USER MOD reduce.3.24.130724 H: found=0, std=0, add=251, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 253 hydrogens (139 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 10 DT C7 :methyl 150:sc= -0.291 (180deg=-0.291) USER MOD Single : A 10 DT O3' : rot 180:sc= 0 USER MOD Single : B 13 DT C7 :methyl -30:sc= -2.52! (180deg=-2.57!) USER MOD Single : B 20 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 C5' XTY A 1 -12.637 -16.187 -6.024 1.00 0.00 C HETATM 2 C4' XTY A 1 -12.583 -15.635 -4.599 1.00 0.00 C HETATM 3 O4' XTY A 1 -11.634 -16.392 -3.815 1.00 0.00 O HETATM 4 C3' XTY A 1 -12.117 -14.181 -4.489 1.00 0.00 C HETATM 5 C2' XTY A 1 -10.660 -14.300 -4.061 1.00 0.00 C HETATM 6 C1' XTY A 1 -10.728 -15.506 -3.141 1.00 0.00 C HETATM 7 O5' XTY A 1 -11.768 -15.466 -6.904 1.00 0.00 O HETATM 8 C2 XTY A 1 -9.144 -17.756 -6.294 1.00 0.00 C HETATM 9 O2 XTY A 1 -9.779 -17.900 -7.336 1.00 0.00 O HETATM 10 N3 XTY A 1 -7.894 -18.324 -6.136 1.00 0.00 N HETATM 11 C4 XTY A 1 -7.120 -18.206 -5.003 1.00 0.00 C HETATM 12 O4 XTY A 1 -6.011 -18.728 -4.950 1.00 0.00 O HETATM 13 C5 XTY A 1 -7.632 -17.461 -3.940 1.00 0.00 C HETATM 14 C6 XTY A 1 -8.911 -16.868 -4.072 1.00 0.00 C HETATM 15 N XTY A 1 -9.657 -17.013 -5.236 1.00 0.00 N HETATM 16 CP XTY A 1 -6.884 -17.305 -2.753 1.00 0.00 C HETATM 17 CD XTY A 1 -8.689 -15.964 -1.834 1.00 0.00 C HETATM 18 C8 XTY A 1 -9.456 -16.108 -3.012 1.00 0.00 C HETATM 19 C7 XTY A 1 -7.418 -16.555 -1.705 1.00 0.00 C HETATM 20 C7A XTY A 1 -6.621 -16.373 -0.416 1.00 0.00 C HETATM 21 O3' XTY A 1 -12.832 -13.606 -3.387 1.00 0.00 O HETATM 0 H7A3 XTY A 1 -6.424 -17.348 0.031 1.00 0.00 H new HETATM 0 H7A2 XTY A 1 -5.676 -15.878 -0.639 1.00 0.00 H new HETATM 0 H7A1 XTY A 1 -7.193 -15.763 0.283 1.00 0.00 H new HETATM 0 H5'2 XTY A 1 -12.356 -17.240 -6.017 1.00 0.00 H new HETATM 0 H5'1 XTY A 1 -13.660 -16.132 -6.397 1.00 0.00 H new HETATM 0 H2'2 XTY A 1 -9.993 -14.464 -4.908 1.00 0.00 H new HETATM 0 H2'1 XTY A 1 -10.307 -13.407 -3.545 1.00 0.00 H new HETATM 0 HP XTY A 1 -5.901 -17.765 -2.656 1.00 0.00 H new HETATM 0 HN3 XTY A 1 -7.519 -18.868 -6.913 1.00 0.00 H new HETATM 0 HN XTY A 1 -10.576 -16.577 -5.314 1.00 0.00 H new HETATM 0 HD XTY A 1 -9.091 -15.381 -1.005 1.00 0.00 H new HETATM 0 H4' XTY A 1 -13.612 -15.707 -4.246 1.00 0.00 H new HETATM 0 H3' XTY A 1 -12.260 -13.598 -5.399 1.00 0.00 H new HETATM 0 H1' XTY A 1 -11.050 -15.251 -2.131 1.00 0.00 H new ATOM 37 P DG A 2 -13.340 -12.075 -3.424 1.00 0.00 P ATOM 38 OP1 DG A 2 -12.933 -11.481 -4.717 1.00 0.00 O ATOM 39 OP2 DG A 2 -14.763 -12.051 -3.016 1.00 0.00 O ATOM 40 O5' DG A 2 -12.465 -11.379 -2.262 1.00 0.00 O ATOM 41 C5' DG A 2 -11.566 -12.152 -1.458 1.00 0.00 C ATOM 42 C4' DG A 2 -10.323 -11.355 -1.078 1.00 0.00 C ATOM 43 O4' DG A 2 -9.370 -11.438 -2.155 1.00 0.00 O ATOM 44 C3' DG A 2 -10.559 -9.860 -0.864 1.00 0.00 C ATOM 45 O3' DG A 2 -9.649 -9.442 0.155 1.00 0.00 O ATOM 46 C2' DG A 2 -10.102 -9.216 -2.164 1.00 0.00 C ATOM 47 C1' DG A 2 -8.960 -10.132 -2.578 1.00 0.00 C ATOM 48 N9 DG A 2 -8.735 -10.133 -4.042 1.00 0.00 N ATOM 49 C8 DG A 2 -9.324 -9.342 -4.998 1.00 0.00 C ATOM 50 N7 DG A 2 -8.897 -9.575 -6.207 1.00 0.00 N ATOM 51 C5 DG A 2 -7.961 -10.588 -6.046 1.00 0.00 C ATOM 52 C6 DG A 2 -7.164 -11.251 -7.018 1.00 0.00 C ATOM 53 O6 DG A 2 -7.135 -11.067 -8.232 1.00 0.00 O ATOM 54 N1 DG A 2 -6.349 -12.210 -6.442 1.00 0.00 N ATOM 55 C2 DG A 2 -6.301 -12.502 -5.098 1.00 0.00 C ATOM 56 N2 DG A 2 -5.452 -13.457 -4.720 1.00 0.00 N ATOM 57 N3 DG A 2 -7.045 -11.886 -4.174 1.00 0.00 N ATOM 58 C4 DG A 2 -7.851 -10.941 -4.721 1.00 0.00 C ATOM 0 H5' DG A 2 -11.271 -13.049 -2.002 1.00 0.00 H new ATOM 0 H5'' DG A 2 -12.078 -12.481 -0.554 1.00 0.00 H new ATOM 0 H4' DG A 2 -9.985 -11.791 -0.138 1.00 0.00 H new ATOM 0 H3' DG A 2 -11.587 -9.613 -0.599 1.00 0.00 H new ATOM 0 H2' DG A 2 -10.897 -9.190 -2.909 1.00 0.00 H new ATOM 0 H2'' DG A 2 -9.770 -8.188 -2.017 1.00 0.00 H new ATOM 0 H1' DG A 2 -8.022 -9.803 -2.132 1.00 0.00 H new ATOM 0 H8 DG A 2 -10.071 -8.597 -4.769 1.00 0.00 H new ATOM 0 H1 DG A 2 -5.737 -12.741 -7.061 1.00 0.00 H new ATOM 0 H21 DG A 2 -5.377 -13.712 -3.735 1.00 0.00 H new ATOM 0 H22 DG A 2 -4.877 -13.933 -5.415 1.00 0.00 H new HETATM 70 P XTY A 3 -10.060 -8.293 1.206 1.00 0.00 P HETATM 71 OP1 XTY A 3 -9.902 -8.838 2.573 1.00 0.00 O HETATM 72 OP2 XTY A 3 -11.358 -7.719 0.787 1.00 0.00 O HETATM 73 C5' XTY A 3 -7.780 -7.450 0.154 1.00 0.00 C HETATM 74 C4' XTY A 3 -6.796 -6.287 0.166 1.00 0.00 C HETATM 75 O4' XTY A 3 -6.166 -6.201 -1.117 1.00 0.00 O HETATM 76 C3' XTY A 3 -7.437 -4.925 0.406 1.00 0.00 C HETATM 77 C2' XTY A 3 -7.565 -4.321 -0.987 1.00 0.00 C HETATM 78 C1' XTY A 3 -6.366 -4.920 -1.728 1.00 0.00 C HETATM 79 O5' XTY A 3 -8.921 -7.178 0.975 1.00 0.00 O HETATM 80 C2 XTY A 3 -3.864 -7.406 -3.899 1.00 0.00 C HETATM 81 O2 XTY A 3 -2.887 -7.920 -3.358 1.00 0.00 O HETATM 82 N3 XTY A 3 -4.149 -7.646 -5.232 1.00 0.00 N HETATM 83 C4 XTY A 3 -5.224 -7.111 -5.911 1.00 0.00 C HETATM 84 O4 XTY A 3 -5.409 -7.377 -7.097 1.00 0.00 O HETATM 85 C5 XTY A 3 -6.085 -6.265 -5.204 1.00 0.00 C HETATM 86 C6 XTY A 3 -5.819 -5.999 -3.838 1.00 0.00 C HETATM 87 N XTY A 3 -4.719 -6.563 -3.191 1.00 0.00 N HETATM 88 CP XTY A 3 -7.203 -5.686 -5.845 1.00 0.00 C HETATM 89 CD XTY A 3 -7.787 -4.576 -3.759 1.00 0.00 C HETATM 90 C8 XTY A 3 -6.669 -5.149 -3.094 1.00 0.00 C HETATM 91 C7 XTY A 3 -8.047 -4.845 -5.116 1.00 0.00 C HETATM 92 C7A XTY A 3 -9.260 -4.216 -5.795 1.00 0.00 C HETATM 93 O3' XTY A 3 -6.497 -4.138 1.145 1.00 0.00 O HETATM 0 H7A3 XTY A 3 -8.930 -3.600 -6.632 1.00 0.00 H new HETATM 0 H7A2 XTY A 3 -9.920 -5.002 -6.161 1.00 0.00 H new HETATM 0 H7A1 XTY A 3 -9.797 -3.596 -5.078 1.00 0.00 H new HETATM 0 H5'2 XTY A 3 -8.104 -7.644 -0.869 1.00 0.00 H new HETATM 0 H5'1 XTY A 3 -7.282 -8.353 0.508 1.00 0.00 H new HETATM 0 H2'2 XTY A 3 -8.509 -4.591 -1.460 1.00 0.00 H new HETATM 0 H2'1 XTY A 3 -7.522 -3.232 -0.961 1.00 0.00 H new HETATM 0 HP XTY A 3 -7.405 -5.893 -6.896 1.00 0.00 H new HETATM 0 HN3 XTY A 3 -3.520 -8.261 -5.748 1.00 0.00 H new HETATM 0 HN XTY A 3 -4.542 -6.360 -2.207 1.00 0.00 H new HETATM 0 HD XTY A 3 -8.456 -3.915 -3.207 1.00 0.00 H new HETATM 0 H4' XTY A 3 -6.108 -6.496 0.985 1.00 0.00 H new HETATM 0 H3' XTY A 3 -8.387 -4.975 0.937 1.00 0.00 H new HETATM 0 H1' XTY A 3 -5.505 -4.253 -1.674 1.00 0.00 H new ATOM 108 P DA A 4 -6.735 -3.822 2.713 1.00 0.00 P ATOM 109 OP1 DA A 4 -6.549 -2.368 2.922 1.00 0.00 O ATOM 110 OP2 DA A 4 -7.999 -4.469 3.133 1.00 0.00 O ATOM 111 O5' DA A 4 -5.510 -4.591 3.432 1.00 0.00 O ATOM 112 C5' DA A 4 -5.541 -6.014 3.615 1.00 0.00 C ATOM 113 C4' DA A 4 -4.135 -6.614 3.685 1.00 0.00 C ATOM 114 O4' DA A 4 -3.656 -6.797 2.346 1.00 0.00 O ATOM 115 C3' DA A 4 -3.091 -5.732 4.361 1.00 0.00 C ATOM 116 O3' DA A 4 -2.080 -6.600 4.883 1.00 0.00 O ATOM 117 C2' DA A 4 -2.467 -4.949 3.220 1.00 0.00 C ATOM 118 C1' DA A 4 -2.558 -5.920 2.050 1.00 0.00 C ATOM 119 N9 DA A 4 -2.880 -5.212 0.797 1.00 0.00 N ATOM 120 C8 DA A 4 -3.870 -4.291 0.591 1.00 0.00 C ATOM 121 N7 DA A 4 -3.949 -3.867 -0.633 1.00 0.00 N ATOM 122 C5 DA A 4 -2.940 -4.553 -1.286 1.00 0.00 C ATOM 123 C6 DA A 4 -2.510 -4.542 -2.613 1.00 0.00 C ATOM 124 N6 DA A 4 -3.098 -3.817 -3.560 1.00 0.00 N ATOM 125 N1 DA A 4 -1.479 -5.332 -2.944 1.00 0.00 N ATOM 126 C2 DA A 4 -0.917 -6.085 -2.009 1.00 0.00 C ATOM 127 N3 DA A 4 -1.231 -6.191 -0.722 1.00 0.00 N ATOM 128 C4 DA A 4 -2.271 -5.379 -0.429 1.00 0.00 C ATOM 0 H5' DA A 4 -6.091 -6.473 2.793 1.00 0.00 H new ATOM 0 H5'' DA A 4 -6.082 -6.250 4.531 1.00 0.00 H new ATOM 0 H4' DA A 4 -4.244 -7.529 4.267 1.00 0.00 H new ATOM 0 H3' DA A 4 -3.501 -5.098 5.147 1.00 0.00 H new ATOM 0 H2' DA A 4 -3.009 -4.025 3.021 1.00 0.00 H new ATOM 0 H2'' DA A 4 -1.435 -4.673 3.436 1.00 0.00 H new ATOM 0 H1' DA A 4 -1.609 -6.441 1.922 1.00 0.00 H new ATOM 0 H8 DA A 4 -4.527 -3.947 1.376 1.00 0.00 H new ATOM 0 H61 DA A 4 -2.744 -3.844 -4.516 1.00 0.00 H new ATOM 0 H62 DA A 4 -3.903 -3.234 -3.330 1.00 0.00 H new ATOM 0 H2 DA A 4 -0.090 -6.697 -2.338 1.00 0.00 H new HETATM 140 P XCS A 5 -1.409 -6.306 6.320 1.00 0.00 P HETATM 141 OP2 XCS A 5 -1.858 -4.973 6.781 1.00 0.00 O HETATM 142 C6 XCS A 5 0.758 -2.019 2.240 1.00 0.00 C HETATM 143 C2 XCS A 5 1.868 -1.280 0.236 1.00 0.00 C HETATM 144 O2 XCS A 5 2.842 -1.334 -0.511 1.00 0.00 O HETATM 145 N3 XCS A 5 0.800 -0.471 -0.053 1.00 0.00 N HETATM 146 C4 XCS A 5 -0.272 -0.409 0.750 1.00 0.00 C HETATM 147 N4 XCS A 5 -1.272 0.397 0.393 1.00 0.00 N HETATM 148 C5 XCS A 5 -0.335 -1.193 1.944 1.00 0.00 C HETATM 149 OP1 XCS A 5 -1.620 -7.492 7.180 1.00 0.00 O HETATM 150 O5' XCS A 5 0.161 -6.211 5.970 1.00 0.00 O HETATM 151 C5' XCS A 5 0.675 -6.741 4.744 1.00 0.00 C HETATM 152 C4' XCS A 5 1.898 -5.966 4.263 1.00 0.00 C HETATM 153 O4' XCS A 5 1.480 -4.993 3.297 1.00 0.00 O HETATM 154 C1' XCS A 5 1.860 -3.665 3.679 1.00 0.00 C HETATM 155 ND XCS A 5 1.852 -2.065 1.392 1.00 0.00 N HETATM 156 CP XCS A 5 -1.460 -1.134 2.793 1.00 0.00 C HETATM 157 CD XCS A 5 -0.391 -2.750 4.255 1.00 0.00 C HETATM 158 C8 XCS A 5 0.751 -2.823 3.410 1.00 0.00 C HETATM 159 C7 XCS A 5 -1.481 -1.915 3.947 1.00 0.00 C HETATM 160 C7A XCS A 5 -2.692 -1.870 4.875 1.00 0.00 C HETATM 161 C2' XCS A 5 2.133 -3.750 5.183 1.00 0.00 C HETATM 162 C3' XCS A 5 2.624 -5.180 5.351 1.00 0.00 C HETATM 163 O3' XCS A 5 4.016 -5.191 5.024 1.00 0.00 O HETATM 0 HN42 XCS A 5 -2.103 0.469 0.980 1.00 0.00 H new HETATM 0 HN41 XCS A 5 -1.206 0.941 -0.467 1.00 0.00 H new HETATM 0 H7A3 XCS A 5 -2.832 -0.853 5.242 1.00 0.00 H new HETATM 0 H7A2 XCS A 5 -3.581 -2.183 4.328 1.00 0.00 H new HETATM 0 H7A1 XCS A 5 -2.529 -2.541 5.718 1.00 0.00 H new HETATM 0 H5'2 XCS A 5 0.940 -7.789 4.883 1.00 0.00 H new HETATM 0 H5'1 XCS A 5 -0.101 -6.707 3.979 1.00 0.00 H new HETATM 0 H2'2 XCS A 5 2.882 -3.024 5.501 1.00 0.00 H new HETATM 0 H2'1 XCS A 5 1.234 -3.558 5.770 1.00 0.00 H new HETATM 0 HP XCS A 5 -2.302 -0.486 2.550 1.00 0.00 H new HETATM 0 HND XCS A 5 2.644 -2.670 1.611 1.00 0.00 H new HETATM 0 HD XCS A 5 -0.422 -3.354 5.161 1.00 0.00 H new HETATM 0 H4' XCS A 5 2.579 -6.722 3.872 1.00 0.00 H new HETATM 0 H3' XCS A 5 2.457 -5.577 6.352 1.00 0.00 H new HETATM 0 H1' XCS A 5 2.731 -3.276 3.152 1.00 0.00 H new HETATM 179 P XGA A 6 5.105 -5.671 6.112 1.00 0.00 P HETATM 180 OP1 XGA A 6 5.568 -7.026 5.739 1.00 0.00 O HETATM 181 OP2 XGA A 6 4.550 -5.427 7.464 1.00 0.00 O HETATM 182 C5' XGA A 6 6.861 -4.436 4.568 1.00 0.00 C HETATM 183 O5' XGA A 6 6.317 -4.640 5.876 1.00 0.00 O HETATM 184 C4' XGA A 6 7.485 -3.051 4.432 1.00 0.00 C HETATM 185 O4' XGA A 6 6.489 -2.135 3.953 1.00 0.00 O HETATM 186 C3' XGA A 6 7.998 -2.451 5.740 1.00 0.00 C HETATM 187 C2' XGA A 6 6.896 -1.494 6.166 1.00 0.00 C HETATM 188 C1' XGA A 6 6.377 -1.005 4.822 1.00 0.00 C HETATM 189 N9 XGA A 6 5.000 -0.537 4.851 1.00 0.00 N HETATM 190 C8 XGA A 6 4.104 -0.680 5.884 1.00 0.00 C HETATM 191 N7 XGA A 6 2.941 -0.139 5.607 1.00 0.00 N HETATM 192 C4 XGA A 6 3.827 1.266 1.768 1.00 0.00 C HETATM 193 C5 XGA A 6 2.529 1.514 2.261 1.00 0.00 C HETATM 194 N3 XGA A 6 4.222 1.669 0.554 1.00 0.00 N HETATM 195 C2 XGA A 6 3.316 2.334 -0.198 1.00 0.00 C HETATM 196 N2 XGA A 6 3.691 2.745 -1.432 1.00 0.00 N HETATM 197 N1 XGA A 6 2.060 2.612 0.199 1.00 0.00 N HETATM 198 C6 XGA A 6 1.630 2.206 1.447 1.00 0.00 C HETATM 199 O6 XGA A 6 0.479 2.447 1.815 1.00 0.00 O HETATM 200 C10 XGA A 6 4.357 0.146 3.840 1.00 0.00 C HETATM 201 C11 XGA A 6 3.078 0.377 4.348 1.00 0.00 C HETATM 202 CP XGA A 6 2.149 1.068 3.555 1.00 0.00 C HETATM 203 CD XGA A 6 4.748 0.582 2.561 1.00 0.00 C HETATM 204 O3' XGA A 6 9.142 -1.655 5.417 1.00 0.00 O HETATM 0 HN22 XGA A 6 3.031 3.249 -2.024 1.00 0.00 H new HETATM 0 HN21 XGA A 6 4.634 2.551 -1.770 1.00 0.00 H new HETATM 0 H5'2 XGA A 6 7.614 -5.197 4.363 1.00 0.00 H new HETATM 0 H5'1 XGA A 6 6.075 -4.557 3.823 1.00 0.00 H new HETATM 0 H2'2 XGA A 6 6.121 -1.994 6.747 1.00 0.00 H new HETATM 0 H2'1 XGA A 6 7.277 -0.678 6.779 1.00 0.00 H new HETATM 0 HP XGA A 6 1.144 1.261 3.929 1.00 0.00 H new HETATM 0 HN1 XGA A 6 1.428 3.121 -0.420 1.00 0.00 H new HETATM 0 HD XGA A 6 5.756 0.388 2.195 1.00 0.00 H new HETATM 0 H8 XGA A 6 4.333 -1.184 6.823 1.00 0.00 H new HETATM 0 H4' XGA A 6 8.331 -3.186 3.758 1.00 0.00 H new HETATM 0 H3' XGA A 6 8.244 -3.198 6.495 1.00 0.00 H new HETATM 0 H1' XGA A 6 6.955 -0.139 4.498 1.00 0.00 H new ATOM 218 P DC A 7 10.304 -1.412 6.505 1.00 0.00 P ATOM 219 OP1 DC A 7 11.249 -2.549 6.437 1.00 0.00 O ATOM 220 OP2 DC A 7 9.669 -1.056 7.794 1.00 0.00 O ATOM 221 O5' DC A 7 11.049 -0.103 5.935 1.00 0.00 O ATOM 222 C5' DC A 7 11.283 0.051 4.532 1.00 0.00 C ATOM 223 C4' DC A 7 11.323 1.521 4.126 1.00 0.00 C ATOM 224 O4' DC A 7 9.992 1.955 3.806 1.00 0.00 O ATOM 225 C3' DC A 7 11.813 2.474 5.218 1.00 0.00 C ATOM 226 O3' DC A 7 12.535 3.521 4.564 1.00 0.00 O ATOM 227 C2' DC A 7 10.540 3.090 5.783 1.00 0.00 C ATOM 228 C1' DC A 7 9.639 3.121 4.555 1.00 0.00 C ATOM 229 N1 DC A 7 8.196 3.059 4.887 1.00 0.00 N ATOM 230 C2 DC A 7 7.339 3.894 4.179 1.00 0.00 C ATOM 231 O2 DC A 7 7.780 4.647 3.314 1.00 0.00 O ATOM 232 N3 DC A 7 6.007 3.855 4.462 1.00 0.00 N ATOM 233 C4 DC A 7 5.530 3.031 5.402 1.00 0.00 C ATOM 234 N4 DC A 7 4.217 3.041 5.631 1.00 0.00 N ATOM 235 C5 DC A 7 6.404 2.169 6.136 1.00 0.00 C ATOM 236 C6 DC A 7 7.719 2.213 5.850 1.00 0.00 C ATOM 0 H5' DC A 7 10.498 -0.460 3.974 1.00 0.00 H new ATOM 0 H5'' DC A 7 12.226 -0.426 4.266 1.00 0.00 H new ATOM 0 H4' DC A 7 12.022 1.563 3.290 1.00 0.00 H new ATOM 0 H3' DC A 7 12.429 1.988 5.975 1.00 0.00 H new ATOM 0 H2' DC A 7 10.116 2.488 6.587 1.00 0.00 H new ATOM 0 H2'' DC A 7 10.713 4.087 6.189 1.00 0.00 H new ATOM 0 H1' DC A 7 9.783 4.057 4.015 1.00 0.00 H new ATOM 0 H41 DC A 7 3.818 2.426 6.340 1.00 0.00 H new ATOM 0 H42 DC A 7 3.611 3.664 5.097 1.00 0.00 H new ATOM 0 H5 DC A 7 6.021 1.504 6.896 1.00 0.00 H new ATOM 0 H6 DC A 7 8.404 1.574 6.387 1.00 0.00 H new HETATM 248 P XAE A 8 13.691 4.333 5.339 1.00 0.00 P HETATM 249 OP1 XAE A 8 14.848 4.477 4.427 1.00 0.00 O HETATM 250 OP2 XAE A 8 13.878 3.721 6.675 1.00 0.00 O HETATM 251 C5' XAE A 8 12.363 6.437 4.451 1.00 0.00 C HETATM 252 C4' XAE A 8 11.754 7.769 4.878 1.00 0.00 C HETATM 253 O4' XAE A 8 10.353 7.582 5.134 1.00 0.00 O HETATM 254 C3' XAE A 8 12.324 8.353 6.170 1.00 0.00 C HETATM 255 C2' XAE A 8 11.319 7.937 7.235 1.00 0.00 C HETATM 256 C1' XAE A 8 10.015 8.018 6.454 1.00 0.00 C HETATM 257 O5' XAE A 8 13.024 5.783 5.539 1.00 0.00 O HETATM 258 N9 XAE A 8 8.945 7.191 6.990 1.00 0.00 N HETATM 259 C8 XAE A 8 9.084 6.046 7.737 1.00 0.00 C HETATM 260 N7 XAE A 8 7.924 5.526 8.060 1.00 0.00 N HETATM 261 C5 XAE A 8 4.827 7.289 6.874 1.00 0.00 C HETATM 262 C4 XAE A 8 5.458 8.350 6.192 1.00 0.00 C HETATM 263 C6 XAE A 8 3.401 7.264 6.873 1.00 0.00 C HETATM 264 N6 XAE A 8 2.711 6.308 7.493 1.00 0.00 N HETATM 265 N1 XAE A 8 2.730 8.229 6.236 1.00 0.00 N HETATM 266 C2 XAE A 8 3.438 9.182 5.625 1.00 0.00 C HETATM 267 N3 XAE A 8 4.766 9.336 5.543 1.00 0.00 N HETATM 268 C10 XAE A 8 7.595 7.417 6.827 1.00 0.00 C HETATM 269 C11 XAE A 8 6.989 6.360 7.506 1.00 0.00 C HETATM 270 CP XAE A 8 5.589 6.288 7.535 1.00 0.00 C HETATM 271 CD XAE A 8 6.850 8.414 6.168 1.00 0.00 C HETATM 272 O3' XAE A 8 12.241 9.776 6.051 1.00 0.00 O HETATM 0 HN62 XAE A 8 1.691 6.320 7.473 1.00 0.00 H new HETATM 0 HN61 XAE A 8 3.202 5.564 7.988 1.00 0.00 H new HETATM 0 H5'2 XAE A 8 11.580 5.788 4.058 1.00 0.00 H new HETATM 0 H5'1 XAE A 8 13.074 6.605 3.642 1.00 0.00 H new HETATM 0 H2'2 XAE A 8 11.511 6.933 7.613 1.00 0.00 H new HETATM 0 H2'1 XAE A 8 11.327 8.608 8.094 1.00 0.00 H new HETATM 0 HP XAE A 8 5.090 5.473 8.059 1.00 0.00 H new HETATM 0 HD XAE A 8 7.356 9.226 5.646 1.00 0.00 H new HETATM 0 H8 XAE A 8 10.045 5.620 8.027 1.00 0.00 H new HETATM 0 H4' XAE A 8 11.978 8.453 4.059 1.00 0.00 H new HETATM 0 H3' XAE A 8 13.345 8.036 6.384 1.00 0.00 H new HETATM 0 H2 XAE A 8 2.849 9.947 5.119 1.00 0.00 H new HETATM 0 H1' XAE A 8 9.623 9.034 6.499 1.00 0.00 H new HETATM 286 P XGA A 9 13.349 10.729 6.726 1.00 0.00 P HETATM 287 OP1 XGA A 9 14.466 10.893 5.769 1.00 0.00 O HETATM 288 OP2 XGA A 9 13.616 10.236 8.096 1.00 0.00 O HETATM 289 C5' XGA A 9 11.636 12.536 5.834 1.00 0.00 C HETATM 290 O5' XGA A 9 12.573 12.135 6.840 1.00 0.00 O HETATM 291 C4' XGA A 9 10.526 13.408 6.414 1.00 0.00 C HETATM 292 O4' XGA A 9 9.443 12.563 6.840 1.00 0.00 O HETATM 293 C3' XGA A 9 10.923 14.208 7.656 1.00 0.00 C HETATM 294 C2' XGA A 9 10.408 13.365 8.812 1.00 0.00 C HETATM 295 C1' XGA A 9 9.131 12.793 8.217 1.00 0.00 C HETATM 296 N9 XGA A 9 8.687 11.559 8.844 1.00 0.00 N HETATM 297 C8 XGA A 9 9.484 10.522 9.262 1.00 0.00 C HETATM 298 N7 XGA A 9 8.784 9.550 9.799 1.00 0.00 N HETATM 299 C4 XGA A 9 4.978 11.237 9.367 1.00 0.00 C HETATM 300 C5 XGA A 9 5.051 9.966 9.974 1.00 0.00 C HETATM 301 N3 XGA A 9 3.817 11.874 9.174 1.00 0.00 N HETATM 302 C2 XGA A 9 2.694 11.247 9.590 1.00 0.00 C HETATM 303 N2 XGA A 9 1.508 11.874 9.396 1.00 0.00 N HETATM 304 N1 XGA A 9 2.674 10.034 10.179 1.00 0.00 N HETATM 305 C6 XGA A 9 3.862 9.358 10.387 1.00 0.00 C HETATM 306 O6 XGA A 9 3.855 8.248 10.919 1.00 0.00 O HETATM 307 C10 XGA A 9 7.382 11.223 9.135 1.00 0.00 C HETATM 308 C11 XGA A 9 7.480 9.965 9.729 1.00 0.00 C HETATM 309 CP XGA A 9 6.306 9.323 10.156 1.00 0.00 C HETATM 310 CD XGA A 9 6.147 11.870 8.947 1.00 0.00 C HETATM 311 O3' XGA A 9 10.151 15.415 7.637 1.00 0.00 O HETATM 0 HN22 XGA A 9 0.641 11.430 9.698 1.00 0.00 H new HETATM 0 HN21 XGA A 9 1.483 12.790 8.948 1.00 0.00 H new HETATM 0 H5'2 XGA A 9 12.157 13.084 5.049 1.00 0.00 H new HETATM 0 H5'1 XGA A 9 11.199 11.652 5.370 1.00 0.00 H new HETATM 0 H2'2 XGA A 9 11.114 12.585 9.098 1.00 0.00 H new HETATM 0 H2'1 XGA A 9 10.215 13.963 9.703 1.00 0.00 H new HETATM 0 HP XGA A 9 6.357 8.340 10.623 1.00 0.00 H new HETATM 0 HN1 XGA A 9 1.789 9.618 10.469 1.00 0.00 H new HETATM 0 HD XGA A 9 6.105 12.854 8.479 1.00 0.00 H new HETATM 0 H8 XGA A 9 10.569 10.508 9.160 1.00 0.00 H new HETATM 0 H4' XGA A 9 10.270 14.105 5.616 1.00 0.00 H new HETATM 0 H3' XGA A 9 11.989 14.428 7.717 1.00 0.00 H new HETATM 0 H1' XGA A 9 8.305 13.488 8.371 1.00 0.00 H new ATOM 325 P DT A 10 10.667 16.742 8.394 1.00 0.00 P ATOM 326 OP1 DT A 10 10.436 17.900 7.502 1.00 0.00 O ATOM 327 OP2 DT A 10 12.024 16.480 8.924 1.00 0.00 O ATOM 328 O5' DT A 10 9.654 16.858 9.642 1.00 0.00 O ATOM 329 C5' DT A 10 8.388 16.186 9.625 1.00 0.00 C ATOM 330 C4' DT A 10 7.424 16.762 10.657 1.00 0.00 C ATOM 331 O4' DT A 10 6.569 15.708 11.127 1.00 0.00 O ATOM 332 C3' DT A 10 8.090 17.345 11.909 1.00 0.00 C ATOM 333 O3' DT A 10 7.342 18.460 12.401 1.00 0.00 O ATOM 334 C2' DT A 10 8.023 16.183 12.894 1.00 0.00 C ATOM 335 C1' DT A 10 6.682 15.557 12.542 1.00 0.00 C ATOM 336 N1 DT A 10 6.606 14.116 12.881 1.00 0.00 N ATOM 337 C2 DT A 10 5.436 13.658 13.468 1.00 0.00 C ATOM 338 O2 DT A 10 4.473 14.391 13.689 1.00 0.00 O ATOM 339 N3 DT A 10 5.402 12.314 13.785 1.00 0.00 N ATOM 340 C4 DT A 10 6.415 11.399 13.572 1.00 0.00 C ATOM 341 O4 DT A 10 6.266 10.223 13.899 1.00 0.00 O ATOM 342 C5 DT A 10 7.595 11.958 12.956 1.00 0.00 C ATOM 343 C7 DT A 10 8.794 11.058 12.674 1.00 0.00 C ATOM 344 C6 DT A 10 7.656 13.267 12.634 1.00 0.00 C ATOM 0 H5' DT A 10 8.538 15.124 9.821 1.00 0.00 H new ATOM 0 H5'' DT A 10 7.947 16.267 8.631 1.00 0.00 H new ATOM 0 H4' DT A 10 6.904 17.569 10.141 1.00 0.00 H new ATOM 0 H3' DT A 10 9.102 17.711 11.734 1.00 0.00 H new ATOM 0 H2' DT A 10 8.849 15.484 12.760 1.00 0.00 H new ATOM 0 H2'' DT A 10 8.057 16.522 13.929 1.00 0.00 H new ATOM 0 HO3' DT A 10 7.779 18.820 13.201 1.00 0.00 H new ATOM 0 H1' DT A 10 5.884 16.040 13.106 1.00 0.00 H new ATOM 0 H3 DT A 10 4.547 11.964 14.218 1.00 0.00 H new ATOM 0 H71 DT A 10 9.329 11.428 11.799 1.00 0.00 H new ATOM 0 H72 DT A 10 9.462 11.061 13.536 1.00 0.00 H new ATOM 0 H73 DT A 10 8.449 10.041 12.485 1.00 0.00 H new ATOM 0 H6 DT A 10 8.551 13.656 12.171 1.00 0.00 H new TER 358 DT A 10 HETATM 359 C5' XAE B 11 -6.065 7.082 16.585 1.00 0.00 C HETATM 360 C4' XAE B 11 -5.861 8.279 15.658 1.00 0.00 C HETATM 361 O4' XAE B 11 -4.587 8.873 15.938 1.00 0.00 O HETATM 362 C3' XAE B 11 -5.827 7.939 14.172 1.00 0.00 C HETATM 363 C2' XAE B 11 -4.347 7.769 13.865 1.00 0.00 C HETATM 364 C1' XAE B 11 -3.702 8.772 14.814 1.00 0.00 C HETATM 365 O5' XAE B 11 -6.420 5.903 15.858 1.00 0.00 O HETATM 366 N9 XAE B 11 -2.384 8.360 15.262 1.00 0.00 N HETATM 367 C8 XAE B 11 -2.109 7.346 16.145 1.00 0.00 C HETATM 368 N7 XAE B 11 -0.822 7.209 16.352 1.00 0.00 N HETATM 369 C5 XAE B 11 1.498 9.530 14.529 1.00 0.00 C HETATM 370 C4 XAE B 11 0.523 10.273 13.830 1.00 0.00 C HETATM 371 C6 XAE B 11 2.864 9.882 14.322 1.00 0.00 C HETATM 372 N6 XAE B 11 3.862 9.243 14.932 1.00 0.00 N HETATM 373 N1 XAE B 11 3.160 10.883 13.490 1.00 0.00 N HETATM 374 C2 XAE B 11 2.155 11.515 12.886 1.00 0.00 C HETATM 375 N3 XAE B 11 0.835 11.298 12.978 1.00 0.00 N HETATM 376 C10 XAE B 11 -1.182 8.911 14.874 1.00 0.00 C HETATM 377 C11 XAE B 11 -0.231 8.168 15.574 1.00 0.00 C HETATM 378 CP XAE B 11 1.127 8.476 15.404 1.00 0.00 C HETATM 379 CD XAE B 11 -0.827 9.960 14.004 1.00 0.00 C HETATM 380 O3' XAE B 11 -6.273 9.100 13.466 1.00 0.00 O HETATM 0 HN62 XAE B 11 4.828 9.523 14.759 1.00 0.00 H new HETATM 0 HN61 XAE B 11 3.660 8.474 15.571 1.00 0.00 H new HETATM 0 H5'2 XAE B 11 -5.151 6.899 17.150 1.00 0.00 H new HETATM 0 H5'1 XAE B 11 -6.847 7.312 17.309 1.00 0.00 H new HETATM 0 H2'2 XAE B 11 -4.006 6.751 14.056 1.00 0.00 H new HETATM 0 H2'1 XAE B 11 -4.120 7.991 12.822 1.00 0.00 H new HETATM 0 HP XAE B 11 1.890 7.911 15.939 1.00 0.00 H new HETATM 0 HD XAE B 11 -1.596 10.521 13.473 1.00 0.00 H new HETATM 0 H8 XAE B 11 -2.871 6.727 16.619 1.00 0.00 H new HETATM 0 H4' XAE B 11 -6.715 8.929 15.847 1.00 0.00 H new HETATM 0 H3' XAE B 11 -6.429 7.069 13.909 1.00 0.00 H new HETATM 0 H2 XAE B 11 2.448 12.327 12.220 1.00 0.00 H new HETATM 0 H1' XAE B 11 -3.557 9.723 14.301 1.00 0.00 H new ATOM 395 P DC B 12 -7.372 8.978 12.295 1.00 0.00 P ATOM 396 OP1 DC B 12 -7.380 7.580 11.807 1.00 0.00 O ATOM 397 OP2 DC B 12 -8.627 9.599 12.772 1.00 0.00 O ATOM 398 O5' DC B 12 -6.762 9.909 11.130 1.00 0.00 O ATOM 399 C5' DC B 12 -5.439 10.452 11.232 1.00 0.00 C ATOM 400 C4' DC B 12 -4.802 10.623 9.859 1.00 0.00 C ATOM 401 O4' DC B 12 -3.380 10.465 9.973 1.00 0.00 O ATOM 402 C3' DC B 12 -5.250 9.597 8.818 1.00 0.00 C ATOM 403 O3' DC B 12 -5.304 10.268 7.556 1.00 0.00 O ATOM 404 C2' DC B 12 -4.101 8.602 8.747 1.00 0.00 C ATOM 405 C1' DC B 12 -2.899 9.491 9.043 1.00 0.00 C ATOM 406 N1 DC B 12 -1.763 8.759 9.657 1.00 0.00 N ATOM 407 C2 DC B 12 -0.481 9.095 9.236 1.00 0.00 C ATOM 408 O2 DC B 12 -0.311 9.988 8.406 1.00 0.00 O ATOM 409 N3 DC B 12 0.577 8.434 9.776 1.00 0.00 N ATOM 410 C4 DC B 12 0.397 7.483 10.698 1.00 0.00 C ATOM 411 N4 DC B 12 1.481 6.887 11.196 1.00 0.00 N ATOM 412 C5 DC B 12 -0.916 7.130 11.140 1.00 0.00 C ATOM 413 C6 DC B 12 -1.961 7.786 10.599 1.00 0.00 C ATOM 0 H5' DC B 12 -4.820 9.795 11.843 1.00 0.00 H new ATOM 0 H5'' DC B 12 -5.478 11.416 11.740 1.00 0.00 H new ATOM 0 H4' DC B 12 -5.112 11.614 9.527 1.00 0.00 H new ATOM 0 H3' DC B 12 -6.209 9.135 9.053 1.00 0.00 H new ATOM 0 H2' DC B 12 -4.208 7.802 9.479 1.00 0.00 H new ATOM 0 H2'' DC B 12 -4.029 8.130 7.767 1.00 0.00 H new ATOM 0 H1' DC B 12 -2.515 9.913 8.114 1.00 0.00 H new ATOM 0 H41 DC B 12 1.383 6.157 11.901 1.00 0.00 H new ATOM 0 H42 DC B 12 2.408 7.161 10.872 1.00 0.00 H new ATOM 0 H5 DC B 12 -1.065 6.362 11.884 1.00 0.00 H new ATOM 0 H6 DC B 12 -2.965 7.542 10.912 1.00 0.00 H new ATOM 425 P DT B 13 -6.638 10.206 6.657 1.00 0.00 P ATOM 426 OP1 DT B 13 -7.508 11.340 7.040 1.00 0.00 O ATOM 427 OP2 DT B 13 -7.165 8.823 6.702 1.00 0.00 O ATOM 428 O5' DT B 13 -6.075 10.479 5.176 1.00 0.00 O ATOM 429 C5' DT B 13 -5.247 11.615 4.909 1.00 0.00 C ATOM 430 C4' DT B 13 -4.262 11.340 3.778 1.00 0.00 C ATOM 431 O4' DT B 13 -3.068 10.756 4.327 1.00 0.00 O ATOM 432 C3' DT B 13 -4.754 10.343 2.725 1.00 0.00 C ATOM 433 O3' DT B 13 -4.227 10.772 1.467 1.00 0.00 O ATOM 434 C2' DT B 13 -4.051 9.043 3.086 1.00 0.00 C ATOM 435 C1' DT B 13 -2.723 9.565 3.618 1.00 0.00 C ATOM 436 N1 DT B 13 -2.036 8.629 4.545 1.00 0.00 N ATOM 437 C2 DT B 13 -0.650 8.661 4.562 1.00 0.00 C ATOM 438 O2 DT B 13 0.003 9.420 3.848 1.00 0.00 O ATOM 439 N3 DT B 13 -0.030 7.779 5.431 1.00 0.00 N ATOM 440 C4 DT B 13 -0.663 6.882 6.268 1.00 0.00 C ATOM 441 O4 DT B 13 -0.004 6.144 6.997 1.00 0.00 O ATOM 442 C5 DT B 13 -2.103 6.913 6.188 1.00 0.00 C ATOM 443 C7 DT B 13 -2.923 5.958 7.054 1.00 0.00 C ATOM 444 C6 DT B 13 -2.735 7.763 5.354 1.00 0.00 C ATOM 0 H5' DT B 13 -4.699 11.886 5.811 1.00 0.00 H new ATOM 0 H5'' DT B 13 -5.873 12.468 4.648 1.00 0.00 H new ATOM 0 H4' DT B 13 -4.111 12.307 3.298 1.00 0.00 H new ATOM 0 H3' DT B 13 -5.839 10.252 2.683 1.00 0.00 H new ATOM 0 H2' DT B 13 -4.599 8.473 3.836 1.00 0.00 H new ATOM 0 H2'' DT B 13 -3.921 8.391 2.222 1.00 0.00 H new ATOM 0 H1' DT B 13 -2.026 9.714 2.793 1.00 0.00 H new ATOM 0 H3 DT B 13 0.990 7.793 5.455 1.00 0.00 H new ATOM 0 H71 DT B 13 -2.355 5.044 7.226 1.00 0.00 H new ATOM 0 H72 DT B 13 -3.145 6.433 8.010 1.00 0.00 H new ATOM 0 H73 DT B 13 -3.855 5.715 6.545 1.00 0.00 H new ATOM 0 H6 DT B 13 -3.814 7.764 5.320 1.00 0.00 H new HETATM 457 P XGA B 14 -4.988 10.417 0.093 1.00 0.00 P HETATM 458 OP1 XGA B 14 -6.037 11.437 -0.132 1.00 0.00 O HETATM 459 OP2 XGA B 14 -5.347 8.982 0.118 1.00 0.00 O HETATM 460 C5' XGA B 14 -2.709 11.470 -0.746 1.00 0.00 C HETATM 461 O5' XGA B 14 -3.836 10.627 -1.012 1.00 0.00 O HETATM 462 C4' XGA B 14 -1.462 10.989 -1.484 1.00 0.00 C HETATM 463 O4' XGA B 14 -0.625 10.279 -0.561 1.00 0.00 O HETATM 464 C3' XGA B 14 -1.735 10.012 -2.623 1.00 0.00 C HETATM 465 C2' XGA B 14 -1.523 8.640 -1.998 1.00 0.00 C HETATM 466 C1' XGA B 14 -0.436 8.918 -0.964 1.00 0.00 C HETATM 467 N9 XGA B 14 -0.505 8.049 0.201 1.00 0.00 N HETATM 468 C8 XGA B 14 -1.645 7.539 0.775 1.00 0.00 C HETATM 469 N7 XGA B 14 -1.380 6.792 1.819 1.00 0.00 N HETATM 470 C4 XGA B 14 2.790 7.147 1.779 1.00 0.00 C HETATM 471 C5 XGA B 14 2.222 6.355 2.799 1.00 0.00 C HETATM 472 N3 XGA B 14 4.111 7.331 1.668 1.00 0.00 N HETATM 473 C2 XGA B 14 4.897 6.722 2.585 1.00 0.00 C HETATM 474 N2 XGA B 14 6.237 6.895 2.483 1.00 0.00 N HETATM 475 N1 XGA B 14 4.437 5.950 3.590 1.00 0.00 N HETATM 476 C6 XGA B 14 3.075 5.746 3.723 1.00 0.00 C HETATM 477 O6 XGA B 14 2.639 5.040 4.630 1.00 0.00 O HETATM 478 C10 XGA B 14 0.568 7.590 0.938 1.00 0.00 C HETATM 479 C11 XGA B 14 -0.015 6.811 1.937 1.00 0.00 C HETATM 480 CP XGA B 14 0.813 6.185 2.881 1.00 0.00 C HETATM 481 CD XGA B 14 1.961 7.769 0.844 1.00 0.00 C HETATM 482 O3' XGA B 14 -0.702 10.198 -3.595 1.00 0.00 O HETATM 0 HN22 XGA B 14 6.861 6.451 3.157 1.00 0.00 H new HETATM 0 HN21 XGA B 14 6.621 7.469 1.733 1.00 0.00 H new HETATM 0 H5'2 XGA B 14 -2.939 12.492 -1.047 1.00 0.00 H new HETATM 0 H5'1 XGA B 14 -2.513 11.490 0.326 1.00 0.00 H new HETATM 0 H2'2 XGA B 14 -2.434 8.258 -1.538 1.00 0.00 H new HETATM 0 H2'1 XGA B 14 -1.204 7.902 -2.735 1.00 0.00 H new HETATM 0 HP XGA B 14 0.379 5.573 3.672 1.00 0.00 H new HETATM 0 HN1 XGA B 14 5.088 5.520 4.247 1.00 0.00 H new HETATM 0 HD XGA B 14 2.387 8.385 0.052 1.00 0.00 H new HETATM 0 H8 XGA B 14 -2.652 7.733 0.405 1.00 0.00 H new HETATM 0 H4' XGA B 14 -1.010 11.889 -1.901 1.00 0.00 H new HETATM 0 H3' XGA B 14 -2.719 10.136 -3.075 1.00 0.00 H new HETATM 0 H1' XGA B 14 0.542 8.730 -1.407 1.00 0.00 H new ATOM 496 P DC B 15 -0.976 9.891 -5.153 1.00 0.00 P ATOM 497 OP1 DC B 15 -0.165 10.829 -5.961 1.00 0.00 O ATOM 498 OP2 DC B 15 -2.439 9.811 -5.364 1.00 0.00 O ATOM 499 O5' DC B 15 -0.363 8.412 -5.331 1.00 0.00 O ATOM 500 C5' DC B 15 0.991 8.137 -4.958 1.00 0.00 C ATOM 501 C4' DC B 15 1.485 6.814 -5.541 1.00 0.00 C ATOM 502 O4' DC B 15 1.604 5.856 -4.480 1.00 0.00 O ATOM 503 C3' DC B 15 0.550 6.169 -6.560 1.00 0.00 C ATOM 504 O3' DC B 15 1.371 5.402 -7.447 1.00 0.00 O ATOM 505 C2' DC B 15 -0.267 5.180 -5.742 1.00 0.00 C ATOM 506 C1' DC B 15 0.742 4.732 -4.690 1.00 0.00 C ATOM 507 N1 DC B 15 0.113 4.378 -3.397 1.00 0.00 N ATOM 508 C2 DC B 15 0.579 3.244 -2.746 1.00 0.00 C ATOM 509 O2 DC B 15 1.468 2.558 -3.247 1.00 0.00 O ATOM 510 N3 DC B 15 0.040 2.918 -1.540 1.00 0.00 N ATOM 511 C4 DC B 15 -0.917 3.674 -0.988 1.00 0.00 C ATOM 512 N4 DC B 15 -1.378 3.316 0.211 1.00 0.00 N ATOM 513 C5 DC B 15 -1.406 4.840 -1.653 1.00 0.00 C ATOM 514 C6 DC B 15 -0.868 5.155 -2.846 1.00 0.00 C ATOM 0 H5' DC B 15 1.069 8.107 -3.871 1.00 0.00 H new ATOM 0 H5'' DC B 15 1.634 8.948 -5.301 1.00 0.00 H new ATOM 0 H4' DC B 15 2.422 7.061 -6.039 1.00 0.00 H new ATOM 0 H3' DC B 15 -0.060 6.886 -7.110 1.00 0.00 H new ATOM 0 H2' DC B 15 -1.144 5.647 -5.294 1.00 0.00 H new ATOM 0 H2'' DC B 15 -0.624 4.346 -6.347 1.00 0.00 H new ATOM 0 H1' DC B 15 1.258 3.838 -5.041 1.00 0.00 H new ATOM 0 H41 DC B 15 -2.107 3.868 0.663 1.00 0.00 H new ATOM 0 H42 DC B 15 -1.001 2.490 0.676 1.00 0.00 H new ATOM 0 H5 DC B 15 -2.182 5.449 -1.213 1.00 0.00 H new ATOM 0 H6 DC B 15 -1.215 6.031 -3.374 1.00 0.00 H new ATOM 526 P DG B 16 0.928 5.157 -8.976 1.00 0.00 P ATOM 527 OP1 DG B 16 1.547 6.209 -9.812 1.00 0.00 O ATOM 528 OP2 DG B 16 -0.538 4.954 -9.009 1.00 0.00 O ATOM 529 O5' DG B 16 1.636 3.753 -9.325 1.00 0.00 O ATOM 530 C5' DG B 16 2.828 3.347 -8.643 1.00 0.00 C ATOM 531 C4' DG B 16 2.935 1.827 -8.546 1.00 0.00 C ATOM 532 O4' DG B 16 2.486 1.412 -7.248 1.00 0.00 O ATOM 533 C3' DG B 16 2.070 1.054 -9.542 1.00 0.00 C ATOM 534 O3' DG B 16 2.785 -0.141 -9.866 1.00 0.00 O ATOM 535 C2' DG B 16 0.850 0.632 -8.738 1.00 0.00 C ATOM 536 C1' DG B 16 1.448 0.432 -7.352 1.00 0.00 C ATOM 537 N9 DG B 16 0.482 0.659 -6.258 1.00 0.00 N ATOM 538 C8 DG B 16 -0.581 1.526 -6.207 1.00 0.00 C ATOM 539 N7 DG B 16 -1.218 1.509 -5.069 1.00 0.00 N ATOM 540 C5 DG B 16 -0.532 0.565 -4.314 1.00 0.00 C ATOM 541 C6 DG B 16 -0.762 0.115 -2.985 1.00 0.00 C ATOM 542 O6 DG B 16 -1.631 0.479 -2.195 1.00 0.00 O ATOM 543 N1 DG B 16 0.161 -0.847 -2.604 1.00 0.00 N ATOM 544 C2 DG B 16 1.181 -1.320 -3.398 1.00 0.00 C ATOM 545 N2 DG B 16 1.981 -2.249 -2.871 1.00 0.00 N ATOM 546 N3 DG B 16 1.406 -0.904 -4.646 1.00 0.00 N ATOM 547 C4 DG B 16 0.512 0.036 -5.034 1.00 0.00 C ATOM 0 H5' DG B 16 2.838 3.777 -7.641 1.00 0.00 H new ATOM 0 H5'' DG B 16 3.699 3.740 -9.168 1.00 0.00 H new ATOM 0 H4' DG B 16 3.982 1.606 -8.755 1.00 0.00 H new ATOM 0 H3' DG B 16 1.822 1.625 -10.437 1.00 0.00 H new ATOM 0 H2' DG B 16 0.073 1.396 -8.742 1.00 0.00 H new ATOM 0 H2'' DG B 16 0.400 -0.282 -9.126 1.00 0.00 H new ATOM 0 H1' DG B 16 1.790 -0.598 -7.249 1.00 0.00 H new ATOM 0 H8 DG B 16 -0.864 2.163 -7.032 1.00 0.00 H new ATOM 0 H1 DG B 16 0.078 -1.234 -1.664 1.00 0.00 H new ATOM 0 H21 DG B 16 2.751 -2.630 -3.421 1.00 0.00 H new ATOM 0 H22 DG B 16 1.822 -2.578 -1.919 1.00 0.00 H new HETATM 559 P XTY B 17 3.345 -0.392 -11.355 1.00 0.00 P HETATM 560 OP1 XTY B 17 2.366 0.160 -12.320 1.00 0.00 O HETATM 561 OP2 XTY B 17 4.756 0.049 -11.399 1.00 0.00 O HETATM 562 C5' XTY B 17 3.405 -2.814 -10.295 1.00 0.00 C HETATM 563 C4' XTY B 17 2.648 -4.129 -10.461 1.00 0.00 C HETATM 564 O4' XTY B 17 1.701 -4.261 -9.393 1.00 0.00 O HETATM 565 C3' XTY B 17 1.819 -4.236 -11.732 1.00 0.00 C HETATM 566 C2' XTY B 17 0.463 -3.697 -11.308 1.00 0.00 C HETATM 567 C1' XTY B 17 0.345 -4.229 -9.876 1.00 0.00 C HETATM 568 O5' XTY B 17 3.314 -1.997 -11.469 1.00 0.00 O HETATM 569 C2 XTY B 17 0.368 -4.931 -5.804 1.00 0.00 C HETATM 570 O2 XTY B 17 0.971 -5.899 -5.344 1.00 0.00 O HETATM 571 N3 XTY B 17 -0.315 -4.061 -4.975 1.00 0.00 N HETATM 572 C4 XTY B 17 -1.021 -2.958 -5.406 1.00 0.00 C HETATM 573 O4 XTY B 17 -1.599 -2.231 -4.603 1.00 0.00 O HETATM 574 C5 XTY B 17 -1.053 -2.698 -6.777 1.00 0.00 C HETATM 575 C6 XTY B 17 -0.364 -3.569 -7.654 1.00 0.00 C HETATM 576 N XTY B 17 0.340 -4.677 -7.176 1.00 0.00 N HETATM 577 CP XTY B 17 -1.764 -1.585 -7.274 1.00 0.00 C HETATM 578 CD XTY B 17 -1.097 -2.205 -9.528 1.00 0.00 C HETATM 579 C8 XTY B 17 -0.375 -3.335 -9.046 1.00 0.00 C HETATM 580 C7 XTY B 17 -1.782 -1.346 -8.647 1.00 0.00 C HETATM 581 C7A XTY B 17 -2.549 -0.146 -9.196 1.00 0.00 C HETATM 582 O3' XTY B 17 1.663 -5.632 -12.020 1.00 0.00 O HETATM 0 H7A3 XTY B 17 -3.602 -0.233 -8.927 1.00 0.00 H new HETATM 0 H7A2 XTY B 17 -2.141 0.772 -8.772 1.00 0.00 H new HETATM 0 H7A1 XTY B 17 -2.452 -0.118 -10.281 1.00 0.00 H new HETATM 0 H5'2 XTY B 17 3.004 -2.269 -9.441 1.00 0.00 H new HETATM 0 H5'1 XTY B 17 4.452 -3.022 -10.077 1.00 0.00 H new HETATM 0 H2'2 XTY B 17 0.427 -2.608 -11.343 1.00 0.00 H new HETATM 0 H2'1 XTY B 17 -0.340 -4.063 -11.947 1.00 0.00 H new HETATM 0 HP XTY B 17 -2.293 -0.920 -6.592 1.00 0.00 H new HETATM 0 HN3 XTY B 17 -0.295 -4.248 -3.973 1.00 0.00 H new HETATM 0 HN XTY B 17 0.829 -5.295 -7.824 1.00 0.00 H new HETATM 0 HD XTY B 17 -1.120 -2.002 -10.599 1.00 0.00 H new HETATM 0 H4' XTY B 17 3.424 -4.894 -10.481 1.00 0.00 H new HETATM 0 H3' XTY B 17 2.248 -3.720 -12.591 1.00 0.00 H new HETATM 0 H1' XTY B 17 -0.168 -5.190 -9.863 1.00 0.00 H new ATOM 597 P DA B 18 2.444 -6.307 -13.261 1.00 0.00 P ATOM 598 OP1 DA B 18 3.531 -5.392 -13.680 1.00 0.00 O ATOM 599 OP2 DA B 18 1.439 -6.757 -14.248 1.00 0.00 O ATOM 600 O5' DA B 18 3.116 -7.614 -12.597 1.00 0.00 O ATOM 601 C5' DA B 18 4.116 -7.487 -11.579 1.00 0.00 C ATOM 602 C4' DA B 18 4.106 -8.676 -10.623 1.00 0.00 C ATOM 603 O4' DA B 18 3.119 -8.439 -9.611 1.00 0.00 O ATOM 604 C3' DA B 18 3.718 -10.005 -11.258 1.00 0.00 C ATOM 605 O3' DA B 18 4.333 -11.035 -10.479 1.00 0.00 O ATOM 606 C2' DA B 18 2.218 -10.102 -11.031 1.00 0.00 C ATOM 607 C1' DA B 18 2.039 -9.378 -9.699 1.00 0.00 C ATOM 608 N9 DA B 18 0.767 -8.625 -9.642 1.00 0.00 N ATOM 609 C8 DA B 18 0.144 -7.925 -10.645 1.00 0.00 C ATOM 610 N7 DA B 18 -0.964 -7.351 -10.274 1.00 0.00 N ATOM 611 C5 DA B 18 -1.083 -7.695 -8.933 1.00 0.00 C ATOM 612 C6 DA B 18 -2.051 -7.396 -7.963 1.00 0.00 C ATOM 613 N6 DA B 18 -3.124 -6.645 -8.203 1.00 0.00 N ATOM 614 N1 DA B 18 -1.872 -7.892 -6.729 1.00 0.00 N ATOM 615 C2 DA B 18 -0.801 -8.636 -6.481 1.00 0.00 C ATOM 616 N3 DA B 18 0.178 -8.988 -7.303 1.00 0.00 N ATOM 617 C4 DA B 18 -0.035 -8.473 -8.534 1.00 0.00 C ATOM 0 H5' DA B 18 3.948 -6.568 -11.018 1.00 0.00 H new ATOM 0 H5'' DA B 18 5.099 -7.402 -12.043 1.00 0.00 H new ATOM 0 H4' DA B 18 5.129 -8.755 -10.255 1.00 0.00 H new ATOM 0 H3' DA B 18 4.003 -10.089 -12.307 1.00 0.00 H new ATOM 0 H2' DA B 18 1.654 -9.624 -11.832 1.00 0.00 H new ATOM 0 H2'' DA B 18 1.881 -11.137 -10.979 1.00 0.00 H new ATOM 0 H1' DA B 18 2.028 -10.104 -8.886 1.00 0.00 H new ATOM 0 H8 DA B 18 0.537 -7.857 -11.649 1.00 0.00 H new ATOM 0 H61 DA B 18 -3.795 -6.461 -7.457 1.00 0.00 H new ATOM 0 H62 DA B 18 -3.275 -6.254 -9.133 1.00 0.00 H new ATOM 0 H2 DA B 18 -0.715 -9.006 -5.470 1.00 0.00 H new HETATM 629 P XCS B 19 4.992 -12.324 -11.188 1.00 0.00 P HETATM 630 OP2 XCS B 19 6.347 -12.519 -10.628 1.00 0.00 O HETATM 631 C6 XCS B 19 -1.870 -12.820 -9.573 1.00 0.00 C HETATM 632 C2 XCS B 19 -3.188 -13.414 -7.649 1.00 0.00 C HETATM 633 O2 XCS B 19 -3.372 -14.155 -6.688 1.00 0.00 O HETATM 634 N3 XCS B 19 -4.037 -12.369 -7.912 1.00 0.00 N HETATM 635 C4 XCS B 19 -3.840 -11.552 -8.965 1.00 0.00 C HETATM 636 N4 XCS B 19 -4.711 -10.560 -9.156 1.00 0.00 N HETATM 637 C5 XCS B 19 -2.732 -11.753 -9.847 1.00 0.00 C HETATM 638 OP1 XCS B 19 4.810 -12.196 -12.652 1.00 0.00 O HETATM 639 O5' XCS B 19 4.054 -13.526 -10.670 1.00 0.00 O HETATM 640 C5' XCS B 19 3.399 -13.444 -9.400 1.00 0.00 C HETATM 641 C4' XCS B 19 2.270 -14.464 -9.278 1.00 0.00 C HETATM 642 O4' XCS B 19 1.023 -13.768 -9.095 1.00 0.00 O HETATM 643 C1' XCS B 19 0.065 -14.185 -10.076 1.00 0.00 C HETATM 644 ND XCS B 19 -2.093 -13.644 -8.484 1.00 0.00 N HETATM 645 CP XCS B 19 -2.513 -10.906 -10.955 1.00 0.00 C HETATM 646 CD XCS B 19 -0.544 -12.217 -11.516 1.00 0.00 C HETATM 647 C8 XCS B 19 -0.756 -13.078 -10.401 1.00 0.00 C HETATM 648 C7 XCS B 19 -1.417 -11.145 -11.785 1.00 0.00 C HETATM 649 C7A XCS B 19 -1.168 -10.244 -12.992 1.00 0.00 C HETATM 650 C2' XCS B 19 0.929 -14.636 -11.249 1.00 0.00 C HETATM 651 C3' XCS B 19 2.055 -15.340 -10.514 1.00 0.00 C HETATM 652 O3' XCS B 19 1.538 -16.594 -10.052 1.00 0.00 O HETATM 0 HN42 XCS B 19 -4.593 -9.922 -9.943 1.00 0.00 H new HETATM 0 HN41 XCS B 19 -5.495 -10.439 -8.515 1.00 0.00 H new HETATM 0 H7A3 XCS B 19 -2.025 -10.291 -13.664 1.00 0.00 H new HETATM 0 H7A2 XCS B 19 -1.027 -9.217 -12.656 1.00 0.00 H new HETATM 0 H7A1 XCS B 19 -0.275 -10.580 -13.518 1.00 0.00 H new HETATM 0 H5'2 XCS B 19 4.126 -13.609 -8.605 1.00 0.00 H new HETATM 0 H5'1 XCS B 19 2.998 -12.440 -9.262 1.00 0.00 H new HETATM 0 H2'2 XCS B 19 0.394 -15.304 -11.924 1.00 0.00 H new HETATM 0 H2'1 XCS B 19 1.286 -13.797 -11.847 1.00 0.00 H new HETATM 0 HP XCS B 19 -3.191 -10.077 -11.159 1.00 0.00 H new HETATM 0 HND XCS B 19 -1.458 -14.419 -8.291 1.00 0.00 H new HETATM 0 HD XCS B 19 0.309 -12.391 -12.172 1.00 0.00 H new HETATM 0 H4' XCS B 19 2.563 -15.100 -8.443 1.00 0.00 H new HETATM 0 H3' XCS B 19 2.951 -15.490 -11.116 1.00 0.00 H new HETATM 0 H1' XCS B 19 -0.606 -14.981 -9.754 1.00 0.00 H new ATOM 668 P DA B 20 1.725 -17.938 -10.922 1.00 0.00 P ATOM 669 OP1 DA B 20 2.899 -17.762 -11.806 1.00 0.00 O ATOM 670 OP2 DA B 20 1.662 -19.095 -10.000 1.00 0.00 O ATOM 671 O5' DA B 20 0.400 -17.949 -11.839 1.00 0.00 O ATOM 672 C5' DA B 20 -0.274 -19.177 -12.139 1.00 0.00 C ATOM 673 C4' DA B 20 -1.529 -18.950 -12.981 1.00 0.00 C ATOM 674 O4' DA B 20 -2.666 -18.928 -12.113 1.00 0.00 O ATOM 675 C3' DA B 20 -1.576 -17.620 -13.729 1.00 0.00 C ATOM 676 O3' DA B 20 -2.418 -17.720 -14.880 1.00 0.00 O ATOM 677 C2' DA B 20 -2.198 -16.695 -12.691 1.00 0.00 C ATOM 678 C1' DA B 20 -3.215 -17.610 -12.018 1.00 0.00 C ATOM 679 N9 DA B 20 -3.397 -17.294 -10.589 1.00 0.00 N ATOM 680 C8 DA B 20 -2.468 -16.837 -9.690 1.00 0.00 C ATOM 681 N7 DA B 20 -2.937 -16.681 -8.486 1.00 0.00 N ATOM 682 C5 DA B 20 -4.267 -17.060 -8.597 1.00 0.00 C ATOM 683 C6 DA B 20 -5.311 -17.125 -7.668 1.00 0.00 C ATOM 684 N6 DA B 20 -5.169 -16.782 -6.389 1.00 0.00 N ATOM 685 N1 DA B 20 -6.512 -17.547 -8.103 1.00 0.00 N ATOM 686 C2 DA B 20 -6.653 -17.880 -9.382 1.00 0.00 C ATOM 687 N3 DA B 20 -5.750 -17.864 -10.351 1.00 0.00 N ATOM 688 C4 DA B 20 -4.562 -17.436 -9.875 1.00 0.00 C ATOM 0 H5' DA B 20 -0.546 -19.677 -11.210 1.00 0.00 H new ATOM 0 H5'' DA B 20 0.405 -19.842 -12.672 1.00 0.00 H new ATOM 0 H4' DA B 20 -1.524 -19.758 -13.712 1.00 0.00 H new ATOM 0 H3' DA B 20 -0.606 -17.285 -14.097 1.00 0.00 H new ATOM 0 H2' DA B 20 -1.458 -16.319 -11.985 1.00 0.00 H new ATOM 0 H2'' DA B 20 -2.671 -15.827 -13.150 1.00 0.00 H new ATOM 0 HO3' DA B 20 -2.438 -16.858 -15.347 1.00 0.00 H new ATOM 0 H1' DA B 20 -4.186 -17.498 -12.501 1.00 0.00 H new ATOM 0 H8 DA B 20 -1.443 -16.626 -9.956 1.00 0.00 H new ATOM 0 H61 DA B 20 -5.963 -16.848 -5.752 1.00 0.00 H new ATOM 0 H62 DA B 20 -4.266 -16.453 -6.046 1.00 0.00 H new ATOM 0 H2 DA B 20 -7.640 -18.209 -9.671 1.00 0.00 H new TER 701 DA B 20