USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 264 hydrogens (80 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : X 1 DG O5' : rot 180:sc= 0 USER MOD Single : X 3 DT C7 :methyl -30:sc= -1.26 (180deg=-1.37) USER MOD Single : X 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : X 8 DC O3' : rot 180:sc= 0 USER MOD Single : Y 9 DG O5' : rot 180:sc= 0 USER MOD Single : Y 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : Y 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : Y 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG X 1 37.920 28.237 16.120 1.00 0.00 O ATOM 2 C5' DG X 1 37.147 27.829 17.267 1.00 0.00 C ATOM 3 C4' DG X 1 35.663 28.271 17.198 1.00 0.00 C ATOM 4 O4' DG X 1 35.512 29.662 17.143 1.00 0.00 O ATOM 5 C3' DG X 1 34.886 27.693 15.958 1.00 0.00 C ATOM 6 O3' DG X 1 33.655 27.020 16.332 1.00 0.00 O ATOM 7 C2' DG X 1 34.600 28.929 15.129 1.00 0.00 C ATOM 8 C1' DG X 1 34.520 30.014 16.181 1.00 0.00 C ATOM 9 N9 DG X 1 34.542 31.415 15.583 1.00 0.00 N ATOM 10 C8 DG X 1 34.008 31.934 14.415 1.00 0.00 C ATOM 11 N7 DG X 1 34.053 33.232 14.289 1.00 0.00 N ATOM 12 C5 DG X 1 34.809 33.650 15.390 1.00 0.00 C ATOM 13 C6 DG X 1 35.241 34.958 15.786 1.00 0.00 C ATOM 14 O6 DG X 1 35.167 36.042 15.215 1.00 0.00 O ATOM 15 N1 DG X 1 35.841 34.968 17.050 1.00 0.00 N ATOM 16 C2 DG X 1 35.997 33.842 17.832 1.00 0.00 C ATOM 17 N2 DG X 1 36.450 34.017 19.016 1.00 0.00 N ATOM 18 N3 DG X 1 35.691 32.559 17.462 1.00 0.00 N ATOM 19 C4 DG X 1 35.041 32.531 16.235 1.00 0.00 C ATOM 0 H5' DG X 1 37.600 28.243 18.167 1.00 0.00 H new ATOM 0 H5'' DG X 1 37.191 26.744 17.358 1.00 0.00 H new ATOM 0 H4' DG X 1 35.244 27.869 18.121 1.00 0.00 H new ATOM 0 H3' DG X 1 35.460 26.932 15.430 1.00 0.00 H new ATOM 0 H2' DG X 1 35.390 29.124 14.404 1.00 0.00 H new ATOM 0 H2'' DG X 1 33.669 28.836 14.569 1.00 0.00 H new ATOM 0 HO5' DG X 1 38.845 27.931 16.223 1.00 0.00 H new ATOM 0 H1' DG X 1 33.563 30.069 16.699 1.00 0.00 H new ATOM 0 H8 DG X 1 33.579 31.301 13.652 1.00 0.00 H new ATOM 0 H1 DG X 1 36.182 35.858 17.414 1.00 0.00 H new ATOM 0 H21 DG X 1 36.584 33.217 19.634 1.00 0.00 H new ATOM 0 H22 DG X 1 36.677 34.957 19.341 1.00 0.00 H new ATOM 32 P DC X 2 33.544 25.711 17.183 1.00 0.00 P ATOM 33 OP1 DC X 2 34.779 24.869 17.050 1.00 0.00 O ATOM 34 OP2 DC X 2 32.173 25.142 16.990 1.00 0.00 O1- ATOM 35 O5' DC X 2 33.711 26.280 18.665 1.00 0.00 O ATOM 36 C5' DC X 2 34.819 25.973 19.623 1.00 0.00 C ATOM 37 C4' DC X 2 34.942 27.089 20.716 1.00 0.00 C ATOM 38 O4' DC X 2 34.868 28.466 20.274 1.00 0.00 O ATOM 39 C3' DC X 2 33.901 26.815 21.799 1.00 0.00 C ATOM 40 O3' DC X 2 34.560 26.747 23.054 1.00 0.00 O ATOM 41 C2' DC X 2 33.043 28.122 21.775 1.00 0.00 C ATOM 42 C1' DC X 2 33.896 29.156 21.095 1.00 0.00 C ATOM 43 N1 DC X 2 33.214 30.139 20.162 1.00 0.00 N ATOM 44 C2 DC X 2 33.068 31.451 20.565 1.00 0.00 C ATOM 45 O2 DC X 2 33.635 31.877 21.592 1.00 0.00 O ATOM 46 N3 DC X 2 32.471 32.398 19.772 1.00 0.00 N ATOM 47 C4 DC X 2 31.848 31.937 18.633 1.00 0.00 C ATOM 48 N4 DC X 2 31.314 32.796 17.807 1.00 0.00 N ATOM 49 C5 DC X 2 31.851 30.563 18.279 1.00 0.00 C ATOM 50 C6 DC X 2 32.558 29.697 19.092 1.00 0.00 C ATOM 0 H5' DC X 2 35.760 25.886 19.080 1.00 0.00 H new ATOM 0 H5'' DC X 2 34.636 25.010 20.100 1.00 0.00 H new ATOM 0 H4' DC X 2 35.965 27.014 21.086 1.00 0.00 H new ATOM 0 H3' DC X 2 33.334 25.897 21.647 1.00 0.00 H new ATOM 0 H2' DC X 2 32.109 27.968 21.234 1.00 0.00 H new ATOM 0 H2'' DC X 2 32.778 28.435 22.785 1.00 0.00 H new ATOM 0 H1' DC X 2 34.289 29.744 21.925 1.00 0.00 H new ATOM 0 H41 DC X 2 30.850 32.468 16.960 1.00 0.00 H new ATOM 0 H42 DC X 2 31.361 33.795 18.009 1.00 0.00 H new ATOM 0 H5 DC X 2 31.321 30.207 17.408 1.00 0.00 H new ATOM 0 H6 DC X 2 32.578 28.644 18.855 1.00 0.00 H new ATOM 62 P DT X 3 35.049 25.319 23.628 1.00 0.00 P ATOM 63 OP1 DT X 3 36.320 25.006 23.021 1.00 0.00 O ATOM 64 OP2 DT X 3 33.998 24.313 23.508 1.00 0.00 O1- ATOM 65 O5' DT X 3 35.261 25.763 25.172 1.00 0.00 O ATOM 66 C5' DT X 3 36.548 25.825 25.830 1.00 0.00 C ATOM 67 C4' DT X 3 36.366 26.598 27.118 1.00 0.00 C ATOM 68 O4' DT X 3 36.039 27.938 26.733 1.00 0.00 O ATOM 69 C3' DT X 3 35.231 26.105 28.103 1.00 0.00 C ATOM 70 O3' DT X 3 35.621 25.309 29.273 1.00 0.00 O ATOM 71 C2' DT X 3 34.376 27.330 28.190 1.00 0.00 C ATOM 72 C1' DT X 3 35.285 28.456 27.802 1.00 0.00 C ATOM 73 N1 DT X 3 34.661 29.795 27.445 1.00 0.00 N ATOM 74 C2 DT X 3 34.883 30.946 28.267 1.00 0.00 C ATOM 75 O2 DT X 3 35.443 31.052 29.354 1.00 0.00 O ATOM 76 N3 DT X 3 34.533 32.112 27.651 1.00 0.00 N ATOM 77 C4 DT X 3 33.648 32.319 26.599 1.00 0.00 C ATOM 78 O4 DT X 3 33.314 33.417 26.289 1.00 0.00 O ATOM 79 C5 DT X 3 33.288 31.064 25.921 1.00 0.00 C ATOM 80 C7 DT X 3 32.335 31.060 24.697 1.00 0.00 C ATOM 81 C6 DT X 3 33.678 29.859 26.434 1.00 0.00 C ATOM 0 H5' DT X 3 37.282 26.314 25.190 1.00 0.00 H new ATOM 0 H5'' DT X 3 36.922 24.822 26.035 1.00 0.00 H new ATOM 0 H4' DT X 3 37.293 26.471 27.677 1.00 0.00 H new ATOM 0 H3' DT X 3 34.636 25.256 27.767 1.00 0.00 H new ATOM 0 H2' DT X 3 33.519 27.264 27.519 1.00 0.00 H new ATOM 0 H2'' DT X 3 33.982 27.468 29.197 1.00 0.00 H new ATOM 0 H1' DT X 3 35.861 28.742 28.682 1.00 0.00 H new ATOM 0 H3 DT X 3 34.985 32.951 28.014 1.00 0.00 H new ATOM 0 H71 DT X 3 31.633 31.890 24.780 1.00 0.00 H new ATOM 0 H72 DT X 3 32.918 31.167 23.782 1.00 0.00 H new ATOM 0 H73 DT X 3 31.784 30.120 24.668 1.00 0.00 H new ATOM 0 H6 DT X 3 33.231 28.949 26.063 1.00 0.00 H new ATOM 94 P DA X 4 34.758 24.064 29.731 1.00 0.00 P ATOM 95 OP1 DA X 4 35.470 23.368 30.814 1.00 0.00 O ATOM 96 OP2 DA X 4 34.352 23.306 28.541 1.00 0.00 O1- ATOM 97 O5' DA X 4 33.469 24.716 30.323 1.00 0.00 O ATOM 98 C5' DA X 4 33.481 25.304 31.622 1.00 0.00 C ATOM 99 C4' DA X 4 32.094 25.893 31.985 1.00 0.00 C ATOM 100 O4' DA X 4 31.982 27.076 31.302 1.00 0.00 O ATOM 101 C3' DA X 4 30.832 25.079 31.570 1.00 0.00 C ATOM 102 O3' DA X 4 29.922 24.952 32.602 1.00 0.00 O ATOM 103 C2' DA X 4 30.079 25.887 30.539 1.00 0.00 C ATOM 104 C1' DA X 4 30.639 27.252 30.914 1.00 0.00 C ATOM 105 N9 DA X 4 30.488 28.243 29.765 1.00 0.00 N ATOM 106 C8 DA X 4 29.804 28.069 28.600 1.00 0.00 C ATOM 107 N7 DA X 4 29.738 29.207 27.855 1.00 0.00 N ATOM 108 C5 DA X 4 30.555 30.129 28.603 1.00 0.00 C ATOM 109 C6 DA X 4 30.779 31.543 28.512 1.00 0.00 C ATOM 110 N6 DA X 4 30.270 32.373 27.607 1.00 0.00 N ATOM 111 N1 DA X 4 31.608 32.117 29.405 1.00 0.00 N ATOM 112 C2 DA X 4 31.959 31.431 30.426 1.00 0.00 C ATOM 113 N3 DA X 4 31.798 30.148 30.718 1.00 0.00 N ATOM 114 C4 DA X 4 31.052 29.547 29.749 1.00 0.00 C ATOM 0 H5' DA X 4 34.234 26.091 31.661 1.00 0.00 H new ATOM 0 H5'' DA X 4 33.765 24.554 32.361 1.00 0.00 H new ATOM 0 H4' DA X 4 32.091 25.936 33.074 1.00 0.00 H new ATOM 0 H3' DA X 4 31.183 24.103 31.235 1.00 0.00 H new ATOM 0 H2' DA X 4 30.311 25.596 29.514 1.00 0.00 H new ATOM 0 H2'' DA X 4 28.997 25.823 30.652 1.00 0.00 H new ATOM 0 H1' DA X 4 30.080 27.679 31.747 1.00 0.00 H new ATOM 0 H8 DA X 4 29.362 27.130 28.300 1.00 0.00 H new ATOM 0 H61 DA X 4 30.500 33.366 27.640 1.00 0.00 H new ATOM 0 H62 DA X 4 29.650 32.017 26.880 1.00 0.00 H new ATOM 0 H2 DA X 4 32.479 31.997 31.185 1.00 0.00 H new ATOM 126 P DT X 5 30.026 23.686 33.541 1.00 0.00 P ATOM 127 OP1 DT X 5 29.298 23.941 34.773 1.00 0.00 O ATOM 128 OP2 DT X 5 31.427 23.253 33.664 1.00 0.00 O1- ATOM 129 O5' DT X 5 29.210 22.484 32.770 1.00 0.00 O ATOM 130 C5' DT X 5 27.813 22.525 32.529 1.00 0.00 C ATOM 131 C4' DT X 5 27.417 23.474 31.371 1.00 0.00 C ATOM 132 O4' DT X 5 28.121 23.212 30.205 1.00 0.00 O ATOM 133 C3' DT X 5 25.949 23.259 30.944 1.00 0.00 C ATOM 134 O3' DT X 5 25.127 24.325 31.337 1.00 0.00 O ATOM 135 C2' DT X 5 25.964 23.320 29.385 1.00 0.00 C ATOM 136 C1' DT X 5 27.380 23.650 29.037 1.00 0.00 C ATOM 137 N1 DT X 5 28.042 23.065 27.821 1.00 0.00 N ATOM 138 C2 DT X 5 28.966 23.864 27.147 1.00 0.00 C ATOM 139 O2 DT X 5 29.177 25.004 27.482 1.00 0.00 O ATOM 140 N3 DT X 5 29.567 23.367 26.044 1.00 0.00 N ATOM 141 C4 DT X 5 29.290 22.131 25.467 1.00 0.00 C ATOM 142 O4 DT X 5 29.916 21.835 24.472 1.00 0.00 O ATOM 143 C5 DT X 5 28.292 21.358 26.153 1.00 0.00 C ATOM 144 C7 DT X 5 28.014 19.932 25.640 1.00 0.00 C ATOM 145 C6 DT X 5 27.776 21.805 27.338 1.00 0.00 C ATOM 0 H5' DT X 5 27.304 22.842 33.439 1.00 0.00 H new ATOM 0 H5'' DT X 5 27.461 21.519 32.301 1.00 0.00 H new ATOM 0 H4' DT X 5 27.616 24.472 31.763 1.00 0.00 H new ATOM 0 H3' DT X 5 25.579 22.332 31.381 1.00 0.00 H new ATOM 0 H2' DT X 5 25.659 22.369 28.948 1.00 0.00 H new ATOM 0 H2'' DT X 5 25.276 24.078 29.011 1.00 0.00 H new ATOM 0 H1' DT X 5 27.375 24.707 28.772 1.00 0.00 H new ATOM 0 H3 DT X 5 30.281 23.944 25.598 1.00 0.00 H new ATOM 0 H71 DT X 5 27.695 19.302 26.471 1.00 0.00 H new ATOM 0 H72 DT X 5 27.228 19.964 24.886 1.00 0.00 H new ATOM 0 H73 DT X 5 28.922 19.520 25.200 1.00 0.00 H new ATOM 0 H6 DT X 5 27.140 21.148 27.912 1.00 0.00 H new ATOM 158 P DA X 6 24.501 24.414 32.772 1.00 0.00 P ATOM 159 OP1 DA X 6 25.540 24.870 33.710 1.00 0.00 O ATOM 160 OP2 DA X 6 23.766 23.194 33.067 1.00 0.00 O1- ATOM 161 O5' DA X 6 23.412 25.478 32.431 1.00 0.00 O ATOM 162 C5' DA X 6 23.671 26.833 32.549 1.00 0.00 C ATOM 163 C4' DA X 6 22.427 27.658 32.059 1.00 0.00 C ATOM 164 O4' DA X 6 22.296 27.515 30.642 1.00 0.00 O ATOM 165 C3' DA X 6 21.135 27.151 32.646 1.00 0.00 C ATOM 166 O3' DA X 6 20.263 28.194 33.036 1.00 0.00 O ATOM 167 C2' DA X 6 20.571 26.280 31.553 1.00 0.00 C ATOM 168 C1' DA X 6 21.102 26.883 30.239 1.00 0.00 C ATOM 169 N9 DA X 6 21.502 25.992 29.114 1.00 0.00 N ATOM 170 C8 DA X 6 22.605 25.234 29.017 1.00 0.00 C ATOM 171 N7 DA X 6 22.753 24.556 27.889 1.00 0.00 N ATOM 172 C5 DA X 6 21.638 25.022 27.161 1.00 0.00 C ATOM 173 C6 DA X 6 21.052 24.703 25.898 1.00 0.00 C ATOM 174 N6 DA X 6 21.543 23.840 25.035 1.00 0.00 N ATOM 175 N1 DA X 6 19.854 25.095 25.489 1.00 0.00 N ATOM 176 C2 DA X 6 19.246 25.957 26.328 1.00 0.00 C ATOM 177 N3 DA X 6 19.691 26.449 27.525 1.00 0.00 N ATOM 178 C4 DA X 6 20.894 25.924 27.881 1.00 0.00 C ATOM 0 H5' DA X 6 24.549 27.097 31.960 1.00 0.00 H new ATOM 0 H5'' DA X 6 23.897 27.080 33.586 1.00 0.00 H new ATOM 0 H4' DA X 6 22.596 28.689 32.369 1.00 0.00 H new ATOM 0 H3' DA X 6 21.283 26.601 33.576 1.00 0.00 H new ATOM 0 H2' DA X 6 20.893 25.245 31.669 1.00 0.00 H new ATOM 0 H2'' DA X 6 19.481 26.279 31.573 1.00 0.00 H new ATOM 0 H1' DA X 6 20.276 27.463 29.828 1.00 0.00 H new ATOM 0 H8 DA X 6 23.332 25.180 29.814 1.00 0.00 H new ATOM 0 H61 DA X 6 21.060 23.670 24.153 1.00 0.00 H new ATOM 0 H62 DA X 6 22.406 23.341 25.248 1.00 0.00 H new ATOM 0 H2 DA X 6 18.274 26.307 26.012 1.00 0.00 H new ATOM 190 P DG X 7 19.060 28.018 34.070 1.00 0.00 P ATOM 191 OP1 DG X 7 18.691 29.427 34.475 1.00 0.00 O ATOM 192 OP2 DG X 7 19.569 27.127 35.121 1.00 0.00 O1- ATOM 193 O5' DG X 7 17.979 27.276 33.168 1.00 0.00 O ATOM 194 C5' DG X 7 17.064 27.921 32.369 1.00 0.00 C ATOM 195 C4' DG X 7 16.133 27.049 31.557 1.00 0.00 C ATOM 196 O4' DG X 7 16.871 26.479 30.527 1.00 0.00 O ATOM 197 C3' DG X 7 15.324 25.951 32.341 1.00 0.00 C ATOM 198 O3' DG X 7 13.998 25.785 32.110 1.00 0.00 O ATOM 199 C2' DG X 7 16.074 24.695 31.795 1.00 0.00 C ATOM 200 C1' DG X 7 16.424 25.151 30.388 1.00 0.00 C ATOM 201 N9 DG X 7 17.552 24.420 29.769 1.00 0.00 N ATOM 202 C8 DG X 7 18.746 23.920 30.303 1.00 0.00 C ATOM 203 N7 DG X 7 19.396 23.082 29.531 1.00 0.00 N ATOM 204 C5 DG X 7 18.604 23.048 28.356 1.00 0.00 C ATOM 205 C6 DG X 7 18.741 22.410 27.073 1.00 0.00 C ATOM 206 O6 DG X 7 19.617 21.668 26.624 1.00 0.00 O ATOM 207 N1 DG X 7 17.769 22.650 26.227 1.00 0.00 N ATOM 208 C2 DG X 7 16.812 23.560 26.396 1.00 0.00 C ATOM 209 N2 DG X 7 16.013 23.828 25.427 1.00 0.00 N ATOM 210 N3 DG X 7 16.614 24.257 27.496 1.00 0.00 N ATOM 211 C4 DG X 7 17.563 23.960 28.454 1.00 0.00 C ATOM 0 H5' DG X 7 17.610 28.568 31.682 1.00 0.00 H new ATOM 0 H5'' DG X 7 16.457 28.568 33.002 1.00 0.00 H new ATOM 0 H4' DG X 7 15.347 27.710 31.192 1.00 0.00 H new ATOM 0 H3' DG X 7 15.306 26.190 33.404 1.00 0.00 H new ATOM 0 H2' DG X 7 16.960 24.457 32.383 1.00 0.00 H new ATOM 0 H2'' DG X 7 15.443 23.806 31.795 1.00 0.00 H new ATOM 0 H1' DG X 7 15.546 24.997 29.761 1.00 0.00 H new ATOM 0 H8 DG X 7 19.106 24.204 31.281 1.00 0.00 H new ATOM 0 H1 DG X 7 17.744 22.096 25.371 1.00 0.00 H new ATOM 0 H21 DG X 7 15.278 24.524 25.550 1.00 0.00 H new ATOM 0 H22 DG X 7 16.114 23.345 24.534 1.00 0.00 H new ATOM 223 P DC X 8 12.999 25.292 33.316 1.00 0.00 P ATOM 224 OP1 DC X 8 11.687 25.918 32.975 1.00 0.00 O ATOM 225 OP2 DC X 8 13.534 25.584 34.626 1.00 0.00 O ATOM 226 O5' DC X 8 13.000 23.731 33.141 1.00 0.00 O ATOM 227 C5' DC X 8 11.922 23.064 32.469 1.00 0.00 C ATOM 228 C4' DC X 8 12.007 23.290 30.949 1.00 0.00 C ATOM 229 O4' DC X 8 13.335 23.147 30.486 1.00 0.00 O ATOM 230 C3' DC X 8 11.097 22.320 30.136 1.00 0.00 C ATOM 231 O3' DC X 8 10.560 22.960 29.026 1.00 0.00 O ATOM 232 C2' DC X 8 12.121 21.259 29.873 1.00 0.00 C ATOM 233 C1' DC X 8 13.348 22.063 29.511 1.00 0.00 C ATOM 234 N1 DC X 8 14.603 21.325 29.462 1.00 0.00 N ATOM 235 C2 DC X 8 15.101 20.880 28.217 1.00 0.00 C ATOM 236 O2 DC X 8 14.408 21.003 27.221 1.00 0.00 O ATOM 237 N3 DC X 8 16.289 20.246 28.124 1.00 0.00 N ATOM 238 C4 DC X 8 17.089 20.126 29.158 1.00 0.00 C ATOM 239 N4 DC X 8 18.048 19.225 29.122 1.00 0.00 N ATOM 240 C5 DC X 8 16.516 20.380 30.477 1.00 0.00 C ATOM 241 C6 DC X 8 15.357 21.005 30.580 1.00 0.00 C ATOM 0 H5' DC X 8 10.968 23.435 32.844 1.00 0.00 H new ATOM 0 H5'' DC X 8 11.957 21.996 32.686 1.00 0.00 H new ATOM 0 H4' DC X 8 11.655 24.309 30.787 1.00 0.00 H new ATOM 0 H3' DC X 8 10.190 21.934 30.602 1.00 0.00 H new ATOM 0 H2' DC X 8 12.291 20.634 30.750 1.00 0.00 H new ATOM 0 H2'' DC X 8 11.818 20.596 29.063 1.00 0.00 H new ATOM 0 HO3' DC X 8 9.994 22.333 28.529 1.00 0.00 H new ATOM 0 H1' DC X 8 13.300 22.411 28.479 1.00 0.00 H new ATOM 0 H41 DC X 8 18.678 19.119 29.917 1.00 0.00 H new ATOM 0 H42 DC X 8 18.161 18.633 28.299 1.00 0.00 H new ATOM 0 H5 DC X 8 17.038 20.058 31.366 1.00 0.00 H new ATOM 0 H6 DC X 8 14.988 21.273 31.559 1.00 0.00 H new TER 254 DC X 8 ATOM 255 O5' DG Y 9 12.717 17.443 20.747 1.00 0.00 O ATOM 256 C5' DG Y 9 13.412 16.344 20.198 1.00 0.00 C ATOM 257 C4' DG Y 9 14.923 16.692 19.991 1.00 0.00 C ATOM 258 O4' DG Y 9 15.593 16.838 21.233 1.00 0.00 O ATOM 259 C3' DG Y 9 15.912 15.843 19.179 1.00 0.00 C ATOM 260 O3' DG Y 9 16.332 16.397 17.945 1.00 0.00 O ATOM 261 C2' DG Y 9 17.084 15.620 20.156 1.00 0.00 C ATOM 262 C1' DG Y 9 17.003 16.921 21.006 1.00 0.00 C ATOM 263 N9 DG Y 9 17.729 16.930 22.318 1.00 0.00 N ATOM 264 C8 DG Y 9 18.988 16.418 22.582 1.00 0.00 C ATOM 265 N7 DG Y 9 19.355 16.689 23.802 1.00 0.00 N ATOM 266 C5 DG Y 9 18.395 17.538 24.341 1.00 0.00 C ATOM 267 C6 DG Y 9 18.344 18.320 25.565 1.00 0.00 C ATOM 268 O6 DG Y 9 19.114 18.315 26.531 1.00 0.00 O ATOM 269 N1 DG Y 9 17.298 19.244 25.591 1.00 0.00 N ATOM 270 C2 DG Y 9 16.457 19.452 24.515 1.00 0.00 C ATOM 271 N2 DG Y 9 15.389 20.152 24.809 1.00 0.00 N ATOM 272 N3 DG Y 9 16.500 18.790 23.371 1.00 0.00 N ATOM 273 C4 DG Y 9 17.550 17.863 23.330 1.00 0.00 C ATOM 0 H5' DG Y 9 12.964 16.064 19.244 1.00 0.00 H new ATOM 0 H5'' DG Y 9 13.320 15.482 20.859 1.00 0.00 H new ATOM 0 H4' DG Y 9 14.728 17.565 19.369 1.00 0.00 H new ATOM 0 H3' DG Y 9 15.436 14.921 18.843 1.00 0.00 H new ATOM 0 H2' DG Y 9 16.954 14.722 20.760 1.00 0.00 H new ATOM 0 H2'' DG Y 9 18.039 15.521 19.640 1.00 0.00 H new ATOM 0 HO5' DG Y 9 11.774 17.206 20.868 1.00 0.00 H new ATOM 0 H1' DG Y 9 17.445 17.794 20.527 1.00 0.00 H new ATOM 0 H8 DG Y 9 19.586 15.867 21.871 1.00 0.00 H new ATOM 0 H1 DG Y 9 17.148 19.789 26.440 1.00 0.00 H new ATOM 0 H21 DG Y 9 14.702 20.363 24.085 1.00 0.00 H new ATOM 0 H22 DG Y 9 15.245 20.486 25.762 1.00 0.00 H new ATOM 286 P DC Y 10 15.274 16.894 16.872 1.00 0.00 P ATOM 287 OP1 DC Y 10 14.178 15.946 16.864 1.00 0.00 O ATOM 288 OP2 DC Y 10 15.961 17.057 15.624 1.00 0.00 O1- ATOM 289 O5' DC Y 10 14.757 18.288 17.340 1.00 0.00 O ATOM 290 C5' DC Y 10 15.583 19.404 17.207 1.00 0.00 C ATOM 291 C4' DC Y 10 15.394 20.569 18.220 1.00 0.00 C ATOM 292 O4' DC Y 10 16.010 20.252 19.399 1.00 0.00 O ATOM 293 C3' DC Y 10 16.026 21.840 17.756 1.00 0.00 C ATOM 294 O3' DC Y 10 15.099 22.605 17.003 1.00 0.00 O ATOM 295 C2' DC Y 10 16.581 22.443 19.056 1.00 0.00 C ATOM 296 C1' DC Y 10 16.205 21.405 20.189 1.00 0.00 C ATOM 297 N1 DC Y 10 17.316 21.316 21.220 1.00 0.00 N ATOM 298 C2 DC Y 10 17.204 21.951 22.428 1.00 0.00 C ATOM 299 O2 DC Y 10 16.196 22.588 22.718 1.00 0.00 O ATOM 300 N3 DC Y 10 18.239 21.772 23.323 1.00 0.00 N ATOM 301 C4 DC Y 10 19.312 20.993 23.038 1.00 0.00 C ATOM 302 N4 DC Y 10 20.044 20.712 24.117 1.00 0.00 N ATOM 303 C5 DC Y 10 19.502 20.487 21.753 1.00 0.00 C ATOM 304 C6 DC Y 10 18.490 20.695 20.872 1.00 0.00 C ATOM 0 H5' DC Y 10 15.444 19.806 16.204 1.00 0.00 H new ATOM 0 H5'' DC Y 10 16.617 19.066 17.274 1.00 0.00 H new ATOM 0 H4' DC Y 10 14.318 20.709 18.328 1.00 0.00 H new ATOM 0 H3' DC Y 10 16.844 21.748 17.041 1.00 0.00 H new ATOM 0 H2' DC Y 10 17.660 22.585 18.995 1.00 0.00 H new ATOM 0 H2'' DC Y 10 16.141 23.420 19.256 1.00 0.00 H new ATOM 0 H1' DC Y 10 15.339 21.634 20.811 1.00 0.00 H new ATOM 0 H41 DC Y 10 20.879 20.132 24.030 1.00 0.00 H new ATOM 0 H42 DC Y 10 19.769 21.077 25.029 1.00 0.00 H new ATOM 0 H5 DC Y 10 20.402 19.960 21.474 1.00 0.00 H new ATOM 0 H6 DC Y 10 18.614 20.357 19.854 1.00 0.00 H new ATOM 316 P DT Y 11 15.389 23.991 16.264 1.00 0.00 P ATOM 317 OP1 DT Y 11 14.278 24.221 15.329 1.00 0.00 O ATOM 318 OP2 DT Y 11 16.783 23.964 15.749 1.00 0.00 O1- ATOM 319 O5' DT Y 11 15.422 24.902 17.587 1.00 0.00 O ATOM 320 C5' DT Y 11 14.332 25.116 18.495 1.00 0.00 C ATOM 321 C4' DT Y 11 14.682 26.031 19.570 1.00 0.00 C ATOM 322 O4' DT Y 11 15.677 25.457 20.384 1.00 0.00 O ATOM 323 C3' DT Y 11 15.114 27.391 19.098 1.00 0.00 C ATOM 324 O3' DT Y 11 14.474 28.402 19.900 1.00 0.00 O ATOM 325 C2' DT Y 11 16.669 27.289 19.345 1.00 0.00 C ATOM 326 C1' DT Y 11 16.654 26.474 20.621 1.00 0.00 C ATOM 327 N1 DT Y 11 17.950 25.787 21.021 1.00 0.00 N ATOM 328 C2 DT Y 11 18.181 25.450 22.348 1.00 0.00 C ATOM 329 O2 DT Y 11 17.391 25.860 23.209 1.00 0.00 O ATOM 330 N3 DT Y 11 19.284 24.742 22.639 1.00 0.00 N ATOM 331 C4 DT Y 11 20.158 24.225 21.770 1.00 0.00 C ATOM 332 O4 DT Y 11 21.083 23.493 22.173 1.00 0.00 O ATOM 333 C5 DT Y 11 19.803 24.481 20.343 1.00 0.00 C ATOM 334 C7 DT Y 11 20.760 24.029 19.239 1.00 0.00 C ATOM 335 C6 DT Y 11 18.835 25.313 20.014 1.00 0.00 C ATOM 0 H5' DT Y 11 14.023 24.161 18.920 1.00 0.00 H new ATOM 0 H5'' DT Y 11 13.478 25.513 17.947 1.00 0.00 H new ATOM 0 H4' DT Y 11 13.770 26.191 20.145 1.00 0.00 H new ATOM 0 H3' DT Y 11 14.861 27.658 18.072 1.00 0.00 H new ATOM 0 H2' DT Y 11 17.192 26.787 18.531 1.00 0.00 H new ATOM 0 H2'' DT Y 11 17.140 28.264 19.474 1.00 0.00 H new ATOM 0 H1' DT Y 11 16.457 27.163 21.443 1.00 0.00 H new ATOM 0 H3 DT Y 11 19.475 24.582 23.628 1.00 0.00 H new ATOM 0 H71 DT Y 11 20.192 23.791 18.340 1.00 0.00 H new ATOM 0 H72 DT Y 11 21.467 24.829 19.020 1.00 0.00 H new ATOM 0 H73 DT Y 11 21.304 23.144 19.569 1.00 0.00 H new ATOM 0 H6 DT Y 11 18.715 25.632 18.989 1.00 0.00 H new ATOM 348 P DA Y 12 14.525 29.967 19.675 1.00 0.00 P ATOM 349 OP1 DA Y 12 13.452 30.493 20.564 1.00 0.00 O ATOM 350 OP2 DA Y 12 14.500 30.183 18.199 1.00 0.00 O1- ATOM 351 O5' DA Y 12 16.002 30.269 20.279 1.00 0.00 O ATOM 352 C5' DA Y 12 16.109 31.144 21.351 1.00 0.00 C ATOM 353 C4' DA Y 12 17.539 31.357 21.726 1.00 0.00 C ATOM 354 O4' DA Y 12 18.085 30.226 22.421 1.00 0.00 O ATOM 355 C3' DA Y 12 18.411 31.743 20.510 1.00 0.00 C ATOM 356 O3' DA Y 12 18.718 33.170 20.566 1.00 0.00 O ATOM 357 C2' DA Y 12 19.658 30.964 20.751 1.00 0.00 C ATOM 358 C1' DA Y 12 19.486 30.278 22.097 1.00 0.00 C ATOM 359 N9 DA Y 12 20.215 28.991 22.130 1.00 0.00 N ATOM 360 C8 DA Y 12 20.687 28.152 21.150 1.00 0.00 C ATOM 361 N7 DA Y 12 21.505 27.241 21.651 1.00 0.00 N ATOM 362 C5 DA Y 12 21.572 27.539 23.047 1.00 0.00 C ATOM 363 C6 DA Y 12 22.350 27.155 24.180 1.00 0.00 C ATOM 364 N6 DA Y 12 23.291 26.229 24.216 1.00 0.00 N ATOM 365 N1 DA Y 12 22.198 27.687 25.366 1.00 0.00 N ATOM 366 C2 DA Y 12 21.362 28.691 25.453 1.00 0.00 C ATOM 367 N3 DA Y 12 20.546 29.169 24.525 1.00 0.00 N ATOM 368 C4 DA Y 12 20.742 28.578 23.311 1.00 0.00 C ATOM 0 H5' DA Y 12 15.560 30.747 22.205 1.00 0.00 H new ATOM 0 H5'' DA Y 12 15.651 32.099 21.093 1.00 0.00 H new ATOM 0 H4' DA Y 12 17.555 32.202 22.414 1.00 0.00 H new ATOM 0 H3' DA Y 12 17.940 31.544 19.547 1.00 0.00 H new ATOM 0 H2' DA Y 12 19.817 30.231 19.960 1.00 0.00 H new ATOM 0 H2'' DA Y 12 20.529 31.619 20.758 1.00 0.00 H new ATOM 0 H1' DA Y 12 19.949 30.851 22.900 1.00 0.00 H new ATOM 0 H8 DA Y 12 20.424 28.227 20.105 1.00 0.00 H new ATOM 0 H61 DA Y 12 23.785 26.038 25.088 1.00 0.00 H new ATOM 0 H62 DA Y 12 23.524 25.705 23.372 1.00 0.00 H new ATOM 0 H2 DA Y 12 21.334 29.196 26.407 1.00 0.00 H new ATOM 380 P DT Y 13 19.198 33.990 19.236 1.00 0.00 P ATOM 381 OP1 DT Y 13 18.246 35.046 19.060 1.00 0.00 O ATOM 382 OP2 DT Y 13 19.485 33.116 18.068 1.00 0.00 O1- ATOM 383 O5' DT Y 13 20.550 34.610 19.712 1.00 0.00 O ATOM 384 C5' DT Y 13 21.829 33.966 19.560 1.00 0.00 C ATOM 385 C4' DT Y 13 22.910 35.085 19.535 1.00 0.00 C ATOM 386 O4' DT Y 13 24.170 34.397 19.371 1.00 0.00 O ATOM 387 C3' DT Y 13 22.766 36.045 18.360 1.00 0.00 C ATOM 388 O3' DT Y 13 23.153 37.392 18.737 1.00 0.00 O ATOM 389 C2' DT Y 13 23.762 35.437 17.413 1.00 0.00 C ATOM 390 C1' DT Y 13 24.882 35.054 18.356 1.00 0.00 C ATOM 391 N1 DT Y 13 25.874 34.290 17.635 1.00 0.00 N ATOM 392 C2 DT Y 13 26.739 34.903 16.738 1.00 0.00 C ATOM 393 O2 DT Y 13 26.650 36.076 16.445 1.00 0.00 O ATOM 394 N3 DT Y 13 27.811 34.149 16.226 1.00 0.00 N ATOM 395 C4 DT Y 13 27.979 32.806 16.532 1.00 0.00 C ATOM 396 O4 DT Y 13 28.971 32.273 16.067 1.00 0.00 O ATOM 397 C5 DT Y 13 26.871 32.219 17.302 1.00 0.00 C ATOM 398 C7 DT Y 13 26.819 30.728 17.400 1.00 0.00 C ATOM 399 C6 DT Y 13 25.866 32.949 17.809 1.00 0.00 C ATOM 0 H5' DT Y 13 21.859 33.382 18.640 1.00 0.00 H new ATOM 0 H5'' DT Y 13 22.011 33.274 20.382 1.00 0.00 H new ATOM 0 H4' DT Y 13 22.823 35.678 20.446 1.00 0.00 H new ATOM 0 H3' DT Y 13 21.756 36.150 17.965 1.00 0.00 H new ATOM 0 H2' DT Y 13 23.354 34.573 16.888 1.00 0.00 H new ATOM 0 H2'' DT Y 13 24.090 36.146 16.653 1.00 0.00 H new ATOM 0 H1' DT Y 13 25.485 35.854 18.785 1.00 0.00 H new ATOM 0 H3 DT Y 13 28.486 34.604 15.611 1.00 0.00 H new ATOM 0 H71 DT Y 13 26.355 30.441 18.344 1.00 0.00 H new ATOM 0 H72 DT Y 13 26.233 30.329 16.572 1.00 0.00 H new ATOM 0 H73 DT Y 13 27.831 30.325 17.356 1.00 0.00 H new ATOM 0 H6 DT Y 13 25.061 32.472 18.349 1.00 0.00 H new ATOM 412 P DA Y 14 23.156 38.701 17.812 1.00 0.00 P ATOM 413 OP1 DA Y 14 23.091 39.934 18.637 1.00 0.00 O ATOM 414 OP2 DA Y 14 22.112 38.517 16.830 1.00 0.00 O1- ATOM 415 O5' DA Y 14 24.583 38.558 17.145 1.00 0.00 O ATOM 416 C5' DA Y 14 25.654 39.353 17.675 1.00 0.00 C ATOM 417 C4' DA Y 14 25.941 39.200 19.241 1.00 0.00 C ATOM 418 O4' DA Y 14 26.294 37.904 19.610 1.00 0.00 O ATOM 419 C3' DA Y 14 27.104 40.113 19.834 1.00 0.00 C ATOM 420 O3' DA Y 14 26.702 40.818 20.906 1.00 0.00 O ATOM 421 C2' DA Y 14 28.152 39.098 20.229 1.00 0.00 C ATOM 422 C1' DA Y 14 27.301 37.915 20.555 1.00 0.00 C ATOM 423 N9 DA Y 14 28.100 36.696 20.520 1.00 0.00 N ATOM 424 C8 DA Y 14 28.745 36.173 19.405 1.00 0.00 C ATOM 425 N7 DA Y 14 29.515 35.177 19.718 1.00 0.00 N ATOM 426 C5 DA Y 14 29.450 35.129 21.104 1.00 0.00 C ATOM 427 C6 DA Y 14 30.081 34.428 22.189 1.00 0.00 C ATOM 428 N6 DA Y 14 31.010 33.503 22.029 1.00 0.00 N ATOM 429 N1 DA Y 14 29.707 34.478 23.433 1.00 0.00 N ATOM 430 C2 DA Y 14 28.880 35.463 23.702 1.00 0.00 C ATOM 431 N3 DA Y 14 28.237 36.262 22.876 1.00 0.00 N ATOM 432 C4 DA Y 14 28.604 35.991 21.603 1.00 0.00 C ATOM 0 H5' DA Y 14 25.438 40.401 17.467 1.00 0.00 H new ATOM 0 H5'' DA Y 14 26.566 39.103 17.134 1.00 0.00 H new ATOM 0 H4' DA Y 14 24.980 39.513 19.650 1.00 0.00 H new ATOM 0 H3' DA Y 14 27.452 40.861 19.122 1.00 0.00 H new ATOM 0 H2' DA Y 14 28.851 38.891 19.419 1.00 0.00 H new ATOM 0 H2'' DA Y 14 28.743 39.428 21.083 1.00 0.00 H new ATOM 0 H1' DA Y 14 26.880 37.971 21.559 1.00 0.00 H new ATOM 0 H8 DA Y 14 28.620 36.550 18.401 1.00 0.00 H new ATOM 0 H61 DA Y 14 31.418 33.043 22.843 1.00 0.00 H new ATOM 0 H62 DA Y 14 31.320 33.248 21.091 1.00 0.00 H new ATOM 0 H2 DA Y 14 28.702 35.643 24.752 1.00 0.00 H new ATOM 444 P DG Y 15 27.499 42.135 21.414 1.00 0.00 P ATOM 445 OP1 DG Y 15 26.691 42.738 22.487 1.00 0.00 O ATOM 446 OP2 DG Y 15 27.920 42.902 20.215 1.00 0.00 O1- ATOM 447 O5' DG Y 15 28.871 41.555 22.041 1.00 0.00 O ATOM 448 C5' DG Y 15 29.004 41.113 23.349 1.00 0.00 C ATOM 449 C4' DG Y 15 30.361 40.496 23.711 1.00 0.00 C ATOM 450 O4' DG Y 15 30.641 39.279 23.047 1.00 0.00 O ATOM 451 C3' DG Y 15 31.502 41.456 23.530 1.00 0.00 C ATOM 452 O3' DG Y 15 32.514 41.312 24.488 1.00 0.00 O ATOM 453 C2' DG Y 15 32.084 40.917 22.217 1.00 0.00 C ATOM 454 C1' DG Y 15 31.877 39.393 22.325 1.00 0.00 C ATOM 455 N9 DG Y 15 31.863 38.745 20.955 1.00 0.00 N ATOM 456 C8 DG Y 15 31.416 39.207 19.748 1.00 0.00 C ATOM 457 N7 DG Y 15 31.578 38.392 18.749 1.00 0.00 N ATOM 458 C5 DG Y 15 32.210 37.265 19.300 1.00 0.00 C ATOM 459 C6 DG Y 15 32.600 35.960 18.831 1.00 0.00 C ATOM 460 O6 DG Y 15 32.332 35.452 17.741 1.00 0.00 O ATOM 461 N1 DG Y 15 33.295 35.193 19.736 1.00 0.00 N ATOM 462 C2 DG Y 15 33.354 35.552 21.000 1.00 0.00 C ATOM 463 N2 DG Y 15 34.023 34.704 21.714 1.00 0.00 N ATOM 464 N3 DG Y 15 33.012 36.724 21.589 1.00 0.00 N ATOM 465 C4 DG Y 15 32.441 37.528 20.673 1.00 0.00 C ATOM 0 H5' DG Y 15 28.227 40.374 23.544 1.00 0.00 H new ATOM 0 H5'' DG Y 15 28.819 41.954 24.017 1.00 0.00 H new ATOM 0 H4' DG Y 15 30.267 40.264 24.772 1.00 0.00 H new ATOM 0 H3' DG Y 15 31.177 42.495 23.579 1.00 0.00 H new ATOM 0 H2' DG Y 15 31.568 41.331 21.350 1.00 0.00 H new ATOM 0 H2'' DG Y 15 33.139 41.172 22.112 1.00 0.00 H new ATOM 0 H1' DG Y 15 32.681 38.867 22.840 1.00 0.00 H new ATOM 0 H8 DG Y 15 30.961 40.180 19.633 1.00 0.00 H new ATOM 0 H1 DG Y 15 33.766 34.343 19.426 1.00 0.00 H new ATOM 0 H21 DG Y 15 34.145 34.864 22.714 1.00 0.00 H new ATOM 0 H22 DG Y 15 34.428 33.876 21.276 1.00 0.00 H new ATOM 477 P DC Y 16 33.608 42.458 24.785 1.00 0.00 P ATOM 478 OP1 DC Y 16 34.152 42.052 26.092 1.00 0.00 O ATOM 479 OP2 DC Y 16 33.015 43.779 24.709 1.00 0.00 O ATOM 480 O5' DC Y 16 34.645 42.318 23.633 1.00 0.00 O ATOM 481 C5' DC Y 16 35.936 41.637 23.691 1.00 0.00 C ATOM 482 C4' DC Y 16 35.900 40.084 23.666 1.00 0.00 C ATOM 483 O4' DC Y 16 35.157 39.544 22.550 1.00 0.00 O ATOM 484 C3' DC Y 16 37.317 39.490 23.610 1.00 0.00 C ATOM 485 O3' DC Y 16 37.562 38.286 24.369 1.00 0.00 O ATOM 486 C2' DC Y 16 37.445 39.267 22.138 1.00 0.00 C ATOM 487 C1' DC Y 16 36.000 38.711 21.884 1.00 0.00 C ATOM 488 N1 DC Y 16 35.669 38.759 20.356 1.00 0.00 N ATOM 489 C2 DC Y 16 36.051 37.653 19.612 1.00 0.00 C ATOM 490 O2 DC Y 16 36.576 36.617 20.108 1.00 0.00 O ATOM 491 N3 DC Y 16 35.791 37.543 18.313 1.00 0.00 N ATOM 492 C4 DC Y 16 35.196 38.563 17.842 1.00 0.00 C ATOM 493 N4 DC Y 16 34.929 38.463 16.600 1.00 0.00 N ATOM 494 C5 DC Y 16 34.868 39.757 18.489 1.00 0.00 C ATOM 495 C6 DC Y 16 35.040 39.825 19.794 1.00 0.00 C ATOM 0 H5' DC Y 16 36.448 41.952 24.600 1.00 0.00 H new ATOM 0 H5'' DC Y 16 36.540 41.978 22.850 1.00 0.00 H new ATOM 0 H4' DC Y 16 35.397 39.804 24.592 1.00 0.00 H new ATOM 0 H3' DC Y 16 38.051 40.147 24.076 1.00 0.00 H new ATOM 0 H2' DC Y 16 37.653 40.182 21.584 1.00 0.00 H new ATOM 0 H2'' DC Y 16 38.228 38.554 21.881 1.00 0.00 H new ATOM 0 HO3' DC Y 16 38.494 38.009 24.251 1.00 0.00 H new ATOM 0 H1' DC Y 16 35.908 37.678 22.220 1.00 0.00 H new ATOM 0 H41 DC Y 16 34.452 39.225 16.118 1.00 0.00 H new ATOM 0 H42 DC Y 16 35.193 37.621 16.088 1.00 0.00 H new ATOM 0 H5 DC Y 16 34.484 40.601 17.935 1.00 0.00 H new ATOM 0 H6 DC Y 16 34.704 40.670 20.377 1.00 0.00 H new TER 508 DC Y 16 HETATM 509 C1 4JF Y 101 27.461 26.828 22.991 1.00 0.00 C HETATM 510 C2 4JF Y 101 27.226 26.761 24.325 1.00 0.00 C HETATM 511 C3 4JF Y 101 26.395 27.663 24.980 1.00 0.00 C HETATM 512 C4 4JF Y 101 25.809 28.701 24.266 1.00 0.00 C HETATM 513 C5 4JF Y 101 25.878 28.657 22.883 1.00 0.00 C HETATM 514 C6 4JF Y 101 26.742 27.776 22.184 1.00 0.00 C HETATM 515 C9 4JF Y 101 25.069 29.785 24.873 1.00 0.00 C HETATM 516 C10 4JF Y 101 26.356 27.666 26.493 1.00 0.00 C HETATM 517 C11 4JF Y 101 24.970 29.782 26.257 1.00 0.00 C HETATM 518 C12 4JF Y 101 25.596 28.811 27.029 1.00 0.00 C HETATM 519 O13 4JF Y 101 24.552 30.689 24.238 1.00 0.00 O HETATM 520 O14 4JF Y 101 26.843 26.713 27.098 1.00 0.00 O HETATM 521 O15 4JF Y 101 25.092 29.440 22.100 1.00 0.00 O HETATM 522 O17 4JF Y 101 27.905 25.765 24.952 1.00 0.00 O HETATM 523 C19 4JF Y 101 24.357 30.743 27.131 1.00 0.00 C HETATM 524 C20 4JF Y 101 24.628 30.307 28.369 1.00 0.00 C HETATM 525 C21 4JF Y 101 25.417 29.127 28.328 1.00 0.00 C HETATM 526 C22 4JF Y 101 23.629 32.009 26.902 1.00 0.00 C HETATM 527 N23 4JF Y 101 25.875 28.444 29.344 1.00 0.00 N HETATM 528 N24 4JF Y 101 26.333 27.823 30.186 1.00 0.00 N HETATM 529 O25 4JF Y 101 25.573 31.472 30.055 1.00 0.00 O HETATM 530 C26 4JF Y 101 23.617 33.052 28.057 1.00 0.00 C HETATM 531 C28 4JF Y 101 23.325 32.251 29.384 1.00 0.00 C HETATM 532 C29 4JF Y 101 24.298 31.016 29.638 1.00 0.00 C HETATM 533 C31 4JF Y 101 21.832 31.804 29.172 1.00 0.00 C HETATM 534 C34 4JF Y 101 21.351 30.606 30.027 1.00 0.00 C HETATM 535 O38 4JF Y 101 23.032 32.116 25.856 1.00 0.00 O HETATM 536 C39 4JF Y 101 24.935 33.955 27.899 1.00 0.00 C HETATM 537 C41 4JF Y 101 26.078 33.263 27.169 1.00 0.00 C HETATM 538 C42 4JF Y 101 24.788 35.389 27.271 1.00 0.00 C HETATM 539 O43 4JF Y 101 26.954 32.742 27.845 1.00 0.00 O HETATM 540 C44 4JF Y 101 26.217 33.376 25.836 1.00 0.00 C HETATM 541 C45 4JF Y 101 25.462 34.303 25.068 1.00 0.00 C HETATM 542 C46 4JF Y 101 24.495 35.323 25.729 1.00 0.00 C HETATM 543 C48 4JF Y 101 26.050 36.256 27.563 1.00 0.00 C HETATM 544 C51 4JF Y 101 26.505 37.384 26.626 1.00 0.00 C HETATM 545 O55 4JF Y 101 23.147 34.783 25.376 1.00 0.00 O HETATM 546 C56 4JF Y 101 25.683 34.184 23.783 1.00 0.00 C HETATM 547 C57 4JF Y 101 26.609 33.151 23.627 1.00 0.00 C HETATM 548 C58 4JF Y 101 27.034 32.674 24.845 1.00 0.00 C HETATM 549 C59 4JF Y 101 27.228 32.717 22.320 1.00 0.00 C HETATM 550 C60 4JF Y 101 27.988 31.645 24.960 1.00 0.00 C HETATM 551 O61 4JF Y 101 26.842 33.095 21.226 1.00 0.00 O HETATM 552 O62 4JF Y 101 28.257 31.135 26.060 1.00 0.00 O HETATM 553 C63 4JF Y 101 29.602 29.906 21.344 1.00 0.00 C HETATM 554 C64 4JF Y 101 29.738 29.236 22.555 1.00 0.00 C HETATM 555 C65 4JF Y 101 29.313 29.842 23.711 1.00 0.00 C HETATM 556 C66 4JF Y 101 28.522 31.030 23.660 1.00 0.00 C HETATM 557 C67 4JF Y 101 28.214 31.571 22.407 1.00 0.00 C HETATM 558 C68 4JF Y 101 28.779 31.066 21.258 1.00 0.00 C HETATM 559 O71 4JF Y 101 29.668 29.265 24.869 1.00 0.00 O HETATM 560 O73 4JF Y 101 28.536 31.584 19.992 1.00 0.00 O HETATM 561 N75 4JF Y 101 25.254 35.028 22.820 1.00 0.00 N HETATM 562 N76 4JF Y 101 24.983 35.765 21.998 1.00 0.00 N HETATM 563 C77 4JF Y 101 25.912 30.416 33.509 1.00 0.00 C HETATM 564 C78 4JF Y 101 26.032 31.481 31.425 1.00 0.00 C HETATM 565 C79 4JF Y 101 27.496 31.402 31.280 1.00 0.00 C HETATM 566 C80 4JF Y 101 28.112 31.296 32.642 1.00 0.00 C HETATM 567 C81 4JF Y 101 27.482 30.141 33.476 1.00 0.00 C HETATM 568 O88 4JF Y 101 25.367 30.395 32.189 1.00 0.00 O HETATM 569 C89 4JF Y 101 25.200 29.392 34.391 1.00 0.00 C HETATM 570 N93 4JF Y 101 28.003 29.968 34.893 1.00 0.00 N HETATM 571 O94 4JF Y 101 29.512 31.230 32.336 1.00 0.00 O HETATM 572 C96 4JF Y 101 27.970 31.263 35.694 1.00 0.00 C HETATM 573 C0A 4JF Y 101 29.333 29.261 34.864 1.00 0.00 C HETATM 574 C4A 4JF Y 101 22.274 35.736 24.864 1.00 0.00 C HETATM 575 C5A 4JF Y 101 21.079 34.864 24.293 1.00 0.00 C HETATM 576 C6A 4JF Y 101 20.012 35.718 23.538 1.00 0.00 C HETATM 577 C7A 4JF Y 101 20.719 36.624 22.495 1.00 0.00 C HETATM 578 C8A 4JF Y 101 21.860 37.462 23.163 1.00 0.00 C HETATM 579 O5B 4JF Y 101 22.835 36.592 23.824 1.00 0.00 O HETATM 580 O6B 4JF Y 101 19.228 34.703 22.849 1.00 0.00 O HETATM 581 N8B 4JF Y 101 19.684 37.496 21.777 1.00 0.00 N HETATM 582 C9B 4JF Y 101 19.272 38.705 22.563 1.00 0.00 C HETATM 583 C3C 4JF Y 101 20.172 37.877 20.426 1.00 0.00 C HETATM 584 C7C 4JF Y 101 22.722 38.299 22.212 1.00 0.00 C HETATM 585 O1D 4JF Y 101 23.575 35.963 27.979 1.00 0.00 O HETATM 586 O2D 4JF Y 101 23.438 33.309 30.385 1.00 0.00 O HETATM 587 C3D 4JF Y 101 23.066 32.857 31.748 1.00 0.00 C HETATM 588 C4D 4JF Y 101 23.638 33.857 32.748 1.00 0.00 C HETATM 589 C6D 4JF Y 101 22.937 35.152 32.696 1.00 0.00 C HETATM 590 C9D 4JF Y 101 20.923 33.992 31.680 1.00 0.00 C HETATM 591 C0E 4JF Y 101 21.435 34.985 32.795 1.00 0.00 C HETATM 592 O4E 4JF Y 101 21.613 32.728 31.878 1.00 0.00 O HETATM 593 C5E 4JF Y 101 19.375 33.759 31.704 1.00 0.00 C HETATM 594 O9E 4JF Y 101 20.779 36.303 32.713 1.00 0.00 O HETATM 595 O1F 4JF Y 101 23.398 35.929 33.840 1.00 0.00 O HETATM 596 C2F 4JF Y 101 24.766 36.513 33.827 1.00 0.00 C HETATM 597 C6F 4JF Y 101 23.116 37.215 27.546 1.00 0.00 C HETATM 598 C7F 4JF Y 101 21.631 37.508 27.895 1.00 0.00 C HETATM 599 C9F 4JF Y 101 21.407 37.498 29.396 1.00 0.00 C HETATM 600 C2G 4JF Y 101 23.828 38.132 29.743 1.00 0.00 C HETATM 601 C3G 4JF Y 101 22.367 38.429 30.130 1.00 0.00 C HETATM 602 O7G 4JF Y 101 23.910 38.240 28.274 1.00 0.00 O HETATM 603 O8G 4JF Y 101 22.180 38.374 31.563 1.00 0.00 O HETATM 604 O0H 4JF Y 101 19.988 37.814 29.745 1.00 0.00 O HETATM 605 C1H 4JF Y 101 19.024 36.757 29.535 1.00 0.00 C HETATM 606 C5H 4JF Y 101 24.787 39.250 30.251 1.00 0.00 C