USER MOD reduce.3.24.130724 H: found=0, std=0, add=243, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 263 hydrogens (20 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 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 15 DT O5' : rot 180:sc= 0 USER MOD Single : A 18 DT C7 :methyl 150:sc= -0.0641 (180deg=-0.0641) USER MOD Single : A 22 DT C7 :methyl -30:sc= 0 (180deg=-0.303) USER MOD Single : A 22 DT O3' : rot 180:sc= 0 USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot -32:sc= 0.0342 USER MOD Single : B 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 7 DT C7 :methyl -30:sc= -0.243 (180deg=-0.903) USER MOD Single : B 7 DT O3' : rot 180:sc= 0 USER MOD Single : C 8 DA O5' : rot -27:sc= 0.0105 USER MOD Single : C 14 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT B 1 0.924 12.221 11.166 1.00 0.00 O ATOM 2 C5' DT B 1 0.742 10.829 11.330 1.00 0.00 C ATOM 3 C4' DT B 1 -0.749 10.506 11.169 1.00 0.00 C ATOM 4 O4' DT B 1 -1.166 10.928 9.875 1.00 0.00 O ATOM 5 C3' DT B 1 -1.014 9.004 11.287 1.00 0.00 C ATOM 6 O3' DT B 1 -2.220 8.808 12.001 1.00 0.00 O ATOM 7 C2' DT B 1 -1.107 8.567 9.828 1.00 0.00 C ATOM 8 C1' DT B 1 -1.671 9.818 9.150 1.00 0.00 C ATOM 9 N1 DT B 1 -1.310 9.953 7.717 1.00 0.00 N ATOM 10 C2 DT B 1 -2.326 10.182 6.777 1.00 0.00 C ATOM 11 O2 DT B 1 -3.508 10.322 7.064 1.00 0.00 O ATOM 12 N3 DT B 1 -1.941 10.255 5.454 1.00 0.00 N ATOM 13 C4 DT B 1 -0.642 10.165 4.993 1.00 0.00 C ATOM 14 O4 DT B 1 -0.425 10.257 3.791 1.00 0.00 O ATOM 15 C5 DT B 1 0.362 9.966 6.030 1.00 0.00 C ATOM 16 C7 DT B 1 1.827 9.857 5.672 1.00 0.00 C ATOM 17 C6 DT B 1 0.007 9.873 7.333 1.00 0.00 C ATOM 0 H5' DT B 1 1.093 10.515 12.313 1.00 0.00 H new ATOM 0 H5'' DT B 1 1.329 10.282 10.593 1.00 0.00 H new ATOM 0 H4' DT B 1 -1.298 11.021 11.958 1.00 0.00 H new ATOM 0 H3' DT B 1 -0.258 8.435 11.827 1.00 0.00 H new ATOM 0 H2' DT B 1 -0.134 8.289 9.424 1.00 0.00 H new ATOM 0 H2'' DT B 1 -1.763 7.705 9.702 1.00 0.00 H new ATOM 0 HO5' DT B 1 0.262 12.565 10.531 1.00 0.00 H new ATOM 0 H1' DT B 1 -2.759 9.755 9.163 1.00 0.00 H new ATOM 0 H3 DT B 1 -2.676 10.386 4.759 1.00 0.00 H new ATOM 0 H71 DT B 1 2.432 10.236 6.495 1.00 0.00 H new ATOM 0 H72 DT B 1 2.080 8.813 5.487 1.00 0.00 H new ATOM 0 H73 DT B 1 2.027 10.443 4.775 1.00 0.00 H new ATOM 0 H6 DT B 1 0.771 9.734 8.083 1.00 0.00 H new ATOM 31 P DC B 2 -2.724 7.338 12.439 1.00 0.00 P ATOM 32 OP1 DC B 2 -3.547 7.438 13.661 1.00 0.00 O ATOM 33 OP2 DC B 2 -1.573 6.410 12.442 1.00 0.00 O ATOM 34 O5' DC B 2 -3.656 7.068 11.158 1.00 0.00 O ATOM 35 C5' DC B 2 -4.825 7.839 10.933 1.00 0.00 C ATOM 36 C4' DC B 2 -5.463 7.500 9.587 1.00 0.00 C ATOM 37 O4' DC B 2 -4.612 7.854 8.505 1.00 0.00 O ATOM 38 C3' DC B 2 -5.809 6.015 9.436 1.00 0.00 C ATOM 39 O3' DC B 2 -7.212 5.909 9.266 1.00 0.00 O ATOM 40 C2' DC B 2 -5.037 5.611 8.182 1.00 0.00 C ATOM 41 C1' DC B 2 -4.885 6.947 7.458 1.00 0.00 C ATOM 42 N1 DC B 2 -3.797 6.957 6.441 1.00 0.00 N ATOM 43 C2 DC B 2 -4.119 7.206 5.101 1.00 0.00 C ATOM 44 O2 DC B 2 -5.273 7.416 4.738 1.00 0.00 O ATOM 45 N3 DC B 2 -3.149 7.195 4.153 1.00 0.00 N ATOM 46 C4 DC B 2 -1.897 6.976 4.508 1.00 0.00 C ATOM 47 N4 DC B 2 -1.012 7.007 3.541 1.00 0.00 N ATOM 48 C5 DC B 2 -1.508 6.733 5.861 1.00 0.00 C ATOM 49 C6 DC B 2 -2.492 6.723 6.797 1.00 0.00 C ATOM 0 H5' DC B 2 -4.575 8.900 10.963 1.00 0.00 H new ATOM 0 H5'' DC B 2 -5.542 7.658 11.734 1.00 0.00 H new ATOM 0 H4' DC B 2 -6.385 8.081 9.562 1.00 0.00 H new ATOM 0 H3' DC B 2 -5.549 5.381 10.284 1.00 0.00 H new ATOM 0 H2' DC B 2 -4.072 5.166 8.423 1.00 0.00 H new ATOM 0 H2'' DC B 2 -5.584 4.882 7.583 1.00 0.00 H new ATOM 0 H1' DC B 2 -5.777 7.191 6.881 1.00 0.00 H new ATOM 0 H41 DC B 2 -0.026 6.846 3.747 1.00 0.00 H new ATOM 0 H42 DC B 2 -1.310 7.192 2.583 1.00 0.00 H new ATOM 0 H5 DC B 2 -0.475 6.564 6.128 1.00 0.00 H new ATOM 0 H6 DC B 2 -2.246 6.529 7.831 1.00 0.00 H new ATOM 61 P DC B 3 -7.960 4.483 9.218 1.00 0.00 P ATOM 62 OP1 DC B 3 -9.299 4.600 9.835 1.00 0.00 O ATOM 63 OP2 DC B 3 -7.064 3.413 9.701 1.00 0.00 O ATOM 64 O5' DC B 3 -8.097 4.393 7.618 1.00 0.00 O ATOM 65 C5' DC B 3 -8.990 5.243 6.917 1.00 0.00 C ATOM 66 C4' DC B 3 -9.122 4.833 5.447 1.00 0.00 C ATOM 67 O4' DC B 3 -7.937 5.147 4.725 1.00 0.00 O ATOM 68 C3' DC B 3 -9.409 3.336 5.286 1.00 0.00 C ATOM 69 O3' DC B 3 -10.561 3.180 4.474 1.00 0.00 O ATOM 70 C2' DC B 3 -8.132 2.827 4.625 1.00 0.00 C ATOM 71 C1' DC B 3 -7.650 4.065 3.863 1.00 0.00 C ATOM 72 N1 DC B 3 -6.196 4.050 3.541 1.00 0.00 N ATOM 73 C2 DC B 3 -5.785 4.185 2.208 1.00 0.00 C ATOM 74 O2 DC B 3 -6.581 4.323 1.280 1.00 0.00 O ATOM 75 N3 DC B 3 -4.465 4.139 1.898 1.00 0.00 N ATOM 76 C4 DC B 3 -3.576 3.975 2.859 1.00 0.00 C ATOM 77 N4 DC B 3 -2.328 3.882 2.476 1.00 0.00 N ATOM 78 C5 DC B 3 -3.935 3.842 4.232 1.00 0.00 C ATOM 79 C6 DC B 3 -5.258 3.896 4.534 1.00 0.00 C ATOM 0 H5' DC B 3 -8.637 6.272 6.978 1.00 0.00 H new ATOM 0 H5'' DC B 3 -9.970 5.214 7.393 1.00 0.00 H new ATOM 0 H4' DC B 3 -9.965 5.396 5.047 1.00 0.00 H new ATOM 0 H3' DC B 3 -9.625 2.792 6.205 1.00 0.00 H new ATOM 0 H2' DC B 3 -7.400 2.489 5.359 1.00 0.00 H new ATOM 0 H2'' DC B 3 -8.325 1.987 3.958 1.00 0.00 H new ATOM 0 H1' DC B 3 -8.148 4.122 2.895 1.00 0.00 H new ATOM 0 H41 DC B 3 -1.590 3.754 3.169 1.00 0.00 H new ATOM 0 H42 DC B 3 -2.093 3.937 1.485 1.00 0.00 H new ATOM 0 H5 DC B 3 -3.187 3.704 4.999 1.00 0.00 H new ATOM 0 H6 DC B 3 -5.576 3.817 5.563 1.00 0.00 H new ATOM 91 P DT B 4 -11.333 1.766 4.339 1.00 0.00 P ATOM 92 OP1 DT B 4 -12.737 2.016 3.950 1.00 0.00 O ATOM 93 OP2 DT B 4 -11.087 0.938 5.539 1.00 0.00 O ATOM 94 O5' DT B 4 -10.496 1.215 3.080 1.00 0.00 O ATOM 95 C5' DT B 4 -10.668 1.786 1.794 1.00 0.00 C ATOM 96 C4' DT B 4 -9.574 1.341 0.824 1.00 0.00 C ATOM 97 O4' DT B 4 -8.292 1.791 1.229 1.00 0.00 O ATOM 98 C3' DT B 4 -9.444 -0.170 0.661 1.00 0.00 C ATOM 99 O3' DT B 4 -10.309 -0.643 -0.354 1.00 0.00 O ATOM 100 C2' DT B 4 -7.974 -0.330 0.275 1.00 0.00 C ATOM 101 C1' DT B 4 -7.367 1.063 0.453 1.00 0.00 C ATOM 102 N1 DT B 4 -6.019 1.007 1.070 1.00 0.00 N ATOM 103 C2 DT B 4 -4.923 1.160 0.222 1.00 0.00 C ATOM 104 O2 DT B 4 -5.020 1.342 -0.986 1.00 0.00 O ATOM 105 N3 DT B 4 -3.680 1.047 0.797 1.00 0.00 N ATOM 106 C4 DT B 4 -3.412 0.708 2.098 1.00 0.00 C ATOM 107 O4 DT B 4 -2.236 0.542 2.419 1.00 0.00 O ATOM 108 C5 DT B 4 -4.600 0.554 2.937 1.00 0.00 C ATOM 109 C7 DT B 4 -4.452 0.217 4.411 1.00 0.00 C ATOM 110 C6 DT B 4 -5.847 0.706 2.406 1.00 0.00 C ATOM 0 H5' DT B 4 -10.662 2.873 1.875 1.00 0.00 H new ATOM 0 H5'' DT B 4 -11.643 1.502 1.398 1.00 0.00 H new ATOM 0 H4' DT B 4 -9.891 1.784 -0.120 1.00 0.00 H new ATOM 0 H3' DT B 4 -9.717 -0.738 1.550 1.00 0.00 H new ATOM 0 H2' DT B 4 -7.476 -1.062 0.911 1.00 0.00 H new ATOM 0 H2'' DT B 4 -7.871 -0.678 -0.753 1.00 0.00 H new ATOM 0 H1' DT B 4 -7.204 1.551 -0.508 1.00 0.00 H new ATOM 0 H3 DT B 4 -2.877 1.234 0.196 1.00 0.00 H new ATOM 0 H71 DT B 4 -5.287 0.643 4.967 1.00 0.00 H new ATOM 0 H72 DT B 4 -4.446 -0.866 4.538 1.00 0.00 H new ATOM 0 H73 DT B 4 -3.516 0.631 4.787 1.00 0.00 H new ATOM 0 H6 DT B 4 -6.713 0.589 3.041 1.00 0.00 H new ATOM 123 P DC B 5 -10.517 -2.225 -0.613 1.00 0.00 P ATOM 124 OP1 DC B 5 -11.850 -2.456 -1.205 1.00 0.00 O ATOM 125 OP2 DC B 5 -10.147 -2.991 0.597 1.00 0.00 O ATOM 126 O5' DC B 5 -9.373 -2.430 -1.728 1.00 0.00 O ATOM 127 C5' DC B 5 -9.520 -1.883 -3.028 1.00 0.00 C ATOM 128 C4' DC B 5 -8.354 -2.276 -3.939 1.00 0.00 C ATOM 129 O4' DC B 5 -7.138 -1.732 -3.447 1.00 0.00 O ATOM 130 C3' DC B 5 -8.181 -3.793 -4.069 1.00 0.00 C ATOM 131 O3' DC B 5 -8.118 -4.124 -5.445 1.00 0.00 O ATOM 132 C2' DC B 5 -6.840 -4.063 -3.402 1.00 0.00 C ATOM 133 C1' DC B 5 -6.131 -2.716 -3.569 1.00 0.00 C ATOM 134 N1 DC B 5 -5.084 -2.479 -2.540 1.00 0.00 N ATOM 135 C2 DC B 5 -3.748 -2.365 -2.938 1.00 0.00 C ATOM 136 O2 DC B 5 -3.404 -2.482 -4.114 1.00 0.00 O ATOM 137 N3 DC B 5 -2.782 -2.144 -2.012 1.00 0.00 N ATOM 138 C4 DC B 5 -3.119 -2.040 -0.737 1.00 0.00 C ATOM 139 N4 DC B 5 -2.128 -1.808 0.086 1.00 0.00 N ATOM 140 C5 DC B 5 -4.464 -2.156 -0.273 1.00 0.00 C ATOM 141 C6 DC B 5 -5.421 -2.377 -1.211 1.00 0.00 C ATOM 0 H5' DC B 5 -9.581 -0.797 -2.962 1.00 0.00 H new ATOM 0 H5'' DC B 5 -10.457 -2.229 -3.465 1.00 0.00 H new ATOM 0 H4' DC B 5 -8.593 -1.874 -4.923 1.00 0.00 H new ATOM 0 H3' DC B 5 -8.991 -4.370 -3.622 1.00 0.00 H new ATOM 0 H2' DC B 5 -6.953 -4.339 -2.353 1.00 0.00 H new ATOM 0 H2'' DC B 5 -6.297 -4.874 -3.888 1.00 0.00 H new ATOM 0 H1' DC B 5 -5.620 -2.690 -4.531 1.00 0.00 H new ATOM 0 H41 DC B 5 -2.307 -1.715 1.086 1.00 0.00 H new ATOM 0 H42 DC B 5 -1.177 -1.720 -0.273 1.00 0.00 H new ATOM 0 H5 DC B 5 -4.709 -2.072 0.775 1.00 0.00 H new ATOM 0 H6 DC B 5 -6.454 -2.473 -0.911 1.00 0.00 H new ATOM 153 P DC B 6 -8.849 -5.436 -6.027 1.00 0.00 P ATOM 154 OP1 DC B 6 -9.037 -5.230 -7.479 1.00 0.00 O ATOM 155 OP2 DC B 6 -10.043 -5.743 -5.212 1.00 0.00 O ATOM 156 O5' DC B 6 -7.680 -6.512 -5.736 1.00 0.00 O ATOM 157 C5' DC B 6 -6.737 -6.850 -6.743 1.00 0.00 C ATOM 158 C4' DC B 6 -5.845 -8.034 -6.350 1.00 0.00 C ATOM 159 O4' DC B 6 -4.831 -7.651 -5.418 1.00 0.00 O ATOM 160 C3' DC B 6 -6.619 -9.209 -5.718 1.00 0.00 C ATOM 161 O3' DC B 6 -6.418 -10.454 -6.372 1.00 0.00 O ATOM 162 C2' DC B 6 -5.953 -9.326 -4.358 1.00 0.00 C ATOM 163 C1' DC B 6 -4.547 -8.829 -4.698 1.00 0.00 C ATOM 164 N1 DC B 6 -3.597 -8.673 -3.557 1.00 0.00 N ATOM 165 C2 DC B 6 -2.225 -8.604 -3.856 1.00 0.00 C ATOM 166 O2 DC B 6 -1.790 -8.482 -5.003 1.00 0.00 O ATOM 167 N3 DC B 6 -1.308 -8.708 -2.862 1.00 0.00 N ATOM 168 C4 DC B 6 -1.718 -8.850 -1.616 1.00 0.00 C ATOM 169 N4 DC B 6 -0.793 -8.953 -0.701 1.00 0.00 N ATOM 170 C5 DC B 6 -3.084 -8.904 -1.244 1.00 0.00 C ATOM 171 C6 DC B 6 -4.000 -8.817 -2.243 1.00 0.00 C ATOM 0 H5' DC B 6 -6.110 -5.983 -6.953 1.00 0.00 H new ATOM 0 H5'' DC B 6 -7.267 -7.091 -7.664 1.00 0.00 H new ATOM 0 H4' DC B 6 -5.407 -8.360 -7.293 1.00 0.00 H new ATOM 0 H3' DC B 6 -7.692 -9.019 -5.743 1.00 0.00 H new ATOM 0 H2' DC B 6 -6.440 -8.709 -3.603 1.00 0.00 H new ATOM 0 H2'' DC B 6 -5.952 -10.349 -3.982 1.00 0.00 H new ATOM 0 H1' DC B 6 -3.971 -9.561 -5.264 1.00 0.00 H new ATOM 0 H41 DC B 6 -1.055 -9.065 0.279 1.00 0.00 H new ATOM 0 H42 DC B 6 0.192 -8.922 -0.965 1.00 0.00 H new ATOM 0 H5 DC B 6 -3.384 -9.010 -0.212 1.00 0.00 H new ATOM 0 H6 DC B 6 -5.053 -8.861 -2.008 1.00 0.00 H new ATOM 183 P DT B 7 -7.251 -10.857 -7.692 1.00 0.00 P ATOM 184 OP1 DT B 7 -8.491 -10.064 -7.787 1.00 0.00 O ATOM 185 OP2 DT B 7 -7.368 -12.330 -7.743 1.00 0.00 O ATOM 186 O5' DT B 7 -6.184 -10.343 -8.788 1.00 0.00 O ATOM 187 C5' DT B 7 -5.137 -11.184 -9.238 1.00 0.00 C ATOM 188 C4' DT B 7 -3.777 -10.515 -9.037 1.00 0.00 C ATOM 189 O4' DT B 7 -3.509 -10.408 -7.645 1.00 0.00 O ATOM 190 C3' DT B 7 -2.667 -11.389 -9.643 1.00 0.00 C ATOM 191 O3' DT B 7 -1.667 -10.584 -10.247 1.00 0.00 O ATOM 192 C2' DT B 7 -2.091 -12.093 -8.422 1.00 0.00 C ATOM 193 C1' DT B 7 -2.250 -10.992 -7.380 1.00 0.00 C ATOM 194 N1 DT B 7 -2.117 -11.490 -5.991 1.00 0.00 N ATOM 195 C2 DT B 7 -0.844 -11.446 -5.421 1.00 0.00 C ATOM 196 O2 DT B 7 0.170 -11.166 -6.052 1.00 0.00 O ATOM 197 N3 DT B 7 -0.758 -11.742 -4.080 1.00 0.00 N ATOM 198 C4 DT B 7 -1.802 -12.092 -3.257 1.00 0.00 C ATOM 199 O4 DT B 7 -1.572 -12.265 -2.063 1.00 0.00 O ATOM 200 C5 DT B 7 -3.091 -12.205 -3.942 1.00 0.00 C ATOM 201 C7 DT B 7 -4.323 -12.632 -3.177 1.00 0.00 C ATOM 202 C6 DT B 7 -3.209 -11.913 -5.267 1.00 0.00 C ATOM 0 H5' DT B 7 -5.280 -11.417 -10.293 1.00 0.00 H new ATOM 0 H5'' DT B 7 -5.166 -12.129 -8.696 1.00 0.00 H new ATOM 0 H4' DT B 7 -3.799 -9.535 -9.514 1.00 0.00 H new ATOM 0 H3' DT B 7 -3.030 -12.066 -10.417 1.00 0.00 H new ATOM 0 H2' DT B 7 -2.644 -12.995 -8.162 1.00 0.00 H new ATOM 0 H2'' DT B 7 -1.051 -12.386 -8.563 1.00 0.00 H new ATOM 0 HO3' DT B 7 -0.969 -11.158 -10.625 1.00 0.00 H new ATOM 0 H1' DT B 7 -1.452 -10.253 -7.456 1.00 0.00 H new ATOM 0 H3 DT B 7 0.169 -11.697 -3.656 1.00 0.00 H new ATOM 0 H71 DT B 7 -4.033 -13.293 -2.360 1.00 0.00 H new ATOM 0 H72 DT B 7 -4.823 -11.752 -2.772 1.00 0.00 H new ATOM 0 H73 DT B 7 -5.002 -13.160 -3.847 1.00 0.00 H new ATOM 0 H6 DT B 7 -4.168 -12.014 -5.754 1.00 0.00 H new TER 216 DT B 7 ATOM 217 O5' DA C 8 8.242 -14.779 -1.295 1.00 0.00 O ATOM 218 C5' DA C 8 8.843 -13.503 -1.395 1.00 0.00 C ATOM 219 C4' DA C 8 8.742 -13.024 -2.850 1.00 0.00 C ATOM 220 O4' DA C 8 7.372 -12.902 -3.211 1.00 0.00 O ATOM 221 C3' DA C 8 9.364 -11.645 -3.054 1.00 0.00 C ATOM 222 O3' DA C 8 9.811 -11.553 -4.396 1.00 0.00 O ATOM 223 C2' DA C 8 8.197 -10.712 -2.741 1.00 0.00 C ATOM 224 C1' DA C 8 6.980 -11.537 -3.174 1.00 0.00 C ATOM 225 N9 DA C 8 5.803 -11.418 -2.281 1.00 0.00 N ATOM 226 C8 DA C 8 5.747 -11.299 -0.912 1.00 0.00 C ATOM 227 N7 DA C 8 4.537 -11.345 -0.428 1.00 0.00 N ATOM 228 C5 DA C 8 3.728 -11.464 -1.552 1.00 0.00 C ATOM 229 C6 DA C 8 2.331 -11.557 -1.758 1.00 0.00 C ATOM 230 N6 DA C 8 1.415 -11.567 -0.796 1.00 0.00 N ATOM 231 N1 DA C 8 1.852 -11.648 -3.003 1.00 0.00 N ATOM 232 C2 DA C 8 2.714 -11.651 -4.017 1.00 0.00 C ATOM 233 N3 DA C 8 4.037 -11.579 -3.969 1.00 0.00 N ATOM 234 C4 DA C 8 4.490 -11.486 -2.690 1.00 0.00 C ATOM 0 H5' DA C 8 9.887 -13.552 -1.085 1.00 0.00 H new ATOM 0 H5'' DA C 8 8.345 -12.798 -0.730 1.00 0.00 H new ATOM 0 H4' DA C 8 9.273 -13.757 -3.457 1.00 0.00 H new ATOM 0 H3' DA C 8 10.233 -11.414 -2.437 1.00 0.00 H new ATOM 0 H2' DA C 8 8.156 -10.456 -1.682 1.00 0.00 H new ATOM 0 H2'' DA C 8 8.268 -9.775 -3.293 1.00 0.00 H new ATOM 0 HO5' DA C 8 7.553 -14.871 -1.986 1.00 0.00 H new ATOM 0 H1' DA C 8 6.668 -11.150 -4.144 1.00 0.00 H new ATOM 0 H8 DA C 8 6.625 -11.178 -0.294 1.00 0.00 H new ATOM 0 H61 DA C 8 0.426 -11.637 -1.034 1.00 0.00 H new ATOM 0 H62 DA C 8 1.701 -11.505 0.181 1.00 0.00 H new ATOM 0 H2 DA C 8 2.281 -11.721 -5.004 1.00 0.00 H new ATOM 247 P DG C 9 10.722 -10.325 -4.906 1.00 0.00 P ATOM 248 OP1 DG C 9 11.556 -10.771 -6.042 1.00 0.00 O ATOM 249 OP2 DG C 9 11.396 -9.710 -3.744 1.00 0.00 O ATOM 250 O5' DG C 9 9.530 -9.377 -5.427 1.00 0.00 O ATOM 251 C5' DG C 9 8.882 -9.628 -6.665 1.00 0.00 C ATOM 252 C4' DG C 9 7.769 -8.610 -6.944 1.00 0.00 C ATOM 253 O4' DG C 9 6.629 -8.896 -6.142 1.00 0.00 O ATOM 254 C3' DG C 9 8.197 -7.161 -6.667 1.00 0.00 C ATOM 255 O3' DG C 9 7.932 -6.355 -7.803 1.00 0.00 O ATOM 256 C2' DG C 9 7.319 -6.782 -5.479 1.00 0.00 C ATOM 257 C1' DG C 9 6.092 -7.665 -5.705 1.00 0.00 C ATOM 258 N9 DG C 9 5.256 -7.863 -4.497 1.00 0.00 N ATOM 259 C8 DG C 9 5.652 -7.957 -3.179 1.00 0.00 C ATOM 260 N7 DG C 9 4.675 -8.144 -2.337 1.00 0.00 N ATOM 261 C5 DG C 9 3.548 -8.157 -3.155 1.00 0.00 C ATOM 262 C6 DG C 9 2.173 -8.325 -2.815 1.00 0.00 C ATOM 263 O6 DG C 9 1.688 -8.509 -1.709 1.00 0.00 O ATOM 264 N1 DG C 9 1.317 -8.275 -3.892 1.00 0.00 N ATOM 265 C2 DG C 9 1.725 -8.074 -5.174 1.00 0.00 C ATOM 266 N2 DG C 9 0.769 -8.029 -6.074 1.00 0.00 N ATOM 267 N3 DG C 9 3.005 -7.913 -5.537 1.00 0.00 N ATOM 268 C4 DG C 9 3.880 -7.973 -4.478 1.00 0.00 C ATOM 0 H5' DG C 9 8.461 -10.633 -6.657 1.00 0.00 H new ATOM 0 H5'' DG C 9 9.615 -9.595 -7.472 1.00 0.00 H new ATOM 0 H4' DG C 9 7.536 -8.700 -8.005 1.00 0.00 H new ATOM 0 H3' DG C 9 9.259 -7.032 -6.460 1.00 0.00 H new ATOM 0 H2' DG C 9 7.805 -6.993 -4.527 1.00 0.00 H new ATOM 0 H2'' DG C 9 7.066 -5.722 -5.479 1.00 0.00 H new ATOM 0 H1' DG C 9 5.415 -7.197 -6.420 1.00 0.00 H new ATOM 0 H8 DG C 9 6.684 -7.882 -2.871 1.00 0.00 H new ATOM 0 H1 DG C 9 0.319 -8.396 -3.719 1.00 0.00 H new ATOM 0 H21 DG C 9 1.000 -7.881 -7.056 1.00 0.00 H new ATOM 0 H22 DG C 9 -0.204 -8.142 -5.790 1.00 0.00 H new ATOM 280 P DG C 10 8.545 -4.867 -7.944 1.00 0.00 P ATOM 281 OP1 DG C 10 8.750 -4.555 -9.374 1.00 0.00 O ATOM 282 OP2 DG C 10 9.698 -4.699 -7.032 1.00 0.00 O ATOM 283 O5' DG C 10 7.284 -4.037 -7.374 1.00 0.00 O ATOM 284 C5' DG C 10 6.110 -3.858 -8.151 1.00 0.00 C ATOM 285 C4' DG C 10 5.178 -2.782 -7.578 1.00 0.00 C ATOM 286 O4' DG C 10 4.416 -3.267 -6.472 1.00 0.00 O ATOM 287 C3' DG C 10 5.930 -1.512 -7.107 1.00 0.00 C ATOM 288 O3' DG C 10 5.375 -0.254 -7.499 1.00 0.00 O ATOM 289 C2' DG C 10 5.709 -1.604 -5.596 1.00 0.00 C ATOM 290 C1' DG C 10 4.289 -2.164 -5.599 1.00 0.00 C ATOM 291 N9 DG C 10 3.672 -2.455 -4.278 1.00 0.00 N ATOM 292 C8 DG C 10 4.223 -2.369 -3.016 1.00 0.00 C ATOM 293 N7 DG C 10 3.342 -2.257 -2.060 1.00 0.00 N ATOM 294 C5 DG C 10 2.116 -2.290 -2.720 1.00 0.00 C ATOM 295 C6 DG C 10 0.780 -2.124 -2.226 1.00 0.00 C ATOM 296 O6 DG C 10 0.396 -1.869 -1.086 1.00 0.00 O ATOM 297 N1 DG C 10 -0.185 -2.258 -3.201 1.00 0.00 N ATOM 298 C2 DG C 10 0.090 -2.502 -4.508 1.00 0.00 C ATOM 299 N2 DG C 10 -0.942 -2.602 -5.312 1.00 0.00 N ATOM 300 N3 DG C 10 1.320 -2.618 -5.013 1.00 0.00 N ATOM 301 C4 DG C 10 2.305 -2.498 -4.068 1.00 0.00 C ATOM 0 H5' DG C 10 5.572 -4.804 -8.212 1.00 0.00 H new ATOM 0 H5'' DG C 10 6.391 -3.585 -9.168 1.00 0.00 H new ATOM 0 H4' DG C 10 4.520 -2.522 -8.407 1.00 0.00 H new ATOM 0 H3' DG C 10 6.941 -1.512 -7.514 1.00 0.00 H new ATOM 0 H2' DG C 10 6.422 -2.266 -5.105 1.00 0.00 H new ATOM 0 H2'' DG C 10 5.779 -0.636 -5.100 1.00 0.00 H new ATOM 0 H1' DG C 10 3.557 -1.427 -5.928 1.00 0.00 H new ATOM 0 H8 DG C 10 5.288 -2.392 -2.836 1.00 0.00 H new ATOM 0 H1 DG C 10 -1.163 -2.169 -2.925 1.00 0.00 H new ATOM 0 H21 DG C 10 -0.799 -2.785 -6.305 1.00 0.00 H new ATOM 0 H22 DG C 10 -1.887 -2.497 -4.944 1.00 0.00 H new ATOM 313 P DA C 11 5.043 0.193 -9.017 1.00 0.00 P ATOM 314 OP1 DA C 11 5.087 -0.867 -10.042 1.00 0.00 O ATOM 315 OP2 DA C 11 5.505 1.553 -9.389 1.00 0.00 O ATOM 316 O5' DA C 11 3.521 0.570 -8.676 1.00 0.00 O ATOM 317 C5' DA C 11 2.500 -0.400 -8.511 1.00 0.00 C ATOM 318 C4' DA C 11 1.375 0.140 -7.622 1.00 0.00 C ATOM 319 O4' DA C 11 1.670 0.082 -6.242 1.00 0.00 O ATOM 320 C3' DA C 11 1.045 1.613 -7.830 1.00 0.00 C ATOM 321 O3' DA C 11 0.277 1.746 -9.011 1.00 0.00 O ATOM 322 C2' DA C 11 0.358 2.011 -6.522 1.00 0.00 C ATOM 323 C1' DA C 11 0.611 0.789 -5.635 1.00 0.00 C ATOM 324 N9 DA C 11 0.876 1.102 -4.217 1.00 0.00 N ATOM 325 C8 DA C 11 2.056 1.331 -3.550 1.00 0.00 C ATOM 326 N7 DA C 11 1.914 1.451 -2.251 1.00 0.00 N ATOM 327 C5 DA C 11 0.533 1.313 -2.056 1.00 0.00 C ATOM 328 C6 DA C 11 -0.339 1.291 -0.938 1.00 0.00 C ATOM 329 N6 DA C 11 -0.002 1.400 0.339 1.00 0.00 N ATOM 330 N1 DA C 11 -1.650 1.112 -1.118 1.00 0.00 N ATOM 331 C2 DA C 11 -2.111 0.936 -2.351 1.00 0.00 C ATOM 332 N3 DA C 11 -1.420 0.907 -3.478 1.00 0.00 N ATOM 333 C4 DA C 11 -0.095 1.114 -3.257 1.00 0.00 C ATOM 0 H5' DA C 11 2.919 -1.303 -8.067 1.00 0.00 H new ATOM 0 H5'' DA C 11 2.098 -0.680 -9.484 1.00 0.00 H new ATOM 0 H4' DA C 11 0.551 -0.510 -7.917 1.00 0.00 H new ATOM 0 H3' DA C 11 1.890 2.280 -8.001 1.00 0.00 H new ATOM 0 H2' DA C 11 0.788 2.918 -6.097 1.00 0.00 H new ATOM 0 H2'' DA C 11 -0.707 2.198 -6.662 1.00 0.00 H new ATOM 0 H1' DA C 11 -0.295 0.186 -5.577 1.00 0.00 H new ATOM 0 H8 DA C 11 3.011 1.405 -4.049 1.00 0.00 H new ATOM 0 H61 DA C 11 -0.722 1.370 1.061 1.00 0.00 H new ATOM 0 H62 DA C 11 0.977 1.514 0.600 1.00 0.00 H new ATOM 0 H2 DA C 11 -3.178 0.800 -2.444 1.00 0.00 H new ATOM 345 P DG C 12 0.228 3.125 -9.820 1.00 0.00 P ATOM 346 OP1 DG C 12 -0.236 2.803 -11.189 1.00 0.00 O ATOM 347 OP2 DG C 12 1.580 3.728 -9.705 1.00 0.00 O ATOM 348 O5' DG C 12 -0.980 3.786 -8.979 1.00 0.00 O ATOM 349 C5' DG C 12 -2.290 3.244 -9.093 1.00 0.00 C ATOM 350 C4' DG C 12 -3.325 3.792 -8.107 1.00 0.00 C ATOM 351 O4' DG C 12 -3.014 3.434 -6.767 1.00 0.00 O ATOM 352 C3' DG C 12 -3.534 5.310 -8.158 1.00 0.00 C ATOM 353 O3' DG C 12 -4.927 5.534 -8.323 1.00 0.00 O ATOM 354 C2' DG C 12 -3.035 5.755 -6.787 1.00 0.00 C ATOM 355 C1' DG C 12 -3.376 4.529 -5.948 1.00 0.00 C ATOM 356 N9 DG C 12 -2.652 4.475 -4.663 1.00 0.00 N ATOM 357 C8 DG C 12 -1.300 4.536 -4.436 1.00 0.00 C ATOM 358 N7 DG C 12 -0.973 4.480 -3.175 1.00 0.00 N ATOM 359 C5 DG C 12 -2.199 4.400 -2.516 1.00 0.00 C ATOM 360 C6 DG C 12 -2.505 4.346 -1.120 1.00 0.00 C ATOM 361 O6 DG C 12 -1.723 4.335 -0.168 1.00 0.00 O ATOM 362 N1 DG C 12 -3.865 4.318 -0.860 1.00 0.00 N ATOM 363 C2 DG C 12 -4.825 4.303 -1.830 1.00 0.00 C ATOM 364 N2 DG C 12 -6.076 4.355 -1.433 1.00 0.00 N ATOM 365 N3 DG C 12 -4.571 4.336 -3.138 1.00 0.00 N ATOM 366 C4 DG C 12 -3.235 4.390 -3.420 1.00 0.00 C ATOM 0 H5' DG C 12 -2.228 2.164 -8.963 1.00 0.00 H new ATOM 0 H5'' DG C 12 -2.650 3.423 -10.106 1.00 0.00 H new ATOM 0 H4' DG C 12 -4.255 3.326 -8.432 1.00 0.00 H new ATOM 0 H3' DG C 12 -3.025 5.842 -8.961 1.00 0.00 H new ATOM 0 H2' DG C 12 -1.967 5.972 -6.786 1.00 0.00 H new ATOM 0 H2'' DG C 12 -3.543 6.652 -6.433 1.00 0.00 H new ATOM 0 H1' DG C 12 -4.429 4.536 -5.667 1.00 0.00 H new ATOM 0 H8 DG C 12 -0.573 4.623 -5.230 1.00 0.00 H new ATOM 0 H1 DG C 12 -4.167 4.308 0.114 1.00 0.00 H new ATOM 0 H21 DG C 12 -6.830 4.346 -2.120 1.00 0.00 H new ATOM 0 H22 DG C 12 -6.294 4.404 -0.438 1.00 0.00 H new ATOM 378 P DG C 13 -5.548 7.000 -8.580 1.00 0.00 P ATOM 379 OP1 DG C 13 -6.740 6.847 -9.444 1.00 0.00 O ATOM 380 OP2 DG C 13 -4.473 7.904 -9.043 1.00 0.00 O ATOM 381 O5' DG C 13 -6.003 7.327 -7.060 1.00 0.00 O ATOM 382 C5' DG C 13 -7.142 6.692 -6.492 1.00 0.00 C ATOM 383 C4' DG C 13 -7.473 7.168 -5.070 1.00 0.00 C ATOM 384 O4' DG C 13 -6.497 6.745 -4.132 1.00 0.00 O ATOM 385 C3' DG C 13 -7.648 8.685 -4.926 1.00 0.00 C ATOM 386 O3' DG C 13 -9.021 8.981 -4.698 1.00 0.00 O ATOM 387 C2' DG C 13 -6.777 9.016 -3.713 1.00 0.00 C ATOM 388 C1' DG C 13 -6.511 7.664 -3.057 1.00 0.00 C ATOM 389 N9 DG C 13 -5.222 7.647 -2.337 1.00 0.00 N ATOM 390 C8 DG C 13 -3.962 7.706 -2.872 1.00 0.00 C ATOM 391 N7 DG C 13 -3.010 7.648 -1.982 1.00 0.00 N ATOM 392 C5 DG C 13 -3.681 7.569 -0.766 1.00 0.00 C ATOM 393 C6 DG C 13 -3.175 7.475 0.573 1.00 0.00 C ATOM 394 O6 DG C 13 -2.004 7.434 0.956 1.00 0.00 O ATOM 395 N1 DG C 13 -4.182 7.423 1.520 1.00 0.00 N ATOM 396 C2 DG C 13 -5.515 7.436 1.224 1.00 0.00 C ATOM 397 N2 DG C 13 -6.355 7.415 2.230 1.00 0.00 N ATOM 398 N3 DG C 13 -6.015 7.510 -0.012 1.00 0.00 N ATOM 399 C4 DG C 13 -5.043 7.574 -0.972 1.00 0.00 C ATOM 0 H5' DG C 13 -6.975 5.615 -6.475 1.00 0.00 H new ATOM 0 H5'' DG C 13 -8.004 6.871 -7.135 1.00 0.00 H new ATOM 0 H4' DG C 13 -8.437 6.703 -4.862 1.00 0.00 H new ATOM 0 H3' DG C 13 -7.360 9.262 -5.805 1.00 0.00 H new ATOM 0 H2' DG C 13 -5.848 9.502 -4.011 1.00 0.00 H new ATOM 0 H2'' DG C 13 -7.288 9.695 -3.030 1.00 0.00 H new ATOM 0 H1' DG C 13 -7.266 7.425 -2.308 1.00 0.00 H new ATOM 0 H8 DG C 13 -3.774 7.792 -3.932 1.00 0.00 H new ATOM 0 H1 DG C 13 -3.912 7.372 2.502 1.00 0.00 H new ATOM 0 H21 DG C 13 -7.360 7.424 2.056 1.00 0.00 H new ATOM 0 H22 DG C 13 -6.004 7.390 3.187 1.00 0.00 H new ATOM 411 P DA C 14 -9.598 10.494 -4.707 1.00 0.00 P ATOM 412 OP1 DA C 14 -11.029 10.482 -5.083 1.00 0.00 O ATOM 413 OP2 DA C 14 -8.696 11.403 -5.445 1.00 0.00 O ATOM 414 O5' DA C 14 -9.488 10.789 -3.125 1.00 0.00 O ATOM 415 C5' DA C 14 -10.328 10.122 -2.195 1.00 0.00 C ATOM 416 C4' DA C 14 -10.045 10.577 -0.759 1.00 0.00 C ATOM 417 O4' DA C 14 -8.777 10.094 -0.331 1.00 0.00 O ATOM 418 C3' DA C 14 -10.041 12.107 -0.612 1.00 0.00 C ATOM 419 O3' DA C 14 -10.830 12.498 0.501 1.00 0.00 O ATOM 420 C2' DA C 14 -8.576 12.417 -0.334 1.00 0.00 C ATOM 421 C1' DA C 14 -8.135 11.137 0.373 1.00 0.00 C ATOM 422 N9 DA C 14 -6.666 10.961 0.379 1.00 0.00 N ATOM 423 C8 DA C 14 -5.793 10.978 -0.681 1.00 0.00 C ATOM 424 N7 DA C 14 -4.536 10.859 -0.344 1.00 0.00 N ATOM 425 C5 DA C 14 -4.591 10.759 1.055 1.00 0.00 C ATOM 426 C6 DA C 14 -3.628 10.617 2.082 1.00 0.00 C ATOM 427 N6 DA C 14 -2.331 10.546 1.869 1.00 0.00 N ATOM 428 N1 DA C 14 -3.992 10.537 3.369 1.00 0.00 N ATOM 429 C2 DA C 14 -5.290 10.605 3.647 1.00 0.00 C ATOM 430 N3 DA C 14 -6.303 10.762 2.798 1.00 0.00 N ATOM 431 C4 DA C 14 -5.884 10.821 1.502 1.00 0.00 C ATOM 0 H5' DA C 14 -10.177 9.045 -2.273 1.00 0.00 H new ATOM 0 H5'' DA C 14 -11.372 10.316 -2.441 1.00 0.00 H new ATOM 0 H4' DA C 14 -10.849 10.170 -0.146 1.00 0.00 H new ATOM 0 H3' DA C 14 -10.444 12.623 -1.483 1.00 0.00 H new ATOM 0 H2' DA C 14 -8.012 12.598 -1.249 1.00 0.00 H new ATOM 0 H2'' DA C 14 -8.453 13.299 0.295 1.00 0.00 H new ATOM 0 HO3' DA C 14 -10.817 13.474 0.584 1.00 0.00 H new ATOM 0 H1' DA C 14 -8.410 11.158 1.428 1.00 0.00 H new ATOM 0 H8 DA C 14 -6.118 11.081 -1.706 1.00 0.00 H new ATOM 0 H61 DA C 14 -1.690 10.444 2.656 1.00 0.00 H new ATOM 0 H62 DA C 14 -1.967 10.593 0.917 1.00 0.00 H new ATOM 0 H2 DA C 14 -5.555 10.523 4.691 1.00 0.00 H new TER 444 DA C 14 ATOM 445 O5' DT A 15 0.235 15.539 -1.086 1.00 0.00 O ATOM 446 C5' DT A 15 0.918 14.913 -2.159 1.00 0.00 C ATOM 447 C4' DT A 15 1.771 13.768 -1.610 1.00 0.00 C ATOM 448 O4' DT A 15 0.964 12.762 -1.021 1.00 0.00 O ATOM 449 C3' DT A 15 2.618 13.143 -2.714 1.00 0.00 C ATOM 450 O3' DT A 15 3.954 13.557 -2.515 1.00 0.00 O ATOM 451 C2' DT A 15 2.438 11.650 -2.483 1.00 0.00 C ATOM 452 C1' DT A 15 1.111 11.539 -1.733 1.00 0.00 C ATOM 453 N1 DT A 15 -0.137 11.319 -2.523 1.00 0.00 N ATOM 454 C2 DT A 15 -1.251 10.921 -1.773 1.00 0.00 C ATOM 455 O2 DT A 15 -1.197 10.619 -0.586 1.00 0.00 O ATOM 456 N3 DT A 15 -2.459 10.863 -2.420 1.00 0.00 N ATOM 457 C4 DT A 15 -2.654 11.055 -3.769 1.00 0.00 C ATOM 458 O4 DT A 15 -3.795 10.976 -4.208 1.00 0.00 O ATOM 459 C5 DT A 15 -1.436 11.355 -4.523 1.00 0.00 C ATOM 460 C7 DT A 15 -1.514 11.530 -6.029 1.00 0.00 C ATOM 461 C6 DT A 15 -0.234 11.481 -3.893 1.00 0.00 C ATOM 0 H5' DT A 15 1.548 15.636 -2.677 1.00 0.00 H new ATOM 0 H5'' DT A 15 0.203 14.533 -2.889 1.00 0.00 H new ATOM 0 H4' DT A 15 2.424 14.192 -0.847 1.00 0.00 H new ATOM 0 H3' DT A 15 2.346 13.422 -3.732 1.00 0.00 H new ATOM 0 H2' DT A 15 2.409 11.103 -3.425 1.00 0.00 H new ATOM 0 H2'' DT A 15 3.260 11.236 -1.899 1.00 0.00 H new ATOM 0 HO5' DT A 15 -0.312 16.275 -1.431 1.00 0.00 H new ATOM 0 H1' DT A 15 1.193 10.633 -1.133 1.00 0.00 H new ATOM 0 H3 DT A 15 -3.283 10.660 -1.853 1.00 0.00 H new ATOM 0 H71 DT A 15 -0.741 12.226 -6.355 1.00 0.00 H new ATOM 0 H72 DT A 15 -1.363 10.566 -6.516 1.00 0.00 H new ATOM 0 H73 DT A 15 -2.494 11.923 -6.299 1.00 0.00 H new ATOM 0 H6 DT A 15 0.651 11.709 -4.469 1.00 0.00 H new ATOM 475 P DG A 16 5.006 13.628 -3.732 1.00 0.00 P ATOM 476 OP1 DG A 16 6.208 14.355 -3.279 1.00 0.00 O ATOM 477 OP2 DG A 16 4.283 14.145 -4.912 1.00 0.00 O ATOM 478 O5' DG A 16 5.296 12.058 -3.890 1.00 0.00 O ATOM 479 C5' DG A 16 5.965 11.321 -2.878 1.00 0.00 C ATOM 480 C4' DG A 16 5.883 9.818 -3.173 1.00 0.00 C ATOM 481 O4' DG A 16 4.532 9.413 -3.296 1.00 0.00 O ATOM 482 C3' DG A 16 6.616 9.434 -4.468 1.00 0.00 C ATOM 483 O3' DG A 16 7.413 8.266 -4.326 1.00 0.00 O ATOM 484 C2' DG A 16 5.453 9.115 -5.397 1.00 0.00 C ATOM 485 C1' DG A 16 4.442 8.546 -4.404 1.00 0.00 C ATOM 486 N9 DG A 16 3.054 8.464 -4.917 1.00 0.00 N ATOM 487 C8 DG A 16 2.618 8.520 -6.219 1.00 0.00 C ATOM 488 N7 DG A 16 1.330 8.403 -6.360 1.00 0.00 N ATOM 489 C5 DG A 16 0.868 8.218 -5.054 1.00 0.00 C ATOM 490 C6 DG A 16 -0.456 8.021 -4.539 1.00 0.00 C ATOM 491 O6 DG A 16 -1.531 7.974 -5.125 1.00 0.00 O ATOM 492 N1 DG A 16 -0.488 7.879 -3.168 1.00 0.00 N ATOM 493 C2 DG A 16 0.599 7.912 -2.360 1.00 0.00 C ATOM 494 N2 DG A 16 0.393 7.812 -1.065 1.00 0.00 N ATOM 495 N3 DG A 16 1.842 8.093 -2.800 1.00 0.00 N ATOM 496 C4 DG A 16 1.919 8.242 -4.162 1.00 0.00 C ATOM 0 H5' DG A 16 5.517 11.533 -1.907 1.00 0.00 H new ATOM 0 H5'' DG A 16 7.008 11.631 -2.822 1.00 0.00 H new ATOM 0 H4' DG A 16 6.365 9.314 -2.335 1.00 0.00 H new ATOM 0 H3' DG A 16 7.297 10.217 -4.801 1.00 0.00 H new ATOM 0 H2' DG A 16 5.077 10.001 -5.908 1.00 0.00 H new ATOM 0 H2'' DG A 16 5.726 8.394 -6.168 1.00 0.00 H new ATOM 0 H1' DG A 16 4.677 7.508 -4.170 1.00 0.00 H new ATOM 0 H8 DG A 16 3.289 8.650 -7.055 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.398 7.739 -2.729 1.00 0.00 H new ATOM 0 H21 DG A 16 1.183 7.832 -0.420 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.557 7.714 -0.706 1.00 0.00 H new ATOM 508 P DG A 17 8.858 8.283 -3.597 1.00 0.00 P ATOM 509 OP1 DG A 17 9.390 9.662 -3.554 1.00 0.00 O ATOM 510 OP2 DG A 17 9.708 7.224 -4.177 1.00 0.00 O ATOM 511 O5' DG A 17 8.372 7.814 -2.132 1.00 0.00 O ATOM 512 C5' DG A 17 8.389 8.689 -1.016 1.00 0.00 C ATOM 513 C4' DG A 17 7.562 8.130 0.153 1.00 0.00 C ATOM 514 O4' DG A 17 6.237 7.767 -0.235 1.00 0.00 O ATOM 515 C3' DG A 17 8.210 6.897 0.768 1.00 0.00 C ATOM 516 O3' DG A 17 8.024 6.971 2.169 1.00 0.00 O ATOM 517 C2' DG A 17 7.453 5.750 0.111 1.00 0.00 C ATOM 518 C1' DG A 17 6.070 6.353 -0.145 1.00 0.00 C ATOM 519 N9 DG A 17 5.412 5.835 -1.369 1.00 0.00 N ATOM 520 C8 DG A 17 5.925 5.694 -2.637 1.00 0.00 C ATOM 521 N7 DG A 17 5.062 5.266 -3.517 1.00 0.00 N ATOM 522 C5 DG A 17 3.885 5.106 -2.783 1.00 0.00 C ATOM 523 C6 DG A 17 2.564 4.714 -3.189 1.00 0.00 C ATOM 524 O6 DG A 17 2.140 4.435 -4.308 1.00 0.00 O ATOM 525 N1 DG A 17 1.665 4.666 -2.140 1.00 0.00 N ATOM 526 C2 DG A 17 1.984 4.943 -0.843 1.00 0.00 C ATOM 527 N2 DG A 17 1.041 4.836 0.068 1.00 0.00 N ATOM 528 N3 DG A 17 3.191 5.340 -0.436 1.00 0.00 N ATOM 529 C4 DG A 17 4.102 5.413 -1.457 1.00 0.00 C ATOM 0 H5' DG A 17 7.994 9.662 -1.309 1.00 0.00 H new ATOM 0 H5'' DG A 17 9.418 8.847 -0.692 1.00 0.00 H new ATOM 0 H4' DG A 17 7.521 8.941 0.880 1.00 0.00 H new ATOM 0 H3' DG A 17 9.283 6.786 0.611 1.00 0.00 H new ATOM 0 H2' DG A 17 7.931 5.429 -0.814 1.00 0.00 H new ATOM 0 H2'' DG A 17 7.399 4.877 0.762 1.00 0.00 H new ATOM 0 H1' DG A 17 5.412 6.071 0.677 1.00 0.00 H new ATOM 0 H8 DG A 17 6.952 5.918 -2.883 1.00 0.00 H new ATOM 0 H1 DG A 17 0.701 4.407 -2.349 1.00 0.00 H new ATOM 0 H21 DG A 17 1.251 5.037 1.046 1.00 0.00 H new ATOM 0 H22 DG A 17 0.100 4.552 -0.203 1.00 0.00 H new ATOM 541 P DT A 18 8.760 5.959 3.174 1.00 0.00 P ATOM 542 OP1 DT A 18 9.107 6.688 4.413 1.00 0.00 O ATOM 543 OP2 DT A 18 9.839 5.239 2.463 1.00 0.00 O ATOM 544 O5' DT A 18 7.497 4.990 3.412 1.00 0.00 O ATOM 545 C5' DT A 18 6.473 5.351 4.324 1.00 0.00 C ATOM 546 C4' DT A 18 5.466 4.215 4.534 1.00 0.00 C ATOM 547 O4' DT A 18 4.617 4.053 3.411 1.00 0.00 O ATOM 548 C3' DT A 18 6.145 2.881 4.840 1.00 0.00 C ATOM 549 O3' DT A 18 6.240 2.704 6.241 1.00 0.00 O ATOM 550 C2' DT A 18 5.210 1.868 4.194 1.00 0.00 C ATOM 551 C1' DT A 18 4.413 2.674 3.161 1.00 0.00 C ATOM 552 N1 DT A 18 4.773 2.404 1.748 1.00 0.00 N ATOM 553 C2 DT A 18 3.733 2.151 0.845 1.00 0.00 C ATOM 554 O2 DT A 18 2.552 2.041 1.171 1.00 0.00 O ATOM 555 N3 DT A 18 4.086 1.997 -0.475 1.00 0.00 N ATOM 556 C4 DT A 18 5.369 1.987 -0.977 1.00 0.00 C ATOM 557 O4 DT A 18 5.531 1.811 -2.181 1.00 0.00 O ATOM 558 C5 DT A 18 6.405 2.219 0.027 1.00 0.00 C ATOM 559 C7 DT A 18 7.860 2.248 -0.371 1.00 0.00 C ATOM 560 C6 DT A 18 6.084 2.430 1.330 1.00 0.00 C ATOM 0 H5' DT A 18 5.952 6.234 3.953 1.00 0.00 H new ATOM 0 H5'' DT A 18 6.919 5.622 5.281 1.00 0.00 H new ATOM 0 H4' DT A 18 4.870 4.507 5.399 1.00 0.00 H new ATOM 0 H3' DT A 18 7.165 2.796 4.464 1.00 0.00 H new ATOM 0 H2' DT A 18 5.768 1.060 3.720 1.00 0.00 H new ATOM 0 H2'' DT A 18 4.552 1.410 4.932 1.00 0.00 H new ATOM 0 H1' DT A 18 3.373 2.369 3.279 1.00 0.00 H new ATOM 0 H3 DT A 18 3.327 1.879 -1.146 1.00 0.00 H new ATOM 0 H71 DT A 18 8.406 2.915 0.296 1.00 0.00 H new ATOM 0 H72 DT A 18 8.276 1.243 -0.301 1.00 0.00 H new ATOM 0 H73 DT A 18 7.950 2.607 -1.396 1.00 0.00 H new ATOM 0 H6 DT A 18 6.868 2.621 2.048 1.00 0.00 H new ATOM 573 P DG A 19 7.228 1.602 6.875 1.00 0.00 P ATOM 574 OP1 DG A 19 7.503 1.932 8.290 1.00 0.00 O ATOM 575 OP2 DG A 19 8.374 1.326 5.985 1.00 0.00 O ATOM 576 O5' DG A 19 6.239 0.342 6.765 1.00 0.00 O ATOM 577 C5' DG A 19 5.362 -0.016 7.817 1.00 0.00 C ATOM 578 C4' DG A 19 4.837 -1.440 7.601 1.00 0.00 C ATOM 579 O4' DG A 19 3.910 -1.504 6.517 1.00 0.00 O ATOM 580 C3' DG A 19 5.966 -2.429 7.299 1.00 0.00 C ATOM 581 O3' DG A 19 6.551 -3.043 8.431 1.00 0.00 O ATOM 582 C2' DG A 19 5.239 -3.431 6.414 1.00 0.00 C ATOM 583 C1' DG A 19 4.298 -2.529 5.612 1.00 0.00 C ATOM 584 N9 DG A 19 4.944 -1.949 4.398 1.00 0.00 N ATOM 585 C8 DG A 19 6.270 -1.695 4.107 1.00 0.00 C ATOM 586 N7 DG A 19 6.510 -1.433 2.854 1.00 0.00 N ATOM 587 C5 DG A 19 5.252 -1.484 2.261 1.00 0.00 C ATOM 588 C6 DG A 19 4.846 -1.330 0.895 1.00 0.00 C ATOM 589 O6 DG A 19 5.536 -1.121 -0.098 1.00 0.00 O ATOM 590 N1 DG A 19 3.480 -1.455 0.716 1.00 0.00 N ATOM 591 C2 DG A 19 2.596 -1.661 1.737 1.00 0.00 C ATOM 592 N2 DG A 19 1.317 -1.694 1.455 1.00 0.00 N ATOM 593 N3 DG A 19 2.941 -1.837 3.011 1.00 0.00 N ATOM 594 C4 DG A 19 4.287 -1.742 3.210 1.00 0.00 C ATOM 0 H5' DG A 19 4.528 0.685 7.861 1.00 0.00 H new ATOM 0 H5'' DG A 19 5.882 0.047 8.773 1.00 0.00 H new ATOM 0 H4' DG A 19 4.344 -1.712 8.534 1.00 0.00 H new ATOM 0 H3' DG A 19 6.833 -1.946 6.849 1.00 0.00 H new ATOM 0 H2' DG A 19 5.926 -3.979 5.769 1.00 0.00 H new ATOM 0 H2'' DG A 19 4.693 -4.171 7.000 1.00 0.00 H new ATOM 0 H1' DG A 19 3.450 -3.099 5.232 1.00 0.00 H new ATOM 0 H8 DG A 19 7.046 -1.712 4.858 1.00 0.00 H new ATOM 0 H1 DG A 19 3.112 -1.390 -0.233 1.00 0.00 H new ATOM 0 H21 DG A 19 0.635 -1.846 2.198 1.00 0.00 H new ATOM 0 H22 DG A 19 1.004 -1.567 0.493 1.00 0.00 H new HETATM 606 C1 J32 A 20 -3.587 -5.467 -1.362 1.00 0.00 C HETATM 607 C2 J32 A 20 -3.094 -5.535 -2.668 1.00 0.00 C HETATM 608 C3 J32 A 20 -1.718 -5.500 -2.907 1.00 0.00 C HETATM 609 C4 J32 A 20 0.551 -5.365 -2.069 1.00 0.00 C HETATM 610 C5 J32 A 20 1.444 -5.247 -0.998 1.00 0.00 C HETATM 611 C6 J32 A 20 1.813 -5.064 1.411 1.00 0.00 C HETATM 612 C7 J32 A 20 1.324 -5.056 2.713 1.00 0.00 C HETATM 613 P J32 A 20 8.095 -3.430 8.441 1.00 0.00 P HETATM 614 OP1 J32 A 20 8.070 -4.572 9.418 1.00 0.00 O HETATM 615 OP2 J32 A 20 8.746 -2.149 8.884 1.00 0.00 O HETATM 616 O5' J32 A 20 8.393 -3.802 6.918 1.00 0.00 O HETATM 617 C2' J32 A 20 9.640 -4.404 6.475 1.00 0.00 C HETATM 618 C3' J32 A 20 10.023 -3.762 5.107 1.00 0.00 C HETATM 619 O1 J32 A 20 10.242 -4.763 4.063 1.00 0.00 O HETATM 620 C4' J32 A 20 9.976 -4.430 2.665 1.00 0.00 C HETATM 621 C2A J32 A 20 8.511 -4.600 2.275 1.00 0.00 C HETATM 622 C12 J32 A 20 8.106 -4.605 0.924 1.00 0.00 C HETATM 623 C11 J32 A 20 6.757 -4.766 0.582 1.00 0.00 C HETATM 624 C4A J32 A 20 5.823 -4.884 1.606 1.00 0.00 C HETATM 625 C14 J32 A 20 6.205 -4.877 2.938 1.00 0.00 C HETATM 626 C13 J32 A 20 7.541 -4.756 3.269 1.00 0.00 C HETATM 627 C15 J32 A 20 4.409 -4.954 1.432 1.00 0.00 C HETATM 628 C16 J32 A 20 3.239 -5.006 1.375 1.00 0.00 C HETATM 629 C8 J32 A 20 -0.038 -5.067 2.954 1.00 0.00 C HETATM 630 C8A J32 A 20 -0.926 -5.147 1.871 1.00 0.00 C HETATM 631 C1B J32 A 20 -0.429 -5.211 0.555 1.00 0.00 C HETATM 632 C1A J32 A 20 -1.318 -5.318 -0.522 1.00 0.00 C HETATM 633 C3A J32 A 20 -0.826 -5.393 -1.832 1.00 0.00 C HETATM 634 C5A J32 A 20 0.954 -5.170 0.312 1.00 0.00 C HETATM 635 C1C J32 A 20 -2.698 -5.358 -0.287 1.00 0.00 C HETATM 636 C10 J32 A 20 -3.191 -5.280 1.019 1.00 0.00 C HETATM 637 C9 J32 A 20 -2.306 -5.175 2.098 1.00 0.00 C HETATM 638 C1' J32 A 20 9.418 -5.930 6.394 1.00 0.00 C HETATM 639 O3' J32 A 20 9.372 -6.416 7.623 1.00 0.00 O ATOM 660 P DG A 21 9.015 -7.862 7.868 1.00 0.00 P ATOM 661 OP1 DG A 21 9.476 -8.211 9.221 1.00 0.00 O ATOM 662 OP2 DG A 21 9.704 -8.604 6.790 1.00 0.00 O ATOM 663 O5' DG A 21 7.432 -8.081 7.663 1.00 0.00 O ATOM 664 C5' DG A 21 6.469 -7.384 8.432 1.00 0.00 C ATOM 665 C4' DG A 21 5.063 -7.433 7.811 1.00 0.00 C ATOM 666 O4' DG A 21 4.991 -6.695 6.591 1.00 0.00 O ATOM 667 C3' DG A 21 4.516 -8.839 7.562 1.00 0.00 C ATOM 668 O3' DG A 21 3.773 -9.275 8.689 1.00 0.00 O ATOM 669 C2' DG A 21 3.589 -8.580 6.379 1.00 0.00 C ATOM 670 C1' DG A 21 4.237 -7.421 5.631 1.00 0.00 C ATOM 671 N9 DG A 21 5.137 -7.883 4.544 1.00 0.00 N ATOM 672 C8 DG A 21 6.504 -7.996 4.538 1.00 0.00 C ATOM 673 N7 DG A 21 7.025 -8.196 3.361 1.00 0.00 N ATOM 674 C5 DG A 21 5.915 -8.269 2.518 1.00 0.00 C ATOM 675 C6 DG A 21 5.811 -8.448 1.096 1.00 0.00 C ATOM 676 O6 DG A 21 6.698 -8.586 0.258 1.00 0.00 O ATOM 677 N1 DG A 21 4.501 -8.455 0.647 1.00 0.00 N ATOM 678 C2 DG A 21 3.410 -8.391 1.470 1.00 0.00 C ATOM 679 N2 DG A 21 2.228 -8.552 0.923 1.00 0.00 N ATOM 680 N3 DG A 21 3.471 -8.208 2.789 1.00 0.00 N ATOM 681 C4 DG A 21 4.753 -8.137 3.250 1.00 0.00 C ATOM 0 H5' DG A 21 6.779 -6.344 8.538 1.00 0.00 H new ATOM 0 H5'' DG A 21 6.434 -7.810 9.435 1.00 0.00 H new ATOM 0 H4' DG A 21 4.434 -6.973 8.573 1.00 0.00 H new ATOM 0 H3' DG A 21 5.272 -9.603 7.384 1.00 0.00 H new ATOM 0 H2' DG A 21 3.500 -9.462 5.744 1.00 0.00 H new ATOM 0 H2'' DG A 21 2.583 -8.324 6.712 1.00 0.00 H new ATOM 0 H1' DG A 21 3.465 -6.813 5.159 1.00 0.00 H new ATOM 0 H8 DG A 21 7.100 -7.925 5.436 1.00 0.00 H new ATOM 0 H1 DG A 21 4.340 -8.511 -0.359 1.00 0.00 H new ATOM 0 H21 DG A 21 1.389 -8.512 1.501 1.00 0.00 H new ATOM 0 H22 DG A 21 2.149 -8.718 -0.080 1.00 0.00 H new ATOM 693 P DT A 22 3.505 -10.838 8.990 1.00 0.00 P ATOM 694 OP1 DT A 22 2.870 -11.010 10.312 1.00 0.00 O ATOM 695 OP2 DT A 22 4.712 -11.628 8.682 1.00 0.00 O ATOM 696 O5' DT A 22 2.437 -11.174 7.842 1.00 0.00 O ATOM 697 C5' DT A 22 1.116 -10.672 7.860 1.00 0.00 C ATOM 698 C4' DT A 22 0.334 -11.218 6.656 1.00 0.00 C ATOM 699 O4' DT A 22 1.005 -10.868 5.450 1.00 0.00 O ATOM 700 C3' DT A 22 0.200 -12.746 6.698 1.00 0.00 C ATOM 701 O3' DT A 22 -1.065 -13.152 6.199 1.00 0.00 O ATOM 702 C2' DT A 22 1.307 -13.223 5.769 1.00 0.00 C ATOM 703 C1' DT A 22 1.445 -12.047 4.792 1.00 0.00 C ATOM 704 N1 DT A 22 2.805 -11.873 4.217 1.00 0.00 N ATOM 705 C2 DT A 22 2.927 -11.723 2.827 1.00 0.00 C ATOM 706 O2 DT A 22 1.980 -11.697 2.040 1.00 0.00 O ATOM 707 N3 DT A 22 4.206 -11.629 2.334 1.00 0.00 N ATOM 708 C4 DT A 22 5.373 -11.654 3.061 1.00 0.00 C ATOM 709 O4 DT A 22 6.442 -11.582 2.463 1.00 0.00 O ATOM 710 C5 DT A 22 5.174 -11.773 4.498 1.00 0.00 C ATOM 711 C7 DT A 22 6.358 -11.769 5.436 1.00 0.00 C ATOM 712 C6 DT A 22 3.927 -11.886 5.021 1.00 0.00 C ATOM 0 H5' DT A 22 1.131 -9.582 7.831 1.00 0.00 H new ATOM 0 H5'' DT A 22 0.621 -10.960 8.787 1.00 0.00 H new ATOM 0 H4' DT A 22 -0.662 -10.778 6.696 1.00 0.00 H new ATOM 0 H3' DT A 22 0.278 -13.150 7.707 1.00 0.00 H new ATOM 0 H2' DT A 22 2.235 -13.415 6.308 1.00 0.00 H new ATOM 0 H2'' DT A 22 1.038 -14.147 5.257 1.00 0.00 H new ATOM 0 HO3' DT A 22 -1.131 -14.129 6.232 1.00 0.00 H new ATOM 0 H1' DT A 22 0.820 -12.267 3.927 1.00 0.00 H new ATOM 0 H3 DT A 22 4.300 -11.530 1.323 1.00 0.00 H new ATOM 0 H71 DT A 22 7.225 -12.194 4.930 1.00 0.00 H new ATOM 0 H72 DT A 22 6.580 -10.745 5.738 1.00 0.00 H new ATOM 0 H73 DT A 22 6.125 -12.365 6.318 1.00 0.00 H new ATOM 0 H6 DT A 22 3.810 -11.988 6.090 1.00 0.00 H new TER 726 DT A 22