USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 242 hydrogens (0 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 Set 1.1: A 5 DT C7 :methyl 150:sc= -7.08! (180deg=-5.35!) USER MOD Set 1.2: A 6 DT C7 :methyl 150:sc= -6.92! (180deg=-5.24!) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl -30:sc= -27.2! (180deg=-33.5!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -5.27! (180deg=-6.56!) USER MOD Single : A 11 DT C7 :methyl 150:sc= -0.629 (180deg=-0.629) USER MOD Single : A 15 DT C7 :methyl -30:sc= -0.483 (180deg=-1.92) USER MOD Single : A 16 DT C7 :methyl -30:sc= 0 (180deg=-0.431) USER MOD Single : A 17 DT C7 :methyl -30:sc= 0 (180deg=-1.74!) USER MOD Single : A 18 DT C7 :methyl -30:sc= -1.13 (180deg=-1.53) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.457 -6.722 -7.444 1.00 0.46 O ATOM 2 C5' DG A 1 -4.444 -6.460 -6.040 1.00 0.36 C ATOM 3 C4' DG A 1 -5.756 -5.827 -5.576 1.00 0.26 C ATOM 4 O4' DG A 1 -5.698 -5.619 -4.160 1.00 0.23 O ATOM 5 C3' DG A 1 -6.056 -4.473 -6.233 1.00 0.24 C ATOM 6 O3' DG A 1 -7.416 -4.444 -6.727 1.00 0.24 O ATOM 7 C2' DG A 1 -5.860 -3.456 -5.111 1.00 0.22 C ATOM 8 C1' DG A 1 -6.109 -4.285 -3.861 1.00 0.18 C ATOM 9 N9 DG A 1 -5.360 -3.854 -2.666 1.00 0.17 N ATOM 10 C8 DG A 1 -5.842 -3.602 -1.408 1.00 0.17 C ATOM 11 N7 DG A 1 -4.922 -3.320 -0.532 1.00 0.17 N ATOM 12 C5 DG A 1 -3.740 -3.387 -1.260 1.00 0.17 C ATOM 13 C6 DG A 1 -2.407 -3.178 -0.833 1.00 0.19 C ATOM 14 O6 DG A 1 -2.007 -2.897 0.285 1.00 0.23 O ATOM 15 N1 DG A 1 -1.504 -3.343 -1.861 1.00 0.20 N ATOM 16 C2 DG A 1 -1.837 -3.663 -3.164 1.00 0.19 C ATOM 17 N2 DG A 1 -0.834 -3.749 -4.040 1.00 0.20 N ATOM 18 N3 DG A 1 -3.095 -3.861 -3.574 1.00 0.18 N ATOM 19 C4 DG A 1 -3.993 -3.708 -2.568 1.00 0.17 C ATOM 0 H5' DG A 1 -3.614 -5.796 -5.800 1.00 0.36 H new ATOM 0 H5'' DG A 1 -4.275 -7.390 -5.497 1.00 0.36 H new ATOM 0 H4' DG A 1 -6.548 -6.518 -5.865 1.00 0.26 H new ATOM 0 H3' DG A 1 -5.414 -4.268 -7.090 1.00 0.24 H new ATOM 0 H2' DG A 1 -4.857 -3.030 -5.121 1.00 0.22 H new ATOM 0 H2'' DG A 1 -6.560 -2.624 -5.191 1.00 0.22 H new ATOM 0 HO5' DG A 1 -3.604 -7.125 -7.710 1.00 0.46 H new ATOM 0 H1' DG A 1 -7.166 -4.178 -3.617 1.00 0.18 H new ATOM 0 H8 DG A 1 -6.894 -3.635 -1.165 1.00 0.17 H new ATOM 0 H1 DG A 1 -0.515 -3.220 -1.644 1.00 0.20 H new ATOM 0 H21 DG A 1 -1.026 -3.982 -5.014 1.00 0.20 H new ATOM 0 H22 DG A 1 0.125 -3.581 -3.735 1.00 0.20 H new ATOM 32 P DG A 2 -8.709 -4.674 -5.778 1.00 0.21 P ATOM 33 OP1 DG A 2 -8.461 -5.847 -4.914 1.00 0.27 O ATOM 34 OP2 DG A 2 -9.918 -4.637 -6.633 1.00 0.29 O ATOM 35 O5' DG A 2 -8.712 -3.367 -4.851 1.00 0.20 O ATOM 36 C5' DG A 2 -9.546 -3.299 -3.693 1.00 0.19 C ATOM 37 C4' DG A 2 -9.300 -2.010 -2.928 1.00 0.18 C ATOM 38 O4' DG A 2 -7.962 -1.992 -2.448 1.00 0.19 O ATOM 39 C3' DG A 2 -9.484 -0.759 -3.780 1.00 0.16 C ATOM 40 O3' DG A 2 -10.734 -0.150 -3.441 1.00 0.20 O ATOM 41 C2' DG A 2 -8.311 0.153 -3.401 1.00 0.16 C ATOM 42 C1' DG A 2 -7.551 -0.637 -2.342 1.00 0.15 C ATOM 43 N9 DG A 2 -6.097 -0.601 -2.511 1.00 0.15 N ATOM 44 C8 DG A 2 -5.369 -0.668 -3.665 1.00 0.14 C ATOM 45 N7 DG A 2 -4.093 -0.524 -3.487 1.00 0.15 N ATOM 46 C5 DG A 2 -3.965 -0.357 -2.122 1.00 0.14 C ATOM 47 C6 DG A 2 -2.812 -0.155 -1.349 1.00 0.16 C ATOM 48 O6 DG A 2 -1.659 -0.071 -1.717 1.00 0.20 O ATOM 49 N1 DG A 2 -3.109 -0.034 -0.022 1.00 0.15 N ATOM 50 C2 DG A 2 -4.354 -0.094 0.530 1.00 0.15 C ATOM 51 N2 DG A 2 -4.423 0.062 1.867 1.00 0.17 N ATOM 52 N3 DG A 2 -5.458 -0.287 -0.193 1.00 0.16 N ATOM 53 C4 DG A 2 -5.184 -0.407 -1.511 1.00 0.14 C ATOM 0 H5' DG A 2 -9.349 -4.154 -3.047 1.00 0.19 H new ATOM 0 H5'' DG A 2 -10.593 -3.357 -3.989 1.00 0.19 H new ATOM 0 H4' DG A 2 -10.033 -1.993 -2.121 1.00 0.18 H new ATOM 0 H3' DG A 2 -9.497 -0.964 -4.850 1.00 0.16 H new ATOM 0 H2' DG A 2 -7.681 0.371 -4.263 1.00 0.16 H new ATOM 0 H2'' DG A 2 -8.660 1.109 -3.011 1.00 0.16 H new ATOM 0 H1' DG A 2 -7.775 -0.187 -1.375 1.00 0.15 H new ATOM 0 H8 DG A 2 -5.815 -0.826 -4.636 1.00 0.14 H new ATOM 0 H1 DG A 2 -2.327 0.115 0.616 1.00 0.15 H new ATOM 0 H21 DG A 2 -5.327 0.027 2.339 1.00 0.17 H new ATOM 0 H22 DG A 2 -3.571 0.215 2.407 1.00 0.17 H new ATOM 65 P DG A 3 -11.101 1.344 -3.922 1.00 0.23 P ATOM 66 OP1 DG A 3 -12.575 1.482 -3.917 1.00 0.30 O ATOM 67 OP2 DG A 3 -10.336 1.648 -5.150 1.00 0.24 O ATOM 68 O5' DG A 3 -10.506 2.234 -2.728 1.00 0.22 O ATOM 69 C5' DG A 3 -10.810 1.913 -1.369 1.00 0.23 C ATOM 70 C4' DG A 3 -9.892 2.654 -0.409 1.00 0.21 C ATOM 71 O4' DG A 3 -8.526 2.278 -0.651 1.00 0.21 O ATOM 72 C3' DG A 3 -9.954 4.189 -0.543 1.00 0.24 C ATOM 73 O3' DG A 3 -9.880 4.795 0.756 1.00 0.26 O ATOM 74 C2' DG A 3 -8.677 4.503 -1.295 1.00 0.23 C ATOM 75 C1' DG A 3 -7.773 3.483 -0.644 1.00 0.18 C ATOM 76 N9 DG A 3 -6.487 3.252 -1.307 1.00 0.17 N ATOM 77 C8 DG A 3 -6.221 2.972 -2.615 1.00 0.20 C ATOM 78 N7 DG A 3 -4.950 2.856 -2.879 1.00 0.20 N ATOM 79 C5 DG A 3 -4.334 3.075 -1.651 1.00 0.18 C ATOM 80 C6 DG A 3 -2.958 3.078 -1.306 1.00 0.17 C ATOM 81 O6 DG A 3 -1.993 2.872 -2.039 1.00 0.20 O ATOM 82 N1 DG A 3 -2.774 3.351 0.047 1.00 0.16 N ATOM 83 C2 DG A 3 -3.785 3.581 0.946 1.00 0.16 C ATOM 84 N2 DG A 3 -3.420 3.808 2.206 1.00 0.17 N ATOM 85 N3 DG A 3 -5.075 3.574 0.622 1.00 0.17 N ATOM 86 C4 DG A 3 -5.271 3.318 -0.689 1.00 0.17 C ATOM 0 H5' DG A 3 -10.710 0.839 -1.215 1.00 0.23 H new ATOM 0 H5'' DG A 3 -11.847 2.170 -1.155 1.00 0.23 H new ATOM 0 H4' DG A 3 -10.237 2.377 0.587 1.00 0.21 H new ATOM 0 H3' DG A 3 -10.864 4.545 -1.025 1.00 0.24 H new ATOM 0 H2' DG A 3 -8.773 4.357 -2.371 1.00 0.23 H new ATOM 0 H2'' DG A 3 -8.337 5.527 -1.142 1.00 0.23 H new ATOM 0 H1' DG A 3 -7.494 3.850 0.344 1.00 0.18 H new ATOM 0 H8 DG A 3 -6.992 2.857 -3.363 1.00 0.20 H new ATOM 0 H1 DG A 3 -1.816 3.382 0.396 1.00 0.16 H new ATOM 0 H21 DG A 3 -4.128 3.985 2.918 1.00 0.17 H new ATOM 0 H22 DG A 3 -2.432 3.805 2.459 1.00 0.17 H new ATOM 98 P DT A 4 -10.924 4.419 1.921 1.00 0.26 P ATOM 99 OP1 DT A 4 -11.095 2.948 1.956 1.00 0.34 O ATOM 100 OP2 DT A 4 -12.110 5.293 1.771 1.00 0.34 O ATOM 101 O5' DT A 4 -10.141 4.860 3.257 1.00 0.30 O ATOM 102 C5' DT A 4 -10.161 6.216 3.714 1.00 0.31 C ATOM 103 C4' DT A 4 -8.758 6.818 3.787 1.00 0.27 C ATOM 104 O4' DT A 4 -7.982 6.132 4.786 1.00 0.28 O ATOM 105 C3' DT A 4 -7.979 6.740 2.465 1.00 0.24 C ATOM 106 O3' DT A 4 -7.769 8.055 1.937 1.00 0.27 O ATOM 107 C2' DT A 4 -6.633 6.110 2.824 1.00 0.23 C ATOM 108 C1' DT A 4 -6.905 5.413 4.163 1.00 0.25 C ATOM 109 N1 DT A 4 -7.279 3.985 4.007 1.00 0.23 N ATOM 110 C2 DT A 4 -8.361 3.482 4.729 1.00 0.26 C ATOM 111 O2 DT A 4 -8.887 4.090 5.659 1.00 0.32 O ATOM 112 N3 DT A 4 -8.787 2.218 4.376 1.00 0.26 N ATOM 113 C4 DT A 4 -8.252 1.425 3.383 1.00 0.24 C ATOM 114 O4 DT A 4 -8.718 0.312 3.155 1.00 0.27 O ATOM 115 C5 DT A 4 -7.135 2.023 2.691 1.00 0.21 C ATOM 116 C7 DT A 4 -6.608 1.373 1.425 1.00 0.21 C ATOM 117 C6 DT A 4 -6.670 3.237 3.033 1.00 0.21 C ATOM 0 H5' DT A 4 -10.626 6.259 4.699 1.00 0.31 H new ATOM 0 H5'' DT A 4 -10.778 6.815 3.044 1.00 0.31 H new ATOM 0 H4' DT A 4 -8.905 7.870 4.031 1.00 0.27 H new ATOM 0 H3' DT A 4 -8.517 6.164 1.713 1.00 0.24 H new ATOM 0 H2' DT A 4 -6.306 5.402 2.063 1.00 0.23 H new ATOM 0 H2'' DT A 4 -5.850 6.863 2.916 1.00 0.23 H new ATOM 0 H1' DT A 4 -5.996 5.421 4.764 1.00 0.25 H new ATOM 0 H3 DT A 4 -9.573 1.833 4.900 1.00 0.26 H new ATOM 0 H71 DT A 4 -6.773 0.297 1.473 1.00 0.21 H new ATOM 0 H72 DT A 4 -7.131 1.782 0.561 1.00 0.21 H new ATOM 0 H73 DT A 4 -5.541 1.573 1.331 1.00 0.21 H new ATOM 0 H6 DT A 4 -5.799 3.631 2.530 1.00 0.21 H new ATOM 130 P DT A 5 -8.666 8.595 0.710 1.00 0.23 P ATOM 131 OP1 DT A 5 -8.349 10.027 0.500 1.00 0.29 O ATOM 132 OP2 DT A 5 -10.064 8.182 0.953 1.00 0.28 O ATOM 133 O5' DT A 5 -8.125 7.753 -0.552 1.00 0.27 O ATOM 134 C5' DT A 5 -7.497 8.406 -1.663 1.00 0.25 C ATOM 135 C4' DT A 5 -5.988 8.491 -1.471 1.00 0.21 C ATOM 136 O4' DT A 5 -5.681 9.456 -0.471 1.00 0.24 O ATOM 137 C3' DT A 5 -5.370 7.182 -0.992 1.00 0.23 C ATOM 138 O3' DT A 5 -4.914 6.416 -2.128 1.00 0.31 O ATOM 139 C2' DT A 5 -4.211 7.613 -0.072 1.00 0.20 C ATOM 140 C1' DT A 5 -4.397 9.132 0.066 1.00 0.20 C ATOM 141 N1 DT A 5 -4.362 9.586 1.467 1.00 0.22 N ATOM 142 C2 DT A 5 -3.391 10.494 1.844 1.00 0.27 C ATOM 143 O2 DT A 5 -2.609 10.995 1.041 1.00 0.32 O ATOM 144 N3 DT A 5 -3.349 10.807 3.189 1.00 0.31 N ATOM 145 C4 DT A 5 -4.178 10.296 4.173 1.00 0.30 C ATOM 146 O4 DT A 5 -4.044 10.645 5.345 1.00 0.34 O ATOM 147 C5 DT A 5 -5.162 9.356 3.679 1.00 0.26 C ATOM 148 C7 DT A 5 -6.102 8.644 4.654 1.00 0.29 C ATOM 149 C6 DT A 5 -5.222 9.049 2.371 1.00 0.23 C ATOM 0 H5' DT A 5 -7.909 9.409 -1.779 1.00 0.25 H new ATOM 0 H5'' DT A 5 -7.719 7.862 -2.581 1.00 0.25 H new ATOM 0 H4' DT A 5 -5.582 8.750 -2.449 1.00 0.21 H new ATOM 0 H3' DT A 5 -6.071 6.539 -0.459 1.00 0.23 H new ATOM 0 H2' DT A 5 -4.262 7.114 0.896 1.00 0.20 H new ATOM 0 H2'' DT A 5 -3.242 7.367 -0.507 1.00 0.20 H new ATOM 0 H1' DT A 5 -3.579 9.624 -0.461 1.00 0.20 H new ATOM 0 H3 DT A 5 -2.640 11.478 3.485 1.00 0.31 H new ATOM 0 H71 DT A 5 -7.048 8.429 4.156 1.00 0.29 H new ATOM 0 H72 DT A 5 -5.645 7.711 4.984 1.00 0.29 H new ATOM 0 H73 DT A 5 -6.284 9.284 5.517 1.00 0.29 H new ATOM 0 H6 DT A 5 -5.976 8.355 2.029 1.00 0.23 H new ATOM 162 P DT A 6 -3.433 6.549 -2.758 1.00 0.26 P ATOM 163 OP1 DT A 6 -2.995 7.960 -2.656 1.00 0.29 O ATOM 164 OP2 DT A 6 -3.435 5.872 -4.074 1.00 0.38 O ATOM 165 O5' DT A 6 -2.557 5.658 -1.749 1.00 0.22 O ATOM 166 C5' DT A 6 -1.135 5.601 -1.850 1.00 0.22 C ATOM 167 C4' DT A 6 -0.484 6.808 -1.180 1.00 0.19 C ATOM 168 O4' DT A 6 -1.088 7.018 0.094 1.00 0.20 O ATOM 169 C3' DT A 6 1.016 6.636 -0.934 1.00 0.20 C ATOM 170 O3' DT A 6 1.758 7.520 -1.783 1.00 0.20 O ATOM 171 C2' DT A 6 1.220 7.027 0.532 1.00 0.22 C ATOM 172 C1' DT A 6 -0.118 7.626 0.932 1.00 0.19 C ATOM 173 N1 DT A 6 -0.504 7.378 2.337 1.00 0.18 N ATOM 174 C2 DT A 6 0.477 7.500 3.302 1.00 0.21 C ATOM 175 O2 DT A 6 1.636 7.788 3.029 1.00 0.27 O ATOM 176 N3 DT A 6 0.077 7.284 4.600 1.00 0.23 N ATOM 177 C4 DT A 6 -1.193 6.968 5.018 1.00 0.22 C ATOM 178 O4 DT A 6 -1.440 6.823 6.212 1.00 0.28 O ATOM 179 C5 DT A 6 -2.150 6.851 3.949 1.00 0.20 C ATOM 180 C7 DT A 6 -3.581 6.461 4.271 1.00 0.25 C ATOM 181 C6 DT A 6 -1.789 7.054 2.670 1.00 0.19 C ATOM 0 H5' DT A 6 -0.844 5.564 -2.900 1.00 0.22 H new ATOM 0 H5'' DT A 6 -0.771 4.684 -1.386 1.00 0.22 H new ATOM 0 H4' DT A 6 -0.628 7.646 -1.862 1.00 0.19 H new ATOM 0 H3' DT A 6 1.355 5.622 -1.144 1.00 0.20 H new ATOM 0 H2' DT A 6 1.472 6.162 1.146 1.00 0.22 H new ATOM 0 H2'' DT A 6 2.031 7.746 0.646 1.00 0.22 H new ATOM 0 H1' DT A 6 -0.048 8.709 0.826 1.00 0.19 H new ATOM 0 H3 DT A 6 0.793 7.366 5.322 1.00 0.23 H new ATOM 0 H71 DT A 6 -4.254 6.909 3.539 1.00 0.25 H new ATOM 0 H72 DT A 6 -3.679 5.376 4.237 1.00 0.25 H new ATOM 0 H73 DT A 6 -3.840 6.818 5.268 1.00 0.25 H new ATOM 0 H6 DT A 6 -2.530 6.959 1.890 1.00 0.19 H new ATOM 194 P DT A 7 3.324 7.784 -1.505 1.00 0.18 P ATOM 195 OP1 DT A 7 3.878 6.594 -0.831 1.00 0.21 O ATOM 196 OP2 DT A 7 3.451 9.111 -0.865 1.00 0.23 O ATOM 197 O5' DT A 7 3.945 7.866 -2.978 1.00 0.18 O ATOM 198 C5' DT A 7 4.323 6.684 -3.687 1.00 0.21 C ATOM 199 C4' DT A 7 4.383 6.960 -5.185 1.00 0.27 C ATOM 200 O4' DT A 7 3.053 7.038 -5.704 1.00 0.35 O ATOM 201 C3' DT A 7 5.114 8.255 -5.531 1.00 0.30 C ATOM 202 O3' DT A 7 6.163 7.966 -6.455 1.00 0.36 O ATOM 203 C2' DT A 7 4.079 9.164 -6.202 1.00 0.38 C ATOM 204 C1' DT A 7 2.809 8.318 -6.300 1.00 0.38 C ATOM 205 N1 DT A 7 1.637 8.909 -5.614 1.00 0.35 N ATOM 206 C2 DT A 7 0.484 9.095 -6.357 1.00 0.46 C ATOM 207 O2 DT A 7 0.422 8.827 -7.554 1.00 0.57 O ATOM 208 N3 DT A 7 -0.598 9.613 -5.679 1.00 0.45 N ATOM 209 C4 DT A 7 -0.636 9.960 -4.343 1.00 0.36 C ATOM 210 O4 DT A 7 -1.659 10.422 -3.849 1.00 0.41 O ATOM 211 C5 DT A 7 0.608 9.733 -3.641 1.00 0.26 C ATOM 212 C7 DT A 7 0.696 10.029 -2.145 1.00 0.25 C ATOM 213 C6 DT A 7 1.683 9.233 -4.281 1.00 0.25 C ATOM 0 H5' DT A 7 3.607 5.887 -3.486 1.00 0.21 H new ATOM 0 H5'' DT A 7 5.294 6.336 -3.336 1.00 0.21 H new ATOM 0 H4' DT A 7 4.942 6.138 -5.633 1.00 0.27 H new ATOM 0 H3' DT A 7 5.546 8.726 -4.648 1.00 0.30 H new ATOM 0 H2' DT A 7 3.907 10.066 -5.615 1.00 0.38 H new ATOM 0 H2'' DT A 7 4.416 9.485 -7.188 1.00 0.38 H new ATOM 0 H1' DT A 7 2.573 8.252 -7.362 1.00 0.38 H new ATOM 0 H3 DT A 7 -1.454 9.754 -6.216 1.00 0.45 H new ATOM 0 H71 DT A 7 0.012 10.840 -1.894 1.00 0.25 H new ATOM 0 H72 DT A 7 0.424 9.137 -1.581 1.00 0.25 H new ATOM 0 H73 DT A 7 1.715 10.322 -1.891 1.00 0.25 H new ATOM 0 H6 DT A 7 2.602 9.084 -3.733 1.00 0.25 H new ATOM 226 P DG A 8 7.690 8.320 -6.086 1.00 0.40 P ATOM 227 OP1 DG A 8 7.700 9.564 -5.286 1.00 0.51 O ATOM 228 OP2 DG A 8 8.491 8.235 -7.323 1.00 0.53 O ATOM 229 O5' DG A 8 8.122 7.096 -5.122 1.00 0.30 O ATOM 230 C5' DG A 8 8.231 5.752 -5.623 1.00 0.26 C ATOM 231 C4' DG A 8 8.730 4.783 -4.543 1.00 0.18 C ATOM 232 O4' DG A 8 7.956 4.969 -3.345 1.00 0.17 O ATOM 233 C3' DG A 8 8.614 3.292 -4.924 1.00 0.14 C ATOM 234 O3' DG A 8 9.773 2.570 -4.448 1.00 0.15 O ATOM 235 C2' DG A 8 7.370 2.857 -4.169 1.00 0.13 C ATOM 236 C1' DG A 8 7.505 3.690 -2.916 1.00 0.12 C ATOM 237 N9 DG A 8 6.275 3.848 -2.137 1.00 0.12 N ATOM 238 C8 DG A 8 6.155 4.059 -0.796 1.00 0.13 C ATOM 239 N7 DG A 8 4.926 4.080 -0.366 1.00 0.12 N ATOM 240 C5 DG A 8 4.181 3.869 -1.522 1.00 0.11 C ATOM 241 C6 DG A 8 2.786 3.787 -1.702 1.00 0.12 C ATOM 242 O6 DG A 8 1.903 3.870 -0.866 1.00 0.14 O ATOM 243 N1 DG A 8 2.461 3.573 -3.017 1.00 0.12 N ATOM 244 C2 DG A 8 3.344 3.446 -4.051 1.00 0.12 C ATOM 245 N2 DG A 8 2.819 3.259 -5.260 1.00 0.13 N ATOM 246 N3 DG A 8 4.653 3.515 -3.900 1.00 0.12 N ATOM 247 C4 DG A 8 5.002 3.729 -2.610 1.00 0.11 C ATOM 0 H5' DG A 8 8.915 5.734 -6.472 1.00 0.26 H new ATOM 0 H5'' DG A 8 7.259 5.420 -5.989 1.00 0.26 H new ATOM 0 H4' DG A 8 9.787 5.014 -4.410 1.00 0.18 H new ATOM 0 H3' DG A 8 8.556 3.112 -5.997 1.00 0.14 H new ATOM 0 H2' DG A 8 6.454 3.077 -4.717 1.00 0.13 H new ATOM 0 H2'' DG A 8 7.366 1.788 -3.958 1.00 0.13 H new ATOM 0 H1' DG A 8 8.193 3.178 -2.243 1.00 0.12 H new ATOM 0 H8 DG A 8 7.006 4.197 -0.146 1.00 0.13 H new ATOM 0 H1 DG A 8 1.469 3.502 -3.244 1.00 0.12 H new ATOM 0 H21 DG A 8 3.429 3.157 -6.071 1.00 0.13 H new ATOM 0 H22 DG A 8 1.806 3.217 -5.375 1.00 0.13 H new ATOM 259 P DG A 9 9.711 0.985 -4.102 1.00 0.15 P ATOM 260 OP1 DG A 9 11.090 0.448 -4.105 1.00 0.21 O ATOM 261 OP2 DG A 9 8.680 0.357 -4.955 1.00 0.18 O ATOM 262 O5' DG A 9 9.171 0.994 -2.589 1.00 0.18 O ATOM 263 C5' DG A 9 9.885 1.718 -1.583 1.00 0.15 C ATOM 264 C4' DG A 9 9.303 1.510 -0.188 1.00 0.13 C ATOM 265 O4' DG A 9 7.906 1.848 -0.104 1.00 0.15 O ATOM 266 C3' DG A 9 9.404 0.065 0.305 1.00 0.14 C ATOM 267 O3' DG A 9 10.539 -0.090 1.186 1.00 0.19 O ATOM 268 C2' DG A 9 8.087 -0.163 1.060 1.00 0.14 C ATOM 269 C1' DG A 9 7.482 1.232 1.111 1.00 0.13 C ATOM 270 N9 DG A 9 5.995 1.250 1.261 1.00 0.13 N ATOM 271 C8 DG A 9 5.282 1.388 2.433 1.00 0.14 C ATOM 272 N7 DG A 9 3.990 1.269 2.298 1.00 0.14 N ATOM 273 C5 DG A 9 3.818 1.036 0.936 1.00 0.13 C ATOM 274 C6 DG A 9 2.617 0.826 0.202 1.00 0.12 C ATOM 275 O6 DG A 9 1.464 0.798 0.635 1.00 0.14 O ATOM 276 N1 DG A 9 2.870 0.630 -1.153 1.00 0.12 N ATOM 277 C2 DG A 9 4.128 0.634 -1.726 1.00 0.13 C ATOM 278 N2 DG A 9 4.183 0.430 -3.041 1.00 0.14 N ATOM 279 N3 DG A 9 5.260 0.831 -1.038 1.00 0.13 N ATOM 280 C4 DG A 9 5.034 1.025 0.284 1.00 0.13 C ATOM 0 H5' DG A 9 9.869 2.781 -1.825 1.00 0.15 H new ATOM 0 H5'' DG A 9 10.929 1.406 -1.588 1.00 0.15 H new ATOM 0 H4' DG A 9 9.908 2.174 0.430 1.00 0.13 H new ATOM 0 H3' DG A 9 9.548 -0.650 -0.505 1.00 0.14 H new ATOM 0 H2' DG A 9 7.438 -0.866 0.538 1.00 0.14 H new ATOM 0 H2'' DG A 9 8.258 -0.567 2.058 1.00 0.14 H new ATOM 0 H1' DG A 9 7.821 1.767 1.998 1.00 0.13 H new ATOM 0 H8 DG A 9 5.755 1.579 3.385 1.00 0.14 H new ATOM 0 H1 DG A 9 2.070 0.472 -1.766 1.00 0.12 H new ATOM 0 H21 DG A 9 5.084 0.422 -3.519 1.00 0.14 H new ATOM 0 H22 DG A 9 3.324 0.282 -3.570 1.00 0.14 H new ATOM 292 P DG A 10 10.875 0.961 2.372 1.00 0.23 P ATOM 293 OP1 DG A 10 10.721 2.338 1.849 1.00 0.28 O ATOM 294 OP2 DG A 10 12.157 0.557 2.992 1.00 0.35 O ATOM 295 O5' DG A 10 9.695 0.695 3.432 1.00 0.21 O ATOM 296 C5' DG A 10 9.665 -0.506 4.211 1.00 0.20 C ATOM 297 C4' DG A 10 8.389 -0.594 5.040 1.00 0.16 C ATOM 298 O4' DG A 10 7.259 -0.596 4.169 1.00 0.16 O ATOM 299 C3' DG A 10 8.296 -1.846 5.921 1.00 0.18 C ATOM 300 O3' DG A 10 8.116 -1.469 7.305 1.00 0.20 O ATOM 301 C2' DG A 10 7.071 -2.604 5.400 1.00 0.18 C ATOM 302 C1' DG A 10 6.298 -1.529 4.652 1.00 0.16 C ATOM 303 N9 DG A 10 5.540 -2.003 3.479 1.00 0.15 N ATOM 304 C8 DG A 10 6.015 -2.295 2.232 1.00 0.16 C ATOM 305 N7 DG A 10 5.089 -2.591 1.364 1.00 0.16 N ATOM 306 C5 DG A 10 3.910 -2.494 2.093 1.00 0.14 C ATOM 307 C6 DG A 10 2.568 -2.704 1.684 1.00 0.14 C ATOM 308 O6 DG A 10 2.144 -3.007 0.576 1.00 0.18 O ATOM 309 N1 DG A 10 1.689 -2.507 2.729 1.00 0.14 N ATOM 310 C2 DG A 10 2.043 -2.154 4.008 1.00 0.14 C ATOM 311 N2 DG A 10 1.052 -2.032 4.882 1.00 0.16 N ATOM 312 N3 DG A 10 3.297 -1.951 4.398 1.00 0.15 N ATOM 313 C4 DG A 10 4.177 -2.139 3.392 1.00 0.14 C ATOM 0 H5' DG A 10 10.533 -0.537 4.870 1.00 0.20 H new ATOM 0 H5'' DG A 10 9.734 -1.372 3.552 1.00 0.20 H new ATOM 0 H4' DG A 10 8.407 0.272 5.701 1.00 0.16 H new ATOM 0 H3' DG A 10 9.199 -2.455 5.876 1.00 0.18 H new ATOM 0 H2' DG A 10 7.354 -3.428 4.745 1.00 0.18 H new ATOM 0 H2'' DG A 10 6.484 -3.031 6.213 1.00 0.18 H new ATOM 0 H1' DG A 10 5.569 -1.122 5.352 1.00 0.16 H new ATOM 0 H8 DG A 10 7.067 -2.282 1.987 1.00 0.16 H new ATOM 0 H1 DG A 10 0.696 -2.634 2.536 1.00 0.14 H new ATOM 0 H21 DG A 10 1.253 -1.772 5.848 1.00 0.16 H new ATOM 0 H22 DG A 10 0.090 -2.198 4.588 1.00 0.16 H new ATOM 325 P DT A 11 7.090 -0.306 7.777 1.00 0.19 P ATOM 326 OP1 DT A 11 7.276 -0.104 9.228 1.00 0.27 O ATOM 327 OP2 DT A 11 5.747 -0.623 7.244 1.00 0.25 O ATOM 328 O5' DT A 11 7.654 1.005 7.017 1.00 0.27 O ATOM 329 C5' DT A 11 6.789 2.102 6.678 1.00 0.29 C ATOM 330 C4' DT A 11 6.577 3.061 7.857 1.00 0.22 C ATOM 331 O4' DT A 11 7.502 2.760 8.915 1.00 0.29 O ATOM 332 C3' DT A 11 6.778 4.536 7.498 1.00 0.23 C ATOM 333 O3' DT A 11 5.513 5.144 7.203 1.00 0.24 O ATOM 334 C2' DT A 11 7.353 5.125 8.772 1.00 0.32 C ATOM 335 C1' DT A 11 8.201 3.957 9.279 1.00 0.34 C ATOM 336 N1 DT A 11 9.555 3.889 8.678 1.00 0.39 N ATOM 337 C2 DT A 11 10.500 4.797 9.125 1.00 0.53 C ATOM 338 O2 DT A 11 10.252 5.635 9.989 1.00 0.61 O ATOM 339 N3 DT A 11 11.751 4.706 8.546 1.00 0.64 N ATOM 340 C4 DT A 11 12.137 3.802 7.576 1.00 0.66 C ATOM 341 O4 DT A 11 13.283 3.813 7.135 1.00 0.78 O ATOM 342 C5 DT A 11 11.090 2.893 7.169 1.00 0.55 C ATOM 343 C7 DT A 11 11.379 1.838 6.103 1.00 0.65 C ATOM 344 C6 DT A 11 9.860 2.959 7.716 1.00 0.42 C ATOM 0 H5' DT A 11 5.825 1.714 6.350 1.00 0.29 H new ATOM 0 H5'' DT A 11 7.214 2.651 5.838 1.00 0.29 H new ATOM 0 H4' DT A 11 5.540 2.915 8.160 1.00 0.22 H new ATOM 0 H3' DT A 11 7.414 4.688 6.626 1.00 0.23 H new ATOM 0 H2' DT A 11 7.951 6.016 8.581 1.00 0.32 H new ATOM 0 H2'' DT A 11 6.576 5.409 9.482 1.00 0.32 H new ATOM 0 H1' DT A 11 8.341 4.084 10.352 1.00 0.34 H new ATOM 0 H3 DT A 11 12.457 5.370 8.865 1.00 0.64 H new ATOM 0 H71 DT A 11 10.755 0.962 6.280 1.00 0.65 H new ATOM 0 H72 DT A 11 11.159 2.247 5.117 1.00 0.65 H new ATOM 0 H73 DT A 11 12.429 1.551 6.151 1.00 0.65 H new ATOM 0 H6 DT A 11 9.099 2.266 7.391 1.00 0.42 H new ATOM 357 P DG A 12 5.219 5.731 5.732 1.00 0.33 P ATOM 358 OP1 DG A 12 5.416 4.636 4.751 1.00 0.60 O ATOM 359 OP2 DG A 12 5.971 6.997 5.575 1.00 0.56 O ATOM 360 O5' DG A 12 3.645 6.089 5.764 1.00 0.27 O ATOM 361 C5' DG A 12 3.072 6.904 6.796 1.00 0.24 C ATOM 362 C4' DG A 12 2.349 6.056 7.826 1.00 0.19 C ATOM 363 O4' DG A 12 1.082 5.708 7.305 1.00 0.16 O ATOM 364 C3' DG A 12 3.063 4.761 8.180 1.00 0.18 C ATOM 365 O3' DG A 12 2.724 4.397 9.529 1.00 0.18 O ATOM 366 C2' DG A 12 2.486 3.785 7.161 1.00 0.19 C ATOM 367 C1' DG A 12 1.074 4.330 6.975 1.00 0.15 C ATOM 368 N9 DG A 12 0.501 4.239 5.627 1.00 0.14 N ATOM 369 C8 DG A 12 -0.813 4.208 5.333 1.00 0.16 C ATOM 370 N7 DG A 12 -1.085 4.114 4.060 1.00 0.16 N ATOM 371 C5 DG A 12 0.169 4.099 3.464 1.00 0.15 C ATOM 372 C6 DG A 12 0.519 4.022 2.096 1.00 0.16 C ATOM 373 O6 DG A 12 -0.219 3.913 1.125 1.00 0.19 O ATOM 374 N1 DG A 12 1.887 4.050 1.920 1.00 0.16 N ATOM 375 C2 DG A 12 2.813 4.133 2.928 1.00 0.16 C ATOM 376 N2 DG A 12 4.088 4.160 2.558 1.00 0.17 N ATOM 377 N3 DG A 12 2.493 4.197 4.220 1.00 0.15 N ATOM 378 C4 DG A 12 1.156 4.179 4.417 1.00 0.14 C ATOM 0 H5' DG A 12 2.376 7.618 6.355 1.00 0.24 H new ATOM 0 H5'' DG A 12 3.856 7.483 7.283 1.00 0.24 H new ATOM 0 H4' DG A 12 2.294 6.657 8.734 1.00 0.19 H new ATOM 0 H3' DG A 12 4.152 4.803 8.143 1.00 0.18 H new ATOM 0 H2' DG A 12 3.051 3.785 6.229 1.00 0.19 H new ATOM 0 H2'' DG A 12 2.483 2.760 7.532 1.00 0.19 H new ATOM 0 H1' DG A 12 0.458 3.700 7.617 1.00 0.15 H new ATOM 0 H8 DG A 12 -1.581 4.257 6.091 1.00 0.16 H new ATOM 0 H1 DG A 12 2.238 4.005 0.963 1.00 0.16 H new ATOM 0 H21 DG A 12 4.822 4.221 3.263 1.00 0.17 H new ATOM 0 H22 DG A 12 4.333 4.120 1.569 1.00 0.17 H new ATOM 390 P DG A 13 2.822 2.879 10.059 1.00 0.19 P ATOM 391 OP1 DG A 13 2.898 2.907 11.537 1.00 0.25 O ATOM 392 OP2 DG A 13 3.864 2.168 9.282 1.00 0.22 O ATOM 393 O5' DG A 13 1.377 2.299 9.643 1.00 0.21 O ATOM 394 C5' DG A 13 0.188 2.996 10.039 1.00 0.20 C ATOM 395 C4' DG A 13 -1.083 2.253 9.636 1.00 0.18 C ATOM 396 O4' DG A 13 -1.338 2.373 8.232 1.00 0.19 O ATOM 397 C3' DG A 13 -1.050 0.751 9.935 1.00 0.17 C ATOM 398 O3' DG A 13 -1.875 0.476 11.076 1.00 0.22 O ATOM 399 C2' DG A 13 -1.652 0.106 8.679 1.00 0.18 C ATOM 400 C1' DG A 13 -2.220 1.301 7.934 1.00 0.15 C ATOM 401 N9 DG A 13 -2.337 1.135 6.463 1.00 0.15 N ATOM 402 C8 DG A 13 -3.488 0.968 5.726 1.00 0.15 C ATOM 403 N7 DG A 13 -3.294 0.872 4.446 1.00 0.14 N ATOM 404 C5 DG A 13 -1.923 0.985 4.315 1.00 0.13 C ATOM 405 C6 DG A 13 -1.150 0.959 3.149 1.00 0.13 C ATOM 406 O6 DG A 13 -1.517 0.885 2.014 1.00 0.16 O ATOM 407 N1 DG A 13 0.170 1.094 3.396 1.00 0.11 N ATOM 408 C2 DG A 13 0.737 1.246 4.641 1.00 0.12 C ATOM 409 N2 DG A 13 2.065 1.368 4.674 1.00 0.14 N ATOM 410 N3 DG A 13 0.018 1.280 5.777 1.00 0.13 N ATOM 411 C4 DG A 13 -1.314 1.142 5.534 1.00 0.13 C ATOM 0 H5' DG A 13 0.184 3.988 9.588 1.00 0.20 H new ATOM 0 H5'' DG A 13 0.196 3.137 11.120 1.00 0.20 H new ATOM 0 H4' DG A 13 -1.861 2.725 10.236 1.00 0.18 H new ATOM 0 H3' DG A 13 -0.050 0.378 10.156 1.00 0.17 H new ATOM 0 H2' DG A 13 -0.898 -0.418 8.091 1.00 0.18 H new ATOM 0 H2'' DG A 13 -2.425 -0.622 8.927 1.00 0.18 H new ATOM 0 H1' DG A 13 -3.248 1.462 8.259 1.00 0.15 H new ATOM 0 H8 DG A 13 -4.469 0.921 6.175 1.00 0.15 H new ATOM 0 H1 DG A 13 0.800 1.082 2.594 1.00 0.11 H new ATOM 0 H21 DG A 13 2.544 1.484 5.567 1.00 0.14 H new ATOM 0 H22 DG A 13 2.601 1.346 3.806 1.00 0.14 H new ATOM 423 P DG A 14 -1.815 -0.957 11.810 1.00 0.22 P ATOM 424 OP1 DG A 14 -2.425 -0.815 13.150 1.00 0.28 O ATOM 425 OP2 DG A 14 -0.439 -1.487 11.677 1.00 0.26 O ATOM 426 O5' DG A 14 -2.793 -1.853 10.901 1.00 0.21 O ATOM 427 C5' DG A 14 -4.214 -1.727 11.018 1.00 0.22 C ATOM 428 C4' DG A 14 -4.931 -2.441 9.880 1.00 0.20 C ATOM 429 O4' DG A 14 -4.626 -1.797 8.650 1.00 0.20 O ATOM 430 C3' DG A 14 -4.525 -3.900 9.719 1.00 0.20 C ATOM 431 O3' DG A 14 -5.452 -4.737 10.423 1.00 0.24 O ATOM 432 C2' DG A 14 -4.616 -4.165 8.215 1.00 0.19 C ATOM 433 C1' DG A 14 -4.701 -2.757 7.594 1.00 0.17 C ATOM 434 N9 DG A 14 -3.587 -2.485 6.679 1.00 0.16 N ATOM 435 C8 DG A 14 -2.280 -2.250 6.987 1.00 0.18 C ATOM 436 N7 DG A 14 -1.515 -2.076 5.954 1.00 0.18 N ATOM 437 C5 DG A 14 -2.378 -2.214 4.881 1.00 0.16 C ATOM 438 C6 DG A 14 -2.113 -2.137 3.502 1.00 0.16 C ATOM 439 O6 DG A 14 -1.054 -1.897 2.948 1.00 0.18 O ATOM 440 N1 DG A 14 -3.249 -2.351 2.755 1.00 0.16 N ATOM 441 C2 DG A 14 -4.498 -2.597 3.268 1.00 0.15 C ATOM 442 N2 DG A 14 -5.472 -2.796 2.384 1.00 0.17 N ATOM 443 N3 DG A 14 -4.760 -2.662 4.570 1.00 0.14 N ATOM 444 C4 DG A 14 -3.652 -2.464 5.314 1.00 0.14 C ATOM 0 H5' DG A 14 -4.488 -0.672 11.018 1.00 0.22 H new ATOM 0 H5'' DG A 14 -4.540 -2.141 11.972 1.00 0.22 H new ATOM 0 H4' DG A 14 -5.991 -2.401 10.129 1.00 0.20 H new ATOM 0 H3' DG A 14 -3.530 -4.106 10.114 1.00 0.20 H new ATOM 0 H2' DG A 14 -3.744 -4.710 7.852 1.00 0.19 H new ATOM 0 H2'' DG A 14 -5.492 -4.764 7.967 1.00 0.19 H new ATOM 0 H1' DG A 14 -5.635 -2.696 7.036 1.00 0.17 H new ATOM 0 H8 DG A 14 -1.914 -2.212 8.002 1.00 0.18 H new ATOM 0 H1 DG A 14 -3.155 -2.325 1.740 1.00 0.16 H new ATOM 0 H21 DG A 14 -6.422 -2.983 2.705 1.00 0.17 H new ATOM 0 H22 DG A 14 -5.269 -2.761 1.385 1.00 0.17 H new ATOM 456 P DT A 15 -5.216 -6.329 10.510 1.00 0.27 P ATOM 457 OP1 DT A 15 -6.170 -6.893 11.488 1.00 0.34 O ATOM 458 OP2 DT A 15 -3.765 -6.576 10.665 1.00 0.31 O ATOM 459 O5' DT A 15 -5.662 -6.818 9.043 1.00 0.24 O ATOM 460 C5' DT A 15 -4.933 -7.829 8.343 1.00 0.26 C ATOM 461 C4' DT A 15 -5.257 -7.802 6.852 1.00 0.23 C ATOM 462 O4' DT A 15 -4.763 -6.604 6.265 1.00 0.25 O ATOM 463 C3' DT A 15 -4.604 -8.909 6.046 1.00 0.23 C ATOM 464 O3' DT A 15 -5.417 -10.091 6.037 1.00 0.27 O ATOM 465 C2' DT A 15 -4.563 -8.324 4.635 1.00 0.23 C ATOM 466 C1' DT A 15 -4.750 -6.832 4.857 1.00 0.23 C ATOM 467 N1 DT A 15 -3.686 -6.040 4.227 1.00 0.23 N ATOM 468 C2 DT A 15 -3.959 -5.508 2.987 1.00 0.26 C ATOM 469 O2 DT A 15 -5.080 -5.558 2.485 1.00 0.31 O ATOM 470 N3 DT A 15 -2.910 -4.894 2.351 1.00 0.28 N ATOM 471 C4 DT A 15 -1.631 -4.753 2.833 1.00 0.27 C ATOM 472 O4 DT A 15 -0.759 -4.217 2.153 1.00 0.31 O ATOM 473 C5 DT A 15 -1.437 -5.314 4.142 1.00 0.23 C ATOM 474 C7 DT A 15 -0.090 -5.131 4.815 1.00 0.26 C ATOM 475 C6 DT A 15 -2.446 -5.938 4.791 1.00 0.22 C ATOM 0 H5' DT A 15 -5.176 -8.809 8.754 1.00 0.26 H new ATOM 0 H5'' DT A 15 -3.863 -7.679 8.489 1.00 0.26 H new ATOM 0 H4' DT A 15 -6.341 -7.906 6.816 1.00 0.23 H new ATOM 0 H3' DT A 15 -3.632 -9.198 6.445 1.00 0.23 H new ATOM 0 H2' DT A 15 -3.616 -8.539 4.140 1.00 0.23 H new ATOM 0 H2'' DT A 15 -5.352 -8.737 4.007 1.00 0.23 H new ATOM 0 H1' DT A 15 -5.686 -6.517 4.397 1.00 0.23 H new ATOM 0 H3 DT A 15 -3.098 -4.503 1.428 1.00 0.28 H new ATOM 0 H71 DT A 15 0.691 -5.071 4.057 1.00 0.26 H new ATOM 0 H72 DT A 15 -0.098 -4.212 5.401 1.00 0.26 H new ATOM 0 H73 DT A 15 0.107 -5.978 5.472 1.00 0.26 H new ATOM 0 H6 DT A 15 -2.269 -6.362 5.769 1.00 0.22 H new ATOM 488 P DT A 16 -4.932 -11.453 5.294 1.00 0.33 P ATOM 489 OP1 DT A 16 -6.093 -12.020 4.575 1.00 0.41 O ATOM 490 OP2 DT A 16 -4.210 -12.284 6.284 1.00 0.44 O ATOM 491 O5' DT A 16 -3.847 -10.954 4.190 1.00 0.29 O ATOM 492 C5' DT A 16 -4.195 -10.703 2.809 1.00 0.25 C ATOM 493 C4' DT A 16 -2.941 -10.546 1.941 1.00 0.22 C ATOM 494 O4' DT A 16 -1.954 -9.781 2.644 1.00 0.26 O ATOM 495 C3' DT A 16 -2.283 -11.861 1.519 1.00 0.26 C ATOM 496 O3' DT A 16 -1.864 -11.715 0.158 1.00 0.25 O ATOM 497 C2' DT A 16 -1.052 -11.966 2.431 1.00 0.30 C ATOM 498 C1' DT A 16 -0.717 -10.503 2.666 1.00 0.27 C ATOM 499 N1 DT A 16 -0.092 -10.238 3.967 1.00 0.30 N ATOM 500 C2 DT A 16 1.173 -9.686 3.979 1.00 0.39 C ATOM 501 O2 DT A 16 1.809 -9.470 2.951 1.00 0.47 O ATOM 502 N3 DT A 16 1.696 -9.407 5.224 1.00 0.44 N ATOM 503 C4 DT A 16 1.071 -9.630 6.438 1.00 0.42 C ATOM 504 O4 DT A 16 1.636 -9.347 7.491 1.00 0.50 O ATOM 505 C5 DT A 16 -0.250 -10.210 6.323 1.00 0.33 C ATOM 506 C7 DT A 16 -1.074 -10.466 7.580 1.00 0.36 C ATOM 507 C6 DT A 16 -0.775 -10.495 5.116 1.00 0.29 C ATOM 0 H5' DT A 16 -4.802 -9.800 2.743 1.00 0.25 H new ATOM 0 H5'' DT A 16 -4.803 -11.524 2.429 1.00 0.25 H new ATOM 0 H4' DT A 16 -3.290 -10.050 1.036 1.00 0.22 H new ATOM 0 H3' DT A 16 -2.932 -12.733 1.598 1.00 0.26 H new ATOM 0 H2' DT A 16 -1.275 -12.489 3.361 1.00 0.30 H new ATOM 0 H2'' DT A 16 -0.232 -12.502 1.952 1.00 0.30 H new ATOM 0 H1' DT A 16 -0.008 -10.203 1.894 1.00 0.27 H new ATOM 0 H3 DT A 16 2.630 -8.998 5.253 1.00 0.44 H new ATOM 0 H71 DT A 16 -0.407 -10.672 8.417 1.00 0.36 H new ATOM 0 H72 DT A 16 -1.677 -9.586 7.805 1.00 0.36 H new ATOM 0 H73 DT A 16 -1.728 -11.323 7.418 1.00 0.36 H new ATOM 0 H6 DT A 16 -1.759 -10.937 5.059 1.00 0.29 H new ATOM 520 P DT A 17 -1.270 -12.938 -0.709 1.00 0.26 P ATOM 521 OP1 DT A 17 -2.402 -13.755 -1.203 1.00 0.36 O ATOM 522 OP2 DT A 17 -0.172 -13.578 0.050 1.00 0.37 O ATOM 523 O5' DT A 17 -0.626 -12.153 -1.966 1.00 0.30 O ATOM 524 C5' DT A 17 -1.307 -11.022 -2.525 1.00 0.28 C ATOM 525 C4' DT A 17 -0.527 -10.386 -3.689 1.00 0.26 C ATOM 526 O4' DT A 17 -1.318 -9.345 -4.293 1.00 0.25 O ATOM 527 C3' DT A 17 0.811 -9.752 -3.272 1.00 0.23 C ATOM 528 O3' DT A 17 1.909 -10.408 -3.911 1.00 0.23 O ATOM 529 C2' DT A 17 0.731 -8.304 -3.741 1.00 0.27 C ATOM 530 C1' DT A 17 -0.761 -8.071 -3.948 1.00 0.22 C ATOM 531 N1 DT A 17 -1.485 -7.552 -2.757 1.00 0.21 N ATOM 532 C2 DT A 17 -0.957 -6.447 -2.098 1.00 0.28 C ATOM 533 O2 DT A 17 0.072 -5.881 -2.458 1.00 0.33 O ATOM 534 N3 DT A 17 -1.682 -5.983 -1.027 1.00 0.36 N ATOM 535 C4 DT A 17 -2.868 -6.498 -0.559 1.00 0.33 C ATOM 536 O4 DT A 17 -3.450 -5.967 0.366 1.00 0.47 O ATOM 537 C5 DT A 17 -3.347 -7.639 -1.285 1.00 0.21 C ATOM 538 C7 DT A 17 -4.643 -8.307 -0.830 1.00 0.19 C ATOM 539 C6 DT A 17 -2.664 -8.126 -2.341 1.00 0.19 C ATOM 0 H5' DT A 17 -1.466 -10.276 -1.747 1.00 0.28 H new ATOM 0 H5'' DT A 17 -2.291 -11.331 -2.876 1.00 0.28 H new ATOM 0 H4' DT A 17 -0.316 -11.204 -4.378 1.00 0.26 H new ATOM 0 H3' DT A 17 0.973 -9.835 -2.197 1.00 0.23 H new ATOM 0 H2' DT A 17 1.144 -7.620 -2.999 1.00 0.27 H new ATOM 0 H2'' DT A 17 1.292 -8.151 -4.663 1.00 0.27 H new ATOM 0 H1' DT A 17 -0.875 -7.306 -4.716 1.00 0.22 H new ATOM 0 H3 DT A 17 -1.303 -5.177 -0.530 1.00 0.36 H new ATOM 0 H71 DT A 17 -4.758 -8.182 0.247 1.00 0.19 H new ATOM 0 H72 DT A 17 -5.489 -7.847 -1.341 1.00 0.19 H new ATOM 0 H73 DT A 17 -4.608 -9.370 -1.070 1.00 0.19 H new ATOM 0 H6 DT A 17 -3.050 -8.984 -2.871 1.00 0.19 H new ATOM 552 P DT A 18 3.385 -9.750 -3.834 1.00 0.23 P ATOM 553 OP1 DT A 18 4.351 -10.727 -4.385 1.00 0.29 O ATOM 554 OP2 DT A 18 3.581 -9.187 -2.476 1.00 0.29 O ATOM 555 O5' DT A 18 3.211 -8.530 -4.874 1.00 0.21 O ATOM 556 C5' DT A 18 4.112 -7.429 -4.929 1.00 0.19 C ATOM 557 C4' DT A 18 5.507 -7.914 -5.346 1.00 0.18 C ATOM 558 O4' DT A 18 5.386 -9.164 -6.032 1.00 0.20 O ATOM 559 C3' DT A 18 6.252 -7.021 -6.303 1.00 0.19 C ATOM 560 O3' DT A 18 7.626 -7.410 -6.256 1.00 0.22 O ATOM 561 C2' DT A 18 5.655 -7.415 -7.642 1.00 0.24 C ATOM 562 C1' DT A 18 5.406 -8.914 -7.448 1.00 0.24 C ATOM 563 N1 DT A 18 4.129 -9.383 -8.031 1.00 0.29 N ATOM 564 C2 DT A 18 4.070 -9.477 -9.411 1.00 0.42 C ATOM 565 O2 DT A 18 5.034 -9.222 -10.130 1.00 0.49 O ATOM 566 N3 DT A 18 2.866 -9.880 -9.941 1.00 0.50 N ATOM 567 C4 DT A 18 1.727 -10.196 -9.230 1.00 0.46 C ATOM 568 O4 DT A 18 0.705 -10.545 -9.814 1.00 0.55 O ATOM 569 C5 DT A 18 1.874 -10.075 -7.798 1.00 0.34 C ATOM 570 C7 DT A 18 0.694 -10.383 -6.890 1.00 0.37 C ATOM 571 C6 DT A 18 3.035 -9.685 -7.248 1.00 0.27 C ATOM 0 H5' DT A 18 4.163 -6.941 -3.956 1.00 0.19 H new ATOM 0 H5'' DT A 18 3.749 -6.686 -5.639 1.00 0.19 H new ATOM 0 H4' DT A 18 6.062 -7.953 -4.409 1.00 0.18 H new ATOM 0 H3' DT A 18 6.182 -5.952 -6.100 1.00 0.19 H new ATOM 0 H2' DT A 18 4.734 -6.872 -7.854 1.00 0.24 H new ATOM 0 H2'' DT A 18 6.339 -7.218 -8.468 1.00 0.24 H new ATOM 0 H1' DT A 18 6.199 -9.456 -7.963 1.00 0.24 H new ATOM 0 H3 DT A 18 2.810 -9.952 -10.957 1.00 0.50 H new ATOM 0 H71 DT A 18 -0.236 -10.154 -7.411 1.00 0.37 H new ATOM 0 H72 DT A 18 0.709 -11.439 -6.620 1.00 0.37 H new ATOM 0 H73 DT A 18 0.762 -9.777 -5.987 1.00 0.37 H new ATOM 0 H6 DT A 18 3.113 -9.606 -6.174 1.00 0.27 H new ATOM 584 P DG A 19 8.803 -6.415 -6.677 1.00 0.20 P ATOM 585 OP1 DG A 19 8.440 -5.783 -7.964 1.00 0.25 O ATOM 586 OP2 DG A 19 10.079 -7.153 -6.553 1.00 0.31 O ATOM 587 O5' DG A 19 8.744 -5.310 -5.497 1.00 0.29 O ATOM 588 C5' DG A 19 8.368 -3.942 -5.735 1.00 0.17 C ATOM 589 C4' DG A 19 7.288 -3.800 -6.796 1.00 0.13 C ATOM 590 O4' DG A 19 6.049 -4.267 -6.262 1.00 0.14 O ATOM 591 C3' DG A 19 7.083 -2.370 -7.289 1.00 0.13 C ATOM 592 O3' DG A 19 7.180 -2.356 -8.727 1.00 0.14 O ATOM 593 C2' DG A 19 5.678 -2.037 -6.837 1.00 0.15 C ATOM 594 C1' DG A 19 5.034 -3.406 -6.728 1.00 0.15 C ATOM 595 N9 DG A 19 3.904 -3.473 -5.788 1.00 0.15 N ATOM 596 C8 DG A 19 2.581 -3.668 -6.071 1.00 0.17 C ATOM 597 N7 DG A 19 1.801 -3.619 -5.029 1.00 0.17 N ATOM 598 C5 DG A 19 2.676 -3.379 -3.973 1.00 0.16 C ATOM 599 C6 DG A 19 2.408 -3.230 -2.590 1.00 0.17 C ATOM 600 O6 DG A 19 1.325 -3.257 -2.015 1.00 0.19 O ATOM 601 N1 DG A 19 3.568 -3.010 -1.869 1.00 0.16 N ATOM 602 C2 DG A 19 4.828 -2.939 -2.401 1.00 0.15 C ATOM 603 N2 DG A 19 5.814 -2.749 -1.536 1.00 0.17 N ATOM 604 N3 DG A 19 5.090 -3.072 -3.701 1.00 0.15 N ATOM 605 C4 DG A 19 3.967 -3.291 -4.427 1.00 0.15 C ATOM 0 H5' DG A 19 9.248 -3.377 -6.042 1.00 0.17 H new ATOM 0 H5'' DG A 19 8.015 -3.500 -4.803 1.00 0.17 H new ATOM 0 H4' DG A 19 7.621 -4.389 -7.650 1.00 0.13 H new ATOM 0 H3' DG A 19 7.816 -1.657 -6.910 1.00 0.13 H new ATOM 0 H2' DG A 19 5.673 -1.509 -5.883 1.00 0.15 H new ATOM 0 H2'' DG A 19 5.161 -1.401 -7.556 1.00 0.15 H new ATOM 0 H1' DG A 19 4.625 -3.674 -7.702 1.00 0.15 H new ATOM 0 H8 DG A 19 2.215 -3.847 -7.071 1.00 0.17 H new ATOM 0 H1 DG A 19 3.478 -2.891 -0.860 1.00 0.16 H new ATOM 0 H21 DG A 19 6.777 -2.687 -1.866 1.00 0.17 H new ATOM 0 H22 DG A 19 5.610 -2.665 -0.540 1.00 0.17 H new ATOM 617 P DG A 20 6.947 -1.006 -9.582 1.00 0.16 P ATOM 618 OP1 DG A 20 7.484 -1.210 -10.948 1.00 0.23 O ATOM 619 OP2 DG A 20 7.405 0.145 -8.774 1.00 0.18 O ATOM 620 O5' DG A 20 5.343 -0.936 -9.677 1.00 0.19 O ATOM 621 C5' DG A 20 4.589 -1.993 -10.282 1.00 0.17 C ATOM 622 C4' DG A 20 3.100 -1.687 -10.227 1.00 0.20 C ATOM 623 O4' DG A 20 2.635 -1.768 -8.877 1.00 0.19 O ATOM 624 C3' DG A 20 2.781 -0.286 -10.732 1.00 0.25 C ATOM 625 O3' DG A 20 2.076 -0.356 -11.986 1.00 0.35 O ATOM 626 C2' DG A 20 1.908 0.344 -9.650 1.00 0.21 C ATOM 627 C1' DG A 20 1.597 -0.809 -8.698 1.00 0.18 C ATOM 628 N9 DG A 20 1.585 -0.443 -7.268 1.00 0.16 N ATOM 629 C8 DG A 20 2.633 -0.120 -6.467 1.00 0.15 C ATOM 630 N7 DG A 20 2.339 0.014 -5.217 1.00 0.14 N ATOM 631 C5 DG A 20 0.988 -0.220 -5.179 1.00 0.13 C ATOM 632 C6 DG A 20 0.120 -0.206 -4.078 1.00 0.13 C ATOM 633 O6 DG A 20 0.408 0.005 -2.898 1.00 0.15 O ATOM 634 N1 DG A 20 -1.183 -0.488 -4.470 1.00 0.13 N ATOM 635 C2 DG A 20 -1.582 -0.745 -5.768 1.00 0.15 C ATOM 636 N2 DG A 20 -2.876 -0.950 -5.974 1.00 0.16 N ATOM 637 N3 DG A 20 -0.754 -0.764 -6.800 1.00 0.15 N ATOM 638 C4 DG A 20 0.508 -0.494 -6.434 1.00 0.14 C ATOM 0 H5' DG A 20 4.792 -2.932 -9.768 1.00 0.17 H new ATOM 0 H5'' DG A 20 4.901 -2.123 -11.318 1.00 0.17 H new ATOM 0 H4' DG A 20 2.608 -2.421 -10.865 1.00 0.20 H new ATOM 0 H3' DG A 20 3.681 0.301 -10.911 1.00 0.25 H new ATOM 0 H2' DG A 20 2.430 1.153 -9.138 1.00 0.21 H new ATOM 0 H2'' DG A 20 0.997 0.769 -10.071 1.00 0.21 H new ATOM 0 H1' DG A 20 0.595 -1.166 -8.936 1.00 0.18 H new ATOM 0 H8 DG A 20 3.635 0.014 -6.846 1.00 0.15 H new ATOM 0 H1 DG A 20 -1.900 -0.507 -3.744 1.00 0.13 H new ATOM 0 H21 DG A 20 -3.218 -1.143 -6.915 1.00 0.16 H new ATOM 0 H22 DG A 20 -3.529 -0.914 -5.191 1.00 0.16 H new ATOM 650 P DG A 21 0.638 -1.080 -12.153 1.00 0.41 P ATOM 651 OP1 DG A 21 -0.076 -1.086 -10.858 1.00 0.57 O ATOM 652 OP2 DG A 21 0.847 -2.354 -12.876 1.00 0.48 O ATOM 653 O5' DG A 21 -0.128 -0.067 -13.145 1.00 0.61 O ATOM 654 C5' DG A 21 0.115 1.347 -13.085 1.00 0.48 C ATOM 655 C4' DG A 21 -0.918 2.071 -12.222 1.00 0.31 C ATOM 656 O4' DG A 21 -0.776 1.703 -10.862 1.00 0.30 O ATOM 657 C3' DG A 21 -0.802 3.585 -12.242 1.00 0.34 C ATOM 658 O3' DG A 21 -1.509 4.149 -13.353 1.00 0.48 O ATOM 659 C2' DG A 21 -1.439 3.997 -10.908 1.00 0.27 C ATOM 660 C1' DG A 21 -1.437 2.702 -10.086 1.00 0.22 C ATOM 661 N9 DG A 21 -0.737 2.808 -8.796 1.00 0.17 N ATOM 662 C8 DG A 21 0.602 2.953 -8.553 1.00 0.16 C ATOM 663 N7 DG A 21 0.913 2.985 -7.286 1.00 0.15 N ATOM 664 C5 DG A 21 -0.314 2.856 -6.650 1.00 0.13 C ATOM 665 C6 DG A 21 -0.619 2.825 -5.273 1.00 0.13 C ATOM 666 O6 DG A 21 0.132 2.902 -4.332 1.00 0.19 O ATOM 667 N1 DG A 21 -1.959 2.688 -5.048 1.00 0.11 N ATOM 668 C2 DG A 21 -2.920 2.596 -6.027 1.00 0.15 C ATOM 669 N2 DG A 21 -4.181 2.530 -5.628 1.00 0.19 N ATOM 670 N3 DG A 21 -2.646 2.616 -7.327 1.00 0.18 N ATOM 671 C4 DG A 21 -1.325 2.749 -7.564 1.00 0.14 C ATOM 0 H5' DG A 21 0.098 1.761 -14.093 1.00 0.48 H new ATOM 0 H5'' DG A 21 1.112 1.526 -12.683 1.00 0.48 H new ATOM 0 H4' DG A 21 -1.875 1.775 -12.652 1.00 0.31 H new ATOM 0 H3' DG A 21 0.225 3.934 -12.353 1.00 0.34 H new ATOM 0 H2' DG A 21 -0.866 4.783 -10.417 1.00 0.27 H new ATOM 0 H2'' DG A 21 -2.450 4.380 -11.049 1.00 0.27 H new ATOM 0 HO3' DG A 21 -1.417 5.125 -13.338 1.00 0.48 H new ATOM 0 H1' DG A 21 -2.476 2.462 -9.861 1.00 0.22 H new ATOM 0 H8 DG A 21 1.337 3.034 -9.341 1.00 0.16 H new ATOM 0 H1 DG A 21 -2.271 2.651 -4.078 1.00 0.11 H new ATOM 0 H21 DG A 21 -4.931 2.461 -6.316 1.00 0.19 H new ATOM 0 H22 DG A 21 -4.403 2.548 -4.633 1.00 0.19 H new TER 684 DG A 21