USER MOD reduce.3.24.130724 H: found=0, std=0, add=253, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 253 hydrogens (14 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 : A 1 DC O5' : rot -31:sc= 0.00923 USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.3 (180deg=-1.3) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.642 (180deg=-1.06) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : B 12 DG O5' : rot 37:sc= 0.0169 USER MOD Single : B 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 19 DT C7 :methyl 150:sc= -0.225 (180deg=-0.225) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 7.748 -16.108 0.033 1.00 0.00 O ATOM 2 C5' DC A 1 7.863 -14.860 -0.616 1.00 0.00 C ATOM 3 C4' DC A 1 7.051 -14.862 -1.918 1.00 0.00 C ATOM 4 O4' DC A 1 5.694 -15.059 -1.551 1.00 0.00 O ATOM 5 C3' DC A 1 7.148 -13.500 -2.614 1.00 0.00 C ATOM 6 O3' DC A 1 7.162 -13.707 -4.017 1.00 0.00 O ATOM 7 C2' DC A 1 5.869 -12.815 -2.143 1.00 0.00 C ATOM 8 C1' DC A 1 4.916 -14.007 -2.093 1.00 0.00 C ATOM 9 N1 DC A 1 3.754 -13.781 -1.188 1.00 0.00 N ATOM 10 C2 DC A 1 2.464 -13.779 -1.725 1.00 0.00 C ATOM 11 O2 DC A 1 2.273 -13.908 -2.932 1.00 0.00 O ATOM 12 N3 DC A 1 1.405 -13.630 -0.879 1.00 0.00 N ATOM 13 C4 DC A 1 1.587 -13.455 0.438 1.00 0.00 C ATOM 14 N4 DC A 1 0.515 -13.310 1.222 1.00 0.00 N ATOM 15 C5 DC A 1 2.902 -13.443 1.013 1.00 0.00 C ATOM 16 C6 DC A 1 3.944 -13.613 0.164 1.00 0.00 C ATOM 0 H5' DC A 1 8.910 -14.650 -0.833 1.00 0.00 H new ATOM 0 H5'' DC A 1 7.508 -14.066 0.041 1.00 0.00 H new ATOM 0 H4' DC A 1 7.425 -15.635 -2.590 1.00 0.00 H new ATOM 0 H3' DC A 1 8.039 -12.915 -2.388 1.00 0.00 H new ATOM 0 H2' DC A 1 5.988 -12.339 -1.170 1.00 0.00 H new ATOM 0 H2'' DC A 1 5.532 -12.044 -2.836 1.00 0.00 H new ATOM 0 HO5' DC A 1 6.873 -16.501 -0.166 1.00 0.00 H new ATOM 0 H1' DC A 1 4.508 -14.203 -3.085 1.00 0.00 H new ATOM 0 H41 DC A 1 0.632 -13.176 2.226 1.00 0.00 H new ATOM 0 H42 DC A 1 -0.420 -13.333 0.816 1.00 0.00 H new ATOM 0 H5 DC A 1 3.054 -13.305 2.073 1.00 0.00 H new ATOM 0 H6 DC A 1 4.949 -13.617 0.559 1.00 0.00 H new ATOM 29 P DG A 2 7.371 -12.495 -5.065 1.00 0.00 P ATOM 30 OP1 DG A 2 8.044 -13.041 -6.265 1.00 0.00 O ATOM 31 OP2 DG A 2 7.975 -11.353 -4.344 1.00 0.00 O ATOM 32 O5' DG A 2 5.864 -12.085 -5.471 1.00 0.00 O ATOM 33 C5' DG A 2 5.107 -12.854 -6.388 1.00 0.00 C ATOM 34 C4' DG A 2 3.780 -12.160 -6.719 1.00 0.00 C ATOM 35 O4' DG A 2 2.953 -12.201 -5.567 1.00 0.00 O ATOM 36 C3' DG A 2 3.976 -10.683 -7.100 1.00 0.00 C ATOM 37 O3' DG A 2 3.142 -10.440 -8.221 1.00 0.00 O ATOM 38 C2' DG A 2 3.494 -9.989 -5.827 1.00 0.00 C ATOM 39 C1' DG A 2 2.394 -10.915 -5.405 1.00 0.00 C ATOM 40 N9 DG A 2 1.905 -10.769 -4.020 1.00 0.00 N ATOM 41 C8 DG A 2 2.606 -10.477 -2.882 1.00 0.00 C ATOM 42 N7 DG A 2 1.897 -10.530 -1.789 1.00 0.00 N ATOM 43 C5 DG A 2 0.618 -10.850 -2.239 1.00 0.00 C ATOM 44 C6 DG A 2 -0.601 -11.025 -1.514 1.00 0.00 C ATOM 45 O6 DG A 2 -0.763 -11.029 -0.298 1.00 0.00 O ATOM 46 N1 DG A 2 -1.699 -11.209 -2.352 1.00 0.00 N ATOM 47 C2 DG A 2 -1.624 -11.264 -3.732 1.00 0.00 C ATOM 48 N2 DG A 2 -2.765 -11.442 -4.403 1.00 0.00 N ATOM 49 N3 DG A 2 -0.473 -11.155 -4.412 1.00 0.00 N ATOM 50 C4 DG A 2 0.606 -10.946 -3.610 1.00 0.00 C ATOM 0 H5' DG A 2 4.911 -13.840 -5.967 1.00 0.00 H new ATOM 0 H5'' DG A 2 5.681 -13.006 -7.302 1.00 0.00 H new ATOM 0 H4' DG A 2 3.335 -12.681 -7.567 1.00 0.00 H new ATOM 0 H3' DG A 2 4.977 -10.358 -7.382 1.00 0.00 H new ATOM 0 H2' DG A 2 4.280 -9.911 -5.076 1.00 0.00 H new ATOM 0 H2'' DG A 2 3.133 -8.978 -6.018 1.00 0.00 H new ATOM 0 H1' DG A 2 1.510 -10.700 -6.005 1.00 0.00 H new ATOM 0 H8 DG A 2 3.656 -10.224 -2.888 1.00 0.00 H new ATOM 0 H1 DG A 2 -2.617 -11.310 -1.920 1.00 0.00 H new ATOM 0 H21 DG A 2 -2.756 -11.488 -5.422 1.00 0.00 H new ATOM 0 H22 DG A 2 -3.646 -11.531 -3.896 1.00 0.00 H new ATOM 62 P DC A 3 2.967 -8.992 -8.918 1.00 0.00 P ATOM 63 OP1 DC A 3 3.181 -9.152 -10.374 1.00 0.00 O ATOM 64 OP2 DC A 3 3.748 -7.986 -8.166 1.00 0.00 O ATOM 65 O5' DC A 3 1.398 -8.714 -8.663 1.00 0.00 O ATOM 66 C5' DC A 3 0.411 -9.544 -9.249 1.00 0.00 C ATOM 67 C4' DC A 3 -1.006 -9.065 -8.918 1.00 0.00 C ATOM 68 O4' DC A 3 -1.182 -9.163 -7.514 1.00 0.00 O ATOM 69 C3' DC A 3 -1.228 -7.605 -9.322 1.00 0.00 C ATOM 70 O3' DC A 3 -2.519 -7.522 -9.908 1.00 0.00 O ATOM 71 C2' DC A 3 -1.134 -6.877 -7.983 1.00 0.00 C ATOM 72 C1' DC A 3 -1.675 -7.932 -7.017 1.00 0.00 C ATOM 73 N1 DC A 3 -1.160 -7.835 -5.622 1.00 0.00 N ATOM 74 C2 DC A 3 -2.034 -8.076 -4.557 1.00 0.00 C ATOM 75 O2 DC A 3 -3.224 -8.314 -4.746 1.00 0.00 O ATOM 76 N3 DC A 3 -1.543 -8.042 -3.285 1.00 0.00 N ATOM 77 C4 DC A 3 -0.247 -7.794 -3.050 1.00 0.00 C ATOM 78 N4 DC A 3 0.184 -7.758 -1.785 1.00 0.00 N ATOM 79 C5 DC A 3 0.683 -7.617 -4.127 1.00 0.00 C ATOM 80 C6 DC A 3 0.181 -7.648 -5.383 1.00 0.00 C ATOM 0 H5' DC A 3 0.540 -10.567 -8.896 1.00 0.00 H new ATOM 0 H5'' DC A 3 0.546 -9.561 -10.331 1.00 0.00 H new ATOM 0 H4' DC A 3 -1.715 -9.683 -9.469 1.00 0.00 H new ATOM 0 H3' DC A 3 -0.529 -7.188 -10.047 1.00 0.00 H new ATOM 0 H2' DC A 3 -0.110 -6.590 -7.744 1.00 0.00 H new ATOM 0 H2'' DC A 3 -1.732 -5.965 -7.970 1.00 0.00 H new ATOM 0 H1' DC A 3 -2.758 -7.814 -6.969 1.00 0.00 H new ATOM 0 H41 DC A 3 1.167 -7.571 -1.586 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.470 -7.918 -1.019 1.00 0.00 H new ATOM 0 H5 DC A 3 1.737 -7.466 -3.944 1.00 0.00 H new ATOM 0 H6 DC A 3 0.852 -7.523 -6.220 1.00 0.00 H new ATOM 92 P DA A 4 -3.160 -6.134 -10.430 1.00 0.00 P ATOM 93 OP1 DA A 4 -4.116 -6.447 -11.515 1.00 0.00 O ATOM 94 OP2 DA A 4 -2.066 -5.166 -10.669 1.00 0.00 O ATOM 95 O5' DA A 4 -3.997 -5.646 -9.141 1.00 0.00 O ATOM 96 C5' DA A 4 -5.197 -6.291 -8.761 1.00 0.00 C ATOM 97 C4' DA A 4 -5.750 -5.674 -7.476 1.00 0.00 C ATOM 98 O4' DA A 4 -4.978 -6.039 -6.356 1.00 0.00 O ATOM 99 C3' DA A 4 -5.940 -4.157 -7.518 1.00 0.00 C ATOM 100 O3' DA A 4 -7.313 -3.816 -7.353 1.00 0.00 O ATOM 101 C2' DA A 4 -5.103 -3.832 -6.323 1.00 0.00 C ATOM 102 C1' DA A 4 -5.213 -5.022 -5.413 1.00 0.00 C ATOM 103 N9 DA A 4 -4.105 -5.069 -4.464 1.00 0.00 N ATOM 104 C8 DA A 4 -2.799 -4.976 -4.802 1.00 0.00 C ATOM 105 N7 DA A 4 -1.971 -5.012 -3.796 1.00 0.00 N ATOM 106 C5 DA A 4 -2.822 -5.163 -2.702 1.00 0.00 C ATOM 107 C6 DA A 4 -2.593 -5.288 -1.318 1.00 0.00 C ATOM 108 N6 DA A 4 -1.368 -5.308 -0.786 1.00 0.00 N ATOM 109 N1 DA A 4 -3.658 -5.402 -0.502 1.00 0.00 N ATOM 110 C2 DA A 4 -4.883 -5.410 -1.023 1.00 0.00 C ATOM 111 N3 DA A 4 -5.231 -5.317 -2.303 1.00 0.00 N ATOM 112 C4 DA A 4 -4.136 -5.196 -3.101 1.00 0.00 C ATOM 0 H5' DA A 4 -5.014 -7.355 -8.611 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.933 -6.204 -9.560 1.00 0.00 H new ATOM 0 H4' DA A 4 -6.752 -6.094 -7.383 1.00 0.00 H new ATOM 0 H3' DA A 4 -5.668 -3.636 -8.436 1.00 0.00 H new ATOM 0 H2' DA A 4 -4.067 -3.652 -6.608 1.00 0.00 H new ATOM 0 H2'' DA A 4 -5.459 -2.928 -5.830 1.00 0.00 H new ATOM 0 H1' DA A 4 -6.136 -5.056 -4.835 1.00 0.00 H new ATOM 0 H8 DA A 4 -2.468 -4.879 -5.825 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.252 -5.400 0.223 1.00 0.00 H new ATOM 0 H62 DA A 4 -0.549 -5.231 -1.389 1.00 0.00 H new ATOM 0 H2 DA A 4 -5.696 -5.504 -0.318 1.00 0.00 H new ATOM 124 P DT A 5 -7.829 -2.288 -7.156 1.00 0.00 P ATOM 125 OP1 DT A 5 -9.215 -2.207 -7.668 1.00 0.00 O ATOM 126 OP2 DT A 5 -6.797 -1.374 -7.693 1.00 0.00 O ATOM 127 O5' DT A 5 -7.876 -2.097 -5.546 1.00 0.00 O ATOM 128 C5' DT A 5 -8.852 -2.759 -4.762 1.00 0.00 C ATOM 129 C4' DT A 5 -8.709 -2.464 -3.262 1.00 0.00 C ATOM 130 O4' DT A 5 -7.481 -2.946 -2.785 1.00 0.00 O ATOM 131 C3' DT A 5 -8.850 -0.991 -2.854 1.00 0.00 C ATOM 132 O3' DT A 5 -9.967 -0.894 -1.981 1.00 0.00 O ATOM 133 C2' DT A 5 -7.533 -0.704 -2.143 1.00 0.00 C ATOM 134 C1' DT A 5 -7.071 -2.096 -1.734 1.00 0.00 C ATOM 135 N1 DT A 5 -5.599 -2.142 -1.779 1.00 0.00 N ATOM 136 C2 DT A 5 -4.887 -2.272 -0.598 1.00 0.00 C ATOM 137 O2 DT A 5 -5.415 -2.549 0.475 1.00 0.00 O ATOM 138 N3 DT A 5 -3.522 -2.063 -0.698 1.00 0.00 N ATOM 139 C4 DT A 5 -2.800 -1.931 -1.875 1.00 0.00 C ATOM 140 O4 DT A 5 -1.572 -1.899 -1.832 1.00 0.00 O ATOM 141 C5 DT A 5 -3.623 -1.842 -3.075 1.00 0.00 C ATOM 142 C7 DT A 5 -2.949 -1.652 -4.421 1.00 0.00 C ATOM 143 C6 DT A 5 -4.979 -1.929 -2.982 1.00 0.00 C ATOM 0 H5' DT A 5 -8.775 -3.834 -4.925 1.00 0.00 H new ATOM 0 H5'' DT A 5 -9.845 -2.456 -5.094 1.00 0.00 H new ATOM 0 H4' DT A 5 -9.553 -2.983 -2.808 1.00 0.00 H new ATOM 0 H3' DT A 5 -9.020 -0.288 -3.669 1.00 0.00 H new ATOM 0 H2' DT A 5 -6.815 -0.215 -2.801 1.00 0.00 H new ATOM 0 H2'' DT A 5 -7.671 -0.052 -1.280 1.00 0.00 H new ATOM 0 H1' DT A 5 -7.454 -2.362 -0.749 1.00 0.00 H new ATOM 0 H3 DT A 5 -2.999 -2.000 0.175 1.00 0.00 H new ATOM 0 H71 DT A 5 -3.554 -2.116 -5.200 1.00 0.00 H new ATOM 0 H72 DT A 5 -2.845 -0.587 -4.629 1.00 0.00 H new ATOM 0 H73 DT A 5 -1.963 -2.116 -4.403 1.00 0.00 H new ATOM 0 H6 DT A 5 -5.578 -1.828 -3.875 1.00 0.00 H new ATOM 156 P DA A 6 -10.422 0.481 -1.258 1.00 0.00 P ATOM 157 OP1 DA A 6 -11.813 0.307 -0.786 1.00 0.00 O ATOM 158 OP2 DA A 6 -10.089 1.608 -2.157 1.00 0.00 O ATOM 159 O5' DA A 6 -9.462 0.577 0.043 1.00 0.00 O ATOM 160 C5' DA A 6 -9.517 -0.372 1.093 1.00 0.00 C ATOM 161 C4' DA A 6 -8.508 -0.037 2.205 1.00 0.00 C ATOM 162 O4' DA A 6 -7.227 -0.510 1.826 1.00 0.00 O ATOM 163 C3' DA A 6 -8.379 1.466 2.524 1.00 0.00 C ATOM 164 O3' DA A 6 -9.039 1.766 3.745 1.00 0.00 O ATOM 165 C2' DA A 6 -6.879 1.569 2.598 1.00 0.00 C ATOM 166 C1' DA A 6 -6.285 0.204 2.601 1.00 0.00 C ATOM 167 N9 DA A 6 -5.010 0.302 1.856 1.00 0.00 N ATOM 168 C8 DA A 6 -4.892 0.531 0.523 1.00 0.00 C ATOM 169 N7 DA A 6 -3.690 0.683 0.063 1.00 0.00 N ATOM 170 C5 DA A 6 -2.933 0.537 1.208 1.00 0.00 C ATOM 171 C6 DA A 6 -1.548 0.462 1.409 1.00 0.00 C ATOM 172 N6 DA A 6 -0.686 0.424 0.389 1.00 0.00 N ATOM 173 N1 DA A 6 -1.103 0.346 2.671 1.00 0.00 N ATOM 174 C2 DA A 6 -1.990 0.304 3.662 1.00 0.00 C ATOM 175 N3 DA A 6 -3.316 0.329 3.608 1.00 0.00 N ATOM 176 C4 DA A 6 -3.731 0.429 2.324 1.00 0.00 C ATOM 0 H5' DA A 6 -9.309 -1.366 0.698 1.00 0.00 H new ATOM 0 H5'' DA A 6 -10.524 -0.399 1.509 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.889 -0.523 3.104 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.829 2.164 1.819 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.501 2.139 1.749 1.00 0.00 H new ATOM 0 H2'' DA A 6 -6.585 2.107 3.500 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.096 -0.239 3.579 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.757 0.584 -0.122 1.00 0.00 H new ATOM 0 H61 DA A 6 0.316 0.369 0.570 1.00 0.00 H new ATOM 0 H62 DA A 6 -1.030 0.450 -0.571 1.00 0.00 H new ATOM 0 H2 DA A 6 -1.570 0.240 4.655 1.00 0.00 H new ATOM 188 P DT A 7 -9.030 3.241 4.414 1.00 0.00 P ATOM 189 OP1 DT A 7 -10.034 3.253 5.501 1.00 0.00 O ATOM 190 OP2 DT A 7 -9.110 4.247 3.331 1.00 0.00 O ATOM 191 O5' DT A 7 -7.567 3.351 5.089 1.00 0.00 O ATOM 192 C5' DT A 7 -7.118 2.400 6.038 1.00 0.00 C ATOM 193 C4' DT A 7 -5.666 2.671 6.447 1.00 0.00 C ATOM 194 O4' DT A 7 -4.838 2.443 5.316 1.00 0.00 O ATOM 195 C3' DT A 7 -5.466 4.126 6.889 1.00 0.00 C ATOM 196 O3' DT A 7 -4.888 4.141 8.184 1.00 0.00 O ATOM 197 C2' DT A 7 -4.525 4.662 5.813 1.00 0.00 C ATOM 198 C1' DT A 7 -3.807 3.409 5.321 1.00 0.00 C ATOM 199 N1 DT A 7 -3.278 3.571 3.949 1.00 0.00 N ATOM 200 C2 DT A 7 -1.908 3.432 3.719 1.00 0.00 C ATOM 201 O2 DT A 7 -1.079 3.277 4.612 1.00 0.00 O ATOM 202 N3 DT A 7 -1.507 3.477 2.394 1.00 0.00 N ATOM 203 C4 DT A 7 -2.332 3.686 1.300 1.00 0.00 C ATOM 204 O4 DT A 7 -1.847 3.690 0.170 1.00 0.00 O ATOM 205 C5 DT A 7 -3.735 3.882 1.638 1.00 0.00 C ATOM 206 C7 DT A 7 -4.761 4.126 0.555 1.00 0.00 C ATOM 207 C6 DT A 7 -4.149 3.819 2.927 1.00 0.00 C ATOM 0 H5' DT A 7 -7.200 1.397 5.619 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.759 2.431 6.919 1.00 0.00 H new ATOM 0 H4' DT A 7 -5.415 2.014 7.280 1.00 0.00 H new ATOM 0 H3' DT A 7 -6.374 4.723 6.970 1.00 0.00 H new ATOM 0 H2' DT A 7 -5.072 5.154 5.009 1.00 0.00 H new ATOM 0 H2'' DT A 7 -3.826 5.394 6.218 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.947 3.157 5.942 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.513 3.344 2.206 1.00 0.00 H new ATOM 0 H71 DT A 7 -4.289 4.637 -0.285 1.00 0.00 H new ATOM 0 H72 DT A 7 -5.168 3.173 0.218 1.00 0.00 H new ATOM 0 H73 DT A 7 -5.567 4.745 0.950 1.00 0.00 H new ATOM 0 H6 DT A 7 -5.195 3.969 3.152 1.00 0.00 H new ATOM 220 P DA A 8 -4.634 5.513 9.004 1.00 0.00 P ATOM 221 OP1 DA A 8 -4.640 5.193 10.449 1.00 0.00 O ATOM 222 OP2 DA A 8 -5.544 6.555 8.480 1.00 0.00 O ATOM 223 O5' DA A 8 -3.129 5.903 8.580 1.00 0.00 O ATOM 224 C5' DA A 8 -2.020 5.188 9.087 1.00 0.00 C ATOM 225 C4' DA A 8 -0.716 5.710 8.480 1.00 0.00 C ATOM 226 O4' DA A 8 -0.652 5.363 7.108 1.00 0.00 O ATOM 227 C3' DA A 8 -0.557 7.236 8.581 1.00 0.00 C ATOM 228 O3' DA A 8 0.645 7.528 9.276 1.00 0.00 O ATOM 229 C2' DA A 8 -0.529 7.609 7.125 1.00 0.00 C ATOM 230 C1' DA A 8 0.077 6.400 6.491 1.00 0.00 C ATOM 231 N9 DA A 8 -0.154 6.384 5.040 1.00 0.00 N ATOM 232 C8 DA A 8 -1.333 6.597 4.391 1.00 0.00 C ATOM 233 N7 DA A 8 -1.269 6.485 3.094 1.00 0.00 N ATOM 234 C5 DA A 8 0.076 6.201 2.869 1.00 0.00 C ATOM 235 C6 DA A 8 0.824 5.936 1.704 1.00 0.00 C ATOM 236 N6 DA A 8 0.275 5.821 0.488 1.00 0.00 N ATOM 237 N1 DA A 8 2.154 5.774 1.831 1.00 0.00 N ATOM 238 C2 DA A 8 2.711 5.831 3.039 1.00 0.00 C ATOM 239 N3 DA A 8 2.114 6.017 4.210 1.00 0.00 N ATOM 240 C4 DA A 8 0.775 6.194 4.052 1.00 0.00 C ATOM 0 H5' DA A 8 -2.132 4.127 8.863 1.00 0.00 H new ATOM 0 H5'' DA A 8 -1.985 5.283 10.172 1.00 0.00 H new ATOM 0 H4' DA A 8 0.085 5.247 9.056 1.00 0.00 H new ATOM 0 H3' DA A 8 -1.326 7.779 9.130 1.00 0.00 H new ATOM 0 H2' DA A 8 -1.528 7.811 6.739 1.00 0.00 H new ATOM 0 H2'' DA A 8 0.069 8.503 6.947 1.00 0.00 H new ATOM 0 H1' DA A 8 1.158 6.337 6.616 1.00 0.00 H new ATOM 0 H8 DA A 8 -2.248 6.840 4.910 1.00 0.00 H new ATOM 0 H61 DA A 8 0.865 5.628 -0.322 1.00 0.00 H new ATOM 0 H62 DA A 8 -0.733 5.926 0.372 1.00 0.00 H new ATOM 0 H2 DA A 8 3.784 5.711 3.070 1.00 0.00 H new ATOM 252 P DG A 9 1.127 9.038 9.604 1.00 0.00 P ATOM 253 OP1 DG A 9 1.539 9.092 11.024 1.00 0.00 O ATOM 254 OP2 DG A 9 0.116 9.991 9.096 1.00 0.00 O ATOM 255 O5' DG A 9 2.446 9.180 8.687 1.00 0.00 O ATOM 256 C5' DG A 9 3.592 8.387 8.929 1.00 0.00 C ATOM 257 C4' DG A 9 4.806 8.856 8.117 1.00 0.00 C ATOM 258 O4' DG A 9 4.558 8.646 6.737 1.00 0.00 O ATOM 259 C3' DG A 9 5.106 10.343 8.304 1.00 0.00 C ATOM 260 O3' DG A 9 6.521 10.441 8.235 1.00 0.00 O ATOM 261 C2' DG A 9 4.352 10.973 7.135 1.00 0.00 C ATOM 262 C1' DG A 9 4.452 9.890 6.062 1.00 0.00 C ATOM 263 N9 DG A 9 3.301 9.732 5.145 1.00 0.00 N ATOM 264 C8 DG A 9 1.965 9.978 5.348 1.00 0.00 C ATOM 265 N7 DG A 9 1.222 9.768 4.294 1.00 0.00 N ATOM 266 C5 DG A 9 2.126 9.352 3.320 1.00 0.00 C ATOM 267 C6 DG A 9 1.925 9.043 1.938 1.00 0.00 C ATOM 268 O6 DG A 9 0.869 9.018 1.313 1.00 0.00 O ATOM 269 N1 DG A 9 3.116 8.741 1.278 1.00 0.00 N ATOM 270 C2 DG A 9 4.354 8.690 1.889 1.00 0.00 C ATOM 271 N2 DG A 9 5.407 8.403 1.118 1.00 0.00 N ATOM 272 N3 DG A 9 4.541 8.962 3.188 1.00 0.00 N ATOM 273 C4 DG A 9 3.394 9.294 3.844 1.00 0.00 C ATOM 0 H5' DG A 9 3.371 7.349 8.682 1.00 0.00 H new ATOM 0 H5'' DG A 9 3.834 8.417 9.991 1.00 0.00 H new ATOM 0 H4' DG A 9 5.660 8.280 8.474 1.00 0.00 H new ATOM 0 H3' DG A 9 4.803 10.829 9.231 1.00 0.00 H new ATOM 0 H2' DG A 9 3.317 11.197 7.392 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.809 11.908 6.813 1.00 0.00 H new ATOM 0 H1' DG A 9 5.299 10.193 5.446 1.00 0.00 H new ATOM 0 H8 DG A 9 1.565 10.314 6.293 1.00 0.00 H new ATOM 0 H1 DG A 9 3.070 8.545 0.278 1.00 0.00 H new ATOM 0 H21 DG A 9 6.340 8.355 1.527 1.00 0.00 H new ATOM 0 H22 DG A 9 5.277 8.232 0.121 1.00 0.00 H new ATOM 285 P DC A 10 7.347 11.821 8.083 1.00 0.00 P ATOM 286 OP1 DC A 10 8.611 11.684 8.840 1.00 0.00 O ATOM 287 OP2 DC A 10 6.448 12.965 8.353 1.00 0.00 O ATOM 288 O5' DC A 10 7.695 11.787 6.505 1.00 0.00 O ATOM 289 C5' DC A 10 8.463 10.725 5.960 1.00 0.00 C ATOM 290 C4' DC A 10 8.788 10.913 4.471 1.00 0.00 C ATOM 291 O4' DC A 10 7.589 10.611 3.792 1.00 0.00 O ATOM 292 C3' DC A 10 9.199 12.338 4.072 1.00 0.00 C ATOM 293 O3' DC A 10 10.602 12.470 3.897 1.00 0.00 O ATOM 294 C2' DC A 10 8.473 12.525 2.748 1.00 0.00 C ATOM 295 C1' DC A 10 7.524 11.358 2.598 1.00 0.00 C ATOM 296 N1 DC A 10 6.122 11.809 2.425 1.00 0.00 N ATOM 297 C2 DC A 10 5.577 11.813 1.142 1.00 0.00 C ATOM 298 O2 DC A 10 6.291 11.638 0.159 1.00 0.00 O ATOM 299 N3 DC A 10 4.233 12.015 1.003 1.00 0.00 N ATOM 300 C4 DC A 10 3.454 12.223 2.076 1.00 0.00 C ATOM 301 N4 DC A 10 2.136 12.366 1.903 1.00 0.00 N ATOM 302 C5 DC A 10 4.011 12.265 3.399 1.00 0.00 C ATOM 303 C6 DC A 10 5.339 12.074 3.519 1.00 0.00 C ATOM 0 H5' DC A 10 7.920 9.789 6.091 1.00 0.00 H new ATOM 0 H5'' DC A 10 9.394 10.635 6.520 1.00 0.00 H new ATOM 0 H4' DC A 10 9.640 10.279 4.226 1.00 0.00 H new ATOM 0 H3' DC A 10 8.947 13.077 4.833 1.00 0.00 H new ATOM 0 H2' DC A 10 7.929 13.469 2.736 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.181 12.555 1.920 1.00 0.00 H new ATOM 0 H1' DC A 10 7.811 10.780 1.720 1.00 0.00 H new ATOM 0 H41 DC A 10 1.530 12.525 2.708 1.00 0.00 H new ATOM 0 H42 DC A 10 1.736 12.316 0.966 1.00 0.00 H new ATOM 0 H5 DC A 10 3.389 12.443 4.264 1.00 0.00 H new ATOM 0 H6 DC A 10 5.796 12.131 4.496 1.00 0.00 H new ATOM 315 P DC A 11 11.294 13.883 3.486 1.00 0.00 P ATOM 316 OP1 DC A 11 12.759 13.725 3.623 1.00 0.00 O ATOM 317 OP2 DC A 11 10.606 14.964 4.226 1.00 0.00 O ATOM 318 O5' DC A 11 10.964 14.080 1.912 1.00 0.00 O ATOM 319 C5' DC A 11 11.612 13.312 0.913 1.00 0.00 C ATOM 320 C4' DC A 11 10.999 13.543 -0.477 1.00 0.00 C ATOM 321 O4' DC A 11 9.641 13.166 -0.486 1.00 0.00 O ATOM 322 C3' DC A 11 11.091 14.971 -1.008 1.00 0.00 C ATOM 323 O3' DC A 11 12.302 15.183 -1.703 1.00 0.00 O ATOM 324 C2' DC A 11 9.897 15.015 -1.963 1.00 0.00 C ATOM 325 C1' DC A 11 8.968 13.875 -1.516 1.00 0.00 C ATOM 326 N1 DC A 11 7.727 14.390 -0.880 1.00 0.00 N ATOM 327 C2 DC A 11 6.501 14.280 -1.540 1.00 0.00 C ATOM 328 O2 DC A 11 6.428 13.852 -2.691 1.00 0.00 O ATOM 329 N3 DC A 11 5.372 14.662 -0.873 1.00 0.00 N ATOM 330 C4 DC A 11 5.433 15.153 0.375 1.00 0.00 C ATOM 331 N4 DC A 11 4.296 15.471 1.001 1.00 0.00 N ATOM 332 C5 DC A 11 6.689 15.321 1.049 1.00 0.00 C ATOM 333 C6 DC A 11 7.796 14.925 0.379 1.00 0.00 C ATOM 0 H5' DC A 11 11.545 12.254 1.168 1.00 0.00 H new ATOM 0 H5'' DC A 11 12.671 13.567 0.889 1.00 0.00 H new ATOM 0 H4' DC A 11 11.604 12.922 -1.137 1.00 0.00 H new ATOM 0 H3' DC A 11 11.074 15.736 -0.231 1.00 0.00 H new ATOM 0 H2' DC A 11 9.389 15.978 -1.911 1.00 0.00 H new ATOM 0 H2'' DC A 11 10.216 14.878 -2.996 1.00 0.00 H new ATOM 0 HO3' DC A 11 12.333 16.105 -2.033 1.00 0.00 H new ATOM 0 H1' DC A 11 8.720 13.276 -2.393 1.00 0.00 H new ATOM 0 H41 DC A 11 4.323 15.845 1.949 1.00 0.00 H new ATOM 0 H42 DC A 11 3.401 15.339 0.530 1.00 0.00 H new ATOM 0 H5 DC A 11 6.748 15.743 2.042 1.00 0.00 H new ATOM 0 H6 DC A 11 8.762 15.034 0.850 1.00 0.00 H new TER 346 DC A 11 ATOM 347 O5' DG B 12 -4.883 15.103 -5.121 1.00 0.00 O ATOM 348 C5' DG B 12 -4.366 15.695 -6.294 1.00 0.00 C ATOM 349 C4' DG B 12 -2.997 15.101 -6.643 1.00 0.00 C ATOM 350 O4' DG B 12 -2.137 15.350 -5.546 1.00 0.00 O ATOM 351 C3' DG B 12 -3.054 13.580 -6.854 1.00 0.00 C ATOM 352 O3' DG B 12 -2.536 13.283 -8.140 1.00 0.00 O ATOM 353 C2' DG B 12 -2.172 13.050 -5.724 1.00 0.00 C ATOM 354 C1' DG B 12 -1.280 14.237 -5.412 1.00 0.00 C ATOM 355 N9 DG B 12 -0.780 14.223 -4.018 1.00 0.00 N ATOM 356 C8 DG B 12 -1.509 14.283 -2.856 1.00 0.00 C ATOM 357 N7 DG B 12 -0.788 14.339 -1.773 1.00 0.00 N ATOM 358 C5 DG B 12 0.519 14.308 -2.244 1.00 0.00 C ATOM 359 C6 DG B 12 1.749 14.346 -1.523 1.00 0.00 C ATOM 360 O6 DG B 12 1.911 14.422 -0.308 1.00 0.00 O ATOM 361 N1 DG B 12 2.858 14.285 -2.361 1.00 0.00 N ATOM 362 C2 DG B 12 2.793 14.177 -3.738 1.00 0.00 C ATOM 363 N2 DG B 12 3.955 14.077 -4.392 1.00 0.00 N ATOM 364 N3 DG B 12 1.635 14.144 -4.419 1.00 0.00 N ATOM 365 C4 DG B 12 0.537 14.215 -3.617 1.00 0.00 C ATOM 0 H5' DG B 12 -4.275 16.772 -6.154 1.00 0.00 H new ATOM 0 H5'' DG B 12 -5.058 15.538 -7.122 1.00 0.00 H new ATOM 0 H4' DG B 12 -2.651 15.558 -7.570 1.00 0.00 H new ATOM 0 H3' DG B 12 -4.050 13.139 -6.823 1.00 0.00 H new ATOM 0 H2' DG B 12 -2.761 12.748 -4.858 1.00 0.00 H new ATOM 0 H2'' DG B 12 -1.594 12.180 -6.036 1.00 0.00 H new ATOM 0 HO5' DG B 12 -4.153 14.938 -4.488 1.00 0.00 H new ATOM 0 H1' DG B 12 -0.407 14.240 -6.064 1.00 0.00 H new ATOM 0 H8 DG B 12 -2.589 14.284 -2.841 1.00 0.00 H new ATOM 0 H1 DG B 12 3.782 14.322 -1.930 1.00 0.00 H new ATOM 0 H21 DG B 12 3.963 13.995 -5.409 1.00 0.00 H new ATOM 0 H22 DG B 12 4.834 14.083 -3.874 1.00 0.00 H new ATOM 378 P DG B 13 -2.487 11.779 -8.734 1.00 0.00 P ATOM 379 OP1 DG B 13 -2.530 11.867 -10.211 1.00 0.00 O ATOM 380 OP2 DG B 13 -3.488 10.956 -8.018 1.00 0.00 O ATOM 381 O5' DG B 13 -1.019 11.269 -8.303 1.00 0.00 O ATOM 382 C5' DG B 13 0.147 11.860 -8.840 1.00 0.00 C ATOM 383 C4' DG B 13 1.419 11.200 -8.297 1.00 0.00 C ATOM 384 O4' DG B 13 1.486 11.434 -6.899 1.00 0.00 O ATOM 385 C3' DG B 13 1.435 9.683 -8.508 1.00 0.00 C ATOM 386 O3' DG B 13 2.794 9.358 -8.755 1.00 0.00 O ATOM 387 C2' DG B 13 0.936 9.169 -7.156 1.00 0.00 C ATOM 388 C1' DG B 13 1.553 10.191 -6.220 1.00 0.00 C ATOM 389 N9 DG B 13 0.944 10.399 -4.888 1.00 0.00 N ATOM 390 C8 DG B 13 -0.361 10.320 -4.471 1.00 0.00 C ATOM 391 N7 DG B 13 -0.532 10.593 -3.205 1.00 0.00 N ATOM 392 C5 DG B 13 0.752 10.860 -2.740 1.00 0.00 C ATOM 393 C6 DG B 13 1.223 11.175 -1.426 1.00 0.00 C ATOM 394 O6 DG B 13 0.566 11.358 -0.405 1.00 0.00 O ATOM 395 N1 DG B 13 2.612 11.273 -1.368 1.00 0.00 N ATOM 396 C2 DG B 13 3.449 11.148 -2.461 1.00 0.00 C ATOM 397 N2 DG B 13 4.758 11.302 -2.260 1.00 0.00 N ATOM 398 N3 DG B 13 3.006 10.895 -3.698 1.00 0.00 N ATOM 399 C4 DG B 13 1.656 10.752 -3.768 1.00 0.00 C ATOM 0 H5' DG B 13 0.159 12.924 -8.602 1.00 0.00 H new ATOM 0 H5'' DG B 13 0.130 11.777 -9.927 1.00 0.00 H new ATOM 0 H4' DG B 13 2.263 11.631 -8.836 1.00 0.00 H new ATOM 0 H3' DG B 13 0.838 9.274 -9.323 1.00 0.00 H new ATOM 0 H2' DG B 13 -0.152 9.156 -7.095 1.00 0.00 H new ATOM 0 H2'' DG B 13 1.279 8.156 -6.946 1.00 0.00 H new ATOM 0 H1' DG B 13 2.545 9.798 -5.996 1.00 0.00 H new ATOM 0 H8 DG B 13 -1.174 10.056 -5.131 1.00 0.00 H new ATOM 0 H1 DG B 13 3.039 11.449 -0.459 1.00 0.00 H new ATOM 0 H21 DG B 13 5.407 11.217 -3.042 1.00 0.00 H new ATOM 0 H22 DG B 13 5.110 11.505 -1.324 1.00 0.00 H new ATOM 411 P DC B 14 3.335 7.868 -9.064 1.00 0.00 P ATOM 412 OP1 DC B 14 4.025 7.887 -10.373 1.00 0.00 O ATOM 413 OP2 DC B 14 2.259 6.884 -8.811 1.00 0.00 O ATOM 414 O5' DC B 14 4.446 7.723 -7.902 1.00 0.00 O ATOM 415 C5' DC B 14 5.601 8.543 -7.898 1.00 0.00 C ATOM 416 C4' DC B 14 6.471 8.293 -6.662 1.00 0.00 C ATOM 417 O4' DC B 14 5.715 8.660 -5.519 1.00 0.00 O ATOM 418 C3' DC B 14 6.857 6.816 -6.518 1.00 0.00 C ATOM 419 O3' DC B 14 8.232 6.766 -6.176 1.00 0.00 O ATOM 420 C2' DC B 14 5.940 6.356 -5.386 1.00 0.00 C ATOM 421 C1' DC B 14 5.828 7.631 -4.552 1.00 0.00 C ATOM 422 N1 DC B 14 4.593 7.679 -3.717 1.00 0.00 N ATOM 423 C2 DC B 14 4.703 7.857 -2.333 1.00 0.00 C ATOM 424 O2 DC B 14 5.797 7.933 -1.780 1.00 0.00 O ATOM 425 N3 DC B 14 3.562 7.946 -1.587 1.00 0.00 N ATOM 426 C4 DC B 14 2.354 7.872 -2.164 1.00 0.00 C ATOM 427 N4 DC B 14 1.258 7.978 -1.408 1.00 0.00 N ATOM 428 C5 DC B 14 2.219 7.731 -3.583 1.00 0.00 C ATOM 429 C6 DC B 14 3.353 7.647 -4.313 1.00 0.00 C ATOM 0 H5' DC B 14 5.303 9.591 -7.927 1.00 0.00 H new ATOM 0 H5'' DC B 14 6.185 8.353 -8.798 1.00 0.00 H new ATOM 0 H4' DC B 14 7.386 8.877 -6.762 1.00 0.00 H new ATOM 0 H3' DC B 14 6.740 6.191 -7.403 1.00 0.00 H new ATOM 0 H2' DC B 14 4.971 6.019 -5.754 1.00 0.00 H new ATOM 0 H2'' DC B 14 6.370 5.531 -4.819 1.00 0.00 H new ATOM 0 H1' DC B 14 6.676 7.708 -3.872 1.00 0.00 H new ATOM 0 H41 DC B 14 0.335 7.923 -1.838 1.00 0.00 H new ATOM 0 H42 DC B 14 1.344 8.114 -0.401 1.00 0.00 H new ATOM 0 H5 DC B 14 1.247 7.693 -4.052 1.00 0.00 H new ATOM 0 H6 DC B 14 3.285 7.553 -5.387 1.00 0.00 H new ATOM 441 P DT B 15 9.036 5.378 -5.996 1.00 0.00 P ATOM 442 OP1 DT B 15 10.479 5.655 -6.175 1.00 0.00 O ATOM 443 OP2 DT B 15 8.379 4.340 -6.820 1.00 0.00 O ATOM 444 O5' DT B 15 8.776 5.031 -4.446 1.00 0.00 O ATOM 445 C5' DT B 15 9.357 5.801 -3.411 1.00 0.00 C ATOM 446 C4' DT B 15 8.917 5.284 -2.038 1.00 0.00 C ATOM 447 O4' DT B 15 7.547 5.566 -1.903 1.00 0.00 O ATOM 448 C3' DT B 15 9.060 3.766 -1.856 1.00 0.00 C ATOM 449 O3' DT B 15 10.207 3.528 -1.049 1.00 0.00 O ATOM 450 C2' DT B 15 7.743 3.349 -1.207 1.00 0.00 C ATOM 451 C1' DT B 15 7.037 4.670 -0.943 1.00 0.00 C ATOM 452 N1 DT B 15 5.592 4.584 -1.230 1.00 0.00 N ATOM 453 C2 DT B 15 4.694 5.015 -0.263 1.00 0.00 C ATOM 454 O2 DT B 15 5.035 5.377 0.859 1.00 0.00 O ATOM 455 N3 DT B 15 3.362 5.015 -0.636 1.00 0.00 N ATOM 456 C4 DT B 15 2.854 4.624 -1.863 1.00 0.00 C ATOM 457 O4 DT B 15 1.642 4.688 -2.060 1.00 0.00 O ATOM 458 C5 DT B 15 3.858 4.163 -2.809 1.00 0.00 C ATOM 459 C7 DT B 15 3.426 3.704 -4.187 1.00 0.00 C ATOM 460 C6 DT B 15 5.172 4.156 -2.465 1.00 0.00 C ATOM 0 H5' DT B 15 9.067 6.846 -3.522 1.00 0.00 H new ATOM 0 H5'' DT B 15 10.444 5.762 -3.488 1.00 0.00 H new ATOM 0 H4' DT B 15 9.558 5.770 -1.303 1.00 0.00 H new ATOM 0 H3' DT B 15 9.217 3.193 -2.770 1.00 0.00 H new ATOM 0 H2' DT B 15 7.158 2.707 -1.865 1.00 0.00 H new ATOM 0 H2'' DT B 15 7.910 2.793 -0.285 1.00 0.00 H new ATOM 0 H1' DT B 15 7.189 4.958 0.097 1.00 0.00 H new ATOM 0 H3 DT B 15 2.689 5.334 0.061 1.00 0.00 H new ATOM 0 H71 DT B 15 4.224 3.901 -4.903 1.00 0.00 H new ATOM 0 H72 DT B 15 3.215 2.635 -4.165 1.00 0.00 H new ATOM 0 H73 DT B 15 2.528 4.245 -4.486 1.00 0.00 H new ATOM 0 H6 DT B 15 5.903 3.806 -3.179 1.00 0.00 H new ATOM 473 P DA B 16 10.665 2.055 -0.563 1.00 0.00 P ATOM 474 OP1 DA B 16 12.066 2.142 -0.095 1.00 0.00 O ATOM 475 OP2 DA B 16 10.302 1.083 -1.618 1.00 0.00 O ATOM 476 O5' DA B 16 9.725 1.777 0.721 1.00 0.00 O ATOM 477 C5' DA B 16 9.879 2.482 1.942 1.00 0.00 C ATOM 478 C4' DA B 16 8.703 2.207 2.898 1.00 0.00 C ATOM 479 O4' DA B 16 7.511 2.676 2.313 1.00 0.00 O ATOM 480 C3' DA B 16 8.432 0.741 3.177 1.00 0.00 C ATOM 481 O3' DA B 16 8.989 0.296 4.405 1.00 0.00 O ATOM 482 C2' DA B 16 6.965 0.482 2.953 1.00 0.00 C ATOM 483 C1' DA B 16 6.489 1.895 2.892 1.00 0.00 C ATOM 484 N9 DA B 16 5.288 1.996 2.058 1.00 0.00 N ATOM 485 C8 DA B 16 5.259 1.684 0.739 1.00 0.00 C ATOM 486 N7 DA B 16 4.103 1.873 0.164 1.00 0.00 N ATOM 487 C5 DA B 16 3.287 2.279 1.221 1.00 0.00 C ATOM 488 C6 DA B 16 1.915 2.606 1.313 1.00 0.00 C ATOM 489 N6 DA B 16 1.117 2.728 0.245 1.00 0.00 N ATOM 490 N1 DA B 16 1.385 2.803 2.537 1.00 0.00 N ATOM 491 C2 DA B 16 2.178 2.729 3.606 1.00 0.00 C ATOM 492 N3 DA B 16 3.489 2.498 3.648 1.00 0.00 N ATOM 493 C4 DA B 16 3.990 2.278 2.403 1.00 0.00 C ATOM 0 H5' DA B 16 9.945 3.551 1.741 1.00 0.00 H new ATOM 0 H5'' DA B 16 10.814 2.189 2.419 1.00 0.00 H new ATOM 0 H4' DA B 16 8.988 2.703 3.826 1.00 0.00 H new ATOM 0 H3' DA B 16 8.966 0.104 2.472 1.00 0.00 H new ATOM 0 H2' DA B 16 6.770 -0.069 2.033 1.00 0.00 H new ATOM 0 H2'' DA B 16 6.508 -0.082 3.766 1.00 0.00 H new ATOM 0 H1' DA B 16 6.249 2.242 3.897 1.00 0.00 H new ATOM 0 H8 DA B 16 6.122 1.310 0.208 1.00 0.00 H new ATOM 0 H61 DA B 16 0.133 2.966 0.368 1.00 0.00 H new ATOM 0 H62 DA B 16 1.493 2.583 -0.692 1.00 0.00 H new ATOM 0 H2 DA B 16 1.695 2.875 4.561 1.00 0.00 H new HETATM 505 N1 T41 B 17 3.287 -0.942 4.156 1.00 0.00 N HETATM 506 C2 T41 B 17 1.983 -0.536 3.878 1.00 0.00 C HETATM 507 N3 T41 B 17 1.619 -0.522 2.540 1.00 0.00 N HETATM 508 C4 T41 B 17 2.418 -0.873 1.465 1.00 0.00 C HETATM 509 C5 T41 B 17 3.746 -1.308 1.842 1.00 0.00 C HETATM 510 C5M T41 B 17 4.725 -1.775 0.793 1.00 0.00 C HETATM 511 C6 T41 B 17 4.124 -1.322 3.138 1.00 0.00 C HETATM 512 O2 T41 B 17 1.176 -0.204 4.743 1.00 0.00 O HETATM 513 O4 T41 B 17 1.983 -0.800 0.319 1.00 0.00 O HETATM 514 C1' T41 B 17 3.751 -0.916 5.568 1.00 0.00 C HETATM 515 C2' T41 B 17 4.225 -2.199 6.175 1.00 0.00 C HETATM 516 O2' T41 B 17 5.091 -2.911 5.344 1.00 0.00 O HETATM 517 C3' T41 B 17 5.007 -1.729 7.393 1.00 0.00 C HETATM 518 C4' T41 B 17 5.502 -0.347 6.940 1.00 0.00 C HETATM 519 O3' T41 B 17 4.197 -1.537 8.544 1.00 0.00 O HETATM 520 O4' T41 B 17 4.803 0.008 5.754 1.00 0.00 O HETATM 521 C5' T41 B 17 7.003 -0.302 6.627 1.00 0.00 C HETATM 522 O5' T41 B 17 7.364 -1.233 5.625 1.00 0.00 O HETATM 523 C6' T41 B 17 4.691 -4.238 5.404 1.00 0.00 C HETATM 524 P T41 B 17 8.835 -1.221 4.955 1.00 0.00 P HETATM 525 O1P T41 B 17 9.828 -1.418 6.034 1.00 0.00 O HETATM 526 O2P T41 B 17 8.818 -2.140 3.795 1.00 0.00 O HETATM 0 H5M3 T41 B 17 4.311 -2.635 0.266 1.00 0.00 H new HETATM 0 H5M2 T41 B 17 4.909 -0.969 0.083 1.00 0.00 H new HETATM 0 H5M1 T41 B 17 5.663 -2.059 1.271 1.00 0.00 H new HETATM 0 H5'2 T41 B 17 7.276 0.703 6.304 1.00 0.00 H new HETATM 0 H5'1 T41 B 17 7.569 -0.509 7.535 1.00 0.00 H new HETATM 0 H2'1 T41 B 17 3.390 -2.869 6.380 1.00 0.00 H new HETATM 0 H6 T41 B 17 5.134 -1.648 3.385 1.00 0.00 H new HETATM 0 H4' T41 B 17 5.319 0.342 7.765 1.00 0.00 H new HETATM 0 H3' T41 B 17 5.769 -2.455 7.678 1.00 0.00 H new HETATM 0 H3 T41 B 17 0.667 -0.223 2.326 1.00 0.00 H new HETATM 0 H13 T41 B 17 4.759 -4.592 6.433 1.00 0.00 H new HETATM 0 H12 T41 B 17 3.661 -4.324 5.058 1.00 0.00 H new HETATM 0 H11 T41 B 17 5.338 -4.842 4.769 1.00 0.00 H new HETATM 0 H1' T41 B 17 2.826 -0.644 6.077 1.00 0.00 H new ATOM 541 P DA B 18 3.535 -2.754 9.375 1.00 0.00 P ATOM 542 OP1 DA B 18 3.477 -2.354 10.799 1.00 0.00 O ATOM 543 OP2 DA B 18 4.217 -4.011 8.998 1.00 0.00 O ATOM 544 O5' DA B 18 2.026 -2.812 8.806 1.00 0.00 O ATOM 545 C5' DA B 18 1.041 -1.870 9.201 1.00 0.00 C ATOM 546 C4' DA B 18 -0.308 -2.243 8.575 1.00 0.00 C ATOM 547 O4' DA B 18 -0.173 -2.137 7.179 1.00 0.00 O ATOM 548 C3' DA B 18 -0.724 -3.683 8.906 1.00 0.00 C ATOM 549 O3' DA B 18 -1.955 -3.632 9.609 1.00 0.00 O ATOM 550 C2' DA B 18 -0.838 -4.303 7.514 1.00 0.00 C ATOM 551 C1' DA B 18 -1.034 -3.100 6.627 1.00 0.00 C ATOM 552 N9 DA B 18 -0.576 -3.295 5.236 1.00 0.00 N ATOM 553 C8 DA B 18 0.704 -3.577 4.832 1.00 0.00 C ATOM 554 N7 DA B 18 0.883 -3.552 3.544 1.00 0.00 N ATOM 555 C5 DA B 18 -0.373 -3.220 3.055 1.00 0.00 C ATOM 556 C6 DA B 18 -0.850 -2.982 1.753 1.00 0.00 C ATOM 557 N6 DA B 18 -0.082 -3.002 0.659 1.00 0.00 N ATOM 558 N1 DA B 18 -2.137 -2.647 1.608 1.00 0.00 N ATOM 559 C2 DA B 18 -2.937 -2.546 2.661 1.00 0.00 C ATOM 560 N3 DA B 18 -2.605 -2.733 3.942 1.00 0.00 N ATOM 561 C4 DA B 18 -1.286 -3.074 4.075 1.00 0.00 C ATOM 0 H5' DA B 18 1.335 -0.868 8.887 1.00 0.00 H new ATOM 0 H5'' DA B 18 0.956 -1.851 10.288 1.00 0.00 H new ATOM 0 H4' DA B 18 -1.070 -1.573 8.974 1.00 0.00 H new ATOM 0 H3' DA B 18 -0.048 -4.255 9.541 1.00 0.00 H new ATOM 0 H2' DA B 18 0.059 -4.862 7.245 1.00 0.00 H new ATOM 0 H2'' DA B 18 -1.677 -4.996 7.447 1.00 0.00 H new ATOM 0 H1' DA B 18 -2.095 -2.854 6.587 1.00 0.00 H new ATOM 0 H8 DA B 18 1.499 -3.802 5.527 1.00 0.00 H new ATOM 0 H61 DA B 18 -0.494 -2.820 -0.256 1.00 0.00 H new ATOM 0 H62 DA B 18 0.916 -3.199 0.740 1.00 0.00 H new ATOM 0 H2 DA B 18 -3.966 -2.285 2.462 1.00 0.00 H new ATOM 573 P DT B 19 -2.793 -4.953 10.016 1.00 0.00 P ATOM 574 OP1 DT B 19 -3.596 -4.639 11.219 1.00 0.00 O ATOM 575 OP2 DT B 19 -1.877 -6.115 10.024 1.00 0.00 O ATOM 576 O5' DT B 19 -3.798 -5.107 8.764 1.00 0.00 O ATOM 577 C5' DT B 19 -4.758 -4.110 8.470 1.00 0.00 C ATOM 578 C4' DT B 19 -5.587 -4.489 7.238 1.00 0.00 C ATOM 579 O4' DT B 19 -4.724 -4.415 6.112 1.00 0.00 O ATOM 580 C3' DT B 19 -6.136 -5.923 7.326 1.00 0.00 C ATOM 581 O3' DT B 19 -7.488 -5.919 6.891 1.00 0.00 O ATOM 582 C2' DT B 19 -5.224 -6.668 6.348 1.00 0.00 C ATOM 583 C1' DT B 19 -4.937 -5.578 5.341 1.00 0.00 C ATOM 584 N1 DT B 19 -3.825 -5.803 4.396 1.00 0.00 N ATOM 585 C2 DT B 19 -4.005 -5.641 3.024 1.00 0.00 C ATOM 586 O2 DT B 19 -5.072 -5.312 2.512 1.00 0.00 O ATOM 587 N3 DT B 19 -2.884 -5.877 2.240 1.00 0.00 N ATOM 588 C4 DT B 19 -1.630 -6.263 2.694 1.00 0.00 C ATOM 589 O4 DT B 19 -0.715 -6.438 1.893 1.00 0.00 O ATOM 590 C5 DT B 19 -1.541 -6.417 4.135 1.00 0.00 C ATOM 591 C7 DT B 19 -0.240 -6.873 4.764 1.00 0.00 C ATOM 592 C6 DT B 19 -2.629 -6.174 4.909 1.00 0.00 C ATOM 0 H5' DT B 19 -4.257 -3.158 8.296 1.00 0.00 H new ATOM 0 H5'' DT B 19 -5.417 -3.971 9.327 1.00 0.00 H new ATOM 0 H4' DT B 19 -6.436 -3.810 7.165 1.00 0.00 H new ATOM 0 H3' DT B 19 -6.137 -6.368 8.321 1.00 0.00 H new ATOM 0 H2' DT B 19 -4.317 -7.037 6.828 1.00 0.00 H new ATOM 0 H2'' DT B 19 -5.718 -7.528 5.896 1.00 0.00 H new ATOM 0 H1' DT B 19 -5.786 -5.519 4.660 1.00 0.00 H new ATOM 0 H3 DT B 19 -2.992 -5.755 1.233 1.00 0.00 H new ATOM 0 H71 DT B 19 -0.151 -6.449 5.764 1.00 0.00 H new ATOM 0 H72 DT B 19 -0.229 -7.961 4.829 1.00 0.00 H new ATOM 0 H73 DT B 19 0.597 -6.538 4.152 1.00 0.00 H new ATOM 0 H6 DT B 19 -2.536 -6.281 5.980 1.00 0.00 H new ATOM 605 P DG B 20 -8.457 -7.210 7.039 1.00 0.00 P ATOM 606 OP1 DG B 20 -9.507 -6.885 8.029 1.00 0.00 O ATOM 607 OP2 DG B 20 -7.623 -8.418 7.224 1.00 0.00 O ATOM 608 O5' DG B 20 -9.152 -7.304 5.583 1.00 0.00 O ATOM 609 C5' DG B 20 -8.373 -7.247 4.405 1.00 0.00 C ATOM 610 C4' DG B 20 -9.163 -7.695 3.170 1.00 0.00 C ATOM 611 O4' DG B 20 -8.251 -7.603 2.088 1.00 0.00 O ATOM 612 C3' DG B 20 -9.577 -9.167 3.218 1.00 0.00 C ATOM 613 O3' DG B 20 -10.610 -9.337 2.258 1.00 0.00 O ATOM 614 C2' DG B 20 -8.268 -9.855 2.854 1.00 0.00 C ATOM 615 C1' DG B 20 -7.772 -8.902 1.775 1.00 0.00 C ATOM 616 N9 DG B 20 -6.304 -8.823 1.638 1.00 0.00 N ATOM 617 C8 DG B 20 -5.355 -8.871 2.621 1.00 0.00 C ATOM 618 N7 DG B 20 -4.128 -8.774 2.193 1.00 0.00 N ATOM 619 C5 DG B 20 -4.271 -8.644 0.816 1.00 0.00 C ATOM 620 C6 DG B 20 -3.280 -8.524 -0.203 1.00 0.00 C ATOM 621 O6 DG B 20 -2.064 -8.441 -0.063 1.00 0.00 O ATOM 622 N1 DG B 20 -3.829 -8.503 -1.483 1.00 0.00 N ATOM 623 C2 DG B 20 -5.186 -8.549 -1.750 1.00 0.00 C ATOM 624 N2 DG B 20 -5.566 -8.517 -3.031 1.00 0.00 N ATOM 625 N3 DG B 20 -6.120 -8.631 -0.791 1.00 0.00 N ATOM 626 C4 DG B 20 -5.600 -8.681 0.465 1.00 0.00 C ATOM 0 H5' DG B 20 -7.493 -7.880 4.521 1.00 0.00 H new ATOM 0 H5'' DG B 20 -8.015 -6.228 4.256 1.00 0.00 H new ATOM 0 H4' DG B 20 -10.062 -7.083 3.095 1.00 0.00 H new ATOM 0 H3' DG B 20 -9.976 -9.554 4.155 1.00 0.00 H new ATOM 0 H2' DG B 20 -7.583 -9.924 3.699 1.00 0.00 H new ATOM 0 H2'' DG B 20 -8.417 -10.868 2.481 1.00 0.00 H new ATOM 0 H1' DG B 20 -8.147 -9.290 0.828 1.00 0.00 H new ATOM 0 H8 DG B 20 -5.602 -8.980 3.667 1.00 0.00 H new ATOM 0 H1 DG B 20 -3.189 -8.450 -2.275 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.557 -8.549 -3.270 1.00 0.00 H new ATOM 0 H22 DG B 20 -4.865 -8.461 -3.770 1.00 0.00 H new ATOM 638 P DC B 21 -11.215 -10.773 1.826 1.00 0.00 P ATOM 639 OP1 DC B 21 -12.667 -10.609 1.592 1.00 0.00 O ATOM 640 OP2 DC B 21 -10.736 -11.807 2.770 1.00 0.00 O ATOM 641 O5' DC B 21 -10.499 -11.011 0.396 1.00 0.00 O ATOM 642 C5' DC B 21 -10.747 -10.131 -0.687 1.00 0.00 C ATOM 643 C4' DC B 21 -10.037 -10.571 -1.972 1.00 0.00 C ATOM 644 O4' DC B 21 -8.642 -10.478 -1.736 1.00 0.00 O ATOM 645 C3' DC B 21 -10.352 -12.020 -2.371 1.00 0.00 C ATOM 646 O3' DC B 21 -10.598 -12.034 -3.770 1.00 0.00 O ATOM 647 C2' DC B 21 -9.066 -12.742 -1.968 1.00 0.00 C ATOM 648 C1' DC B 21 -8.023 -11.655 -2.216 1.00 0.00 C ATOM 649 N1 DC B 21 -6.783 -11.837 -1.413 1.00 0.00 N ATOM 650 C2 DC B 21 -5.539 -11.773 -2.044 1.00 0.00 C ATOM 651 O2 DC B 21 -5.447 -11.729 -3.269 1.00 0.00 O ATOM 652 N3 DC B 21 -4.413 -11.759 -1.272 1.00 0.00 N ATOM 653 C4 DC B 21 -4.492 -11.835 0.066 1.00 0.00 C ATOM 654 N4 DC B 21 -3.366 -11.795 0.784 1.00 0.00 N ATOM 655 C5 DC B 21 -5.759 -11.915 0.734 1.00 0.00 C ATOM 656 C6 DC B 21 -6.864 -11.915 -0.045 1.00 0.00 C ATOM 0 H5' DC B 21 -10.418 -9.127 -0.419 1.00 0.00 H new ATOM 0 H5'' DC B 21 -11.820 -10.076 -0.869 1.00 0.00 H new ATOM 0 H4' DC B 21 -10.380 -9.928 -2.783 1.00 0.00 H new ATOM 0 H3' DC B 21 -11.225 -12.481 -1.910 1.00 0.00 H new ATOM 0 H2' DC B 21 -9.084 -13.064 -0.927 1.00 0.00 H new ATOM 0 H2'' DC B 21 -8.886 -13.630 -2.574 1.00 0.00 H new ATOM 0 H1' DC B 21 -7.733 -11.653 -3.267 1.00 0.00 H new ATOM 0 H41 DC B 21 -3.408 -11.852 1.802 1.00 0.00 H new ATOM 0 H42 DC B 21 -2.465 -11.708 0.315 1.00 0.00 H new ATOM 0 H5 DC B 21 -5.827 -11.973 1.810 1.00 0.00 H new ATOM 0 H6 DC B 21 -7.836 -11.978 0.421 1.00 0.00 H new ATOM 668 P DG B 22 -10.832 -13.395 -4.607 1.00 0.00 P ATOM 669 OP1 DG B 22 -11.656 -13.081 -5.795 1.00 0.00 O ATOM 670 OP2 DG B 22 -11.254 -14.464 -3.674 1.00 0.00 O ATOM 671 O5' DG B 22 -9.333 -13.702 -5.106 1.00 0.00 O ATOM 672 C5' DG B 22 -8.916 -15.003 -5.464 1.00 0.00 C ATOM 673 C4' DG B 22 -7.457 -14.934 -5.921 1.00 0.00 C ATOM 674 O4' DG B 22 -6.702 -14.436 -4.830 1.00 0.00 O ATOM 675 C3' DG B 22 -6.900 -16.326 -6.251 1.00 0.00 C ATOM 676 O3' DG B 22 -6.327 -16.329 -7.543 1.00 0.00 O ATOM 677 C2' DG B 22 -5.818 -16.534 -5.202 1.00 0.00 C ATOM 678 C1' DG B 22 -5.464 -15.109 -4.827 1.00 0.00 C ATOM 679 N9 DG B 22 -4.864 -14.999 -3.481 1.00 0.00 N ATOM 680 C8 DG B 22 -5.474 -15.075 -2.254 1.00 0.00 C ATOM 681 N7 DG B 22 -4.665 -14.913 -1.245 1.00 0.00 N ATOM 682 C5 DG B 22 -3.423 -14.717 -1.842 1.00 0.00 C ATOM 683 C6 DG B 22 -2.147 -14.460 -1.253 1.00 0.00 C ATOM 684 O6 DG B 22 -1.876 -14.332 -0.063 1.00 0.00 O ATOM 685 N1 DG B 22 -1.134 -14.352 -2.203 1.00 0.00 N ATOM 686 C2 DG B 22 -1.327 -14.468 -3.568 1.00 0.00 C ATOM 687 N2 DG B 22 -0.255 -14.331 -4.355 1.00 0.00 N ATOM 688 N3 DG B 22 -2.530 -14.679 -4.124 1.00 0.00 N ATOM 689 C4 DG B 22 -3.533 -14.790 -3.210 1.00 0.00 C ATOM 0 H5' DG B 22 -9.545 -15.397 -6.262 1.00 0.00 H new ATOM 0 H5'' DG B 22 -9.016 -15.680 -4.616 1.00 0.00 H new ATOM 0 H4' DG B 22 -7.397 -14.308 -6.811 1.00 0.00 H new ATOM 0 H3' DG B 22 -7.664 -17.104 -6.241 1.00 0.00 H new ATOM 0 H2' DG B 22 -6.183 -17.102 -4.346 1.00 0.00 H new ATOM 0 H2'' DG B 22 -4.961 -17.076 -5.602 1.00 0.00 H new ATOM 0 HO3' DG B 22 -5.974 -17.221 -7.742 1.00 0.00 H new ATOM 0 H1' DG B 22 -4.726 -14.703 -5.518 1.00 0.00 H new ATOM 0 H8 DG B 22 -6.532 -15.254 -2.135 1.00 0.00 H new ATOM 0 H1 DG B 22 -0.186 -14.176 -1.870 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.352 -14.409 -5.367 1.00 0.00 H new ATOM 0 H22 DG B 22 0.660 -14.148 -3.943 1.00 0.00 H new TER 702 DG B 22