* A 5 3.232 -1.944 8.783 47 2H5* A 5 1H5* A 5 3.812 -0.275 8.775 48 H4* A 5 H4* A 5 5.413 -1.841 7.778 49 H3* A 5 H3* A 5 4.343 0.334 6.006 50 H2* A 5 1H2* A 5 5.912 -0.457 4.335 51 2HO* A 5 2HO* A 5 7.422 -0.928 6.171 52 H1* A 5 H1* A 5 5.411 -3.080 4.632 53 H8 A 5 H8 A 5 2.091 -1.274 5.075 54 1H6 A 5 1H6 A 5 1.874 -1.502 -1.144 55 2H6 A 5 2H6 A 5 0.965 -1.217 0.359 56 H2 A 5 H2 A 5 5.950 -2.542 0.080 57 1H5* G 6 2H5* G 6 8.436 0.889 5.469 58 2H5* G 6 1H5* G 6 8.714 2.633 5.373 59 H4* G 6 H4* G 6 9.394 1.413 3.364 60 H3* G 6 H3* G 6 7.188 3.409 2.914 61 H2* G 6 1H2* G 6 7.621 2.971 0.553 62 2HO* G 6 2HO* G 6 9.938 2.799 1.060 63 H1* G 6 H1* G 6 7.802 0.266 0.846 64 H8 G 6 H8 G 6 4.922 1.424 3.003 65 H1 G 6 H1 G 6 3.736 1.309 -3.344 66 1H2 G 6 1H2 G 6 5.778 1.047 -4.367 67 2H2 G 6 2H2 G 6 7.237 0.811 -3.347 68 1H5* A 7 2H5* A 7 10.467 4.566 0.248 69 2H5* A 7 1H5* A 7 10.423 6.329 0.124 70 H4* A 7 H4* A 7 10.257 5.152 -2.043 71 H3* A 7 H3* A 7 7.976 6.955 -1.297 72 H2* A 7 1H2* A 7 7.139 6.518 -3.532 73 2HO* A 7 2HO* A 7 9.219 6.583 -4.497 74 H1* A 7 H1* A 7 7.590 3.841 -3.497 75 H8 A 7 H8 A 7 6.403 4.779 -0.028 76 1H6 A 7 1H6 A 7 0.726 4.640 -2.604 77 2H6 A 7 2H6 A 7 1.636 4.615 -1.062 78 H2 A 7 H2 A 7 3.622 4.473 -5.824 79 1H5* A 8 2H5* A 8 9.347 8.298 -5.257 80 2H5* A 8 1H5* A 8 9.149 10.055 -5.251 81 H4* A 8 H4* A 8 7.939 8.930 -7.089 82 H3* A 8 H3* A 8 6.245 10.441 -5.118 83 H2* A 8 1H2* A 8 4.439 10.047 -6.685 84 2HO* A 8 2HO* A 8 5.257 10.228 -8.660 85 H1* A 8 H1* A 8 5.030 7.422 -7.068 86 H8 A 8 H8 A 8 5.650 8.224 -3.413 87 1H6 A 8 1H6 A 8 -0.539 7.679 -2.854 88 2H6 A 8 2H6 A 8 1.010 7.794 -1.967 89 H2 A 8 H2 A 8 0.392 7.756 -7.100 90 1H5* G 9 2H5* G 9 5.504 12.028 -9.098 91 2H5* G 9 1H5* G 9 5.204 13.765 -8.958 92 H4* G 9 H4* G 9 3.393 12.514 -10.111 93 H3* G 9 H3* G 9 2.655 13.982 -7.583 94 H2* G 9 1H2* G 9 0.337 13.339 -8.132 95 2HO* G 9 2HO* G 9 1.093 13.566 -10.487 96 H1* G 9 H1* G 9 0.910 10.788 -8.720 97 H8 G 9 H8 G 9 3.088 11.750 -5.724 98 H1 G 9 H1 G 9 -3.103 10.529 -4.389 99 1H2 G 9 1H2 G 9 -4.201 10.430 -6.393 100 2H2 G 9 2H2 G 9 -3.250 10.538 -7.905 101 1H5* C 10 2H5* C 10 -0.237 15.199 -10.459 102 2H5* C 10 1H5* C 10 -0.483 16.947 -10.316 103 H4* C 10 H4* C 10 -2.605 15.770 -10.051 104 H3* C 10 H3* C 10 -1.562 17.039 -7.507 105 H2* C 10 1H2* C 10 -3.636 16.439 -6.488 106 2HO* C 10 2HO* C 10 -4.632 16.858 -8.726 107 H1* C 10 H1* C 10 -3.712 13.915 -7.559 108 1H4 C 10 1H4 C 10 -1.511 13.649 -1.819 109 2H4 C 10 2H4 C 10 0.199 13.663 -2.327 110 H5 C 10 H5 C 10 0.734 14.438 -4.591 111 H6 C 10 H6 C 10 -0.228 14.719 -6.802 112 H3T C 10 H3T C 10 -2.268 18.693 -8.603 113 1H5* G 1 2H5* G 1 -10.081 12.396 4.144 114 2H5* G 1 1H5* G 1 -10.727 10.758 4.336 115 H4* G 1 H4* G 1 -11.379 11.630 2.203 116 H3* G 1 H3* G 1 -10.171 9.158 2.418 117 H1* G 1 H1* G 1 -9.259 11.688 -0.358 118 H8 G 1 H8 G 1 -6.804 11.697 2.603 119 H1 G 1 H1 G 1 -4.425 13.617 -3.059 120 1H2 G 1 1H2 G 1 -6.052 13.237 -4.579 121 2H2 G 1 2H2 G 1 -7.636 12.585 -4.069 122 2H2* G 1 1H2* G 1 -8.812 9.418 0.076 123 1H2* G 1 2H2* G 1 -8.077 9.769 1.669 124 H5T G 1 H5T G 1 -8.482 11.053 5.035 125 1H5* 5PC 2 1H5* 5PC 2 -12.011 9.345 -2.655 126 2H5* 5PC 2 2H5* 5PC 2 -10.962 10.520 -1.863 127 H4* 5PC 2 H4* 5PC 2 -10.582 10.208 -4.263 128 H3* 5PC 2 H3* 5PC 2 -10.447 7.410 -3.725 129 1H2* 5PC 2 1H2* 5PC 2 -7.984 7.532 -5.028 130 2H2* 5PC 2 2H2* 5PC 2 -8.174 7.351 -3.235 131 H1* 5PC 2 H1* 5PC 2 -7.723 9.812 -4.959 132 H41 5PC 2 1H4 5PC 2 -2.664 10.223 -1.520 133 H42 5PC 2 2H4 5PC 2 -3.638 9.701 -0.060 134 H6 5PC 2 H6 5PC 2 -7.560 8.830 -1.448 135 H91 5PC 2 1H9 5PC 2 -6.128 9.016 3.493 136 H92 5PC 2 2H9 5PC 2 -5.762 7.350 3.042 137 H93 5PC 2 3H9 5PC 2 -4.421 8.534 3.232 138 1H5* PDU 3 1H5* PDU 3 -9.326 7.118 -9.070 139 2H5* PDU 3 2H5* PDU 3 -8.658 8.357 -8.005 140 H4* PDU 3 H4* PDU 3 -7.107 7.444 -9.632 141 H3* PDU 3 H3* PDU 3 -7.832 4.820 -8.756 142 2H2* PDU 3 2H2* PDU 3 -6.290 4.722 -7.023 143 H1* PDU 3 H1* PDU 3 -4.480 6.683 -8.486 144 H6 PDU 3 H6 PDU 3 -6.216 5.968 -5.157 145 H3 PDU 3 H3 PDU 3 -1.624 7.595 -5.194 146 1H5M PDU 3 1H5M PDU 3 -7.446 6.431 -0.292 147 2H5M PDU 3 2H5M PDU 3 -7.257 4.702 -0.616 148 3H5M PDU 3 3H5M PDU 3 -5.975 5.612 0.283 149 1H2* PDU 3 1H2* PDU 3 -5.124 4.432 -8.368 150 1H5* PDU 4 1H5* PDU 4 -3.848 4.024 -12.441 151 2H5* PDU 4 2H5* PDU 4 -3.869 5.267 -11.192 152 H4* PDU 4 H4* PDU 4 -1.694 4.382 -11.781 153 H3* PDU 4 H3* PDU 4 -2.679 1.744 -11.325 154 2H2* PDU 4 2H2* PDU 4 -2.322 1.812 -9.019 155 H1* PDU 4 H1* PDU 4 0.012 3.723 -9.455 156 H6 PDU 4 H6 PDU 4 -3.178 3.245 -7.430 157 H3 PDU 4 H3 PDU 4 0.944 4.563 -5.182 158 1H5M PDU 4 1H5M PDU 4 -6.749 3.773 -4.293 159 2H5M PDU 4 2H5M PDU 4 -6.459 2.066 -4.640 160 3H5M PDU 4 3H5M PDU 4 -6.074 2.742 -3.005 161 1H2* PDU 4 1H2* PDU 4 -0.633 1.423 -9.506 162 1H5* 5PC 5 1H5* 5PC 5 2.690 1.316 -12.481 163 2H5* 5PC 5 2H5* 5PC 5 1.915 2.496 -11.421 164 H4* 5PC 5 H4* 5PC 5 4.175 1.862 -10.662 165 H3* 5PC 5 H3* 5PC 5 3.210 -0.898 -10.865 166 1H2* 5PC 5 1H2* 5PC 5 4.498 -0.902 -8.322 167 2H2* 5PC 5 2H2* 5PC 5 2.716 -1.060 -8.612 168 H1* 5PC 5 H1* 5PC 5 4.425 1.396 -8.034 169 H41 5PC 5 1H4 5PC 5 0.826 1.258 -3.045 170 H42 5PC 5 2H4 5PC 5 -0.632 0.996 -4.110 171 H6 5PC 5 H6 5PC 5 0.864 0.676 -8.111 172 H91 5PC 5 1H9 5PC 5 -4.095 0.976 -6.813 173 H92 5PC 5 2H9 5PC 5 -3.651 -0.669 -7.284 174 H93 5PC 5 3H9 5PC 5 -3.947 -0.261 -5.548 175 1H5* PDU 6 1H5* PDU 6 8.384 -2.089 -9.545 176 2H5* PDU 6 2H5* PDU 6 7.468 -0.768 -8.825 177 H4* PDU 6 H4* PDU 6 8.840 -2.000 -7.272 178 H3* PDU 6 H3* PDU 6 7.745 -4.446 -8.232 179 2H2* PDU 6 2H2* PDU 6 5.816 -4.333 -6.906 180 H1* PDU 6 H1* PDU 6 7.404 -2.804 -4.802 181 H6 PDU 6 H6 PDU 6 4.167 -2.730 -6.845 182 H3 PDU 6 H3 PDU 6 4.057 -1.906 -2.042 183 1H5M PDU 6 1H5M PDU 6 -0.612 -1.831 -8.253 184 2H5M PDU 6 2H5M PDU 6 -0.369 -3.579 -8.144 185 3H5M PDU 6 3H5M PDU 6 -1.276 -2.700 -6.846 186 1H2* PDU 6 1H2* PDU 6 6.934 -4.978 -5.651 187 1H5* 5PC 7 1H5* 5PC 7 10.717 -5.773 -3.804 188 2H5* 5PC 7 2H5* 5PC 7 9.572 -4.447 -3.979 189 H4* 5PC 7 H4* 5PC 7 9.618 -5.402 -1.712 190 H3* 5PC 7 H3* 5PC 7 9.138 -7.996 -2.995 191 1H2* 5PC 7 1H2* 5PC 7 7.253 -8.061 -0.882 192 2H2* 5PC 7 2H2* 5PC 7 6.841 -7.871 -2.636 193 H1* 5PC 7 H1* 5PC 7 7.352 -5.744 -0.494 194 H41 5PC 7 1H4 5PC 7 1.392 -4.704 -1.548 195 H42 5PC 7 2H4 5PC 7 1.705 -4.771 -3.345 196 H6 5PC 7 H6 5PC 7 5.800 -5.907 -3.773 197 H91 5PC 7 1H9 5PC 7 2.716 -5.064 -7.702 198 H92 5PC 7 2H9 5PC 7 2.835 -6.800 -7.409 199 H93 5PC 7 3H9 5PC 7 1.312 -5.920 -7.007 200 1H5* PDU 8 1H5* PDU 8 9.820 -9.214 2.313 201 2H5* PDU 8 2H5* PDU 8 8.936 -7.815 1.701 202 H4* PDU 8 H4* PDU 8 8.038 -8.746 3.753 203 H3* PDU 8 H3* PDU 8 8.099 -11.327 2.540 204 2H2* PDU 8 2H2* PDU 8 6.054 -11.087 1.456 205 H1* PDU 8 H1* PDU 8 5.101 -9.206 3.657 206 H6 PDU 8 H6 PDU 8 5.504 -9.457 -0.125 207 H3 PDU 8 H3 PDU 8 1.255 -7.995 1.752 208 1H5M PDU 8 1H5M PDU 8 4.860 -8.150 -5.001 209 2H5M PDU 8 2H5M PDU 8 4.998 -9.911 -4.892 210 3H5M PDU 8 3H5M PDU 8 3.384 -9.130 -5.144 211 1H2* PDU 8 1H2* PDU 8 5.410 -11.496 3.094 212 1H5* PDU 9 1H5* PDU 9 5.631 -11.974 7.414 213 2H5* PDU 9 2H5* PDU 9 5.391 -10.664 6.264 214 H4* PDU 9 H4* PDU 9 3.464 -11.203 7.575 215 H3* PDU 9 H3* PDU 9 3.761 -13.952 6.901 216 2H2* PDU 9 2H2* PDU 9 2.694 -13.742 4.843 217 H1* PDU 9 H1* PDU 9 0.995 -11.456 5.989 218 H6 PDU 9 H6 PDU 9 3.179 -12.283 2.991 219 H3 PDU 9 H3 PDU 9 -1.379 -10.711 2.320 220 1H5M PDU 9 1H5M PDU 9 5.438 -11.584 -1.187 221 2H5M PDU 9 2H5M PDU 9 5.377 -13.308 -0.818 222 3H5M PDU 9 3H5M PDU 9 4.422 -12.630 -2.202 223 1H2* PDU 9 1H2* PDU 9 1.203 -13.885 5.854 224 1H5* C 10 2H5* C 10 -0.530 -12.653 8.431 225 2H5* C 10 1H5* C 10 -0.904 -13.796 9.723 226 H4* C 10 H4* C 10 -2.940 -13.238 8.668 227 H3* C 10 H3* C 10 -2.035 -15.953 8.627 228 H1* C 10 H1* C 10 -4.129 -14.068 6.003 229 1H4 C 10 1H4 C 10 -2.093 -13.681 0.195 230 2H4 C 10 2H4 C 10 -0.378 -14.037 0.505 231 H5 C 10 H5 C 10 0.218 -14.781 2.798 232 H6 C 10 H6 C 10 -0.655 -14.955 5.102 233 H3T C 10 H3T C 10 -4.630 -14.774 8.359 234 2H2* C 10 1H2* C 10 -3.723 -16.383 6.487 235 1H2* C 10 2H2* C 10 -1.952 -16.185 6.379 Start of MODEL 4 1 1H5* G 1 2H5* G 1 -11.872 -13.043 -4.418 2 2H5* G 1 1H5* G 1 -11.873 -11.347 -3.893 3 H4* G 1 H4* G 1 -12.259 -12.956 -2.057 4 H3* G 1 H3* G 1 -9.876 -11.156 -1.861 5 H2* G 1 1H2* G 1 -9.477 -12.108 0.316 6 2HO* G 1 2HO* G 1 -11.671 -12.301 0.928 7 H1* G 1 H1* G 1 -9.782 -14.660 -0.422 8 H8 G 1 H8 G 1 -8.131 -13.195 -3.468 9 H1 G 1 H1 G 1 -4.270 -13.914 1.654 10 1H2 G 1 1H2 G 1 -5.658 -14.185 3.449 11 2H2 G 1 2H2 G 1 -7.436 -14.208 3.211 12 H5T G 1 H5T G 1 -10.147 -11.847 -5.373 13 1H5* A 2 2H5* A 2 -11.872 -10.599 1.863 14 2H5* A 2 1H5* A 2 -11.741 -8.883 2.256 15 H4* A 2 H4* A 2 -10.813 -10.358 3.985 16 H3* A 2 H3* A 2 -8.923 -8.408 2.718 17 H2* A 2 1H2* A 2 -7.305 -9.164 4.376 18 2HO* A 2 2HO* A 2 -9.003 -9.403 5.985 19 H1* A 2 H1* A 2 -7.735 -11.782 4.027 20 H8 A 2 H8 A 2 -8.206 -10.234 0.590 21 1H6 A 2 1H6 A 2 -1.996 -10.496 0.363 22 2H6 A 2 2H6 A 2 -3.473 -10.250 -0.616 23 H2 A 2 H2 A 2 -3.168 -11.330 4.444 24 1H5* A 3 2H5* A 3 -8.623 -7.694 7.015 25 2H5* A 3 1H5* A 3 -8.372 -5.951 7.187 26 H4* A 3 H4* A 3 -6.605 -7.298 8.224 27 H3* A 3 H3* A 3 -5.727 -5.477 6.000 28 H2* A 3 1H2* A 3 -3.468 -6.113 6.665 29 2HO* A 3 2HO* A 3 -4.150 -6.193 8.928 30 H1* A 3 H1* A 3 -3.954 -8.750 6.752 31 H8 A 3 H8 A 3 -6.105 -7.266 3.963 32 1H6 A 3 1H6 A 3 -0.845 -7.467 0.646 33 2H6 A 3 2H6 A 3 -2.601 -7.137 0.592 34 H2 A 3 H2 A 3 0.176 -8.414 4.767 35 1H5* G 4 2H5* G 4 -3.305 -4.548 9.376 36 2H5* G 4 1H5* G 4 -2.928 -2.822 9.344 37 H4* G 4 H4* G 4 -0.954 -4.314 9.367 38 H3* G 4 H3* G 4 -1.195 -2.435 7.030 39 H2* G 4 1H2* G 4 1.063 -3.195 6.485 40 2HO* G 4 2HO* G 4 1.605 -3.326 8.765 41 H1* G 4 H1* G 4 0.520 -5.818 6.798 42 H8 G 4 H8 G 4 -2.627 -4.381 5.259 43 H1 G 4 H1 G 4 2.388 -4.847 1.223 44 1H2 G 4 1H2 G 4 4.248 -5.218 2.540 45 2H2 G 4 2H2 G 4 4.010 -5.436 4.310 46 1H5* A 5 2H5* A 5 2.671 -1.796 8.976 47 2H5* A 5 1H5* A 5 3.020 -0.064 8.881 48 H4* A 5 H4* A 5 4.810 -1.494 7.948 49 H3* A 5 H3* A 5 3.507 0.472 6.101 50 H2* A 5 1H2* A 5 5.236 -0.151 4.503 51 2HO* A 5 2HO* A 5 7.011 -1.093 5.036 52 H1* A 5 H1* A 5 4.869 -2.776 4.774 53 H8 A 5 H8 A 5 1.400 -1.339 5.298 54 1H6 A 5 1H6 A 5 1.179 -1.383 -0.933 55 2H6 A 5 2H6 A 5 0.248 -1.240 0.577 56 H2 A 5 H2 A 5 5.335 -2.088 0.258 57 1H5* G 6 2H5* G 6 7.567 1.200 5.789 58 2H5* G 6 1H5* G 6 7.859 2.940 5.634 59 H4* G 6 H4* G 6 8.795 1.648 3.784 60 H3* G 6 H3* G 6 6.643 3.603 3.017 61 H2* G 6 1H2* G 6 7.265 3.043 0.722 62 2HO* G 6 2HO* G 6 9.528 2.833 1.458 63 H1* G 6 H1* G 6 7.285 0.377 1.112 64 H8 G 6 H8 G 6 4.368 1.748 3.185 65 H1 G 6 H1 G 6 3.382 1.564 -3.182 66 1H2 G 6 1H2 G 6 5.451 1.309 -4.153 67 2H2 G 6 2H2 G 6 6.882 1.045 -3.097 68 1H5* A 7 2H5* A 7 10.080 4.515 0.576 69 2H5* A 7 1H5* A 7 10.144 6.275 0.397 70 H4* A 7 H4* A 7 10.121 5.075 -1.740 71 H3* A 7 H3* A 7 7.816 6.935 -1.237 72 H2* A 7 1H2* A 7 7.214 6.490 -3.561 73 2HO* A 7 2HO* A 7 9.526 6.387 -4.101 74 H1* A 7 H1* A 7 7.477 3.817 -3.393 75 H8 A 7 H8 A 7 6.178 4.886 0.005 76 1H6 A 7 1H6 A 7 0.633 4.937 -2.832 77 2H6 A 7 2H6 A 7 1.476 4.860 -1.261 78 H2 A 7 H2 A 7 3.685 4.692 -5.924 79 1H5* A 8 2H5* A 8 9.508 8.130 -4.998 80 2H5* A 8 1H5* A 8 9.454 9.898 -5.062 81 H4* A 8 H4* A 8 8.328 8.839 -6.973 82 H3* A 8 H3* A 8 6.580 10.477 -5.162 83 H2* A 8 1H2* A 8 4.855 10.152 -6.826 84 2HO* A 8 2HO* A 8 5.881 10.291 -8.731 85 H1* A 8 H1* A 8 5.300 7.497 -7.130 86 H8 A 8 H8 A 8 5.803 8.269 -3.453 87 1H6 A 8 1H6 A 8 -0.430 8.025 -3.186 88 2H6 A 8 2H6 A 8 1.083 8.030 -2.238 89 H2 A 8 H2 A 8 0.717 8.160 -7.393 90 1H5* G 9 2H5* G 9 6.140 12.007 -9.225 91 2H5* G 9 1H5* G 9 6.011 13.767 -9.089 92 H4* G 9 H4* G 9 4.130 12.777 -10.324 93 H3* G 9 H3* G 9 3.431 14.137 -7.722 94 H2* G 9 1H2* G 9 1.094 13.800 -8.430 95 2HO* G 9 2HO* G 9 1.949 14.093 -10.722 96 H1* G 9 H1* G 9 1.433 11.233 -9.106 97 H8 G 9 H8 G 9 3.598 11.844 -6.008 98 H1 G 9 H1 G 9 -2.730 11.312 -4.901 99 1H2 G 9 1H2 G 9 -3.770 11.538 -6.939 100 2H2 G 9 2H2 G 9 -2.755 11.656 -8.419 101 1H5* C 10 2H5* C 10 0.909 15.830 -10.645 102 2H5* C 10 1H5* C 10 0.820 17.585 -10.412 103 H4* C 10 H4* C 10 -1.420 16.588 -10.393 104 H3* C 10 H3* C 10 -0.453 17.723 -7.767 105 H2* C 10 1H2* C 10 -2.620 17.281 -6.860 106 2HO* C 10 2HO* C 10 -3.412 17.772 -9.210 107 H1* C 10 H1* C 10 -2.877 14.796 -7.989 108 1H4 C 10 1H4 C 10-1009.000 14.072 -2.168 109 2H4 C 10 2H4 C 10 0.707 13.923 -2.617 110 H5 C 10 H5 C 10 1.426 14.686 -4.813 111 H6 C 10 H6 C 10 0.622 15.168 -7.044 112 H3T C 10 H3T C 10 -1.217 19.489 -8.606 113 1H5* G 1 2H5* G 1 -11.274 13.257 3.032 114 2H5* G 1 1H5* G 1 -11.768 11.593 2.671 115 H4* G 1 H4* G 1 -11.287 12.898 0.736 116 H3* G 1 H3* G 1 -9.758 10.425 1.173 117 H1* G 1 H1* G 1 -9.016 13.651 -0.971 118 H8 G 1 H8 G 1 -6.822 12.263 1.713 119 H1 G 1 H1 G 1 -3.852 14.514 -3.505 120 1H2 G 1 1H2 G 1 -5.470 14.616 -5.084 121 2H2 G 1 2H2 G 1 -7.181 14.291 -4.679 122 2H2* G 1 1H2* G 1 -9.179 11.470 -1.527 123 1H2* G 1 2H2* G 1 -8.109 10.920 -0.221 124 H5T G 1 H5T G 1 -9.097 12.222 3.291 125 1H5* 5PC 2 1H5* 5PC 2 -11.824 9.672 -3.727 126 2H5* 5PC 2 2H5* 5PC 2 -11.270 11.164 -2.944 127 H4* 5PC 2 H4* 5PC 2 -10.392 10.909 -5.132 128 H3* 5PC 2 H3* 5PC 2 -9.509 8.243 -4.302 129 1H2* 5PC 2 1H2* 5PC 2 -7.700 9.263 -6.348 130 2H2* 5PC 2 2H2* 5PC 2 -7.356 8.557 -4.738 131 H1* 5PC 2 H1* 5PC 2 -7.516 11.395 -5.611 132 H41 5PC 2 1H4 5PC 2 -2.491 10.808 -2.123 133 H42 5PC 2 2H4 5PC 2 -3.588 10.285 -0.761 134 H6 5PC 2 H6 5PC 2 -7.488 9.842 -2.354 135 H91 5PC 2 1H9 5PC 2 -6.182 7.821 1.914 136 H92 5PC 2 2H9 5PC 2 -4.996 9.003 2.546 137 H93 5PC 2 3H9 5PC 2 -6.756 9.390 2.473 138 1H5* PDU 3 1H5* PDU 3 -8.971 7.172 -9.519 139 2H5* PDU 3 2H5* PDU 3 -8.707 8.755 -8.760 140 H4* PDU 3 H4* PDU 3 -6.840 8.075 -10.065 141 H3* PDU 3 H3* PDU 3 -6.849 5.541 -8.571 142 2H2* PDU 3 2H2* PDU 3 -4.764 5.716 -7.871 143 H1* PDU 3 H1* PDU 3 -4.118 8.414 -8.928 144 H6 PDU 3 H6 PDU 3 -6.028 7.257 -6.035 145 H3 PDU 3 H3 PDU 3 -1.305 8.161 -5.424 146 1H5M PDU 3 1H5M PDU 3 -8.116 7.602 -1.660 147 2H5M PDU 3 2H5M PDU 3 -8.024 5.886 -2.027 148 3H5M PDU 3 3H5M PDU 3 -7.030 6.570 -0.685 149 1H2* PDU 3 1H2* PDU 3 -4.130 6.192 -9.466 150 1H5* PDU 4 1H5* PDU 4 -3.711 3.951 -12.632 151 2H5* PDU 4 2H5* PDU 4 -3.797 5.534 -11.840 152 H4* PDU 4 H4* PDU 4 -1.608 4.771 -11.973 153 H3* PDU 4 H3* PDU 4 -2.424 2.195 -10.904 154 2H2* PDU 4 2H2* PDU 4 -1.335 2.386 -8.986 155 H1* PDU 4 H1* PDU 4 0.194 4.891 -9.638 156 H6 PDU 4 H6 PDU 4 -2.993 4.210 -7.956 157 H3 PDU 4 H3 PDU 4 0.970 4.907 -5.231 158 1H5M PDU 4 1H5M PDU 4 -6.859 4.980 -5.266 159 2H5M PDU 4 2H5M PDU 4 -6.678 3.231 -5.300 160 3H5M PDU 4 3H5M PDU 4 -6.450 4.120 -3.748 161 1H2* PDU 4 1H2* PDU 4 0.225 2.582 -9.826 162 1H5* 5PC 5 1H5* 5PC 5 2.639 1.128 -12.457 163 2H5* 5PC 5 2H5* 5PC 5 1.921 2.557 -11.685 164 H4* 5PC 5 H4* 5PC 5 3.904 1.829 -10.512 165 H3* 5PC 5 H3* 5PC 5 2.603 -0.821 -10.357 166 1H2* 5PC 5 1H2* 5PC 5 4.420 -0.455 -8.093 167 2H2* 5PC 5 2H2* 5PC 5 2.671 -0.844 -8.120 168 H1* 5PC 5 H1* 5PC 5 4.106 1.815 -7.964 169 H41 5PC 5 1H4 5PC 5 0.510 1.706 -2.960 170 H42 5PC 5 2H4 5PC 5 -0.933 1.544 -4.067 171 H6 5PC 5 H6 5PC 5 0.630 0.930 -8.002 172 H91 5PC 5 1H9 5PC 5 -4.347 1.800 -6.768 173 H92 5PC 5 2H9 5PC 5 -4.199 0.047 -6.696 174 H93 5PC 5 3H9 5PC 5 -4.288 1.000 -5.171 175 1H5* PDU 6 1H5* PDU 6 7.660 -2.432 -9.389 176 2H5* PDU 6 2H5* PDU 6 6.911 -0.875 -8.994 177 H4* PDU 6 H4* PDU 6 8.028 -1.825 -7.172 178 H3* PDU 6 H3* PDU 6 6.521 -4.293 -7.556 179 2H2* PDU 6 2H2* PDU 6 5.424 -4.196 -5.640 180 H1* PDU 6 H1* PDU 6 6.770 -1.769 -4.506 181 H6 PDU 6 H6 PDU 6 3.792 -2.273 -6.575 182 H3 PDU 6 H3 PDU 6 3.281 -1.700 -1.775 183 1H5M PDU 6 1H5M PDU 6 -1.014 -1.163 -8.167 184 2H5M PDU 6 2H5M PDU 6 -0.104 -2.522 -8.877 185 3H5M PDU 6 3H5M PDU 6 -1.394 -2.804 -7.643 186 1H2* PDU 6 1H2* PDU 6 6.925 -4.054 -4.687 187 1H5* 5PC 7 1H5* 5PC 7 10.140 -5.945 -3.945 188 2H5* 5PC 7 2H5* 5PC 7 9.272 -4.412 -4.115 189 H4* 5PC 7 H4* 5PC 7 9.105 -5.284 -1.860 190 H3* 5PC 7 H3* 5PC 7 8.006 -7.740 -3.118 191 1H2* 5PC 7 1H2* 5PC 7 7.060 -7.387 -0.346 192 2H2* 5PC 7 2H2* 5PC 7 6.139 -7.652 -1.858 193 H1* 5PC 7 H1* 5PC 7 6.989 -5.108 -0.468 194 H41 5PC 7 1H4 5PC 7 0.876 -4.604 -1.128 195 H42 5PC 7 2H4 5PC 7 1.122 -4.693 -2.934 196 H6 5PC 7 H6 5PC 7 5.244 -5.706 -3.538 197 H91 5PC 7 1H9 5PC 7 1.591 -4.679 -7.209 198 H92 5PC 7 2H9 5PC 7 1.662 -6.433 -7.024 199 H93 5PC 7 3H9 5PC 7 0.298 -5.500 -6.297 200 1H5* PDU 8 1H5* PDU 8 9.704 -9.690 1.648 201 2H5* PDU 8 2H5* PDU 8 9.144 -8.046 1.277 202 H4* PDU 8 H4* PDU 8 8.166 -8.961 3.252 203 H3* PDU 8 H3* PDU 8 7.277 -11.213 1.589 204 2H2* PDU 8 2H2* PDU 8 5.138 -10.896 1.932 205 H1* PDU 8 H1* PDU 8 5.282 -8.506 3.707 206 H6 PDU 8 H6 PDU 8 5.308 -9.045 0.078 207 H3 PDU 8 H3 PDU 8 1.076 -8.001 2.219 208 1H5M PDU 8 1H5M PDU 8 3.954 -8.006 -4.915 209 2H5M PDU 8 2H5M PDU 8 4.090 -9.761 -4.706 210 3H5M PDU 8 3H5M PDU 8 2.465 -8.960 -4.749 211 1H2* PDU 8 1H2* PDU 8 5.321 -10.819 3.715 212 1H5* PDU 9 1H5* PDU 9 6.491 -13.627 6.343 213 2H5* PDU 9 2H5* PDU 9 6.264 -11.906 5.981 214 H4* PDU 9 H4* PDU 9 4.375 -12.894 7.088 215 H3* PDU 9 H3* PDU 9 4.303 -14.845 4.877 216 2H2* PDU 9 2H2* PDU 9 2.252 -14.381 4.275 217 H1* PDU 9 H1* PDU 9 1.701 -12.095 6.094 218 H6 PDU 9 H6 PDU 9 3.513 -12.518 2.921 219 H3 PDU 9 H3 PDU 9 -1.129 -11.114 2.721 220 1H5M PDU 9 1H5M PDU 9 5.401 -11.035 -1.401 221 2H5M PDU 9 2H5M PDU 9 5.538 -12.776 -1.164 222 3H5M PDU 9 3H5M PDU 9 4.413 -12.107 -2.416 223 1H2* PDU 9 1H2* PDU 9 1.606 -14.385 5.957 224 1H5* C 10 2H5* C 10 1.337 -15.616 8.172 225 2H5* C 10 1H5* C 10 1.173 -17.356 8.444 226 H4* C 10 H4* C 10 -1.050 -16.451 8.255 227 H3* C 10 H3* C 10 -0.160 -17.918 5.775 228 H1* C 10 H1* C 10 -2.756 -15.019 6.122 229 1H4 C 10 1H4 C 10 -1.758 -13.760 0.093 230 2H4 C 10 2H4 C 10 -0.029 -14.200 0.079 231 H5 C 10 H5 C 10 0.867 -15.332 2.087 232 H6 C 10 H6 C 10 0.309 -15.943 4.450 233 H3T C 10 H3T C 10 -0.529 -19.212 7.531 234 2H2* C 10 1H2* C 10 -3.050 -17.283 6.231 235 1H2* C 10 2H2* C 10 -2.087 -17.438 4.713
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