USER MOD reduce.3.24.130724 H: found=0, std=0, add=243, rem=0, adj=7 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 -38:sc= 1.08 USER MOD Single : A 18 DT C7 :methyl 150:sc= -0.332 (180deg=-0.332) USER MOD Single : A 22 DT C7 :methyl 150:sc= 0 (180deg=0) 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 180:sc= 0 USER MOD Single : B 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 7 DT C7 :methyl -30:sc= 0 (180deg=-0.509) USER MOD Single : B 7 DT O3' : rot 180:sc= 0 USER MOD Single : C 8 DA O5' : rot 180:sc= 0 USER MOD Single : C 14 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT B 1 2.133 10.827 10.918 1.00 0.00 O ATOM 2 C5' DT B 1 1.724 9.478 10.763 1.00 0.00 C ATOM 3 C4' DT B 1 0.196 9.398 10.649 1.00 0.00 C ATOM 4 O4' DT B 1 -0.224 9.914 9.392 1.00 0.00 O ATOM 5 C3' DT B 1 -0.299 7.950 10.736 1.00 0.00 C ATOM 6 O3' DT B 1 -1.481 7.938 11.515 1.00 0.00 O ATOM 7 C2' DT B 1 -0.545 7.581 9.277 1.00 0.00 C ATOM 8 C1' DT B 1 -0.954 8.930 8.682 1.00 0.00 C ATOM 9 N1 DT B 1 -0.684 9.101 7.234 1.00 0.00 N ATOM 10 C2 DT B 1 -1.701 9.611 6.416 1.00 0.00 C ATOM 11 O2 DT B 1 -2.843 9.834 6.799 1.00 0.00 O ATOM 12 N3 DT B 1 -1.369 9.867 5.103 1.00 0.00 N ATOM 13 C4 DT B 1 -0.128 9.679 4.535 1.00 0.00 C ATOM 14 O4 DT B 1 0.039 9.987 3.360 1.00 0.00 O ATOM 15 C5 DT B 1 0.874 9.121 5.436 1.00 0.00 C ATOM 16 C7 DT B 1 2.272 8.807 4.955 1.00 0.00 C ATOM 17 C6 DT B 1 0.574 8.856 6.730 1.00 0.00 C ATOM 0 H5' DT B 1 2.064 8.887 11.614 1.00 0.00 H new ATOM 0 H5'' DT B 1 2.185 9.050 9.873 1.00 0.00 H new ATOM 0 H4' DT B 1 -0.218 9.978 11.474 1.00 0.00 H new ATOM 0 H3' DT B 1 0.385 7.244 11.207 1.00 0.00 H new ATOM 0 H2' DT B 1 0.348 7.177 8.800 1.00 0.00 H new ATOM 0 H2'' DT B 1 -1.329 6.832 9.171 1.00 0.00 H new ATOM 0 HO5' DT B 1 3.109 10.866 10.991 1.00 0.00 H new ATOM 0 H1' DT B 1 -2.037 9.010 8.779 1.00 0.00 H new ATOM 0 H3 DT B 1 -2.107 10.227 4.498 1.00 0.00 H new ATOM 0 H71 DT B 1 2.975 8.920 5.781 1.00 0.00 H new ATOM 0 H72 DT B 1 2.308 7.782 4.585 1.00 0.00 H new ATOM 0 H73 DT B 1 2.543 9.492 4.152 1.00 0.00 H new ATOM 0 H6 DT B 1 1.334 8.445 7.378 1.00 0.00 H new ATOM 31 P DC B 2 -2.162 6.565 12.017 1.00 0.00 P ATOM 32 OP1 DC B 2 -2.856 6.796 13.300 1.00 0.00 O ATOM 33 OP2 DC B 2 -1.167 5.473 11.946 1.00 0.00 O ATOM 34 O5' DC B 2 -3.224 6.435 10.814 1.00 0.00 O ATOM 35 C5' DC B 2 -4.324 7.325 10.722 1.00 0.00 C ATOM 36 C4' DC B 2 -5.124 7.090 9.441 1.00 0.00 C ATOM 37 O4' DC B 2 -4.344 7.430 8.305 1.00 0.00 O ATOM 38 C3' DC B 2 -5.603 5.644 9.269 1.00 0.00 C ATOM 39 O3' DC B 2 -7.021 5.636 9.234 1.00 0.00 O ATOM 40 C2' DC B 2 -4.994 5.231 7.932 1.00 0.00 C ATOM 41 C1' DC B 2 -4.739 6.578 7.255 1.00 0.00 C ATOM 42 N1 DC B 2 -3.681 6.552 6.208 1.00 0.00 N ATOM 43 C2 DC B 2 -3.982 7.037 4.931 1.00 0.00 C ATOM 44 O2 DC B 2 -5.104 7.440 4.637 1.00 0.00 O ATOM 45 N3 DC B 2 -3.031 7.036 3.963 1.00 0.00 N ATOM 46 C4 DC B 2 -1.821 6.580 4.234 1.00 0.00 C ATOM 47 N4 DC B 2 -0.954 6.618 3.252 1.00 0.00 N ATOM 48 C5 DC B 2 -1.458 6.080 5.521 1.00 0.00 C ATOM 49 C6 DC B 2 -2.419 6.081 6.480 1.00 0.00 C ATOM 0 H5' DC B 2 -3.965 8.354 10.745 1.00 0.00 H new ATOM 0 H5'' DC B 2 -4.973 7.194 11.588 1.00 0.00 H new ATOM 0 H4' DC B 2 -6.004 7.727 9.527 1.00 0.00 H new ATOM 0 H3' DC B 2 -5.310 4.966 10.071 1.00 0.00 H new ATOM 0 H2' DC B 2 -4.074 4.662 8.064 1.00 0.00 H new ATOM 0 H2'' DC B 2 -5.674 4.607 7.352 1.00 0.00 H new ATOM 0 H1' DC B 2 -5.637 6.898 6.727 1.00 0.00 H new ATOM 0 H41 DC B 2 -0.003 6.280 3.398 1.00 0.00 H new ATOM 0 H42 DC B 2 -1.231 6.985 2.342 1.00 0.00 H new ATOM 0 H5 DC B 2 -0.461 5.716 5.723 1.00 0.00 H new ATOM 0 H6 DC B 2 -2.189 5.708 7.467 1.00 0.00 H new ATOM 61 P DC B 3 -7.873 4.265 9.287 1.00 0.00 P ATOM 62 OP1 DC B 3 -9.164 4.516 9.962 1.00 0.00 O ATOM 63 OP2 DC B 3 -7.032 3.156 9.786 1.00 0.00 O ATOM 64 O5' DC B 3 -8.106 4.103 7.701 1.00 0.00 O ATOM 65 C5' DC B 3 -8.971 4.985 7.005 1.00 0.00 C ATOM 66 C4' DC B 3 -9.080 4.635 5.517 1.00 0.00 C ATOM 67 O4' DC B 3 -7.869 4.932 4.830 1.00 0.00 O ATOM 68 C3' DC B 3 -9.419 3.160 5.266 1.00 0.00 C ATOM 69 O3' DC B 3 -10.543 3.100 4.402 1.00 0.00 O ATOM 70 C2' DC B 3 -8.147 2.638 4.603 1.00 0.00 C ATOM 71 C1' DC B 3 -7.639 3.896 3.896 1.00 0.00 C ATOM 72 N1 DC B 3 -6.197 3.847 3.531 1.00 0.00 N ATOM 73 C2 DC B 3 -5.813 4.042 2.198 1.00 0.00 C ATOM 74 O2 DC B 3 -6.628 4.240 1.298 1.00 0.00 O ATOM 75 N3 DC B 3 -4.501 3.988 1.857 1.00 0.00 N ATOM 76 C4 DC B 3 -3.596 3.746 2.786 1.00 0.00 C ATOM 77 N4 DC B 3 -2.360 3.644 2.369 1.00 0.00 N ATOM 78 C5 DC B 3 -3.929 3.530 4.155 1.00 0.00 C ATOM 79 C6 DC B 3 -5.242 3.598 4.488 1.00 0.00 C ATOM 0 H5' DC B 3 -8.607 6.007 7.110 1.00 0.00 H new ATOM 0 H5'' DC B 3 -9.962 4.952 7.458 1.00 0.00 H new ATOM 0 H4' DC B 3 -9.898 5.247 5.138 1.00 0.00 H new ATOM 0 H3' DC B 3 -9.683 2.580 6.150 1.00 0.00 H new ATOM 0 H2' DC B 3 -7.430 2.258 5.331 1.00 0.00 H new ATOM 0 H2'' DC B 3 -8.351 1.827 3.903 1.00 0.00 H new ATOM 0 H1' DC B 3 -8.153 4.029 2.944 1.00 0.00 H new ATOM 0 H41 DC B 3 -1.611 3.458 3.035 1.00 0.00 H new ATOM 0 H42 DC B 3 -2.146 3.751 1.377 1.00 0.00 H new ATOM 0 H5 DC B 3 -3.170 3.321 4.894 1.00 0.00 H new ATOM 0 H6 DC B 3 -5.540 3.455 5.516 1.00 0.00 H new ATOM 91 P DT B 4 -11.349 1.726 4.132 1.00 0.00 P ATOM 92 OP1 DT B 4 -12.732 2.043 3.717 1.00 0.00 O ATOM 93 OP2 DT B 4 -11.158 0.794 5.263 1.00 0.00 O ATOM 94 O5' DT B 4 -10.508 1.246 2.846 1.00 0.00 O ATOM 95 C5' DT B 4 -10.650 1.914 1.606 1.00 0.00 C ATOM 96 C4' DT B 4 -9.624 1.432 0.582 1.00 0.00 C ATOM 97 O4' DT B 4 -8.305 1.734 0.992 1.00 0.00 O ATOM 98 C3' DT B 4 -9.660 -0.074 0.307 1.00 0.00 C ATOM 99 O3' DT B 4 -10.514 -0.340 -0.800 1.00 0.00 O ATOM 100 C2' DT B 4 -8.185 -0.395 0.030 1.00 0.00 C ATOM 101 C1' DT B 4 -7.453 0.938 0.200 1.00 0.00 C ATOM 102 N1 DT B 4 -6.113 0.793 0.822 1.00 0.00 N ATOM 103 C2 DT B 4 -4.998 0.916 -0.007 1.00 0.00 C ATOM 104 O2 DT B 4 -5.072 1.076 -1.220 1.00 0.00 O ATOM 105 N3 DT B 4 -3.766 0.813 0.595 1.00 0.00 N ATOM 106 C4 DT B 4 -3.529 0.498 1.914 1.00 0.00 C ATOM 107 O4 DT B 4 -2.362 0.377 2.280 1.00 0.00 O ATOM 108 C5 DT B 4 -4.741 0.338 2.723 1.00 0.00 C ATOM 109 C7 DT B 4 -4.658 0.025 4.206 1.00 0.00 C ATOM 110 C6 DT B 4 -5.971 0.502 2.163 1.00 0.00 C ATOM 0 H5' DT B 4 -10.537 2.988 1.756 1.00 0.00 H new ATOM 0 H5'' DT B 4 -11.655 1.751 1.218 1.00 0.00 H new ATOM 0 H4' DT B 4 -9.901 1.962 -0.329 1.00 0.00 H new ATOM 0 H3' DT B 4 -10.060 -0.685 1.117 1.00 0.00 H new ATOM 0 H2' DT B 4 -7.807 -1.145 0.725 1.00 0.00 H new ATOM 0 H2'' DT B 4 -8.050 -0.795 -0.975 1.00 0.00 H new ATOM 0 H1' DT B 4 -7.252 1.389 -0.772 1.00 0.00 H new ATOM 0 H3 DT B 4 -2.950 0.987 0.008 1.00 0.00 H new ATOM 0 H71 DT B 4 -5.522 0.450 4.716 1.00 0.00 H new ATOM 0 H72 DT B 4 -4.647 -1.055 4.350 1.00 0.00 H new ATOM 0 H73 DT B 4 -3.745 0.455 4.618 1.00 0.00 H new ATOM 0 H6 DT B 4 -6.852 0.402 2.780 1.00 0.00 H new ATOM 123 P DC B 5 -10.962 -1.841 -1.191 1.00 0.00 P ATOM 124 OP1 DC B 5 -12.131 -1.882 -2.105 1.00 0.00 O ATOM 125 OP2 DC B 5 -10.979 -2.735 -0.019 1.00 0.00 O ATOM 126 O5' DC B 5 -9.714 -2.204 -2.125 1.00 0.00 O ATOM 127 C5' DC B 5 -9.541 -1.583 -3.387 1.00 0.00 C ATOM 128 C4' DC B 5 -8.251 -2.048 -4.055 1.00 0.00 C ATOM 129 O4' DC B 5 -7.115 -1.582 -3.361 1.00 0.00 O ATOM 130 C3' DC B 5 -8.148 -3.570 -4.139 1.00 0.00 C ATOM 131 O3' DC B 5 -8.272 -3.925 -5.498 1.00 0.00 O ATOM 132 C2' DC B 5 -6.761 -3.894 -3.597 1.00 0.00 C ATOM 133 C1' DC B 5 -6.088 -2.521 -3.582 1.00 0.00 C ATOM 134 N1 DC B 5 -5.085 -2.386 -2.504 1.00 0.00 N ATOM 135 C2 DC B 5 -3.750 -2.171 -2.851 1.00 0.00 C ATOM 136 O2 DC B 5 -3.386 -2.077 -4.023 1.00 0.00 O ATOM 137 N3 DC B 5 -2.809 -2.091 -1.882 1.00 0.00 N ATOM 138 C4 DC B 5 -3.170 -2.214 -0.619 1.00 0.00 C ATOM 139 N4 DC B 5 -2.196 -2.153 0.244 1.00 0.00 N ATOM 140 C5 DC B 5 -4.518 -2.420 -0.203 1.00 0.00 C ATOM 141 C6 DC B 5 -5.452 -2.499 -1.184 1.00 0.00 C ATOM 0 H5' DC B 5 -9.520 -0.500 -3.263 1.00 0.00 H new ATOM 0 H5'' DC B 5 -10.391 -1.814 -4.029 1.00 0.00 H new ATOM 0 H4' DC B 5 -8.282 -1.633 -5.062 1.00 0.00 H new ATOM 0 H3' DC B 5 -8.912 -4.109 -3.579 1.00 0.00 H new ATOM 0 H2' DC B 5 -6.806 -4.336 -2.601 1.00 0.00 H new ATOM 0 H2'' DC B 5 -6.230 -4.600 -4.235 1.00 0.00 H new ATOM 0 H1' DC B 5 -5.560 -2.370 -4.524 1.00 0.00 H new ATOM 0 H41 DC B 5 -2.392 -2.240 1.241 1.00 0.00 H new ATOM 0 H42 DC B 5 -1.237 -2.019 -0.078 1.00 0.00 H new ATOM 0 H5 DC B 5 -4.782 -2.509 0.840 1.00 0.00 H new ATOM 0 H6 DC B 5 -6.490 -2.652 -0.926 1.00 0.00 H new ATOM 153 P DC B 6 -9.042 -5.259 -5.933 1.00 0.00 P ATOM 154 OP1 DC B 6 -9.300 -5.165 -7.384 1.00 0.00 O ATOM 155 OP2 DC B 6 -10.219 -5.390 -5.035 1.00 0.00 O ATOM 156 O5' DC B 6 -7.827 -6.272 -5.582 1.00 0.00 O ATOM 157 C5' DC B 6 -6.737 -6.463 -6.483 1.00 0.00 C ATOM 158 C4' DC B 6 -5.856 -7.672 -6.126 1.00 0.00 C ATOM 159 O4' DC B 6 -4.861 -7.376 -5.148 1.00 0.00 O ATOM 160 C3' DC B 6 -6.650 -8.884 -5.593 1.00 0.00 C ATOM 161 O3' DC B 6 -6.566 -10.044 -6.401 1.00 0.00 O ATOM 162 C2' DC B 6 -5.938 -9.186 -4.287 1.00 0.00 C ATOM 163 C1' DC B 6 -4.543 -8.626 -4.576 1.00 0.00 C ATOM 164 N1 DC B 6 -3.595 -8.553 -3.426 1.00 0.00 N ATOM 165 C2 DC B 6 -2.221 -8.439 -3.706 1.00 0.00 C ATOM 166 O2 DC B 6 -1.779 -8.255 -4.842 1.00 0.00 O ATOM 167 N3 DC B 6 -1.314 -8.563 -2.708 1.00 0.00 N ATOM 168 C4 DC B 6 -1.734 -8.762 -1.472 1.00 0.00 C ATOM 169 N4 DC B 6 -0.814 -8.859 -0.558 1.00 0.00 N ATOM 170 C5 DC B 6 -3.104 -8.857 -1.118 1.00 0.00 C ATOM 171 C6 DC B 6 -4.007 -8.752 -2.123 1.00 0.00 C ATOM 0 H5' DC B 6 -6.121 -5.564 -6.493 1.00 0.00 H new ATOM 0 H5'' DC B 6 -7.128 -6.593 -7.492 1.00 0.00 H new ATOM 0 H4' DC B 6 -5.391 -7.921 -7.080 1.00 0.00 H new ATOM 0 H3' DC B 6 -7.712 -8.647 -5.537 1.00 0.00 H new ATOM 0 H2' DC B 6 -6.411 -8.695 -3.437 1.00 0.00 H new ATOM 0 H2'' DC B 6 -5.916 -10.253 -4.067 1.00 0.00 H new ATOM 0 H1' DC B 6 -3.961 -9.286 -5.219 1.00 0.00 H new ATOM 0 H41 DC B 6 -1.077 -9.013 0.416 1.00 0.00 H new ATOM 0 H42 DC B 6 0.170 -8.781 -0.815 1.00 0.00 H new ATOM 0 H5 DC B 6 -3.414 -9.006 -0.094 1.00 0.00 H new ATOM 0 H6 DC B 6 -5.062 -8.825 -1.902 1.00 0.00 H new ATOM 183 P DT B 7 -7.311 -10.124 -7.827 1.00 0.00 P ATOM 184 OP1 DT B 7 -8.319 -9.055 -7.955 1.00 0.00 O ATOM 185 OP2 DT B 7 -7.735 -11.516 -8.092 1.00 0.00 O ATOM 186 O5' DT B 7 -6.005 -9.769 -8.692 1.00 0.00 O ATOM 187 C5' DT B 7 -5.077 -10.782 -9.023 1.00 0.00 C ATOM 188 C4' DT B 7 -3.649 -10.268 -8.855 1.00 0.00 C ATOM 189 O4' DT B 7 -3.368 -10.155 -7.466 1.00 0.00 O ATOM 190 C3' DT B 7 -2.647 -11.272 -9.448 1.00 0.00 C ATOM 191 O3' DT B 7 -1.666 -10.601 -10.219 1.00 0.00 O ATOM 192 C2' DT B 7 -2.006 -11.898 -8.216 1.00 0.00 C ATOM 193 C1' DT B 7 -2.116 -10.755 -7.217 1.00 0.00 C ATOM 194 N1 DT B 7 -1.981 -11.225 -5.822 1.00 0.00 N ATOM 195 C2 DT B 7 -0.710 -11.159 -5.255 1.00 0.00 C ATOM 196 O2 DT B 7 0.291 -10.829 -5.880 1.00 0.00 O ATOM 197 N3 DT B 7 -0.615 -11.500 -3.929 1.00 0.00 N ATOM 198 C4 DT B 7 -1.641 -11.903 -3.109 1.00 0.00 C ATOM 199 O4 DT B 7 -1.389 -12.117 -1.924 1.00 0.00 O ATOM 200 C5 DT B 7 -2.931 -12.019 -3.791 1.00 0.00 C ATOM 201 C7 DT B 7 -4.154 -12.523 -3.062 1.00 0.00 C ATOM 202 C6 DT B 7 -3.058 -11.696 -5.105 1.00 0.00 C ATOM 0 H5' DT B 7 -5.235 -11.107 -10.051 1.00 0.00 H new ATOM 0 H5'' DT B 7 -5.235 -11.652 -8.385 1.00 0.00 H new ATOM 0 H4' DT B 7 -3.558 -9.308 -9.363 1.00 0.00 H new ATOM 0 H3' DT B 7 -3.116 -12.000 -10.109 1.00 0.00 H new ATOM 0 H2' DT B 7 -2.538 -12.789 -7.883 1.00 0.00 H new ATOM 0 H2'' DT B 7 -0.972 -12.192 -8.394 1.00 0.00 H new ATOM 0 HO3' DT B 7 -1.036 -11.255 -10.587 1.00 0.00 H new ATOM 0 H1' DT B 7 -1.307 -10.036 -7.341 1.00 0.00 H new ATOM 0 H3 DT B 7 0.313 -11.449 -3.509 1.00 0.00 H new ATOM 0 H71 DT B 7 -3.851 -13.222 -2.282 1.00 0.00 H new ATOM 0 H72 DT B 7 -4.681 -11.682 -2.611 1.00 0.00 H new ATOM 0 H73 DT B 7 -4.814 -13.029 -3.766 1.00 0.00 H new ATOM 0 H6 DT B 7 -4.015 -11.810 -5.593 1.00 0.00 H new TER 216 DT B 7 ATOM 217 O5' DA C 8 8.675 -14.728 -1.803 1.00 0.00 O ATOM 218 C5' DA C 8 9.010 -13.360 -1.663 1.00 0.00 C ATOM 219 C4' DA C 8 8.893 -12.637 -3.013 1.00 0.00 C ATOM 220 O4' DA C 8 7.526 -12.491 -3.366 1.00 0.00 O ATOM 221 C3' DA C 8 9.483 -11.229 -2.948 1.00 0.00 C ATOM 222 O3' DA C 8 10.008 -10.899 -4.221 1.00 0.00 O ATOM 223 C2' DA C 8 8.285 -10.377 -2.541 1.00 0.00 C ATOM 224 C1' DA C 8 7.099 -11.159 -3.115 1.00 0.00 C ATOM 225 N9 DA C 8 5.924 -11.209 -2.221 1.00 0.00 N ATOM 226 C8 DA C 8 5.867 -11.271 -0.850 1.00 0.00 C ATOM 227 N7 DA C 8 4.658 -11.383 -0.380 1.00 0.00 N ATOM 228 C5 DA C 8 3.850 -11.367 -1.505 1.00 0.00 C ATOM 229 C6 DA C 8 2.455 -11.436 -1.715 1.00 0.00 C ATOM 230 N6 DA C 8 1.531 -11.530 -0.762 1.00 0.00 N ATOM 231 N1 DA C 8 1.987 -11.412 -2.965 1.00 0.00 N ATOM 232 C2 DA C 8 2.847 -11.310 -3.975 1.00 0.00 C ATOM 233 N3 DA C 8 4.168 -11.223 -3.919 1.00 0.00 N ATOM 234 C4 DA C 8 4.614 -11.259 -2.637 1.00 0.00 C ATOM 0 H5' DA C 8 10.026 -13.266 -1.280 1.00 0.00 H new ATOM 0 H5'' DA C 8 8.350 -12.891 -0.934 1.00 0.00 H new ATOM 0 H4' DA C 8 9.436 -13.237 -3.743 1.00 0.00 H new ATOM 0 H3' DA C 8 10.310 -11.095 -2.251 1.00 0.00 H new ATOM 0 H2' DA C 8 8.213 -10.271 -1.459 1.00 0.00 H new ATOM 0 H2'' DA C 8 8.345 -9.371 -2.956 1.00 0.00 H new ATOM 0 HO5' DA C 8 8.756 -15.175 -0.935 1.00 0.00 H new ATOM 0 H1' DA C 8 6.784 -10.640 -4.020 1.00 0.00 H new ATOM 0 H8 DA C 8 6.744 -11.231 -0.220 1.00 0.00 H new ATOM 0 H61 DA C 8 0.543 -11.574 -1.012 1.00 0.00 H new ATOM 0 H62 DA C 8 1.811 -11.558 0.219 1.00 0.00 H new ATOM 0 H2 DA C 8 2.414 -11.296 -4.964 1.00 0.00 H new ATOM 247 P DG C 9 10.864 -9.556 -4.463 1.00 0.00 P ATOM 248 OP1 DG C 9 11.858 -9.771 -5.536 1.00 0.00 O ATOM 249 OP2 DG C 9 11.337 -9.019 -3.169 1.00 0.00 O ATOM 250 O5' DG C 9 9.647 -8.659 -4.998 1.00 0.00 O ATOM 251 C5' DG C 9 9.095 -8.862 -6.288 1.00 0.00 C ATOM 252 C4' DG C 9 7.914 -7.917 -6.521 1.00 0.00 C ATOM 253 O4' DG C 9 6.800 -8.320 -5.743 1.00 0.00 O ATOM 254 C3' DG C 9 8.235 -6.457 -6.167 1.00 0.00 C ATOM 255 O3' DG C 9 8.237 -5.669 -7.344 1.00 0.00 O ATOM 256 C2' DG C 9 7.118 -6.075 -5.193 1.00 0.00 C ATOM 257 C1' DG C 9 6.068 -7.161 -5.414 1.00 0.00 C ATOM 258 N9 DG C 9 5.234 -7.425 -4.224 1.00 0.00 N ATOM 259 C8 DG C 9 5.631 -7.597 -2.918 1.00 0.00 C ATOM 260 N7 DG C 9 4.657 -7.864 -2.096 1.00 0.00 N ATOM 261 C5 DG C 9 3.534 -7.862 -2.916 1.00 0.00 C ATOM 262 C6 DG C 9 2.167 -8.117 -2.600 1.00 0.00 C ATOM 263 O6 DG C 9 1.680 -8.403 -1.516 1.00 0.00 O ATOM 264 N1 DG C 9 1.319 -8.028 -3.679 1.00 0.00 N ATOM 265 C2 DG C 9 1.726 -7.721 -4.937 1.00 0.00 C ATOM 266 N2 DG C 9 0.776 -7.647 -5.838 1.00 0.00 N ATOM 267 N3 DG C 9 2.998 -7.478 -5.279 1.00 0.00 N ATOM 268 C4 DG C 9 3.864 -7.575 -4.218 1.00 0.00 C ATOM 0 H5' DG C 9 8.766 -9.896 -6.391 1.00 0.00 H new ATOM 0 H5'' DG C 9 9.859 -8.693 -7.047 1.00 0.00 H new ATOM 0 H4' DG C 9 7.691 -7.973 -7.587 1.00 0.00 H new ATOM 0 H3' DG C 9 9.218 -6.305 -5.721 1.00 0.00 H new ATOM 0 H2' DG C 9 7.471 -6.062 -4.162 1.00 0.00 H new ATOM 0 H2'' DG C 9 6.721 -5.083 -5.407 1.00 0.00 H new ATOM 0 H1' DG C 9 5.372 -6.847 -6.192 1.00 0.00 H new ATOM 0 H8 DG C 9 6.661 -7.518 -2.602 1.00 0.00 H new ATOM 0 H1 DG C 9 0.326 -8.203 -3.525 1.00 0.00 H new ATOM 0 H21 DG C 9 1.007 -7.421 -6.805 1.00 0.00 H new ATOM 0 H22 DG C 9 -0.194 -7.816 -5.571 1.00 0.00 H new ATOM 280 P DG C 10 8.891 -4.198 -7.377 1.00 0.00 P ATOM 281 OP1 DG C 10 9.321 -3.794 -8.726 1.00 0.00 O ATOM 282 OP2 DG C 10 9.851 -4.002 -6.264 1.00 0.00 O ATOM 283 O5' DG C 10 7.600 -3.368 -6.913 1.00 0.00 O ATOM 284 C5' DG C 10 6.465 -3.243 -7.758 1.00 0.00 C ATOM 285 C4' DG C 10 5.416 -2.306 -7.153 1.00 0.00 C ATOM 286 O4' DG C 10 4.649 -2.940 -6.134 1.00 0.00 O ATOM 287 C3' DG C 10 6.036 -1.036 -6.524 1.00 0.00 C ATOM 288 O3' DG C 10 5.422 0.164 -6.944 1.00 0.00 O ATOM 289 C2' DG C 10 5.657 -1.192 -5.056 1.00 0.00 C ATOM 290 C1' DG C 10 4.316 -1.890 -5.251 1.00 0.00 C ATOM 291 N9 DG C 10 3.631 -2.305 -4.010 1.00 0.00 N ATOM 292 C8 DG C 10 4.134 -2.422 -2.737 1.00 0.00 C ATOM 293 N7 DG C 10 3.224 -2.411 -1.805 1.00 0.00 N ATOM 294 C5 DG C 10 2.032 -2.268 -2.503 1.00 0.00 C ATOM 295 C6 DG C 10 0.696 -2.068 -2.036 1.00 0.00 C ATOM 296 O6 DG C 10 0.293 -1.920 -0.887 1.00 0.00 O ATOM 297 N1 DG C 10 -0.234 -2.020 -3.051 1.00 0.00 N ATOM 298 C2 DG C 10 0.080 -2.091 -4.371 1.00 0.00 C ATOM 299 N2 DG C 10 -0.919 -2.060 -5.220 1.00 0.00 N ATOM 300 N3 DG C 10 1.320 -2.202 -4.846 1.00 0.00 N ATOM 301 C4 DG C 10 2.262 -2.290 -3.858 1.00 0.00 C ATOM 0 H5' DG C 10 6.024 -4.226 -7.924 1.00 0.00 H new ATOM 0 H5'' DG C 10 6.775 -2.864 -8.732 1.00 0.00 H new ATOM 0 H4' DG C 10 4.781 -2.032 -7.996 1.00 0.00 H new ATOM 0 H3' DG C 10 7.094 -0.964 -6.777 1.00 0.00 H new ATOM 0 H2' DG C 10 6.371 -1.794 -4.495 1.00 0.00 H new ATOM 0 H2'' DG C 10 5.567 -0.238 -4.537 1.00 0.00 H new ATOM 0 H1' DG C 10 3.551 -1.225 -5.653 1.00 0.00 H new ATOM 0 H8 DG C 10 5.189 -2.515 -2.528 1.00 0.00 H new ATOM 0 H1 DG C 10 -1.217 -1.926 -2.796 1.00 0.00 H new ATOM 0 H21 DG C 10 -0.738 -2.110 -6.223 1.00 0.00 H new ATOM 0 H22 DG C 10 -1.877 -1.986 -4.878 1.00 0.00 H new ATOM 313 P DA C 11 5.561 0.754 -8.435 1.00 0.00 P ATOM 314 OP1 DA C 11 5.697 -0.343 -9.417 1.00 0.00 O ATOM 315 OP2 DA C 11 6.578 1.825 -8.445 1.00 0.00 O ATOM 316 O5' DA C 11 4.049 1.307 -8.430 1.00 0.00 O ATOM 317 C5' DA C 11 2.945 0.434 -8.620 1.00 0.00 C ATOM 318 C4' DA C 11 1.719 0.845 -7.798 1.00 0.00 C ATOM 319 O4' DA C 11 1.859 0.571 -6.414 1.00 0.00 O ATOM 320 C3' DA C 11 1.341 2.324 -7.895 1.00 0.00 C ATOM 321 O3' DA C 11 0.472 2.517 -9.000 1.00 0.00 O ATOM 322 C2' DA C 11 0.677 2.581 -6.535 1.00 0.00 C ATOM 323 C1' DA C 11 0.779 1.242 -5.799 1.00 0.00 C ATOM 324 N9 DA C 11 0.943 1.376 -4.332 1.00 0.00 N ATOM 325 C8 DA C 11 2.083 1.540 -3.582 1.00 0.00 C ATOM 326 N7 DA C 11 1.868 1.558 -2.290 1.00 0.00 N ATOM 327 C5 DA C 11 0.481 1.410 -2.178 1.00 0.00 C ATOM 328 C6 DA C 11 -0.445 1.309 -1.105 1.00 0.00 C ATOM 329 N6 DA C 11 -0.159 1.344 0.190 1.00 0.00 N ATOM 330 N1 DA C 11 -1.746 1.142 -1.356 1.00 0.00 N ATOM 331 C2 DA C 11 -2.146 1.071 -2.622 1.00 0.00 C ATOM 332 N3 DA C 11 -1.401 1.138 -3.716 1.00 0.00 N ATOM 333 C4 DA C 11 -0.084 1.311 -3.423 1.00 0.00 C ATOM 0 H5' DA C 11 3.237 -0.580 -8.347 1.00 0.00 H new ATOM 0 H5'' DA C 11 2.679 0.415 -9.677 1.00 0.00 H new ATOM 0 H4' DA C 11 0.935 0.237 -8.250 1.00 0.00 H new ATOM 0 H3' DA C 11 2.168 3.012 -8.072 1.00 0.00 H new ATOM 0 H2' DA C 11 1.187 3.374 -5.988 1.00 0.00 H new ATOM 0 H2'' DA C 11 -0.361 2.891 -6.653 1.00 0.00 H new ATOM 0 H1' DA C 11 -0.151 0.679 -5.884 1.00 0.00 H new ATOM 0 H8 DA C 11 3.066 1.644 -4.018 1.00 0.00 H new ATOM 0 H61 DA C 11 -0.906 1.262 0.880 1.00 0.00 H new ATOM 0 H62 DA C 11 0.808 1.453 0.496 1.00 0.00 H new ATOM 0 H2 DA C 11 -3.207 0.943 -2.778 1.00 0.00 H new ATOM 345 P DG C 12 0.122 3.980 -9.590 1.00 0.00 P ATOM 346 OP1 DG C 12 -0.198 3.902 -11.029 1.00 0.00 O ATOM 347 OP2 DG C 12 1.064 5.040 -9.148 1.00 0.00 O ATOM 348 O5' DG C 12 -1.208 4.265 -8.747 1.00 0.00 O ATOM 349 C5' DG C 12 -2.419 3.581 -9.025 1.00 0.00 C ATOM 350 C4' DG C 12 -3.532 4.069 -8.095 1.00 0.00 C ATOM 351 O4' DG C 12 -3.263 3.649 -6.764 1.00 0.00 O ATOM 352 C3' DG C 12 -3.675 5.597 -8.097 1.00 0.00 C ATOM 353 O3' DG C 12 -5.045 5.910 -8.279 1.00 0.00 O ATOM 354 C2' DG C 12 -3.144 5.985 -6.720 1.00 0.00 C ATOM 355 C1' DG C 12 -3.498 4.747 -5.906 1.00 0.00 C ATOM 356 N9 DG C 12 -2.707 4.621 -4.664 1.00 0.00 N ATOM 357 C8 DG C 12 -1.352 4.749 -4.462 1.00 0.00 C ATOM 358 N7 DG C 12 -0.983 4.670 -3.211 1.00 0.00 N ATOM 359 C5 DG C 12 -2.191 4.482 -2.534 1.00 0.00 C ATOM 360 C6 DG C 12 -2.477 4.361 -1.136 1.00 0.00 C ATOM 361 O6 DG C 12 -1.691 4.379 -0.190 1.00 0.00 O ATOM 362 N1 DG C 12 -3.826 4.225 -0.862 1.00 0.00 N ATOM 363 C2 DG C 12 -4.799 4.177 -1.813 1.00 0.00 C ATOM 364 N2 DG C 12 -6.046 4.141 -1.402 1.00 0.00 N ATOM 365 N3 DG C 12 -4.568 4.274 -3.120 1.00 0.00 N ATOM 366 C4 DG C 12 -3.244 4.429 -3.418 1.00 0.00 C ATOM 0 H5' DG C 12 -2.275 2.508 -8.899 1.00 0.00 H new ATOM 0 H5'' DG C 12 -2.706 3.744 -10.064 1.00 0.00 H new ATOM 0 H4' DG C 12 -4.462 3.638 -8.465 1.00 0.00 H new ATOM 0 H3' DG C 12 -3.140 6.126 -8.886 1.00 0.00 H new ATOM 0 H2' DG C 12 -2.071 6.177 -6.732 1.00 0.00 H new ATOM 0 H2'' DG C 12 -3.624 6.883 -6.332 1.00 0.00 H new ATOM 0 H1' DG C 12 -4.534 4.802 -5.572 1.00 0.00 H new ATOM 0 H8 DG C 12 -0.652 4.902 -5.270 1.00 0.00 H new ATOM 0 H1 DG C 12 -4.110 4.156 0.115 1.00 0.00 H new ATOM 0 H21 DG C 12 -6.806 4.105 -2.081 1.00 0.00 H new ATOM 0 H22 DG C 12 -6.254 4.150 -0.404 1.00 0.00 H new ATOM 378 P DG C 13 -5.575 7.430 -8.380 1.00 0.00 P ATOM 379 OP1 DG C 13 -6.688 7.490 -9.349 1.00 0.00 O ATOM 380 OP2 DG C 13 -4.429 8.344 -8.583 1.00 0.00 O ATOM 381 O5' DG C 13 -6.141 7.516 -6.872 1.00 0.00 O ATOM 382 C5' DG C 13 -7.251 6.723 -6.476 1.00 0.00 C ATOM 383 C4' DG C 13 -7.653 6.971 -5.020 1.00 0.00 C ATOM 384 O4' DG C 13 -6.614 6.574 -4.138 1.00 0.00 O ATOM 385 C3' DG C 13 -8.013 8.434 -4.728 1.00 0.00 C ATOM 386 O3' DG C 13 -9.367 8.506 -4.302 1.00 0.00 O ATOM 387 C2' DG C 13 -7.035 8.812 -3.620 1.00 0.00 C ATOM 388 C1' DG C 13 -6.622 7.464 -3.044 1.00 0.00 C ATOM 389 N9 DG C 13 -5.293 7.535 -2.408 1.00 0.00 N ATOM 390 C8 DG C 13 -4.064 7.695 -2.995 1.00 0.00 C ATOM 391 N7 DG C 13 -3.071 7.702 -2.145 1.00 0.00 N ATOM 392 C5 DG C 13 -3.692 7.576 -0.904 1.00 0.00 C ATOM 393 C6 DG C 13 -3.145 7.522 0.421 1.00 0.00 C ATOM 394 O6 DG C 13 -1.964 7.534 0.769 1.00 0.00 O ATOM 395 N1 DG C 13 -4.119 7.439 1.401 1.00 0.00 N ATOM 396 C2 DG C 13 -5.456 7.362 1.147 1.00 0.00 C ATOM 397 N2 DG C 13 -6.269 7.322 2.176 1.00 0.00 N ATOM 398 N3 DG C 13 -5.992 7.376 -0.071 1.00 0.00 N ATOM 399 C4 DG C 13 -5.056 7.490 -1.057 1.00 0.00 C ATOM 0 H5' DG C 13 -7.007 5.669 -6.609 1.00 0.00 H new ATOM 0 H5'' DG C 13 -8.099 6.938 -7.126 1.00 0.00 H new ATOM 0 H4' DG C 13 -8.547 6.369 -4.856 1.00 0.00 H new ATOM 0 H3' DG C 13 -7.934 9.104 -5.584 1.00 0.00 H new ATOM 0 H2' DG C 13 -6.179 9.363 -4.010 1.00 0.00 H new ATOM 0 H2'' DG C 13 -7.505 9.445 -2.867 1.00 0.00 H new ATOM 0 H1' DG C 13 -7.309 7.137 -2.263 1.00 0.00 H new ATOM 0 H8 DG C 13 -3.929 7.805 -4.061 1.00 0.00 H new ATOM 0 H1 DG C 13 -3.817 7.435 2.375 1.00 0.00 H new ATOM 0 H21 DG C 13 -7.277 7.264 2.028 1.00 0.00 H new ATOM 0 H22 DG C 13 -5.893 7.349 3.124 1.00 0.00 H new ATOM 411 P DA C 14 -10.175 9.906 -4.228 1.00 0.00 P ATOM 412 OP1 DA C 14 -11.628 9.645 -4.308 1.00 0.00 O ATOM 413 OP2 DA C 14 -9.596 10.898 -5.158 1.00 0.00 O ATOM 414 O5' DA C 14 -9.805 10.309 -2.712 1.00 0.00 O ATOM 415 C5' DA C 14 -10.363 9.605 -1.616 1.00 0.00 C ATOM 416 C4' DA C 14 -9.839 10.133 -0.277 1.00 0.00 C ATOM 417 O4' DA C 14 -8.479 9.775 -0.091 1.00 0.00 O ATOM 418 C3' DA C 14 -9.939 11.660 -0.119 1.00 0.00 C ATOM 419 O3' DA C 14 -10.838 12.006 0.922 1.00 0.00 O ATOM 420 C2' DA C 14 -8.528 12.077 0.283 1.00 0.00 C ATOM 421 C1' DA C 14 -7.899 10.761 0.733 1.00 0.00 C ATOM 422 N9 DA C 14 -6.432 10.767 0.585 1.00 0.00 N ATOM 423 C8 DA C 14 -5.681 10.848 -0.564 1.00 0.00 C ATOM 424 N7 DA C 14 -4.392 10.851 -0.357 1.00 0.00 N ATOM 425 C5 DA C 14 -4.289 10.773 1.038 1.00 0.00 C ATOM 426 C6 DA C 14 -3.216 10.716 1.958 1.00 0.00 C ATOM 427 N6 DA C 14 -1.941 10.748 1.619 1.00 0.00 N ATOM 428 N1 DA C 14 -3.447 10.598 3.272 1.00 0.00 N ATOM 429 C2 DA C 14 -4.709 10.558 3.685 1.00 0.00 C ATOM 430 N3 DA C 14 -5.812 10.629 2.947 1.00 0.00 N ATOM 431 C4 DA C 14 -5.528 10.721 1.618 1.00 0.00 C ATOM 0 H5' DA C 14 -10.127 8.545 -1.706 1.00 0.00 H new ATOM 0 H5'' DA C 14 -11.449 9.693 -1.642 1.00 0.00 H new ATOM 0 H4' DA C 14 -10.483 9.671 0.471 1.00 0.00 H new ATOM 0 H3' DA C 14 -10.301 12.142 -1.027 1.00 0.00 H new ATOM 0 H2' DA C 14 -7.984 12.520 -0.551 1.00 0.00 H new ATOM 0 H2'' DA C 14 -8.538 12.815 1.085 1.00 0.00 H new ATOM 0 HO3' DA C 14 -10.883 12.981 1.004 1.00 0.00 H new ATOM 0 H1' DA C 14 -8.084 10.581 1.792 1.00 0.00 H new ATOM 0 H8 DA C 14 -6.118 10.904 -1.550 1.00 0.00 H new ATOM 0 H61 DA C 14 -1.220 10.703 2.339 1.00 0.00 H new ATOM 0 H62 DA C 14 -1.676 10.818 0.636 1.00 0.00 H new ATOM 0 H2 DA C 14 -4.857 10.455 4.750 1.00 0.00 H new TER 444 DA C 14 ATOM 445 O5' DT A 15 3.448 15.567 -4.711 1.00 0.00 O ATOM 446 C5' DT A 15 2.129 15.410 -4.196 1.00 0.00 C ATOM 447 C4' DT A 15 2.036 14.476 -2.983 1.00 0.00 C ATOM 448 O4' DT A 15 0.699 14.038 -2.821 1.00 0.00 O ATOM 449 C3' DT A 15 2.903 13.215 -3.071 1.00 0.00 C ATOM 450 O3' DT A 15 3.785 13.241 -1.970 1.00 0.00 O ATOM 451 C2' DT A 15 1.958 12.034 -2.971 1.00 0.00 C ATOM 452 C1' DT A 15 0.691 12.677 -2.425 1.00 0.00 C ATOM 453 N1 DT A 15 -0.527 12.036 -2.976 1.00 0.00 N ATOM 454 C2 DT A 15 -1.348 11.329 -2.099 1.00 0.00 C ATOM 455 O2 DT A 15 -1.053 11.109 -0.930 1.00 0.00 O ATOM 456 N3 DT A 15 -2.547 10.886 -2.599 1.00 0.00 N ATOM 457 C4 DT A 15 -2.989 11.044 -3.897 1.00 0.00 C ATOM 458 O4 DT A 15 -4.106 10.636 -4.184 1.00 0.00 O ATOM 459 C5 DT A 15 -2.052 11.733 -4.783 1.00 0.00 C ATOM 460 C7 DT A 15 -2.411 12.002 -6.234 1.00 0.00 C ATOM 461 C6 DT A 15 -0.875 12.210 -4.300 1.00 0.00 C ATOM 0 H5' DT A 15 1.485 15.025 -4.987 1.00 0.00 H new ATOM 0 H5'' DT A 15 1.741 16.390 -3.917 1.00 0.00 H new ATOM 0 H4' DT A 15 2.399 15.073 -2.146 1.00 0.00 H new ATOM 0 H3' DT A 15 3.479 13.152 -3.994 1.00 0.00 H new ATOM 0 H2' DT A 15 1.790 11.564 -3.940 1.00 0.00 H new ATOM 0 H2'' DT A 15 2.342 11.262 -2.304 1.00 0.00 H new ATOM 0 HO5' DT A 15 4.088 15.593 -3.969 1.00 0.00 H new ATOM 0 H1' DT A 15 0.673 12.564 -1.341 1.00 0.00 H new ATOM 0 H3 DT A 15 -3.167 10.396 -1.954 1.00 0.00 H new ATOM 0 H71 DT A 15 -1.914 12.912 -6.569 1.00 0.00 H new ATOM 0 H72 DT A 15 -2.087 11.163 -6.850 1.00 0.00 H new ATOM 0 H73 DT A 15 -3.490 12.124 -6.325 1.00 0.00 H new ATOM 0 H6 DT A 15 -0.201 12.733 -4.962 1.00 0.00 H new ATOM 475 P DG A 16 5.277 13.763 -2.176 1.00 0.00 P ATOM 476 OP1 DG A 16 5.797 14.160 -0.850 1.00 0.00 O ATOM 477 OP2 DG A 16 5.164 14.828 -3.201 1.00 0.00 O ATOM 478 O5' DG A 16 5.821 12.341 -2.673 1.00 0.00 O ATOM 479 C5' DG A 16 5.984 11.276 -1.744 1.00 0.00 C ATOM 480 C4' DG A 16 5.860 9.898 -2.404 1.00 0.00 C ATOM 481 O4' DG A 16 4.508 9.660 -2.754 1.00 0.00 O ATOM 482 C3' DG A 16 6.705 9.735 -3.676 1.00 0.00 C ATOM 483 O3' DG A 16 7.522 8.573 -3.652 1.00 0.00 O ATOM 484 C2' DG A 16 5.633 9.547 -4.746 1.00 0.00 C ATOM 485 C1' DG A 16 4.515 8.894 -3.937 1.00 0.00 C ATOM 486 N9 DG A 16 3.184 8.871 -4.593 1.00 0.00 N ATOM 487 C8 DG A 16 2.868 9.027 -5.923 1.00 0.00 C ATOM 488 N7 DG A 16 1.606 8.839 -6.213 1.00 0.00 N ATOM 489 C5 DG A 16 1.029 8.581 -4.961 1.00 0.00 C ATOM 490 C6 DG A 16 -0.335 8.340 -4.580 1.00 0.00 C ATOM 491 O6 DG A 16 -1.338 8.310 -5.285 1.00 0.00 O ATOM 492 N1 DG A 16 -0.496 8.111 -3.227 1.00 0.00 N ATOM 493 C2 DG A 16 0.524 8.072 -2.328 1.00 0.00 C ATOM 494 N2 DG A 16 0.243 7.810 -1.071 1.00 0.00 N ATOM 495 N3 DG A 16 1.796 8.294 -2.645 1.00 0.00 N ATOM 496 C4 DG A 16 1.992 8.559 -3.974 1.00 0.00 C ATOM 0 H5' DG A 16 5.236 11.367 -0.957 1.00 0.00 H new ATOM 0 H5'' DG A 16 6.960 11.360 -1.267 1.00 0.00 H new ATOM 0 H4' DG A 16 6.229 9.184 -1.668 1.00 0.00 H new ATOM 0 H3' DG A 16 7.386 10.574 -3.821 1.00 0.00 H new ATOM 0 H2' DG A 16 5.322 10.494 -5.187 1.00 0.00 H new ATOM 0 H2'' DG A 16 5.975 8.911 -5.563 1.00 0.00 H new ATOM 0 H1' DG A 16 4.704 7.831 -3.790 1.00 0.00 H new ATOM 0 H8 DG A 16 3.605 9.285 -6.670 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.443 7.961 -2.879 1.00 0.00 H new ATOM 0 H21 DG A 16 0.991 7.775 -0.378 1.00 0.00 H new ATOM 0 H22 DG A 16 -0.723 7.642 -0.789 1.00 0.00 H new ATOM 508 P DG A 17 8.943 8.525 -2.878 1.00 0.00 P ATOM 509 OP1 DG A 17 9.460 9.896 -2.677 1.00 0.00 O ATOM 510 OP2 DG A 17 9.825 7.535 -3.527 1.00 0.00 O ATOM 511 O5' DG A 17 8.414 7.913 -1.484 1.00 0.00 O ATOM 512 C5' DG A 17 8.359 8.689 -0.299 1.00 0.00 C ATOM 513 C4' DG A 17 7.519 8.010 0.791 1.00 0.00 C ATOM 514 O4' DG A 17 6.208 7.685 0.330 1.00 0.00 O ATOM 515 C3' DG A 17 8.163 6.724 1.299 1.00 0.00 C ATOM 516 O3' DG A 17 7.943 6.667 2.697 1.00 0.00 O ATOM 517 C2' DG A 17 7.431 5.652 0.499 1.00 0.00 C ATOM 518 C1' DG A 17 6.057 6.272 0.244 1.00 0.00 C ATOM 519 N9 DG A 17 5.459 5.891 -1.062 1.00 0.00 N ATOM 520 C8 DG A 17 6.030 5.868 -2.314 1.00 0.00 C ATOM 521 N7 DG A 17 5.201 5.559 -3.274 1.00 0.00 N ATOM 522 C5 DG A 17 3.988 5.342 -2.618 1.00 0.00 C ATOM 523 C6 DG A 17 2.677 5.020 -3.119 1.00 0.00 C ATOM 524 O6 DG A 17 2.293 4.882 -4.279 1.00 0.00 O ATOM 525 N1 DG A 17 1.729 4.873 -2.121 1.00 0.00 N ATOM 526 C2 DG A 17 2.001 5.021 -0.793 1.00 0.00 C ATOM 527 N2 DG A 17 1.028 4.862 0.073 1.00 0.00 N ATOM 528 N3 DG A 17 3.193 5.353 -0.294 1.00 0.00 N ATOM 529 C4 DG A 17 4.150 5.507 -1.258 1.00 0.00 C ATOM 0 H5' DG A 17 7.937 9.668 -0.525 1.00 0.00 H new ATOM 0 H5'' DG A 17 9.370 8.856 0.073 1.00 0.00 H new ATOM 0 H4' DG A 17 7.460 8.737 1.601 1.00 0.00 H new ATOM 0 H3' DG A 17 9.240 6.622 1.167 1.00 0.00 H new ATOM 0 H2' DG A 17 7.948 5.424 -0.433 1.00 0.00 H new ATOM 0 H2'' DG A 17 7.353 4.719 1.056 1.00 0.00 H new ATOM 0 H1' DG A 17 5.364 5.891 0.994 1.00 0.00 H new ATOM 0 H8 DG A 17 7.073 6.087 -2.487 1.00 0.00 H new ATOM 0 H1 DG A 17 0.774 4.641 -2.394 1.00 0.00 H new ATOM 0 H21 DG A 17 1.211 4.968 1.071 1.00 0.00 H new ATOM 0 H22 DG A 17 0.089 4.632 -0.252 1.00 0.00 H new ATOM 541 P DT A 18 8.521 5.476 3.606 1.00 0.00 P ATOM 542 OP1 DT A 18 8.884 5.970 4.951 1.00 0.00 O ATOM 543 OP2 DT A 18 9.522 4.686 2.858 1.00 0.00 O ATOM 544 O5' DT A 18 7.138 4.665 3.683 1.00 0.00 O ATOM 545 C5' DT A 18 6.067 5.141 4.481 1.00 0.00 C ATOM 546 C4' DT A 18 5.017 4.054 4.718 1.00 0.00 C ATOM 547 O4' DT A 18 4.187 3.854 3.590 1.00 0.00 O ATOM 548 C3' DT A 18 5.648 2.726 5.138 1.00 0.00 C ATOM 549 O3' DT A 18 5.499 2.609 6.540 1.00 0.00 O ATOM 550 C2' DT A 18 4.850 1.679 4.373 1.00 0.00 C ATOM 551 C1' DT A 18 4.078 2.472 3.308 1.00 0.00 C ATOM 552 N1 DT A 18 4.512 2.275 1.902 1.00 0.00 N ATOM 553 C2 DT A 18 3.512 2.115 0.935 1.00 0.00 C ATOM 554 O2 DT A 18 2.314 2.020 1.199 1.00 0.00 O ATOM 555 N3 DT A 18 3.922 2.041 -0.375 1.00 0.00 N ATOM 556 C4 DT A 18 5.226 2.051 -0.818 1.00 0.00 C ATOM 557 O4 DT A 18 5.443 1.964 -2.023 1.00 0.00 O ATOM 558 C5 DT A 18 6.217 2.184 0.246 1.00 0.00 C ATOM 559 C7 DT A 18 7.689 2.196 -0.089 1.00 0.00 C ATOM 560 C6 DT A 18 5.841 2.306 1.546 1.00 0.00 C ATOM 0 H5' DT A 18 5.602 5.998 3.993 1.00 0.00 H new ATOM 0 H5'' DT A 18 6.453 5.490 5.439 1.00 0.00 H new ATOM 0 H4' DT A 18 4.397 4.416 5.538 1.00 0.00 H new ATOM 0 H3' DT A 18 6.711 2.626 4.920 1.00 0.00 H new ATOM 0 H2' DT A 18 5.506 0.938 3.916 1.00 0.00 H new ATOM 0 H2'' DT A 18 4.171 1.139 5.033 1.00 0.00 H new ATOM 0 H1' DT A 18 3.059 2.089 3.371 1.00 0.00 H new ATOM 0 H3 DT A 18 3.193 1.972 -1.085 1.00 0.00 H new ATOM 0 H71 DT A 18 8.224 2.800 0.644 1.00 0.00 H new ATOM 0 H72 DT A 18 8.075 1.177 -0.071 1.00 0.00 H new ATOM 0 H73 DT A 18 7.833 2.620 -1.083 1.00 0.00 H new ATOM 0 H6 DT A 18 6.595 2.429 2.310 1.00 0.00 H new ATOM 573 P DG A 19 6.547 1.791 7.427 1.00 0.00 P ATOM 574 OP1 DG A 19 6.407 2.231 8.831 1.00 0.00 O ATOM 575 OP2 DG A 19 7.915 1.994 6.909 1.00 0.00 O ATOM 576 O5' DG A 19 5.993 0.313 7.178 1.00 0.00 O ATOM 577 C5' DG A 19 4.986 -0.228 8.012 1.00 0.00 C ATOM 578 C4' DG A 19 4.596 -1.652 7.605 1.00 0.00 C ATOM 579 O4' DG A 19 3.732 -1.669 6.473 1.00 0.00 O ATOM 580 C3' DG A 19 5.794 -2.528 7.254 1.00 0.00 C ATOM 581 O3' DG A 19 6.440 -3.109 8.362 1.00 0.00 O ATOM 582 C2' DG A 19 5.099 -3.576 6.404 1.00 0.00 C ATOM 583 C1' DG A 19 4.129 -2.714 5.597 1.00 0.00 C ATOM 584 N9 DG A 19 4.764 -2.125 4.387 1.00 0.00 N ATOM 585 C8 DG A 19 6.090 -1.955 4.046 1.00 0.00 C ATOM 586 N7 DG A 19 6.289 -1.573 2.817 1.00 0.00 N ATOM 587 C5 DG A 19 5.001 -1.488 2.291 1.00 0.00 C ATOM 588 C6 DG A 19 4.541 -1.194 0.968 1.00 0.00 C ATOM 589 O6 DG A 19 5.200 -0.923 -0.032 1.00 0.00 O ATOM 590 N1 DG A 19 3.163 -1.252 0.849 1.00 0.00 N ATOM 591 C2 DG A 19 2.319 -1.505 1.893 1.00 0.00 C ATOM 592 N2 DG A 19 1.029 -1.492 1.677 1.00 0.00 N ATOM 593 N3 DG A 19 2.711 -1.784 3.130 1.00 0.00 N ATOM 594 C4 DG A 19 4.067 -1.777 3.261 1.00 0.00 C ATOM 0 H5' DG A 19 4.105 0.412 7.975 1.00 0.00 H new ATOM 0 H5'' DG A 19 5.335 -0.231 9.045 1.00 0.00 H new ATOM 0 H4' DG A 19 4.093 -2.051 8.486 1.00 0.00 H new ATOM 0 H3' DG A 19 6.608 -1.980 6.780 1.00 0.00 H new ATOM 0 H2' DG A 19 5.798 -4.116 5.765 1.00 0.00 H new ATOM 0 H2'' DG A 19 4.581 -4.319 7.010 1.00 0.00 H new ATOM 0 H1' DG A 19 3.295 -3.320 5.243 1.00 0.00 H new ATOM 0 H8 DG A 19 6.898 -2.125 4.742 1.00 0.00 H new ATOM 0 H1 DG A 19 2.754 -1.097 -0.072 1.00 0.00 H new ATOM 0 H21 DG A 19 0.382 -1.678 2.443 1.00 0.00 H new ATOM 0 H22 DG A 19 0.670 -1.295 0.743 1.00 0.00 H new HETATM 606 C1 J32 A 20 -3.681 -5.543 -1.228 1.00 0.00 C HETATM 607 C2 J32 A 20 -3.200 -5.452 -2.537 1.00 0.00 C HETATM 608 C3 J32 A 20 -1.827 -5.344 -2.778 1.00 0.00 C HETATM 609 C4 J32 A 20 0.445 -5.243 -1.945 1.00 0.00 C HETATM 610 C5 J32 A 20 1.343 -5.193 -0.873 1.00 0.00 C HETATM 611 C6 J32 A 20 1.726 -5.159 1.543 1.00 0.00 C HETATM 612 C7 J32 A 20 1.235 -5.241 2.845 1.00 0.00 C HETATM 613 P J32 A 20 8.009 -3.337 8.359 1.00 0.00 P HETATM 614 OP1 J32 A 20 8.112 -4.271 9.533 1.00 0.00 O HETATM 615 OP2 J32 A 20 8.523 -1.931 8.536 1.00 0.00 O HETATM 616 O5' J32 A 20 8.329 -3.959 6.926 1.00 0.00 O HETATM 617 C2' J32 A 20 9.651 -4.476 6.595 1.00 0.00 C HETATM 618 C3' J32 A 20 10.084 -3.911 5.215 1.00 0.00 C HETATM 619 O1 J32 A 20 10.155 -4.944 4.190 1.00 0.00 O HETATM 620 C4' J32 A 20 9.905 -4.583 2.803 1.00 0.00 C HETATM 621 C2A J32 A 20 8.438 -4.718 2.418 1.00 0.00 C HETATM 622 C12 J32 A 20 8.039 -4.648 1.070 1.00 0.00 C HETATM 623 C11 J32 A 20 6.688 -4.767 0.712 1.00 0.00 C HETATM 624 C4A J32 A 20 5.745 -4.936 1.726 1.00 0.00 C HETATM 625 C14 J32 A 20 6.132 -5.024 3.056 1.00 0.00 C HETATM 626 C13 J32 A 20 7.469 -4.927 3.403 1.00 0.00 C HETATM 627 C15 J32 A 20 4.328 -5.009 1.556 1.00 0.00 C HETATM 628 C16 J32 A 20 3.156 -5.073 1.503 1.00 0.00 C HETATM 629 C8 J32 A 20 -0.128 -5.327 3.083 1.00 0.00 C HETATM 630 C8A J32 A 20 -1.010 -5.389 1.999 1.00 0.00 C HETATM 631 C1B J32 A 20 -0.516 -5.337 0.683 1.00 0.00 C HETATM 632 C1A J32 A 20 -1.411 -5.390 -0.392 1.00 0.00 C HETATM 633 C3A J32 A 20 -0.929 -5.324 -1.705 1.00 0.00 C HETATM 634 C5A J32 A 20 0.863 -5.224 0.442 1.00 0.00 C HETATM 635 C1C J32 A 20 -2.787 -5.506 -0.153 1.00 0.00 C HETATM 636 C10 J32 A 20 -3.271 -5.575 1.157 1.00 0.00 C HETATM 637 C9 J32 A 20 -2.383 -5.510 2.233 1.00 0.00 C HETATM 638 C1' J32 A 20 9.621 -6.021 6.641 1.00 0.00 C HETATM 639 O3' J32 A 20 9.198 -6.383 7.841 1.00 0.00 O ATOM 660 P DG A 21 8.686 -7.779 8.114 1.00 0.00 P ATOM 661 OP1 DG A 21 8.891 -8.068 9.547 1.00 0.00 O ATOM 662 OP2 DG A 21 9.334 -8.687 7.142 1.00 0.00 O ATOM 663 O5' DG A 21 7.109 -7.810 7.780 1.00 0.00 O ATOM 664 C5' DG A 21 6.183 -6.958 8.435 1.00 0.00 C ATOM 665 C4' DG A 21 4.755 -7.188 7.920 1.00 0.00 C ATOM 666 O4' DG A 21 4.635 -6.688 6.595 1.00 0.00 O ATOM 667 C3' DG A 21 4.325 -8.658 7.954 1.00 0.00 C ATOM 668 O3' DG A 21 3.318 -8.882 8.928 1.00 0.00 O ATOM 669 C2' DG A 21 3.765 -8.903 6.562 1.00 0.00 C ATOM 670 C1' DG A 21 4.090 -7.669 5.740 1.00 0.00 C ATOM 671 N9 DG A 21 5.021 -7.990 4.638 1.00 0.00 N ATOM 672 C8 DG A 21 6.390 -8.076 4.619 1.00 0.00 C ATOM 673 N7 DG A 21 6.893 -8.249 3.428 1.00 0.00 N ATOM 674 C5 DG A 21 5.773 -8.327 2.598 1.00 0.00 C ATOM 675 C6 DG A 21 5.643 -8.470 1.176 1.00 0.00 C ATOM 676 O6 DG A 21 6.520 -8.548 0.318 1.00 0.00 O ATOM 677 N1 DG A 21 4.321 -8.506 0.759 1.00 0.00 N ATOM 678 C2 DG A 21 3.253 -8.496 1.611 1.00 0.00 C ATOM 679 N2 DG A 21 2.053 -8.659 1.116 1.00 0.00 N ATOM 680 N3 DG A 21 3.336 -8.339 2.926 1.00 0.00 N ATOM 681 C4 DG A 21 4.625 -8.241 3.354 1.00 0.00 C ATOM 0 H5' DG A 21 6.467 -5.918 8.276 1.00 0.00 H new ATOM 0 H5'' DG A 21 6.218 -7.137 9.510 1.00 0.00 H new ATOM 0 H4' DG A 21 4.091 -6.649 8.596 1.00 0.00 H new ATOM 0 H3' DG A 21 5.150 -9.321 8.214 1.00 0.00 H new ATOM 0 H2' DG A 21 4.209 -9.793 6.117 1.00 0.00 H new ATOM 0 H2'' DG A 21 2.689 -9.070 6.601 1.00 0.00 H new ATOM 0 H1' DG A 21 3.177 -7.288 5.283 1.00 0.00 H new ATOM 0 H8 DG A 21 6.997 -8.007 5.510 1.00 0.00 H new ATOM 0 H1 DG A 21 4.135 -8.542 -0.243 1.00 0.00 H new ATOM 0 H21 DG A 21 1.242 -8.655 1.734 1.00 0.00 H new ATOM 0 H22 DG A 21 1.929 -8.790 0.112 1.00 0.00 H new ATOM 693 P DT A 22 3.039 -10.359 9.529 1.00 0.00 P ATOM 694 OP1 DT A 22 2.086 -10.274 10.656 1.00 0.00 O ATOM 695 OP2 DT A 22 4.318 -11.062 9.750 1.00 0.00 O ATOM 696 O5' DT A 22 2.303 -11.036 8.264 1.00 0.00 O ATOM 697 C5' DT A 22 0.952 -10.741 7.951 1.00 0.00 C ATOM 698 C4' DT A 22 0.517 -11.504 6.695 1.00 0.00 C ATOM 699 O4' DT A 22 1.288 -11.078 5.584 1.00 0.00 O ATOM 700 C3' DT A 22 0.671 -13.023 6.843 1.00 0.00 C ATOM 701 O3' DT A 22 -0.597 -13.654 6.864 1.00 0.00 O ATOM 702 C2' DT A 22 1.441 -13.461 5.601 1.00 0.00 C ATOM 703 C1' DT A 22 1.581 -12.186 4.761 1.00 0.00 C ATOM 704 N1 DT A 22 2.935 -12.023 4.189 1.00 0.00 N ATOM 705 C2 DT A 22 3.059 -11.902 2.802 1.00 0.00 C ATOM 706 O2 DT A 22 2.113 -11.876 2.011 1.00 0.00 O ATOM 707 N3 DT A 22 4.340 -11.827 2.322 1.00 0.00 N ATOM 708 C4 DT A 22 5.504 -11.827 3.051 1.00 0.00 C ATOM 709 O4 DT A 22 6.571 -11.762 2.451 1.00 0.00 O ATOM 710 C5 DT A 22 5.296 -11.908 4.492 1.00 0.00 C ATOM 711 C7 DT A 22 6.459 -11.839 5.452 1.00 0.00 C ATOM 712 C6 DT A 22 4.044 -12.010 5.006 1.00 0.00 C ATOM 0 H5' DT A 22 0.834 -9.669 7.792 1.00 0.00 H new ATOM 0 H5'' DT A 22 0.310 -11.012 8.789 1.00 0.00 H new ATOM 0 H4' DT A 22 -0.540 -11.285 6.544 1.00 0.00 H new ATOM 0 H3' DT A 22 1.179 -13.290 7.770 1.00 0.00 H new ATOM 0 H2' DT A 22 2.416 -13.871 5.864 1.00 0.00 H new ATOM 0 H2'' DT A 22 0.905 -14.238 5.056 1.00 0.00 H new ATOM 0 HO3' DT A 22 -0.479 -14.622 6.957 1.00 0.00 H new ATOM 0 H1' DT A 22 0.887 -12.258 3.923 1.00 0.00 H new ATOM 0 H3 DT A 22 4.441 -11.764 1.309 1.00 0.00 H new ATOM 0 H71 DT A 22 6.130 -11.394 6.391 1.00 0.00 H new ATOM 0 H72 DT A 22 6.836 -12.844 5.640 1.00 0.00 H new ATOM 0 H73 DT A 22 7.252 -11.229 5.019 1.00 0.00 H new ATOM 0 H6 DT A 22 3.915 -12.082 6.076 1.00 0.00 H new TER 726 DT A 22