USER MOD reduce.3.24.130724 H: found=0, std=0, add=249, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 274 hydrogens (25 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 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT O5' : rot -76:sc= 1.16 USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 25 DA O3' : rot -41:sc= 0.00487 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 4 6.488 -9.423 -12.009 1.00 0.90 O ATOM 2 C5' DT A 4 6.890 -10.414 -11.059 1.00 0.59 C ATOM 3 C4' DT A 4 8.373 -10.343 -10.775 1.00 0.48 C ATOM 4 O4' DT A 4 8.645 -11.008 -9.515 1.00 0.56 O ATOM 5 C3' DT A 4 9.260 -11.032 -11.815 1.00 0.51 C ATOM 6 O3' DT A 4 10.470 -10.290 -12.005 1.00 0.55 O ATOM 7 C2' DT A 4 9.554 -12.384 -11.191 1.00 0.58 C ATOM 8 C1' DT A 4 9.577 -12.061 -9.707 1.00 0.56 C ATOM 9 N1 DT A 4 9.185 -13.182 -8.830 1.00 0.70 N ATOM 10 C2 DT A 4 7.884 -13.633 -8.888 1.00 0.92 C ATOM 11 O2 DT A 4 7.043 -13.151 -9.630 1.00 1.02 O ATOM 12 N3 DT A 4 7.601 -14.674 -8.041 1.00 1.06 N ATOM 13 C4 DT A 4 8.468 -15.294 -7.164 1.00 1.01 C ATOM 14 O4 DT A 4 8.068 -16.220 -6.463 1.00 1.18 O ATOM 15 C5 DT A 4 9.815 -14.771 -7.154 1.00 0.82 C ATOM 16 C7 DT A 4 10.822 -15.383 -6.230 1.00 0.87 C ATOM 17 C6 DT A 4 10.108 -13.753 -7.977 1.00 0.68 C ATOM 0 H5' DT A 4 6.638 -11.405 -11.437 1.00 0.59 H new ATOM 0 H5'' DT A 4 6.334 -10.276 -10.131 1.00 0.59 H new ATOM 0 H4' DT A 4 8.611 -9.279 -10.777 1.00 0.48 H new ATOM 0 H3' DT A 4 8.790 -11.111 -12.795 1.00 0.51 H new ATOM 0 H2' DT A 4 8.787 -13.119 -11.435 1.00 0.58 H new ATOM 0 H2'' DT A 4 10.506 -12.791 -11.533 1.00 0.58 H new ATOM 0 HO5' DT A 4 6.457 -8.546 -11.573 1.00 0.90 H new ATOM 0 H1' DT A 4 10.602 -11.809 -9.436 1.00 0.56 H new ATOM 0 H3 DT A 4 6.645 -15.029 -8.061 1.00 1.06 H new ATOM 0 H71 DT A 4 11.817 -15.298 -6.668 1.00 0.87 H new ATOM 0 H72 DT A 4 10.801 -14.862 -5.273 1.00 0.87 H new ATOM 0 H73 DT A 4 10.582 -16.435 -6.076 1.00 0.87 H new ATOM 0 H6 DT A 4 11.114 -13.361 -7.972 1.00 0.68 H new ATOM 31 P DG A 5 11.147 -10.222 -13.462 1.00 0.75 P ATOM 32 OP1 DG A 5 10.094 -9.808 -14.424 1.00 0.99 O ATOM 33 OP2 DG A 5 11.891 -11.487 -13.689 1.00 1.16 O ATOM 34 O5' DG A 5 12.204 -9.036 -13.340 1.00 0.73 O ATOM 35 C5' DG A 5 11.798 -7.673 -13.467 1.00 0.68 C ATOM 36 C4' DG A 5 12.966 -6.754 -13.193 1.00 0.62 C ATOM 37 O4' DG A 5 13.553 -7.102 -11.914 1.00 0.41 O ATOM 38 C3' DG A 5 14.104 -6.840 -14.212 1.00 0.73 C ATOM 39 O3' DG A 5 14.711 -5.555 -14.394 1.00 0.83 O ATOM 40 C2' DG A 5 15.079 -7.803 -13.562 1.00 0.59 C ATOM 41 C1' DG A 5 14.907 -7.495 -12.086 1.00 0.37 C ATOM 42 N9 DG A 5 15.165 -8.628 -11.199 1.00 0.39 N ATOM 43 C8 DG A 5 14.253 -9.550 -10.745 1.00 0.57 C ATOM 44 N7 DG A 5 14.777 -10.452 -9.963 1.00 0.70 N ATOM 45 C5 DG A 5 16.120 -10.106 -9.894 1.00 0.71 C ATOM 46 C6 DG A 5 17.191 -10.717 -9.193 1.00 0.99 C ATOM 47 O6 DG A 5 17.163 -11.720 -8.469 1.00 1.21 O ATOM 48 N1 DG A 5 18.396 -10.045 -9.394 1.00 1.08 N ATOM 49 C2 DG A 5 18.538 -8.923 -10.177 1.00 0.92 C ATOM 50 N2 DG A 5 19.776 -8.412 -10.253 1.00 1.13 N ATOM 51 N3 DG A 5 17.548 -8.344 -10.835 1.00 0.62 N ATOM 52 C4 DG A 5 16.376 -8.983 -10.650 1.00 0.52 C ATOM 0 H5' DG A 5 10.987 -7.461 -12.770 1.00 0.68 H new ATOM 0 H5'' DG A 5 11.411 -7.493 -14.470 1.00 0.68 H new ATOM 0 H4' DG A 5 12.548 -5.748 -13.232 1.00 0.62 H new ATOM 0 H3' DG A 5 13.775 -7.165 -15.199 1.00 0.73 H new ATOM 0 H2' DG A 5 14.838 -8.841 -13.791 1.00 0.59 H new ATOM 0 H2'' DG A 5 16.102 -7.632 -13.896 1.00 0.59 H new ATOM 0 H1' DG A 5 15.633 -6.727 -11.818 1.00 0.37 H new ATOM 0 H8 DG A 5 13.206 -9.530 -11.010 1.00 0.57 H new ATOM 0 H1 DG A 5 19.228 -10.410 -8.929 1.00 1.08 H new ATOM 0 H21 DG A 5 19.951 -7.580 -10.817 1.00 1.13 H new ATOM 0 H22 DG A 5 20.543 -8.855 -9.747 1.00 1.13 H new ATOM 64 P DA A 6 14.239 -4.609 -15.606 1.00 1.03 P ATOM 65 OP1 DA A 6 14.015 -5.478 -16.790 1.00 1.12 O ATOM 66 OP2 DA A 6 15.187 -3.470 -15.704 1.00 1.15 O ATOM 67 O5' DA A 6 12.826 -4.046 -15.131 1.00 1.03 O ATOM 68 C5' DA A 6 12.737 -3.063 -14.099 1.00 1.03 C ATOM 69 C4' DA A 6 11.307 -2.603 -13.940 1.00 1.04 C ATOM 70 O4' DA A 6 10.461 -3.746 -13.699 1.00 0.90 O ATOM 71 C3' DA A 6 11.057 -1.679 -12.757 1.00 1.08 C ATOM 72 O3' DA A 6 11.266 -0.315 -13.140 1.00 1.29 O ATOM 73 C2' DA A 6 9.594 -1.929 -12.429 1.00 1.03 C ATOM 74 C1' DA A 6 9.360 -3.371 -12.879 1.00 0.91 C ATOM 75 N9 DA A 6 9.271 -4.336 -11.782 1.00 0.75 N ATOM 76 C8 DA A 6 10.228 -4.632 -10.842 1.00 0.72 C ATOM 77 N7 DA A 6 9.857 -5.546 -9.980 1.00 0.65 N ATOM 78 C5 DA A 6 8.568 -5.875 -10.376 1.00 0.61 C ATOM 79 C6 DA A 6 7.625 -6.785 -9.867 1.00 0.60 C ATOM 80 N6 DA A 6 7.844 -7.563 -8.804 1.00 0.66 N ATOM 81 N1 DA A 6 6.432 -6.870 -10.495 1.00 0.65 N ATOM 82 C2 DA A 6 6.211 -6.090 -11.560 1.00 0.72 C ATOM 83 N3 DA A 6 7.017 -5.199 -12.132 1.00 0.76 N ATOM 84 C4 DA A 6 8.194 -5.138 -11.484 1.00 0.68 C ATOM 0 H5' DA A 6 13.376 -2.213 -14.340 1.00 1.03 H new ATOM 0 H5'' DA A 6 13.100 -3.478 -13.159 1.00 1.03 H new ATOM 0 H4' DA A 6 11.092 -2.064 -14.863 1.00 1.04 H new ATOM 0 H3' DA A 6 11.721 -1.863 -11.913 1.00 1.08 H new ATOM 0 H2' DA A 6 9.396 -1.805 -11.364 1.00 1.03 H new ATOM 0 H2'' DA A 6 8.941 -1.234 -12.957 1.00 1.03 H new ATOM 0 H1' DA A 6 8.401 -3.394 -13.397 1.00 0.91 H new ATOM 0 H8 DA A 6 11.197 -4.155 -10.816 1.00 0.72 H new ATOM 0 H61 DA A 6 7.118 -8.204 -8.483 1.00 0.66 H new ATOM 0 H62 DA A 6 8.737 -7.516 -8.313 1.00 0.66 H new ATOM 0 H2 DA A 6 5.240 -6.199 -12.021 1.00 0.72 H new ATOM 96 P DG A 7 10.941 0.869 -12.102 1.00 1.11 P ATOM 97 OP1 DG A 7 11.780 2.034 -12.481 1.00 0.99 O ATOM 98 OP2 DG A 7 11.027 0.321 -10.724 1.00 1.04 O ATOM 99 O5' DG A 7 9.420 1.237 -12.401 1.00 1.47 O ATOM 100 C5' DG A 7 8.777 2.314 -11.720 1.00 1.39 C ATOM 101 C4' DG A 7 7.280 2.107 -11.714 1.00 1.18 C ATOM 102 O4' DG A 7 6.993 0.722 -11.389 1.00 1.10 O ATOM 103 C3' DG A 7 6.521 2.939 -10.678 1.00 1.08 C ATOM 104 O3' DG A 7 5.224 3.293 -11.176 1.00 1.00 O ATOM 105 C2' DG A 7 6.404 1.993 -9.501 1.00 0.98 C ATOM 106 C1' DG A 7 6.242 0.649 -10.187 1.00 0.94 C ATOM 107 N9 DG A 7 6.736 -0.485 -9.411 1.00 0.91 N ATOM 108 C8 DG A 7 8.042 -0.762 -9.090 1.00 0.99 C ATOM 109 N7 DG A 7 8.178 -1.847 -8.378 1.00 0.94 N ATOM 110 C5 DG A 7 6.880 -2.316 -8.220 1.00 0.81 C ATOM 111 C6 DG A 7 6.393 -3.460 -7.538 1.00 0.72 C ATOM 112 O6 DG A 7 7.037 -4.312 -6.915 1.00 0.72 O ATOM 113 N1 DG A 7 5.005 -3.567 -7.623 1.00 0.62 N ATOM 114 C2 DG A 7 4.197 -2.671 -8.286 1.00 0.63 C ATOM 115 N2 DG A 7 2.880 -2.925 -8.259 1.00 0.58 N ATOM 116 N3 DG A 7 4.640 -1.602 -8.925 1.00 0.71 N ATOM 117 C4 DG A 7 5.980 -1.487 -8.851 1.00 0.80 C ATOM 0 H5' DG A 7 9.019 3.258 -12.207 1.00 1.39 H new ATOM 0 H5'' DG A 7 9.147 2.379 -10.697 1.00 1.39 H new ATOM 0 H4' DG A 7 6.951 2.410 -12.708 1.00 1.18 H new ATOM 0 H3' DG A 7 7.016 3.877 -10.426 1.00 1.08 H new ATOM 0 H2' DG A 7 7.289 2.022 -8.865 1.00 0.98 H new ATOM 0 H2'' DG A 7 5.549 2.233 -8.869 1.00 0.98 H new ATOM 0 H1' DG A 7 5.177 0.474 -10.336 1.00 0.94 H new ATOM 0 H8 DG A 7 8.873 -0.144 -9.396 1.00 0.99 H new ATOM 0 H1 DG A 7 4.559 -4.361 -7.164 1.00 0.62 H new ATOM 0 H21 DG A 7 2.230 -2.297 -8.732 1.00 0.58 H new ATOM 0 H22 DG A 7 2.529 -3.746 -7.765 1.00 0.58 H new ATOM 129 P DG A 8 4.220 4.160 -10.265 1.00 0.94 P ATOM 130 OP1 DG A 8 3.540 5.133 -11.157 1.00 1.01 O ATOM 131 OP2 DG A 8 4.968 4.653 -9.081 1.00 1.14 O ATOM 132 O5' DG A 8 3.135 3.101 -9.767 1.00 0.69 O ATOM 133 C5' DG A 8 2.067 2.684 -10.619 1.00 0.81 C ATOM 134 C4' DG A 8 0.969 2.034 -9.808 1.00 0.61 C ATOM 135 O4' DG A 8 1.517 0.898 -9.088 1.00 0.58 O ATOM 136 C3' DG A 8 0.327 2.937 -8.748 1.00 0.49 C ATOM 137 O3' DG A 8 -1.089 2.723 -8.707 1.00 0.48 O ATOM 138 C2' DG A 8 0.974 2.484 -7.452 1.00 0.43 C ATOM 139 C1' DG A 8 1.212 1.009 -7.708 1.00 0.47 C ATOM 140 N9 DG A 8 2.324 0.434 -6.953 1.00 0.52 N ATOM 141 C8 DG A 8 3.650 0.774 -7.046 1.00 0.60 C ATOM 142 N7 DG A 8 4.417 0.084 -6.250 1.00 0.67 N ATOM 143 C5 DG A 8 3.544 -0.765 -5.586 1.00 0.60 C ATOM 144 C6 DG A 8 3.799 -1.748 -4.597 1.00 0.65 C ATOM 145 O6 DG A 8 4.884 -2.068 -4.099 1.00 0.76 O ATOM 146 N1 DG A 8 2.631 -2.388 -4.186 1.00 0.61 N ATOM 147 C2 DG A 8 1.376 -2.104 -4.677 1.00 0.56 C ATOM 148 N2 DG A 8 0.361 -2.814 -4.159 1.00 0.60 N ATOM 149 N3 DG A 8 1.127 -1.189 -5.600 1.00 0.52 N ATOM 150 C4 DG A 8 2.249 -0.563 -6.007 1.00 0.52 C ATOM 0 H5' DG A 8 2.441 1.982 -11.365 1.00 0.81 H new ATOM 0 H5'' DG A 8 1.669 3.542 -11.160 1.00 0.81 H new ATOM 0 H4' DG A 8 0.202 1.769 -10.536 1.00 0.61 H new ATOM 0 H3' DG A 8 0.474 3.999 -8.944 1.00 0.49 H new ATOM 0 H2' DG A 8 1.904 3.017 -7.253 1.00 0.43 H new ATOM 0 H2'' DG A 8 0.323 2.648 -6.593 1.00 0.43 H new ATOM 0 H1' DG A 8 0.322 0.464 -7.395 1.00 0.47 H new ATOM 0 H8 DG A 8 4.021 1.538 -7.713 1.00 0.60 H new ATOM 0 H1 DG A 8 2.711 -3.115 -3.475 1.00 0.61 H new ATOM 0 H21 DG A 8 -0.593 -2.650 -4.481 1.00 0.60 H new ATOM 0 H22 DG A 8 0.544 -3.517 -3.443 1.00 0.60 H new ATOM 162 P DG A 9 -2.003 3.584 -7.702 1.00 0.49 P ATOM 163 OP1 DG A 9 -3.282 3.871 -8.400 1.00 0.80 O ATOM 164 OP2 DG A 9 -1.189 4.708 -7.173 1.00 0.89 O ATOM 165 O5' DG A 9 -2.308 2.579 -6.503 1.00 0.83 O ATOM 166 C5' DG A 9 -2.962 1.332 -6.739 1.00 0.75 C ATOM 167 C4' DG A 9 -3.463 0.748 -5.437 1.00 0.62 C ATOM 168 O4' DG A 9 -2.364 0.084 -4.762 1.00 0.59 O ATOM 169 C3' DG A 9 -4.016 1.774 -4.440 1.00 0.68 C ATOM 170 O3' DG A 9 -5.187 1.260 -3.796 1.00 0.83 O ATOM 171 C2' DG A 9 -2.888 1.944 -3.438 1.00 0.73 C ATOM 172 C1' DG A 9 -2.250 0.568 -3.435 1.00 0.59 C ATOM 173 N9 DG A 9 -0.835 0.554 -3.066 1.00 0.58 N ATOM 174 C8 DG A 9 0.174 1.305 -3.618 1.00 0.64 C ATOM 175 N7 DG A 9 1.341 1.075 -3.081 1.00 0.68 N ATOM 176 C5 DG A 9 1.087 0.112 -2.114 1.00 0.62 C ATOM 177 C6 DG A 9 1.968 -0.529 -1.207 1.00 0.64 C ATOM 178 O6 DG A 9 3.186 -0.365 -1.079 1.00 0.72 O ATOM 179 N1 DG A 9 1.303 -1.445 -0.393 1.00 0.59 N ATOM 180 C2 DG A 9 -0.048 -1.701 -0.456 1.00 0.57 C ATOM 181 N2 DG A 9 -0.518 -2.616 0.407 1.00 0.61 N ATOM 182 N3 DG A 9 -0.880 -1.109 -1.297 1.00 0.57 N ATOM 183 C4 DG A 9 -0.249 -0.220 -2.091 1.00 0.57 C ATOM 0 H5' DG A 9 -2.272 0.636 -7.216 1.00 0.75 H new ATOM 0 H5'' DG A 9 -3.796 1.475 -7.426 1.00 0.75 H new ATOM 0 H4' DG A 9 -4.277 0.081 -5.721 1.00 0.62 H new ATOM 0 H3' DG A 9 -4.309 2.712 -4.911 1.00 0.68 H new ATOM 0 H2' DG A 9 -2.184 2.718 -3.745 1.00 0.73 H new ATOM 0 H2'' DG A 9 -3.259 2.223 -2.452 1.00 0.73 H new ATOM 0 H1' DG A 9 -2.759 -0.039 -2.686 1.00 0.59 H new ATOM 0 H8 DG A 9 0.017 2.015 -4.417 1.00 0.64 H new ATOM 0 H1 DG A 9 1.854 -1.959 0.294 1.00 0.59 H new ATOM 0 H21 DG A 9 -1.511 -2.851 0.411 1.00 0.61 H new ATOM 0 H22 DG A 9 0.118 -3.076 1.059 1.00 0.61 H new ATOM 195 P DT A 10 -6.643 1.623 -4.374 1.00 0.92 P ATOM 196 OP1 DT A 10 -6.752 3.104 -4.409 1.00 0.91 O ATOM 197 OP2 DT A 10 -7.652 0.831 -3.625 1.00 1.18 O ATOM 198 O5' DT A 10 -6.605 1.094 -5.876 1.00 0.95 O ATOM 199 C5' DT A 10 -7.794 1.032 -6.665 1.00 0.86 C ATOM 200 C4' DT A 10 -8.014 -0.377 -7.165 1.00 0.76 C ATOM 201 O4' DT A 10 -9.343 -0.473 -7.740 1.00 1.06 O ATOM 202 C3' DT A 10 -7.046 -0.828 -8.263 1.00 0.58 C ATOM 203 O3' DT A 10 -6.713 -2.210 -8.096 1.00 0.80 O ATOM 204 C2' DT A 10 -7.840 -0.620 -9.540 1.00 0.81 C ATOM 205 C1' DT A 10 -9.261 -0.904 -9.090 1.00 0.87 C ATOM 206 N1 DT A 10 -10.299 -0.194 -9.863 1.00 1.41 N ATOM 207 C2 DT A 10 -10.551 -0.613 -11.150 1.00 1.59 C ATOM 208 O2 DT A 10 -9.958 -1.540 -11.678 1.00 1.41 O ATOM 209 N3 DT A 10 -11.527 0.096 -11.803 1.00 2.15 N ATOM 210 C4 DT A 10 -12.259 1.157 -11.307 1.00 2.56 C ATOM 211 O4 DT A 10 -13.106 1.697 -12.014 1.00 3.07 O ATOM 212 C5 DT A 10 -11.944 1.544 -9.950 1.00 2.42 C ATOM 213 C7 DT A 10 -12.688 2.687 -9.331 1.00 2.99 C ATOM 214 C6 DT A 10 -10.991 0.860 -9.299 1.00 1.88 C ATOM 0 H5' DT A 10 -7.716 1.717 -7.509 1.00 0.86 H new ATOM 0 H5'' DT A 10 -8.650 1.353 -6.072 1.00 0.86 H new ATOM 0 H4' DT A 10 -7.860 -1.014 -6.294 1.00 0.76 H new ATOM 0 H3' DT A 10 -6.103 -0.282 -8.255 1.00 0.58 H new ATOM 0 H2' DT A 10 -7.731 0.394 -9.926 1.00 0.81 H new ATOM 0 H2'' DT A 10 -7.521 -1.298 -10.332 1.00 0.81 H new ATOM 0 H1' DT A 10 -9.453 -1.967 -9.233 1.00 0.87 H new ATOM 0 H3 DT A 10 -11.735 -0.192 -12.759 1.00 2.15 H new ATOM 0 H71 DT A 10 -12.758 2.535 -8.254 1.00 2.99 H new ATOM 0 H72 DT A 10 -12.158 3.618 -9.532 1.00 2.99 H new ATOM 0 H73 DT A 10 -13.690 2.741 -9.756 1.00 2.99 H new ATOM 0 H6 DT A 10 -10.754 1.147 -8.285 1.00 1.88 H new ATOM 227 P DG A 11 -5.351 -2.617 -7.343 1.00 1.20 P ATOM 228 OP1 DG A 11 -5.540 -2.331 -5.899 1.00 1.86 O ATOM 229 OP2 DG A 11 -4.214 -1.999 -8.071 1.00 1.56 O ATOM 230 O5' DG A 11 -5.266 -4.198 -7.528 1.00 1.05 O ATOM 231 C5' DG A 11 -4.040 -4.831 -7.896 1.00 0.89 C ATOM 232 C4' DG A 11 -3.923 -6.178 -7.220 1.00 0.65 C ATOM 233 O4' DG A 11 -2.588 -6.702 -7.436 1.00 0.56 O ATOM 234 C3' DG A 11 -4.122 -6.158 -5.703 1.00 0.55 C ATOM 235 O3' DG A 11 -4.760 -7.365 -5.269 1.00 0.45 O ATOM 236 C2' DG A 11 -2.705 -6.077 -5.167 1.00 0.50 C ATOM 237 C1' DG A 11 -1.919 -6.874 -6.194 1.00 0.42 C ATOM 238 N9 DG A 11 -0.534 -6.437 -6.364 1.00 0.42 N ATOM 239 C8 DG A 11 -0.080 -5.407 -7.150 1.00 0.50 C ATOM 240 N7 DG A 11 1.214 -5.250 -7.099 1.00 0.48 N ATOM 241 C5 DG A 11 1.643 -6.239 -6.225 1.00 0.41 C ATOM 242 C6 DG A 11 2.949 -6.561 -5.778 1.00 0.41 C ATOM 243 O6 DG A 11 4.016 -6.014 -6.078 1.00 0.46 O ATOM 244 N1 DG A 11 2.946 -7.637 -4.892 1.00 0.40 N ATOM 245 C2 DG A 11 1.813 -8.311 -4.493 1.00 0.38 C ATOM 246 N2 DG A 11 2.000 -9.323 -3.631 1.00 0.44 N ATOM 247 N3 DG A 11 0.590 -8.019 -4.904 1.00 0.35 N ATOM 248 C4 DG A 11 0.578 -6.980 -5.762 1.00 0.37 C ATOM 0 H5' DG A 11 -3.198 -4.200 -7.613 1.00 0.89 H new ATOM 0 H5'' DG A 11 -3.997 -4.954 -8.978 1.00 0.89 H new ATOM 0 H4' DG A 11 -4.716 -6.782 -7.660 1.00 0.65 H new ATOM 0 H3' DG A 11 -4.754 -5.339 -5.361 1.00 0.55 H new ATOM 0 H2' DG A 11 -2.355 -5.047 -5.099 1.00 0.50 H new ATOM 0 H2'' DG A 11 -2.623 -6.508 -4.169 1.00 0.50 H new ATOM 0 H1' DG A 11 -1.874 -7.907 -5.850 1.00 0.42 H new ATOM 0 H8 DG A 11 -0.730 -4.788 -7.751 1.00 0.50 H new ATOM 0 H1 DG A 11 3.842 -7.946 -4.514 1.00 0.40 H new ATOM 0 H21 DG A 11 1.201 -9.862 -3.297 1.00 0.44 H new ATOM 0 H22 DG A 11 2.941 -9.553 -3.310 1.00 0.44 H new ATOM 260 P DG A 12 -5.514 -7.408 -3.849 1.00 0.34 P ATOM 261 OP1 DG A 12 -6.324 -8.652 -3.815 1.00 0.42 O ATOM 262 OP2 DG A 12 -6.176 -6.096 -3.630 1.00 0.48 O ATOM 263 O5' DG A 12 -4.333 -7.557 -2.790 1.00 0.46 O ATOM 264 C5' DG A 12 -4.564 -7.349 -1.396 1.00 0.53 C ATOM 265 C4' DG A 12 -3.665 -8.250 -0.581 1.00 0.58 C ATOM 266 O4' DG A 12 -2.317 -8.176 -1.109 1.00 0.54 O ATOM 267 C3' DG A 12 -3.558 -7.881 0.900 1.00 0.76 C ATOM 268 O3' DG A 12 -3.448 -9.063 1.701 1.00 0.94 O ATOM 269 C2' DG A 12 -2.280 -7.066 0.970 1.00 0.60 C ATOM 270 C1' DG A 12 -1.423 -7.693 -0.116 1.00 0.52 C ATOM 271 N9 DG A 12 -0.495 -6.767 -0.761 1.00 0.51 N ATOM 272 C8 DG A 12 -0.800 -5.802 -1.689 1.00 0.55 C ATOM 273 N7 DG A 12 0.240 -5.120 -2.084 1.00 0.56 N ATOM 274 C5 DG A 12 1.298 -5.670 -1.373 1.00 0.52 C ATOM 275 C6 DG A 12 2.677 -5.340 -1.382 1.00 0.54 C ATOM 276 O6 DG A 12 3.251 -4.470 -2.045 1.00 0.60 O ATOM 277 N1 DG A 12 3.410 -6.144 -0.510 1.00 0.54 N ATOM 278 C2 DG A 12 2.868 -7.140 0.270 1.00 0.53 C ATOM 279 N2 DG A 12 3.728 -7.816 1.048 1.00 0.60 N ATOM 280 N3 DG A 12 1.583 -7.456 0.287 1.00 0.51 N ATOM 281 C4 DG A 12 0.862 -6.686 -0.552 1.00 0.49 C ATOM 0 H5' DG A 12 -5.608 -7.552 -1.158 1.00 0.53 H new ATOM 0 H5'' DG A 12 -4.376 -6.306 -1.140 1.00 0.53 H new ATOM 0 H4' DG A 12 -4.116 -9.240 -0.653 1.00 0.58 H new ATOM 0 H3' DG A 12 -4.428 -7.339 1.271 1.00 0.76 H new ATOM 0 H2' DG A 12 -2.464 -6.008 0.781 1.00 0.60 H new ATOM 0 H2'' DG A 12 -1.808 -7.137 1.950 1.00 0.60 H new ATOM 0 H1' DG A 12 -0.812 -8.466 0.350 1.00 0.52 H new ATOM 0 H8 DG A 12 -1.800 -5.625 -2.055 1.00 0.55 H new ATOM 0 H1 DG A 12 4.415 -5.983 -0.446 1.00 0.54 H new ATOM 0 H21 DG A 12 3.389 -8.567 1.650 1.00 0.60 H new ATOM 0 H22 DG A 12 4.720 -7.579 1.037 1.00 0.60 H new ATOM 293 P DG A 13 -3.748 -8.995 3.280 1.00 1.23 P ATOM 294 OP1 DG A 13 -4.067 -10.373 3.731 1.00 1.61 O ATOM 295 OP2 DG A 13 -4.722 -7.900 3.525 1.00 1.52 O ATOM 296 O5' DG A 13 -2.351 -8.576 3.920 1.00 1.04 O ATOM 297 C5' DG A 13 -2.274 -8.079 5.256 1.00 0.90 C ATOM 298 C4' DG A 13 -0.863 -8.211 5.781 1.00 0.70 C ATOM 299 O4' DG A 13 0.064 -7.731 4.773 1.00 0.61 O ATOM 300 C3' DG A 13 -0.569 -7.400 7.048 1.00 0.68 C ATOM 301 O3' DG A 13 0.260 -8.154 7.940 1.00 0.74 O ATOM 302 C2' DG A 13 0.175 -6.182 6.529 1.00 0.77 C ATOM 303 C1' DG A 13 0.913 -6.740 5.327 1.00 0.67 C ATOM 304 N9 DG A 13 1.203 -5.757 4.285 1.00 0.58 N ATOM 305 C8 DG A 13 0.307 -5.170 3.425 1.00 0.60 C ATOM 306 N7 DG A 13 0.861 -4.326 2.599 1.00 0.58 N ATOM 307 C5 DG A 13 2.208 -4.356 2.934 1.00 0.53 C ATOM 308 C6 DG A 13 3.304 -3.647 2.382 1.00 0.57 C ATOM 309 O6 DG A 13 3.297 -2.826 1.459 1.00 0.67 O ATOM 310 N1 DG A 13 4.504 -3.971 3.013 1.00 0.55 N ATOM 311 C2 DG A 13 4.620 -4.870 4.049 1.00 0.52 C ATOM 312 N2 DG A 13 5.856 -5.057 4.536 1.00 0.58 N ATOM 313 N3 DG A 13 3.603 -5.537 4.572 1.00 0.52 N ATOM 314 C4 DG A 13 2.436 -5.233 3.971 1.00 0.51 C ATOM 0 H5' DG A 13 -2.962 -8.631 5.897 1.00 0.90 H new ATOM 0 H5'' DG A 13 -2.583 -7.034 5.282 1.00 0.90 H new ATOM 0 H4' DG A 13 -0.748 -9.268 6.021 1.00 0.70 H new ATOM 0 H3' DG A 13 -1.468 -7.140 7.607 1.00 0.68 H new ATOM 0 H2' DG A 13 -0.506 -5.378 6.250 1.00 0.77 H new ATOM 0 H2'' DG A 13 0.860 -5.776 7.274 1.00 0.77 H new ATOM 0 H1' DG A 13 1.880 -7.112 5.666 1.00 0.67 H new ATOM 0 H8 DG A 13 -0.751 -5.386 3.432 1.00 0.60 H new ATOM 0 H1 DG A 13 5.353 -3.511 2.685 1.00 0.55 H new ATOM 0 H21 DG A 13 6.008 -5.710 5.304 1.00 0.58 H new ATOM 0 H22 DG A 13 6.644 -4.546 4.138 1.00 0.58 H new ATOM 326 P DT A 14 0.230 -7.839 9.517 1.00 0.50 P ATOM 327 OP1 DT A 14 -1.182 -7.947 9.964 1.00 0.50 O ATOM 328 OP2 DT A 14 0.980 -6.580 9.756 1.00 0.77 O ATOM 329 O5' DT A 14 1.048 -9.042 10.168 1.00 0.78 O ATOM 330 C5' DT A 14 2.466 -9.135 10.021 1.00 1.19 C ATOM 331 C4' DT A 14 2.817 -10.213 9.022 1.00 0.66 C ATOM 332 O4' DT A 14 4.259 -10.337 8.945 1.00 0.81 O ATOM 333 C3' DT A 14 2.299 -11.608 9.372 1.00 0.75 C ATOM 334 O3' DT A 14 1.976 -12.333 8.180 1.00 0.75 O ATOM 335 C2' DT A 14 3.472 -12.250 10.088 1.00 1.08 C ATOM 336 C1' DT A 14 4.673 -11.617 9.403 1.00 0.60 C ATOM 337 N1 DT A 14 5.841 -11.426 10.283 1.00 0.50 N ATOM 338 C2 DT A 14 6.915 -12.277 10.138 1.00 0.47 C ATOM 339 O2 DT A 14 6.945 -13.180 9.318 1.00 0.87 O ATOM 340 N3 DT A 14 7.958 -12.033 10.995 1.00 0.73 N ATOM 341 C4 DT A 14 8.032 -11.046 11.957 1.00 1.32 C ATOM 342 O4 DT A 14 9.039 -10.949 12.655 1.00 1.74 O ATOM 343 C5 DT A 14 6.872 -10.190 12.055 1.00 1.53 C ATOM 344 C7 DT A 14 6.865 -9.091 13.072 1.00 2.29 C ATOM 345 C6 DT A 14 5.844 -10.416 11.224 1.00 1.08 C ATOM 0 H5' DT A 14 2.925 -9.358 10.984 1.00 1.19 H new ATOM 0 H5'' DT A 14 2.868 -8.177 9.690 1.00 1.19 H new ATOM 0 H4' DT A 14 2.346 -9.896 8.091 1.00 0.66 H new ATOM 0 H3' DT A 14 1.391 -11.591 9.975 1.00 0.75 H new ATOM 0 H2' DT A 14 3.458 -12.038 11.157 1.00 1.08 H new ATOM 0 H2'' DT A 14 3.469 -13.334 9.978 1.00 1.08 H new ATOM 0 H1' DT A 14 4.990 -12.291 8.607 1.00 0.60 H new ATOM 0 H3 DT A 14 8.767 -12.648 10.912 1.00 0.73 H new ATOM 0 H71 DT A 14 6.256 -8.263 12.709 1.00 2.29 H new ATOM 0 H72 DT A 14 6.449 -9.464 14.008 1.00 2.29 H new ATOM 0 H73 DT A 14 7.885 -8.745 13.240 1.00 2.29 H new ATOM 0 H6 DT A 14 4.976 -9.777 11.294 1.00 1.08 H new ATOM 358 P DA A 15 0.445 -12.448 7.704 1.00 0.75 P ATOM 359 OP1 DA A 15 -0.124 -11.076 7.700 1.00 1.05 O ATOM 360 OP2 DA A 15 -0.213 -13.513 8.502 1.00 0.97 O ATOM 361 O5' DA A 15 0.549 -12.945 6.194 1.00 1.10 O ATOM 362 C5' DA A 15 -0.590 -13.472 5.514 1.00 1.10 C ATOM 363 C4' DA A 15 -0.186 -14.015 4.163 1.00 0.74 C ATOM 364 O4' DA A 15 -1.253 -14.851 3.649 1.00 0.70 O ATOM 365 C3' DA A 15 0.062 -12.954 3.090 1.00 0.41 C ATOM 366 O3' DA A 15 1.089 -13.387 2.191 1.00 0.61 O ATOM 367 C2' DA A 15 -1.274 -12.866 2.377 1.00 0.58 C ATOM 368 C1' DA A 15 -1.783 -14.296 2.453 1.00 0.44 C ATOM 369 N9 DA A 15 -3.241 -14.416 2.509 1.00 0.42 N ATOM 370 C8 DA A 15 -4.060 -14.219 3.594 1.00 0.77 C ATOM 371 N7 DA A 15 -5.332 -14.401 3.335 1.00 0.94 N ATOM 372 C5 DA A 15 -5.354 -14.740 1.990 1.00 0.72 C ATOM 373 C6 DA A 15 -6.405 -15.057 1.111 1.00 0.94 C ATOM 374 N6 DA A 15 -7.690 -15.085 1.471 1.00 1.19 N ATOM 375 N1 DA A 15 -6.086 -15.348 -0.169 1.00 1.10 N ATOM 376 C2 DA A 15 -4.797 -15.320 -0.532 1.00 1.12 C ATOM 377 N3 DA A 15 -3.722 -15.038 0.202 1.00 0.88 N ATOM 378 C4 DA A 15 -4.073 -14.753 1.468 1.00 0.55 C ATOM 0 H5' DA A 15 -1.342 -12.693 5.391 1.00 1.10 H new ATOM 0 H5'' DA A 15 -1.045 -14.263 6.111 1.00 1.10 H new ATOM 0 H4' DA A 15 0.749 -14.545 4.343 1.00 0.74 H new ATOM 0 H3' DA A 15 0.394 -11.998 3.494 1.00 0.41 H new ATOM 0 H2' DA A 15 -1.951 -12.168 2.869 1.00 0.58 H new ATOM 0 H2'' DA A 15 -1.162 -12.529 1.346 1.00 0.58 H new ATOM 0 H1' DA A 15 -1.468 -14.809 1.544 1.00 0.44 H new ATOM 0 H8 DA A 15 -3.690 -13.940 4.570 1.00 0.77 H new ATOM 0 H61 DA A 15 -8.407 -15.323 0.785 1.00 1.19 H new ATOM 0 H62 DA A 15 -7.955 -14.869 2.432 1.00 1.19 H new ATOM 0 H2 DA A 15 -4.602 -15.560 -1.567 1.00 1.12 H new ATOM 390 P DG A 16 1.830 -12.318 1.245 1.00 0.81 P ATOM 391 OP1 DG A 16 2.265 -11.186 2.103 1.00 1.25 O ATOM 392 OP2 DG A 16 0.962 -12.055 0.069 1.00 0.99 O ATOM 393 O5' DG A 16 3.134 -13.085 0.740 1.00 0.90 O ATOM 394 C5' DG A 16 3.811 -14.022 1.579 1.00 0.56 C ATOM 395 C4' DG A 16 5.289 -13.709 1.625 1.00 0.39 C ATOM 396 O4' DG A 16 5.708 -13.208 0.329 1.00 0.41 O ATOM 397 C3' DG A 16 5.688 -12.633 2.640 1.00 0.41 C ATOM 398 O3' DG A 16 6.952 -12.953 3.233 1.00 0.61 O ATOM 399 C2' DG A 16 5.797 -11.377 1.796 1.00 0.45 C ATOM 400 C1' DG A 16 6.287 -11.921 0.468 1.00 0.43 C ATOM 401 N9 DG A 16 5.900 -11.121 -0.692 1.00 0.39 N ATOM 402 C8 DG A 16 4.689 -11.132 -1.340 1.00 0.42 C ATOM 403 N7 DG A 16 4.635 -10.302 -2.346 1.00 0.41 N ATOM 404 C5 DG A 16 5.888 -9.705 -2.363 1.00 0.36 C ATOM 405 C6 DG A 16 6.421 -8.719 -3.230 1.00 0.37 C ATOM 406 O6 DG A 16 5.867 -8.158 -4.182 1.00 0.40 O ATOM 407 N1 DG A 16 7.735 -8.390 -2.900 1.00 0.39 N ATOM 408 C2 DG A 16 8.438 -8.950 -1.857 1.00 0.42 C ATOM 409 N2 DG A 16 9.693 -8.508 -1.682 1.00 0.52 N ATOM 410 N3 DG A 16 7.950 -9.870 -1.041 1.00 0.42 N ATOM 411 C4 DG A 16 6.680 -10.198 -1.350 1.00 0.37 C ATOM 0 H5' DG A 16 3.658 -15.034 1.204 1.00 0.56 H new ATOM 0 H5'' DG A 16 3.393 -13.988 2.585 1.00 0.56 H new ATOM 0 H4' DG A 16 5.766 -14.645 1.916 1.00 0.39 H new ATOM 0 H3' DG A 16 4.979 -12.533 3.462 1.00 0.41 H new ATOM 0 H2' DG A 16 4.838 -10.868 1.698 1.00 0.45 H new ATOM 0 H2'' DG A 16 6.496 -10.659 2.224 1.00 0.45 H new ATOM 0 H1' DG A 16 7.377 -11.919 0.486 1.00 0.43 H new ATOM 0 H8 DG A 16 3.864 -11.764 -1.047 1.00 0.42 H new ATOM 0 H1 DG A 16 8.207 -7.688 -3.469 1.00 0.39 H new ATOM 0 H21 DG A 16 10.265 -8.884 -0.926 1.00 0.52 H new ATOM 0 H22 DG A 16 10.074 -7.796 -2.305 1.00 0.52 H new ATOM 423 P DG A 17 7.453 -12.154 4.537 1.00 0.84 P ATOM 424 OP1 DG A 17 8.216 -13.111 5.378 1.00 1.35 O ATOM 425 OP2 DG A 17 6.292 -11.432 5.118 1.00 1.07 O ATOM 426 O5' DG A 17 8.475 -11.075 3.960 1.00 0.75 O ATOM 427 C5' DG A 17 9.764 -11.464 3.483 1.00 0.67 C ATOM 428 C4' DG A 17 10.675 -10.261 3.397 1.00 0.61 C ATOM 429 O4' DG A 17 10.246 -9.419 2.296 1.00 0.59 O ATOM 430 C3' DG A 17 10.675 -9.363 4.639 1.00 0.61 C ATOM 431 O3' DG A 17 11.995 -8.869 4.896 1.00 0.82 O ATOM 432 C2' DG A 17 9.745 -8.227 4.253 1.00 0.63 C ATOM 433 C1' DG A 17 9.991 -8.104 2.761 1.00 0.57 C ATOM 434 N9 DG A 17 8.864 -7.565 2.003 1.00 0.46 N ATOM 435 C8 DG A 17 7.559 -7.993 2.038 1.00 0.45 C ATOM 436 N7 DG A 17 6.773 -7.315 1.248 1.00 0.48 N ATOM 437 C5 DG A 17 7.609 -6.380 0.654 1.00 0.44 C ATOM 438 C6 DG A 17 7.324 -5.367 -0.296 1.00 0.49 C ATOM 439 O6 DG A 17 6.237 -5.090 -0.815 1.00 0.62 O ATOM 440 N1 DG A 17 8.461 -4.636 -0.636 1.00 0.45 N ATOM 441 C2 DG A 17 9.715 -4.864 -0.116 1.00 0.43 C ATOM 442 N2 DG A 17 10.695 -4.062 -0.559 1.00 0.47 N ATOM 443 N3 DG A 17 9.993 -5.805 0.771 1.00 0.44 N ATOM 444 C4 DG A 17 8.902 -6.520 1.109 1.00 0.42 C ATOM 0 H5' DG A 17 9.671 -11.930 2.502 1.00 0.67 H new ATOM 0 H5'' DG A 17 10.197 -12.210 4.150 1.00 0.67 H new ATOM 0 H4' DG A 17 11.677 -10.674 3.276 1.00 0.61 H new ATOM 0 H3' DG A 17 10.359 -9.882 5.544 1.00 0.61 H new ATOM 0 H2' DG A 17 8.704 -8.460 4.476 1.00 0.63 H new ATOM 0 H2'' DG A 17 9.986 -7.305 4.783 1.00 0.63 H new ATOM 0 H1' DG A 17 10.814 -7.405 2.612 1.00 0.57 H new ATOM 0 H8 DG A 17 7.218 -8.809 2.658 1.00 0.45 H new ATOM 0 H1 DG A 17 8.357 -3.882 -1.315 1.00 0.45 H new ATOM 0 H21 DG A 17 11.647 -4.180 -0.212 1.00 0.47 H new ATOM 0 H22 DG A 17 10.488 -3.334 -1.243 1.00 0.47 H new ATOM 456 P DG A 18 12.300 -8.063 6.254 1.00 0.93 P ATOM 457 OP1 DG A 18 13.547 -8.625 6.833 1.00 1.22 O ATOM 458 OP2 DG A 18 11.060 -8.035 7.072 1.00 1.04 O ATOM 459 O5' DG A 18 12.608 -6.579 5.761 1.00 0.93 O ATOM 460 C5' DG A 18 13.763 -6.292 4.971 1.00 0.50 C ATOM 461 C4' DG A 18 13.896 -4.802 4.760 1.00 0.65 C ATOM 462 O4' DG A 18 12.848 -4.357 3.861 1.00 0.66 O ATOM 463 C3' DG A 18 13.757 -3.954 6.031 1.00 0.87 C ATOM 464 O3' DG A 18 14.749 -2.920 6.050 1.00 1.06 O ATOM 465 C2' DG A 18 12.366 -3.354 5.918 1.00 1.04 C ATOM 466 C1' DG A 18 12.182 -3.239 4.418 1.00 0.87 C ATOM 467 N9 DG A 18 10.791 -3.269 3.969 1.00 0.74 N ATOM 468 C8 DG A 18 9.782 -4.068 4.450 1.00 0.67 C ATOM 469 N7 DG A 18 8.638 -3.870 3.855 1.00 0.60 N ATOM 470 C5 DG A 18 8.908 -2.878 2.922 1.00 0.59 C ATOM 471 C6 DG A 18 8.053 -2.250 1.981 1.00 0.56 C ATOM 472 O6 DG A 18 6.850 -2.454 1.786 1.00 0.56 O ATOM 473 N1 DG A 18 8.726 -1.294 1.223 1.00 0.60 N ATOM 474 C2 DG A 18 10.060 -0.989 1.363 1.00 0.69 C ATOM 475 N2 DG A 18 10.540 -0.041 0.543 1.00 0.76 N ATOM 476 N3 DG A 18 10.868 -1.569 2.237 1.00 0.75 N ATOM 477 C4 DG A 18 10.230 -2.496 2.979 1.00 0.68 C ATOM 0 H5' DG A 18 13.688 -6.797 4.008 1.00 0.50 H new ATOM 0 H5'' DG A 18 14.655 -6.677 5.465 1.00 0.50 H new ATOM 0 H4' DG A 18 14.904 -4.660 4.370 1.00 0.65 H new ATOM 0 H3' DG A 18 13.893 -4.533 6.944 1.00 0.87 H new ATOM 0 H2' DG A 18 11.609 -3.994 6.372 1.00 1.04 H new ATOM 0 H2'' DG A 18 12.301 -2.384 6.411 1.00 1.04 H new ATOM 0 H1' DG A 18 12.574 -2.272 4.103 1.00 0.87 H new ATOM 0 H8 DG A 18 9.922 -4.789 5.242 1.00 0.67 H new ATOM 0 H1 DG A 18 8.194 -0.786 0.517 1.00 0.60 H new ATOM 0 H21 DG A 18 11.522 0.231 0.597 1.00 0.76 H new ATOM 0 H22 DG A 18 9.923 0.408 -0.134 1.00 0.76 H new ATOM 489 P DT A 19 16.103 -3.117 6.897 1.00 0.83 P ATOM 490 OP1 DT A 19 15.969 -4.378 7.670 1.00 0.93 O ATOM 491 OP2 DT A 19 16.394 -1.848 7.610 1.00 1.31 O ATOM 492 O5' DT A 19 17.224 -3.335 5.786 1.00 0.74 O ATOM 493 C5' DT A 19 17.391 -2.402 4.718 1.00 1.24 C ATOM 494 C4' DT A 19 18.327 -2.966 3.674 1.00 1.19 C ATOM 495 O4' DT A 19 19.688 -2.898 4.172 1.00 1.14 O ATOM 496 C3' DT A 19 18.083 -4.435 3.317 1.00 1.29 C ATOM 497 O3' DT A 19 18.325 -4.654 1.923 1.00 1.06 O ATOM 498 C2' DT A 19 19.104 -5.176 4.161 1.00 1.43 C ATOM 499 C1' DT A 19 20.262 -4.196 4.211 1.00 1.23 C ATOM 500 N1 DT A 19 21.090 -4.293 5.430 1.00 1.26 N ATOM 501 C2 DT A 19 22.147 -5.176 5.430 1.00 1.58 C ATOM 502 O2 DT A 19 22.429 -5.878 4.473 1.00 2.01 O ATOM 503 N3 DT A 19 22.866 -5.207 6.597 1.00 1.60 N ATOM 504 C4 DT A 19 22.639 -4.462 7.737 1.00 1.40 C ATOM 505 O4 DT A 19 23.372 -4.599 8.712 1.00 1.53 O ATOM 506 C5 DT A 19 21.514 -3.556 7.668 1.00 1.43 C ATOM 507 C7 DT A 19 21.193 -2.707 8.859 1.00 1.86 C ATOM 508 C6 DT A 19 20.801 -3.514 6.533 1.00 1.36 C ATOM 0 H5' DT A 19 17.788 -1.463 5.104 1.00 1.24 H new ATOM 0 H5'' DT A 19 16.424 -2.177 4.267 1.00 1.24 H new ATOM 0 H4' DT A 19 18.149 -2.365 2.782 1.00 1.19 H new ATOM 0 H3' DT A 19 17.060 -4.760 3.506 1.00 1.29 H new ATOM 0 H2' DT A 19 18.721 -5.402 5.156 1.00 1.43 H new ATOM 0 H2'' DT A 19 19.394 -6.124 3.708 1.00 1.43 H new ATOM 0 H1' DT A 19 20.925 -4.418 3.375 1.00 1.23 H new ATOM 0 H3 DT A 19 23.656 -5.852 6.626 1.00 1.60 H new ATOM 0 H71 DT A 19 20.738 -1.773 8.528 1.00 1.86 H new ATOM 0 H72 DT A 19 20.498 -3.239 9.509 1.00 1.86 H new ATOM 0 H73 DT A 19 22.109 -2.489 9.408 1.00 1.86 H new ATOM 0 H6 DT A 19 19.960 -2.838 6.479 1.00 1.36 H new ATOM 521 P DG A 20 17.650 -5.911 1.181 1.00 1.13 P ATOM 522 OP1 DG A 20 16.292 -6.092 1.754 1.00 1.31 O ATOM 523 OP2 DG A 20 18.614 -7.041 1.208 1.00 1.23 O ATOM 524 O5' DG A 20 17.491 -5.426 -0.329 1.00 0.97 O ATOM 525 C5' DG A 20 16.446 -5.935 -1.158 1.00 0.75 C ATOM 526 C4' DG A 20 16.420 -5.198 -2.476 1.00 0.63 C ATOM 527 O4' DG A 20 15.374 -5.758 -3.310 1.00 0.65 O ATOM 528 C3' DG A 20 16.118 -3.699 -2.369 1.00 0.70 C ATOM 529 O3' DG A 20 16.907 -2.963 -3.311 1.00 0.81 O ATOM 530 C2' DG A 20 14.645 -3.607 -2.719 1.00 0.61 C ATOM 531 C1' DG A 20 14.474 -4.740 -3.713 1.00 0.60 C ATOM 532 N9 DG A 20 13.129 -5.311 -3.752 1.00 0.57 N ATOM 533 C8 DG A 20 12.677 -6.415 -3.072 1.00 0.58 C ATOM 534 N7 DG A 20 11.425 -6.693 -3.314 1.00 0.57 N ATOM 535 C5 DG A 20 11.025 -5.711 -4.210 1.00 0.54 C ATOM 536 C6 DG A 20 9.770 -5.494 -4.832 1.00 0.53 C ATOM 537 O6 DG A 20 8.730 -6.151 -4.706 1.00 0.56 O ATOM 538 N1 DG A 20 9.790 -4.383 -5.673 1.00 0.55 N ATOM 539 C2 DG A 20 10.891 -3.586 -5.881 1.00 0.60 C ATOM 540 N2 DG A 20 10.723 -2.549 -6.717 1.00 0.70 N ATOM 541 N3 DG A 20 12.068 -3.778 -5.306 1.00 0.61 N ATOM 542 C4 DG A 20 12.063 -4.850 -4.490 1.00 0.56 C ATOM 0 H5' DG A 20 15.486 -5.826 -0.653 1.00 0.75 H new ATOM 0 H5'' DG A 20 16.596 -7.001 -1.332 1.00 0.75 H new ATOM 0 H4' DG A 20 17.424 -5.314 -2.885 1.00 0.63 H new ATOM 0 H3' DG A 20 16.347 -3.285 -1.387 1.00 0.70 H new ATOM 0 H2' DG A 20 14.010 -3.737 -1.842 1.00 0.61 H new ATOM 0 H2'' DG A 20 14.391 -2.641 -3.156 1.00 0.61 H new ATOM 0 H1' DG A 20 14.662 -4.344 -4.711 1.00 0.60 H new ATOM 0 H8 DG A 20 13.296 -6.995 -2.404 1.00 0.58 H new ATOM 0 H1 DG A 20 8.930 -4.145 -6.167 1.00 0.55 H new ATOM 0 H21 DG A 20 11.502 -1.920 -6.913 1.00 0.70 H new ATOM 0 H22 DG A 20 9.816 -2.390 -7.156 1.00 0.70 H new ATOM 554 P DG A 21 17.092 -1.374 -3.134 1.00 0.91 P ATOM 555 OP1 DG A 21 18.281 -0.975 -3.931 1.00 1.17 O ATOM 556 OP2 DG A 21 17.042 -1.056 -1.685 1.00 1.16 O ATOM 557 O5' DG A 21 15.798 -0.753 -3.829 1.00 0.73 O ATOM 558 C5' DG A 21 15.684 -0.688 -5.251 1.00 0.66 C ATOM 559 C4' DG A 21 14.687 0.376 -5.650 1.00 0.58 C ATOM 560 O4' DG A 21 13.347 -0.177 -5.577 1.00 0.57 O ATOM 561 C3' DG A 21 14.679 1.623 -4.757 1.00 0.59 C ATOM 562 O3' DG A 21 14.491 2.801 -5.551 1.00 0.86 O ATOM 563 C2' DG A 21 13.487 1.396 -3.845 1.00 0.53 C ATOM 564 C1' DG A 21 12.534 0.636 -4.748 1.00 0.46 C ATOM 565 N9 DG A 21 11.591 -0.232 -4.044 1.00 0.41 N ATOM 566 C8 DG A 21 11.864 -1.076 -2.995 1.00 0.41 C ATOM 567 N7 DG A 21 10.818 -1.731 -2.575 1.00 0.43 N ATOM 568 C5 DG A 21 9.789 -1.294 -3.396 1.00 0.44 C ATOM 569 C6 DG A 21 8.417 -1.653 -3.416 1.00 0.50 C ATOM 570 O6 DG A 21 7.828 -2.458 -2.687 1.00 0.56 O ATOM 571 N1 DG A 21 7.715 -0.974 -4.410 1.00 0.54 N ATOM 572 C2 DG A 21 8.279 -0.062 -5.273 1.00 0.52 C ATOM 573 N2 DG A 21 7.450 0.499 -6.166 1.00 0.61 N ATOM 574 N3 DG A 21 9.557 0.280 -5.265 1.00 0.47 N ATOM 575 C4 DG A 21 10.248 -0.370 -4.308 1.00 0.42 C ATOM 0 H5' DG A 21 15.369 -1.656 -5.642 1.00 0.66 H new ATOM 0 H5'' DG A 21 16.657 -0.468 -5.691 1.00 0.66 H new ATOM 0 H4' DG A 21 14.988 0.680 -6.653 1.00 0.58 H new ATOM 0 H3' DG A 21 15.611 1.767 -4.210 1.00 0.59 H new ATOM 0 H2' DG A 21 13.756 0.820 -2.959 1.00 0.53 H new ATOM 0 H2'' DG A 21 13.056 2.335 -3.496 1.00 0.53 H new ATOM 0 H1' DG A 21 11.926 1.364 -5.285 1.00 0.46 H new ATOM 0 H8 DG A 21 12.847 -1.186 -2.562 1.00 0.41 H new ATOM 0 H1 DG A 21 6.718 -1.165 -4.504 1.00 0.54 H new ATOM 0 H21 DG A 21 7.807 1.183 -6.834 1.00 0.61 H new ATOM 0 H22 DG A 21 6.463 0.242 -6.177 1.00 0.61 H new ATOM 587 P DG A 22 14.702 4.255 -4.895 1.00 1.07 P ATOM 588 OP1 DG A 22 15.743 4.952 -5.691 1.00 1.47 O ATOM 589 OP2 DG A 22 14.888 4.087 -3.431 1.00 1.12 O ATOM 590 O5' DG A 22 13.311 4.994 -5.145 1.00 1.13 O ATOM 591 C5' DG A 22 12.443 5.323 -4.059 1.00 0.84 C ATOM 592 C4' DG A 22 11.012 5.390 -4.541 1.00 0.71 C ATOM 593 O4' DG A 22 10.473 4.055 -4.623 1.00 0.72 O ATOM 594 C3' DG A 22 10.057 6.138 -3.621 1.00 0.65 C ATOM 595 O3' DG A 22 10.043 7.533 -3.945 1.00 0.69 O ATOM 596 C2' DG A 22 8.713 5.500 -3.934 1.00 0.62 C ATOM 597 C1' DG A 22 9.075 4.078 -4.361 1.00 0.64 C ATOM 598 N9 DG A 22 8.790 3.057 -3.354 1.00 0.61 N ATOM 599 C8 DG A 22 9.688 2.446 -2.513 1.00 0.64 C ATOM 600 N7 DG A 22 9.138 1.567 -1.721 1.00 0.64 N ATOM 601 C5 DG A 22 7.792 1.599 -2.059 1.00 0.60 C ATOM 602 C6 DG A 22 6.700 0.861 -1.538 1.00 0.60 C ATOM 603 O6 DG A 22 6.710 0.007 -0.645 1.00 0.64 O ATOM 604 N1 DG A 22 5.499 1.196 -2.161 1.00 0.59 N ATOM 605 C2 DG A 22 5.379 2.131 -3.164 1.00 0.60 C ATOM 606 N2 DG A 22 4.142 2.325 -3.649 1.00 0.63 N ATOM 607 N3 DG A 22 6.392 2.826 -3.659 1.00 0.60 N ATOM 608 C4 DG A 22 7.560 2.511 -3.064 1.00 0.59 C ATOM 0 H5' DG A 22 12.735 6.280 -3.627 1.00 0.84 H new ATOM 0 H5'' DG A 22 12.535 4.576 -3.270 1.00 0.84 H new ATOM 0 H4' DG A 22 11.072 5.916 -5.494 1.00 0.71 H new ATOM 0 H3' DG A 22 10.328 6.074 -2.567 1.00 0.65 H new ATOM 0 H2' DG A 22 8.057 5.501 -3.063 1.00 0.62 H new ATOM 0 H2'' DG A 22 8.191 6.035 -4.727 1.00 0.62 H new ATOM 0 H1' DG A 22 8.464 3.838 -5.231 1.00 0.64 H new ATOM 0 H8 DG A 22 10.744 2.671 -2.508 1.00 0.64 H new ATOM 0 H1 DG A 22 4.653 0.717 -1.853 1.00 0.59 H new ATOM 0 H21 DG A 22 3.987 3.005 -4.394 1.00 0.63 H new ATOM 0 H22 DG A 22 3.357 1.793 -3.273 1.00 0.63 H new ATOM 620 P DT A 23 9.493 8.599 -2.874 1.00 0.72 P ATOM 621 OP1 DT A 23 9.625 9.947 -3.482 1.00 0.88 O ATOM 622 OP2 DT A 23 10.134 8.319 -1.564 1.00 0.88 O ATOM 623 O5' DT A 23 7.941 8.260 -2.755 1.00 0.78 O ATOM 624 C5' DT A 23 7.089 9.011 -1.890 1.00 0.59 C ATOM 625 C4' DT A 23 5.641 8.734 -2.218 1.00 0.55 C ATOM 626 O4' DT A 23 5.392 7.310 -2.094 1.00 0.60 O ATOM 627 C3' DT A 23 4.629 9.422 -1.295 1.00 0.47 C ATOM 628 O3' DT A 23 3.492 9.864 -2.046 1.00 0.61 O ATOM 629 C2' DT A 23 4.235 8.325 -0.322 1.00 0.50 C ATOM 630 C1' DT A 23 4.332 7.078 -1.180 1.00 0.60 C ATOM 631 N1 DT A 23 4.634 5.843 -0.429 1.00 0.68 N ATOM 632 C2 DT A 23 3.582 5.042 -0.042 1.00 0.88 C ATOM 633 O2 DT A 23 2.417 5.305 -0.293 1.00 0.99 O ATOM 634 N3 DT A 23 3.945 3.918 0.653 1.00 1.00 N ATOM 635 C4 DT A 23 5.222 3.523 0.992 1.00 0.93 C ATOM 636 O4 DT A 23 5.390 2.483 1.623 1.00 1.09 O ATOM 637 C5 DT A 23 6.279 4.408 0.555 1.00 0.74 C ATOM 638 C7 DT A 23 7.698 4.059 0.880 1.00 0.76 C ATOM 639 C6 DT A 23 5.940 5.513 -0.127 1.00 0.64 C ATOM 0 H5' DT A 23 7.297 10.076 -1.997 1.00 0.59 H new ATOM 0 H5'' DT A 23 7.291 8.750 -0.851 1.00 0.59 H new ATOM 0 H4' DT A 23 5.500 9.123 -3.226 1.00 0.55 H new ATOM 0 H3' DT A 23 5.031 10.305 -0.798 1.00 0.47 H new ATOM 0 H2' DT A 23 4.907 8.282 0.535 1.00 0.50 H new ATOM 0 H2'' DT A 23 3.228 8.471 0.069 1.00 0.50 H new ATOM 0 H1' DT A 23 3.362 6.915 -1.650 1.00 0.60 H new ATOM 0 H3 DT A 23 3.186 3.306 0.953 1.00 1.00 H new ATOM 0 H71 DT A 23 8.356 4.450 0.104 1.00 0.76 H new ATOM 0 H72 DT A 23 7.970 4.497 1.841 1.00 0.76 H new ATOM 0 H73 DT A 23 7.803 2.975 0.933 1.00 0.76 H new ATOM 0 H6 DT A 23 6.727 6.176 -0.455 1.00 0.64 H new ATOM 652 P DA A 24 2.320 10.690 -1.317 1.00 0.64 P ATOM 653 OP1 DA A 24 1.838 11.717 -2.275 1.00 0.96 O ATOM 654 OP2 DA A 24 2.805 11.107 0.024 1.00 0.78 O ATOM 655 O5' DA A 24 1.160 9.614 -1.120 1.00 0.54 O ATOM 656 C5' DA A 24 0.363 9.592 0.066 1.00 0.52 C ATOM 657 C4' DA A 24 -0.045 8.174 0.389 1.00 0.50 C ATOM 658 O4' DA A 24 1.099 7.462 0.927 1.00 0.56 O ATOM 659 C3' DA A 24 -1.149 8.043 1.440 1.00 0.54 C ATOM 660 O3' DA A 24 -1.982 6.916 1.144 1.00 0.62 O ATOM 661 C2' DA A 24 -0.377 7.816 2.726 1.00 0.62 C ATOM 662 C1' DA A 24 0.824 7.020 2.249 1.00 0.60 C ATOM 663 N9 DA A 24 2.034 7.211 3.051 1.00 0.71 N ATOM 664 C8 DA A 24 2.991 8.187 2.911 1.00 0.75 C ATOM 665 N7 DA A 24 3.965 8.100 3.784 1.00 0.90 N ATOM 666 C5 DA A 24 3.629 6.994 4.551 1.00 0.98 C ATOM 667 C6 DA A 24 4.258 6.374 5.645 1.00 1.19 C ATOM 668 N6 DA A 24 5.407 6.799 6.178 1.00 1.35 N ATOM 669 N1 DA A 24 3.660 5.288 6.181 1.00 1.29 N ATOM 670 C2 DA A 24 2.509 4.861 5.647 1.00 1.18 C ATOM 671 N3 DA A 24 1.821 5.358 4.621 1.00 0.97 N ATOM 672 C4 DA A 24 2.442 6.436 4.111 1.00 0.87 C ATOM 0 H5' DA A 24 -0.523 10.212 -0.070 1.00 0.52 H new ATOM 0 H5'' DA A 24 0.924 10.016 0.899 1.00 0.52 H new ATOM 0 H4' DA A 24 -0.420 7.770 -0.551 1.00 0.50 H new ATOM 0 H3' DA A 24 -1.809 8.909 1.487 1.00 0.54 H new ATOM 0 H2' DA A 24 -0.082 8.755 3.194 1.00 0.62 H new ATOM 0 H2'' DA A 24 -0.964 7.265 3.460 1.00 0.62 H new ATOM 0 H1' DA A 24 0.574 5.962 2.324 1.00 0.60 H new ATOM 0 H8 DA A 24 2.945 8.954 2.152 1.00 0.75 H new ATOM 0 H61 DA A 24 5.814 6.306 6.973 1.00 1.35 H new ATOM 0 H62 DA A 24 5.877 7.617 5.790 1.00 1.35 H new ATOM 0 H2 DA A 24 2.077 3.989 6.115 1.00 1.18 H new ATOM 684 P DA A 25 -3.418 6.764 1.853 1.00 0.61 P ATOM 685 OP1 DA A 25 -4.447 7.185 0.869 1.00 1.10 O ATOM 686 OP2 DA A 25 -3.359 7.427 3.181 1.00 0.70 O ATOM 687 O5' DA A 25 -3.568 5.194 2.085 1.00 0.73 O ATOM 688 C5' DA A 25 -2.642 4.275 1.503 1.00 0.66 C ATOM 689 C4' DA A 25 -2.795 2.909 2.130 1.00 0.72 C ATOM 690 O4' DA A 25 -1.854 1.995 1.523 1.00 0.77 O ATOM 691 C3' DA A 25 -2.490 2.847 3.620 1.00 0.78 C ATOM 692 O3' DA A 25 -3.654 3.153 4.393 1.00 0.97 O ATOM 693 C2' DA A 25 -2.073 1.400 3.815 1.00 0.96 C ATOM 694 C1' DA A 25 -1.415 1.039 2.484 1.00 0.80 C ATOM 695 N9 DA A 25 0.050 1.062 2.509 1.00 0.75 N ATOM 696 C8 DA A 25 0.895 1.793 1.709 1.00 0.88 C ATOM 697 N7 DA A 25 2.165 1.605 1.972 1.00 1.03 N ATOM 698 C5 DA A 25 2.160 0.689 3.014 1.00 0.96 C ATOM 699 C6 DA A 25 3.196 0.081 3.745 1.00 1.14 C ATOM 700 N6 DA A 25 4.493 0.321 3.536 1.00 1.44 N ATOM 701 N1 DA A 25 2.849 -0.789 4.719 1.00 1.08 N ATOM 702 C2 DA A 25 1.549 -1.024 4.937 1.00 0.88 C ATOM 703 N3 DA A 25 0.486 -0.515 4.318 1.00 0.74 N ATOM 704 C4 DA A 25 0.864 0.345 3.355 1.00 0.77 C ATOM 0 H5' DA A 25 -1.623 4.636 1.645 1.00 0.66 H new ATOM 0 H5'' DA A 25 -2.810 4.210 0.428 1.00 0.66 H new ATOM 0 H4' DA A 25 -3.843 2.655 1.972 1.00 0.72 H new ATOM 0 H3' DA A 25 -1.732 3.563 3.938 1.00 0.78 H new ATOM 0 H2' DA A 25 -1.380 1.290 4.649 1.00 0.96 H new ATOM 0 H2'' DA A 25 -2.930 0.760 4.027 1.00 0.96 H new ATOM 0 HO3' DA A 25 -4.134 3.901 3.980 1.00 0.97 H new ATOM 0 H1' DA A 25 -1.705 0.015 2.247 1.00 0.80 H new ATOM 0 H8 DA A 25 0.545 2.460 0.935 1.00 0.88 H new ATOM 0 H61 DA A 25 5.197 -0.153 4.101 1.00 1.44 H new ATOM 0 H62 DA A 25 4.780 0.979 2.811 1.00 1.44 H new ATOM 0 H2 DA A 25 1.332 -1.727 5.728 1.00 0.88 H new TER 717 DA A 25 HETATM 718 C17 BO6 A 101 13.737 -7.793 -6.341 1.00 0.50 C HETATM 719 C18 BO6 A 101 14.710 -6.878 -6.731 1.00 0.53 C HETATM 720 N19 BO6 A 101 14.366 -5.790 -7.532 1.00 0.54 N HETATM 721 C31 BO6 A 101 15.401 -4.817 -7.948 1.00 0.65 C HETATM 722 C20 BO6 A 101 13.043 -5.622 -7.940 1.00 0.51 C HETATM 723 C21 BO6 A 101 12.071 -6.537 -7.549 1.00 0.48 C HETATM 724 C16 BO6 A 101 12.404 -7.631 -6.747 1.00 0.47 C HETATM 725 C15 BO6 A 101 11.457 -8.562 -6.335 1.00 0.51 C HETATM 726 C14 BO6 A 101 11.764 -10.048 -6.121 1.00 0.63 C HETATM 727 C7 BO6 A 101 10.939 -10.903 -5.396 1.00 0.58 C HETATM 728 C6 BO6 A 101 9.610 -11.032 -5.774 1.00 0.45 C HETATM 729 C8 BO6 A 101 11.390 -11.627 -4.316 1.00 0.71 C HETATM 730 C9 BO6 A 101 10.514 -12.459 -3.641 1.00 0.72 C HETATM 731 C2 BO6 A 101 9.238 -12.557 -4.037 1.00 0.60 C HETATM 732 N1 BO6 A 101 8.223 -13.273 -3.562 1.00 0.65 N HETATM 733 C3 BO6 A 101 8.788 -11.850 -5.094 1.00 0.48 C HETATM 734 C4 BO6 A 101 7.499 -12.138 -5.260 1.00 0.45 C HETATM 735 C10 BO6 A 101 6.600 -11.705 -6.160 1.00 0.42 C HETATM 736 C5 BO6 A 101 7.148 -13.024 -4.305 1.00 0.56 C HETATM 737 C13 BO6 A 101 5.895 -13.491 -4.234 1.00 0.62 C HETATM 738 C12 BO6 A 101 4.942 -13.068 -5.144 1.00 0.61 C HETATM 739 C11 BO6 A 101 5.291 -12.165 -6.119 1.00 0.53 C HETATM 740 C22 BO6 A 101 4.374 -11.707 -7.059 1.00 0.59 C HETATM 741 C23 BO6 A 101 4.231 -10.230 -7.449 1.00 0.54 C HETATM 742 C24 BO6 A 101 3.127 -9.714 -8.120 1.00 0.47 C HETATM 743 C25 BO6 A 101 1.854 -10.220 -7.817 1.00 0.44 C HETATM 744 C26 BO6 A 101 0.725 -9.728 -8.466 1.00 0.47 C HETATM 745 N27 BO6 A 101 0.853 -8.725 -9.426 1.00 0.52 N HETATM 746 C30 BO6 A 101 -0.348 -8.202 -10.118 1.00 0.64 C HETATM 747 C28 BO6 A 101 2.114 -8.216 -9.734 1.00 0.58 C HETATM 748 C29 BO6 A 101 3.242 -8.708 -9.084 1.00 0.56 C