USER MOD reduce.3.24.130724 H: found=0, std=0, add=248, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 248 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 1 DG O5' : rot 17:sc= 0.768 USER MOD Single : A 20 DT C7 :methyl -30:sc= -4.7! (180deg=-9.07!) USER MOD Single : A 20 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -8.198 -2.029 -6.358 1.00 0.00 O ATOM 2 C5' DG A 1 -8.743 -3.284 -6.767 1.00 0.00 C ATOM 3 C4' DG A 1 -7.730 -4.414 -6.589 1.00 0.00 C ATOM 4 O4' DG A 1 -6.563 -4.182 -7.378 1.00 0.00 O ATOM 5 C3' DG A 1 -7.255 -4.610 -5.156 1.00 0.00 C ATOM 6 O3' DG A 1 -8.091 -5.584 -4.499 1.00 0.00 O ATOM 7 C2' DG A 1 -5.820 -5.097 -5.283 1.00 0.00 C ATOM 8 C1' DG A 1 -5.457 -4.831 -6.740 1.00 0.00 C ATOM 9 N9 DG A 1 -4.262 -3.986 -6.920 1.00 0.00 N ATOM 10 C8 DG A 1 -3.002 -4.351 -7.307 1.00 0.00 C ATOM 11 N7 DG A 1 -2.105 -3.410 -7.236 1.00 0.00 N ATOM 12 C5 DG A 1 -2.831 -2.317 -6.765 1.00 0.00 C ATOM 13 C6 DG A 1 -2.402 -0.990 -6.486 1.00 0.00 C ATOM 14 O6 DG A 1 -1.274 -0.514 -6.597 1.00 0.00 O ATOM 15 N1 DG A 1 -3.452 -0.199 -6.033 1.00 0.00 N ATOM 16 C2 DG A 1 -4.753 -0.634 -5.868 1.00 0.00 C ATOM 17 N2 DG A 1 -5.627 0.266 -5.426 1.00 0.00 N ATOM 18 N3 DG A 1 -5.157 -1.879 -6.128 1.00 0.00 N ATOM 19 C4 DG A 1 -4.149 -2.662 -6.569 1.00 0.00 C ATOM 0 H5' DG A 1 -9.048 -3.227 -7.812 1.00 0.00 H new ATOM 0 H5'' DG A 1 -9.639 -3.501 -6.185 1.00 0.00 H new ATOM 0 H4' DG A 1 -8.269 -5.308 -6.904 1.00 0.00 H new ATOM 0 H3' DG A 1 -7.309 -3.700 -4.559 1.00 0.00 H new ATOM 0 H2' DG A 1 -5.157 -4.561 -4.604 1.00 0.00 H new ATOM 0 H2'' DG A 1 -5.737 -6.156 -5.040 1.00 0.00 H new ATOM 0 HO5' DG A 1 -7.222 -2.100 -6.299 1.00 0.00 H new ATOM 0 H1' DG A 1 -5.229 -5.801 -7.182 1.00 0.00 H new ATOM 0 H8 DG A 1 -2.768 -5.349 -7.647 1.00 0.00 H new ATOM 0 H1 DG A 1 -3.247 0.774 -5.806 1.00 0.00 H new ATOM 0 H21 DG A 1 -6.602 0.003 -5.285 1.00 0.00 H new ATOM 0 H22 DG A 1 -5.322 1.219 -5.228 1.00 0.00 H new ATOM 32 P DG A 2 -8.098 -5.720 -2.889 1.00 0.00 P ATOM 33 OP1 DG A 2 -9.207 -6.623 -2.503 1.00 0.00 O ATOM 34 OP2 DG A 2 -8.000 -4.365 -2.302 1.00 0.00 O ATOM 35 O5' DG A 2 -6.707 -6.487 -2.636 1.00 0.00 O ATOM 36 C5' DG A 2 -6.521 -7.810 -3.156 1.00 0.00 C ATOM 37 C4' DG A 2 -5.063 -8.255 -3.059 1.00 0.00 C ATOM 38 O4' DG A 2 -4.249 -7.361 -3.807 1.00 0.00 O ATOM 39 C3' DG A 2 -4.447 -8.339 -1.670 1.00 0.00 C ATOM 40 O3' DG A 2 -4.695 -9.658 -1.143 1.00 0.00 O ATOM 41 C2' DG A 2 -2.972 -8.075 -1.926 1.00 0.00 C ATOM 42 C1' DG A 2 -2.990 -7.167 -3.151 1.00 0.00 C ATOM 43 N9 DG A 2 -2.899 -5.738 -2.819 1.00 0.00 N ATOM 44 C8 DG A 2 -3.892 -4.895 -2.425 1.00 0.00 C ATOM 45 N7 DG A 2 -3.517 -3.693 -2.142 1.00 0.00 N ATOM 46 C5 DG A 2 -2.150 -3.724 -2.361 1.00 0.00 C ATOM 47 C6 DG A 2 -1.197 -2.690 -2.221 1.00 0.00 C ATOM 48 O6 DG A 2 -1.381 -1.527 -1.860 1.00 0.00 O ATOM 49 N1 DG A 2 0.076 -3.132 -2.549 1.00 0.00 N ATOM 50 C2 DG A 2 0.397 -4.408 -2.956 1.00 0.00 C ATOM 51 N2 DG A 2 1.687 -4.634 -3.228 1.00 0.00 N ATOM 52 N3 DG A 2 -0.503 -5.391 -3.087 1.00 0.00 N ATOM 53 C4 DG A 2 -1.754 -4.975 -2.774 1.00 0.00 C ATOM 0 H5' DG A 2 -6.842 -7.840 -4.197 1.00 0.00 H new ATOM 0 H5'' DG A 2 -7.152 -8.509 -2.607 1.00 0.00 H new ATOM 0 H4' DG A 2 -5.090 -9.276 -3.440 1.00 0.00 H new ATOM 0 H3' DG A 2 -4.849 -7.638 -0.939 1.00 0.00 H new ATOM 0 H2' DG A 2 -2.495 -7.592 -1.073 1.00 0.00 H new ATOM 0 H2'' DG A 2 -2.425 -8.998 -2.117 1.00 0.00 H new ATOM 0 H1' DG A 2 -2.127 -7.426 -3.764 1.00 0.00 H new ATOM 0 H8 DG A 2 -4.923 -5.210 -2.354 1.00 0.00 H new ATOM 0 H1 DG A 2 0.837 -2.456 -2.483 1.00 0.00 H new ATOM 0 H21 DG A 2 1.989 -5.559 -3.534 1.00 0.00 H new ATOM 0 H22 DG A 2 2.368 -3.881 -3.129 1.00 0.00 H new ATOM 65 P DG A 3 -4.495 -10.049 0.417 1.00 0.00 P ATOM 66 OP1 DG A 3 -5.114 -11.375 0.651 1.00 0.00 O ATOM 67 OP2 DG A 3 -4.881 -8.885 1.242 1.00 0.00 O ATOM 68 O5' DG A 3 -2.892 -10.208 0.475 1.00 0.00 O ATOM 69 C5' DG A 3 -2.298 -11.158 -0.410 1.00 0.00 C ATOM 70 C4' DG A 3 -0.769 -11.094 -0.454 1.00 0.00 C ATOM 71 O4' DG A 3 -0.400 -9.732 -0.728 1.00 0.00 O ATOM 72 C3' DG A 3 0.020 -11.489 0.795 1.00 0.00 C ATOM 73 O3' DG A 3 1.193 -12.117 0.284 1.00 0.00 O ATOM 74 C2' DG A 3 0.398 -10.189 1.472 1.00 0.00 C ATOM 75 C1' DG A 3 0.447 -9.210 0.319 1.00 0.00 C ATOM 76 N9 DG A 3 -0.031 -7.867 0.677 1.00 0.00 N ATOM 77 C8 DG A 3 -1.281 -7.466 1.056 1.00 0.00 C ATOM 78 N7 DG A 3 -1.383 -6.218 1.403 1.00 0.00 N ATOM 79 C5 DG A 3 -0.083 -5.742 1.245 1.00 0.00 C ATOM 80 C6 DG A 3 0.438 -4.444 1.470 1.00 0.00 C ATOM 81 O6 DG A 3 -0.151 -3.443 1.863 1.00 0.00 O ATOM 82 N1 DG A 3 1.791 -4.381 1.191 1.00 0.00 N ATOM 83 C2 DG A 3 2.567 -5.426 0.754 1.00 0.00 C ATOM 84 N2 DG A 3 3.866 -5.150 0.557 1.00 0.00 N ATOM 85 N3 DG A 3 2.085 -6.659 0.534 1.00 0.00 N ATOM 86 C4 DG A 3 0.752 -6.742 0.802 1.00 0.00 C ATOM 0 H5' DG A 3 -2.688 -10.996 -1.415 1.00 0.00 H new ATOM 0 H5'' DG A 3 -2.601 -12.160 -0.108 1.00 0.00 H new ATOM 0 H4' DG A 3 -0.509 -11.838 -1.207 1.00 0.00 H new ATOM 0 H3' DG A 3 -0.513 -12.136 1.492 1.00 0.00 H new ATOM 0 H2' DG A 3 -0.337 -9.895 2.221 1.00 0.00 H new ATOM 0 H2'' DG A 3 1.359 -10.263 1.981 1.00 0.00 H new ATOM 0 H1' DG A 3 1.487 -9.106 0.010 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.125 -8.139 1.066 1.00 0.00 H new ATOM 0 H1 DG A 3 2.252 -3.481 1.321 1.00 0.00 H new ATOM 0 H21 DG A 3 4.499 -5.881 0.233 1.00 0.00 H new ATOM 0 H22 DG A 3 4.220 -4.209 0.732 1.00 0.00 H new ATOM 98 P DG A 4 1.393 -13.709 0.207 1.00 0.00 P ATOM 99 OP1 DG A 4 0.129 -14.322 -0.261 1.00 0.00 O ATOM 100 OP2 DG A 4 2.030 -14.175 1.459 1.00 0.00 O ATOM 101 O5' DG A 4 2.476 -13.783 -0.982 1.00 0.00 O ATOM 102 C5' DG A 4 2.032 -13.377 -2.283 1.00 0.00 C ATOM 103 C4' DG A 4 3.142 -13.221 -3.318 1.00 0.00 C ATOM 104 O4' DG A 4 3.944 -12.097 -2.984 1.00 0.00 O ATOM 105 C3' DG A 4 4.064 -14.417 -3.471 1.00 0.00 C ATOM 106 O3' DG A 4 4.396 -14.556 -4.860 1.00 0.00 O ATOM 107 C2' DG A 4 5.317 -14.038 -2.670 1.00 0.00 C ATOM 108 C1' DG A 4 5.160 -12.535 -2.386 1.00 0.00 C ATOM 109 N9 DG A 4 5.093 -12.159 -0.953 1.00 0.00 N ATOM 110 C8 DG A 4 4.657 -12.882 0.126 1.00 0.00 C ATOM 111 N7 DG A 4 4.719 -12.265 1.266 1.00 0.00 N ATOM 112 C5 DG A 4 5.236 -11.019 0.930 1.00 0.00 C ATOM 113 C6 DG A 4 5.524 -9.903 1.761 1.00 0.00 C ATOM 114 O6 DG A 4 5.379 -9.800 2.977 1.00 0.00 O ATOM 115 N1 DG A 4 6.028 -8.839 1.026 1.00 0.00 N ATOM 116 C2 DG A 4 6.232 -8.843 -0.338 1.00 0.00 C ATOM 117 N2 DG A 4 6.723 -7.721 -0.865 1.00 0.00 N ATOM 118 N3 DG A 4 5.964 -9.893 -1.124 1.00 0.00 N ATOM 119 C4 DG A 4 5.469 -10.942 -0.425 1.00 0.00 C ATOM 0 H5' DG A 4 1.504 -12.428 -2.191 1.00 0.00 H new ATOM 0 H5'' DG A 4 1.312 -14.108 -2.650 1.00 0.00 H new ATOM 0 H4' DG A 4 2.622 -13.105 -4.269 1.00 0.00 H new ATOM 0 H3' DG A 4 3.625 -15.353 -3.126 1.00 0.00 H new ATOM 0 H2' DG A 4 5.384 -14.611 -1.745 1.00 0.00 H new ATOM 0 H2'' DG A 4 6.226 -14.241 -3.237 1.00 0.00 H new ATOM 0 H1' DG A 4 6.056 -12.067 -2.793 1.00 0.00 H new ATOM 0 H8 DG A 4 4.288 -13.893 0.034 1.00 0.00 H new ATOM 0 H1 DG A 4 6.266 -7.987 1.534 1.00 0.00 H new ATOM 0 H21 DG A 4 6.896 -7.662 -1.869 1.00 0.00 H new ATOM 0 H22 DG A 4 6.926 -6.922 -0.265 1.00 0.00 H new ATOM 131 P DC A 5 3.542 -15.561 -5.797 1.00 0.00 P ATOM 132 OP1 DC A 5 3.190 -16.752 -4.992 1.00 0.00 O ATOM 133 OP2 DC A 5 4.267 -15.728 -7.076 1.00 0.00 O ATOM 134 O5' DC A 5 2.187 -14.739 -6.095 1.00 0.00 O ATOM 135 C5' DC A 5 2.155 -13.623 -6.990 1.00 0.00 C ATOM 136 C4' DC A 5 0.835 -12.867 -6.869 1.00 0.00 C ATOM 137 O4' DC A 5 0.729 -12.307 -5.564 1.00 0.00 O ATOM 138 C3' DC A 5 0.671 -11.726 -7.864 1.00 0.00 C ATOM 139 O3' DC A 5 -0.109 -12.126 -8.997 1.00 0.00 O ATOM 140 C2' DC A 5 -0.095 -10.653 -7.100 1.00 0.00 C ATOM 141 C1' DC A 5 0.007 -11.076 -5.638 1.00 0.00 C ATOM 142 N1 DC A 5 0.696 -10.098 -4.771 1.00 0.00 N ATOM 143 C2 DC A 5 1.958 -9.676 -5.153 1.00 0.00 C ATOM 144 O2 DC A 5 2.480 -10.138 -6.166 1.00 0.00 O ATOM 145 N3 DC A 5 2.596 -8.754 -4.373 1.00 0.00 N ATOM 146 C4 DC A 5 2.015 -8.270 -3.266 1.00 0.00 C ATOM 147 N4 DC A 5 2.666 -7.376 -2.515 1.00 0.00 N ATOM 148 C5 DC A 5 0.712 -8.701 -2.877 1.00 0.00 C ATOM 149 C6 DC A 5 0.095 -9.613 -3.651 1.00 0.00 C ATOM 0 H5' DC A 5 2.288 -13.969 -8.015 1.00 0.00 H new ATOM 0 H5'' DC A 5 2.985 -12.951 -6.770 1.00 0.00 H new ATOM 0 H4' DC A 5 0.058 -13.603 -7.078 1.00 0.00 H new ATOM 0 H3' DC A 5 1.639 -11.392 -8.239 1.00 0.00 H new ATOM 0 H2' DC A 5 0.340 -9.666 -7.259 1.00 0.00 H new ATOM 0 H2'' DC A 5 -1.134 -10.599 -7.426 1.00 0.00 H new ATOM 0 H1' DC A 5 -1.017 -11.164 -5.276 1.00 0.00 H new ATOM 0 H41 DC A 5 2.229 -7.004 -1.672 1.00 0.00 H new ATOM 0 H42 DC A 5 3.599 -7.066 -2.785 1.00 0.00 H new ATOM 0 H5 DC A 5 0.236 -8.308 -1.991 1.00 0.00 H new ATOM 0 H6 DC A 5 -0.890 -9.964 -3.380 1.00 0.00 H new ATOM 161 P DG A 6 0.492 -12.034 -10.485 1.00 0.00 P ATOM 162 OP1 DG A 6 -0.590 -12.337 -11.449 1.00 0.00 O ATOM 163 OP2 DG A 6 1.761 -12.795 -10.526 1.00 0.00 O ATOM 164 O5' DG A 6 0.836 -10.467 -10.581 1.00 0.00 O ATOM 165 C5' DG A 6 -0.159 -9.458 -10.395 1.00 0.00 C ATOM 166 C4' DG A 6 0.501 -8.080 -10.409 1.00 0.00 C ATOM 167 O4' DG A 6 0.259 -7.430 -11.657 1.00 0.00 O ATOM 168 C3' DG A 6 0.027 -7.116 -9.328 1.00 0.00 C ATOM 169 O3' DG A 6 1.170 -6.393 -8.905 1.00 0.00 O ATOM 170 C2' DG A 6 -0.965 -6.187 -9.998 1.00 0.00 C ATOM 171 C1' DG A 6 -0.764 -6.439 -11.484 1.00 0.00 C ATOM 172 N9 DG A 6 -1.965 -6.942 -12.175 1.00 0.00 N ATOM 173 C8 DG A 6 -2.904 -7.827 -11.721 1.00 0.00 C ATOM 174 N7 DG A 6 -3.813 -8.160 -12.588 1.00 0.00 N ATOM 175 C5 DG A 6 -3.451 -7.439 -13.724 1.00 0.00 C ATOM 176 C6 DG A 6 -4.065 -7.390 -15.004 1.00 0.00 C ATOM 177 O6 DG A 6 -5.065 -7.990 -15.393 1.00 0.00 O ATOM 178 N1 DG A 6 -3.386 -6.536 -15.863 1.00 0.00 N ATOM 179 C2 DG A 6 -2.254 -5.817 -15.536 1.00 0.00 C ATOM 180 N2 DG A 6 -1.744 -5.045 -16.497 1.00 0.00 N ATOM 181 N3 DG A 6 -1.671 -5.863 -14.333 1.00 0.00 N ATOM 182 C4 DG A 6 -2.320 -6.690 -13.481 1.00 0.00 C ATOM 0 H5' DG A 6 -0.678 -9.614 -9.449 1.00 0.00 H new ATOM 0 H5'' DG A 6 -0.908 -9.522 -11.184 1.00 0.00 H new ATOM 0 H4' DG A 6 1.554 -8.295 -10.229 1.00 0.00 H new ATOM 0 H3' DG A 6 -0.437 -7.608 -8.473 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.987 -6.407 -9.691 1.00 0.00 H new ATOM 0 H2'' DG A 6 -0.772 -5.145 -9.741 1.00 0.00 H new ATOM 0 H1' DG A 6 -0.503 -5.473 -11.917 1.00 0.00 H new ATOM 0 H8 DG A 6 -2.891 -8.220 -10.715 1.00 0.00 H new ATOM 0 H1 DG A 6 -3.752 -6.432 -16.809 1.00 0.00 H new ATOM 0 H21 DG A 6 -0.908 -4.490 -16.315 1.00 0.00 H new ATOM 0 H22 DG A 6 -2.190 -5.010 -17.414 1.00 0.00 H new ATOM 194 P DG A 7 1.869 -6.753 -7.512 1.00 0.00 P ATOM 195 OP1 DG A 7 2.114 -8.209 -7.482 1.00 0.00 O ATOM 196 OP2 DG A 7 1.113 -6.102 -6.419 1.00 0.00 O ATOM 197 O5' DG A 7 3.281 -6.022 -7.649 1.00 0.00 O ATOM 198 C5' DG A 7 4.226 -6.510 -8.607 1.00 0.00 C ATOM 199 C4' DG A 7 5.439 -5.614 -8.667 1.00 0.00 C ATOM 200 O4' DG A 7 5.097 -4.325 -9.142 1.00 0.00 O ATOM 201 C3' DG A 7 6.070 -5.435 -7.309 1.00 0.00 C ATOM 202 O3' DG A 7 7.005 -6.488 -7.036 1.00 0.00 O ATOM 203 C2' DG A 7 6.775 -4.092 -7.443 1.00 0.00 C ATOM 204 C1' DG A 7 6.001 -3.385 -8.563 1.00 0.00 C ATOM 205 N9 DG A 7 5.199 -2.236 -8.115 1.00 0.00 N ATOM 206 C8 DG A 7 5.604 -0.967 -7.844 1.00 0.00 C ATOM 207 N7 DG A 7 4.666 -0.155 -7.456 1.00 0.00 N ATOM 208 C5 DG A 7 3.529 -0.960 -7.471 1.00 0.00 C ATOM 209 C6 DG A 7 2.185 -0.639 -7.147 1.00 0.00 C ATOM 210 O6 DG A 7 1.726 0.438 -6.774 1.00 0.00 O ATOM 211 N1 DG A 7 1.350 -1.738 -7.300 1.00 0.00 N ATOM 212 C2 DG A 7 1.752 -2.990 -7.715 1.00 0.00 C ATOM 213 N2 DG A 7 0.798 -3.917 -7.812 1.00 0.00 N ATOM 214 N3 DG A 7 3.018 -3.296 -8.017 1.00 0.00 N ATOM 215 C4 DG A 7 3.848 -2.237 -7.875 1.00 0.00 C ATOM 0 H5' DG A 7 3.759 -6.564 -9.590 1.00 0.00 H new ATOM 0 H5'' DG A 7 4.529 -7.523 -8.342 1.00 0.00 H new ATOM 0 H4' DG A 7 6.141 -6.101 -9.344 1.00 0.00 H new ATOM 0 H3' DG A 7 5.354 -5.465 -6.488 1.00 0.00 H new ATOM 0 H2' DG A 7 6.739 -3.526 -6.512 1.00 0.00 H new ATOM 0 H2'' DG A 7 7.827 -4.216 -7.700 1.00 0.00 H new ATOM 0 H1' DG A 7 6.749 -3.009 -9.261 1.00 0.00 H new ATOM 0 H8 DG A 7 6.633 -0.655 -7.944 1.00 0.00 H new ATOM 0 H1 DG A 7 0.361 -1.609 -7.089 1.00 0.00 H new ATOM 0 H21 DG A 7 1.034 -4.862 -8.114 1.00 0.00 H new ATOM 0 H22 DG A 7 -0.168 -3.681 -7.584 1.00 0.00 H new ATOM 227 P DG A 8 7.076 -7.096 -5.543 1.00 0.00 P ATOM 228 OP1 DG A 8 8.129 -8.137 -5.511 1.00 0.00 O ATOM 229 OP2 DG A 8 5.700 -7.417 -5.101 1.00 0.00 O ATOM 230 O5' DG A 8 7.589 -5.832 -4.709 1.00 0.00 O ATOM 231 C5' DG A 8 8.869 -5.270 -4.954 1.00 0.00 C ATOM 232 C4' DG A 8 9.014 -3.946 -4.230 1.00 0.00 C ATOM 233 O4' DG A 8 7.995 -3.060 -4.687 1.00 0.00 O ATOM 234 C3' DG A 8 8.852 -3.997 -2.728 1.00 0.00 C ATOM 235 O3' DG A 8 10.101 -4.334 -2.094 1.00 0.00 O ATOM 236 C2' DG A 8 8.427 -2.578 -2.399 1.00 0.00 C ATOM 237 C1' DG A 8 7.675 -2.126 -3.648 1.00 0.00 C ATOM 238 N9 DG A 8 6.205 -2.104 -3.474 1.00 0.00 N ATOM 239 C8 DG A 8 5.311 -3.131 -3.576 1.00 0.00 C ATOM 240 N7 DG A 8 4.077 -2.827 -3.306 1.00 0.00 N ATOM 241 C5 DG A 8 4.149 -1.474 -2.989 1.00 0.00 C ATOM 242 C6 DG A 8 3.116 -0.574 -2.614 1.00 0.00 C ATOM 243 O6 DG A 8 1.921 -0.794 -2.486 1.00 0.00 O ATOM 244 N1 DG A 8 3.601 0.697 -2.391 1.00 0.00 N ATOM 245 C2 DG A 8 4.920 1.075 -2.502 1.00 0.00 C ATOM 246 N2 DG A 8 5.186 2.356 -2.240 1.00 0.00 N ATOM 247 N3 DG A 8 5.905 0.236 -2.852 1.00 0.00 N ATOM 248 C4 DG A 8 5.446 -1.020 -3.083 1.00 0.00 C ATOM 0 H5' DG A 8 9.009 -5.123 -6.025 1.00 0.00 H new ATOM 0 H5'' DG A 8 9.645 -5.960 -4.622 1.00 0.00 H new ATOM 0 H4' DG A 8 10.034 -3.629 -4.447 1.00 0.00 H new ATOM 0 H3' DG A 8 8.142 -4.749 -2.383 1.00 0.00 H new ATOM 0 H2' DG A 8 7.790 -2.546 -1.515 1.00 0.00 H new ATOM 0 H2'' DG A 8 9.287 -1.939 -2.196 1.00 0.00 H new ATOM 0 H1' DG A 8 7.978 -1.105 -3.879 1.00 0.00 H new ATOM 0 H8 DG A 8 5.610 -4.129 -3.862 1.00 0.00 H new ATOM 0 H1 DG A 8 2.928 1.415 -2.122 1.00 0.00 H new ATOM 0 H21 DG A 8 6.144 2.701 -2.304 1.00 0.00 H new ATOM 0 H22 DG A 8 4.432 2.990 -1.976 1.00 0.00 H new ATOM 260 P DG A 9 10.121 -4.916 -0.583 1.00 0.00 P ATOM 261 OP1 DG A 9 11.475 -5.440 -0.301 1.00 0.00 O ATOM 262 OP2 DG A 9 8.936 -5.784 -0.402 1.00 0.00 O ATOM 263 O5' DG A 9 9.910 -3.568 0.276 1.00 0.00 O ATOM 264 C5' DG A 9 10.936 -2.569 0.257 1.00 0.00 C ATOM 265 C4' DG A 9 10.345 -1.188 -0.013 1.00 0.00 C ATOM 266 O4' DG A 9 8.935 -1.302 -0.173 1.00 0.00 O ATOM 267 C3' DG A 9 10.569 -0.100 1.030 1.00 0.00 C ATOM 268 O3' DG A 9 10.675 1.128 0.293 1.00 0.00 O ATOM 269 C2' DG A 9 9.274 -0.118 1.825 1.00 0.00 C ATOM 270 C1' DG A 9 8.281 -0.419 0.724 1.00 0.00 C ATOM 271 N9 DG A 9 7.017 -1.066 1.124 1.00 0.00 N ATOM 272 C8 DG A 9 6.636 -2.370 0.962 1.00 0.00 C ATOM 273 N7 DG A 9 5.378 -2.622 1.220 1.00 0.00 N ATOM 274 C5 DG A 9 4.885 -1.368 1.598 1.00 0.00 C ATOM 275 C6 DG A 9 3.575 -0.981 2.003 1.00 0.00 C ATOM 276 O6 DG A 9 2.575 -1.679 2.136 1.00 0.00 O ATOM 277 N1 DG A 9 3.508 0.373 2.290 1.00 0.00 N ATOM 278 C2 DG A 9 4.569 1.253 2.210 1.00 0.00 C ATOM 279 N2 DG A 9 4.317 2.518 2.532 1.00 0.00 N ATOM 280 N3 DG A 9 5.797 0.897 1.836 1.00 0.00 N ATOM 281 C4 DG A 9 5.884 -0.418 1.543 1.00 0.00 C ATOM 0 H5' DG A 9 11.671 -2.811 -0.511 1.00 0.00 H new ATOM 0 H5'' DG A 9 11.462 -2.564 1.212 1.00 0.00 H new ATOM 0 H4' DG A 9 10.887 -0.866 -0.902 1.00 0.00 H new ATOM 0 H3' DG A 9 11.444 -0.222 1.668 1.00 0.00 H new ATOM 0 H2' DG A 9 9.275 -0.882 2.603 1.00 0.00 H new ATOM 0 H2'' DG A 9 9.074 0.835 2.315 1.00 0.00 H new ATOM 0 H1' DG A 9 7.989 0.547 0.313 1.00 0.00 H new ATOM 0 H8 DG A 9 7.325 -3.138 0.643 1.00 0.00 H new ATOM 0 H1 DG A 9 2.606 0.748 2.583 1.00 0.00 H new ATOM 0 H21 DG A 9 5.063 3.213 2.492 1.00 0.00 H new ATOM 0 H22 DG A 9 3.378 2.794 2.820 1.00 0.00 H new ATOM 293 P DC A 10 12.074 1.790 -0.150 1.00 0.00 P ATOM 294 OP1 DC A 10 12.976 0.698 -0.570 1.00 0.00 O ATOM 295 OP2 DC A 10 12.503 2.761 0.884 1.00 0.00 O ATOM 296 O5' DC A 10 11.597 2.608 -1.461 1.00 0.00 O ATOM 297 C5' DC A 10 11.193 1.862 -2.623 1.00 0.00 C ATOM 298 C4' DC A 10 10.165 2.584 -3.491 1.00 0.00 C ATOM 299 O4' DC A 10 8.938 2.657 -2.771 1.00 0.00 O ATOM 300 C3' DC A 10 10.522 3.996 -3.947 1.00 0.00 C ATOM 301 O3' DC A 10 10.026 4.179 -5.281 1.00 0.00 O ATOM 302 C2' DC A 10 9.775 4.901 -2.986 1.00 0.00 C ATOM 303 C1' DC A 10 8.653 4.014 -2.437 1.00 0.00 C ATOM 304 N1 DC A 10 8.470 4.090 -0.969 1.00 0.00 N ATOM 305 C2 DC A 10 7.174 4.257 -0.507 1.00 0.00 C ATOM 306 O2 DC A 10 6.242 4.326 -1.303 1.00 0.00 O ATOM 307 N3 DC A 10 6.971 4.352 0.833 1.00 0.00 N ATOM 308 C4 DC A 10 7.996 4.291 1.689 1.00 0.00 C ATOM 309 N4 DC A 10 7.756 4.394 2.996 1.00 0.00 N ATOM 310 C5 DC A 10 9.337 4.118 1.223 1.00 0.00 C ATOM 311 C6 DC A 10 9.529 4.018 -0.106 1.00 0.00 C ATOM 0 H5' DC A 10 10.778 0.906 -2.304 1.00 0.00 H new ATOM 0 H5'' DC A 10 12.074 1.642 -3.226 1.00 0.00 H new ATOM 0 H4' DC A 10 10.111 1.991 -4.404 1.00 0.00 H new ATOM 0 H3' DC A 10 11.593 4.197 -3.950 1.00 0.00 H new ATOM 0 H2' DC A 10 10.426 5.260 -2.189 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.377 5.780 -3.493 1.00 0.00 H new ATOM 0 H1' DC A 10 7.732 4.380 -2.891 1.00 0.00 H new ATOM 0 H41 DC A 10 8.528 4.349 3.661 1.00 0.00 H new ATOM 0 H42 DC A 10 6.800 4.518 3.331 1.00 0.00 H new ATOM 0 H5 DC A 10 10.167 4.069 1.913 1.00 0.00 H new ATOM 0 H6 DC A 10 10.527 3.880 -0.494 1.00 0.00 H new ATOM 323 P DG A 11 10.370 5.489 -6.156 1.00 0.00 P ATOM 324 OP1 DG A 11 10.127 5.171 -7.583 1.00 0.00 O ATOM 325 OP2 DG A 11 11.692 5.997 -5.730 1.00 0.00 O ATOM 326 O5' DG A 11 9.243 6.543 -5.678 1.00 0.00 O ATOM 327 C5' DG A 11 7.857 6.209 -5.816 1.00 0.00 C ATOM 328 C4' DG A 11 6.920 7.351 -5.397 1.00 0.00 C ATOM 329 O4' DG A 11 5.682 7.236 -6.099 1.00 0.00 O ATOM 330 C3' DG A 11 6.555 7.406 -3.913 1.00 0.00 C ATOM 331 O3' DG A 11 7.489 8.223 -3.178 1.00 0.00 O ATOM 332 C2' DG A 11 5.178 8.060 -3.902 1.00 0.00 C ATOM 333 C1' DG A 11 4.658 7.872 -5.327 1.00 0.00 C ATOM 334 N9 DG A 11 3.429 7.055 -5.405 1.00 0.00 N ATOM 335 C8 DG A 11 2.145 7.427 -5.121 1.00 0.00 C ATOM 336 N7 DG A 11 1.258 6.485 -5.221 1.00 0.00 N ATOM 337 C5 DG A 11 2.011 5.380 -5.612 1.00 0.00 C ATOM 338 C6 DG A 11 1.591 4.051 -5.881 1.00 0.00 C ATOM 339 O6 DG A 11 0.454 3.586 -5.821 1.00 0.00 O ATOM 340 N1 DG A 11 2.661 3.242 -6.247 1.00 0.00 N ATOM 341 C2 DG A 11 3.973 3.659 -6.342 1.00 0.00 C ATOM 342 N2 DG A 11 4.862 2.734 -6.711 1.00 0.00 N ATOM 343 N3 DG A 11 4.374 4.913 -6.087 1.00 0.00 N ATOM 344 C4 DG A 11 3.344 5.718 -5.729 1.00 0.00 C ATOM 0 H5' DG A 11 7.639 5.328 -5.212 1.00 0.00 H new ATOM 0 H5'' DG A 11 7.655 5.943 -6.853 1.00 0.00 H new ATOM 0 H4' DG A 11 7.486 8.252 -5.632 1.00 0.00 H new ATOM 0 H3' DG A 11 6.572 6.421 -3.447 1.00 0.00 H new ATOM 0 H2' DG A 11 4.519 7.588 -3.173 1.00 0.00 H new ATOM 0 H2'' DG A 11 5.241 9.116 -3.638 1.00 0.00 H new ATOM 0 H1' DG A 11 4.405 8.860 -5.712 1.00 0.00 H new ATOM 0 H8 DG A 11 1.886 8.435 -4.833 1.00 0.00 H new ATOM 0 H1 DG A 11 2.461 2.265 -6.462 1.00 0.00 H new ATOM 0 H21 DG A 11 5.848 2.981 -6.799 1.00 0.00 H new ATOM 0 H22 DG A 11 4.555 1.781 -6.905 1.00 0.00 H new ATOM 356 P DG A 12 7.876 7.829 -1.659 1.00 0.00 P ATOM 357 OP1 DG A 12 8.869 8.812 -1.170 1.00 0.00 O ATOM 358 OP2 DG A 12 8.181 6.398 -1.608 1.00 0.00 O ATOM 359 O5' DG A 12 6.502 8.065 -0.858 1.00 0.00 O ATOM 360 C5' DG A 12 5.956 9.369 -0.691 1.00 0.00 C ATOM 361 C4' DG A 12 4.550 9.308 -0.099 1.00 0.00 C ATOM 362 O4' DG A 12 3.688 8.617 -0.995 1.00 0.00 O ATOM 363 C3' DG A 12 4.420 8.600 1.240 1.00 0.00 C ATOM 364 O3' DG A 12 4.705 9.520 2.308 1.00 0.00 O ATOM 365 C2' DG A 12 2.958 8.165 1.245 1.00 0.00 C ATOM 366 C1' DG A 12 2.647 7.972 -0.249 1.00 0.00 C ATOM 367 N9 DG A 12 2.609 6.557 -0.680 1.00 0.00 N ATOM 368 C8 DG A 12 3.635 5.752 -1.092 1.00 0.00 C ATOM 369 N7 DG A 12 3.302 4.521 -1.356 1.00 0.00 N ATOM 370 C5 DG A 12 1.931 4.500 -1.099 1.00 0.00 C ATOM 371 C6 DG A 12 0.999 3.431 -1.210 1.00 0.00 C ATOM 372 O6 DG A 12 1.205 2.273 -1.561 1.00 0.00 O ATOM 373 N1 DG A 12 -0.283 3.832 -0.861 1.00 0.00 N ATOM 374 C2 DG A 12 -0.631 5.104 -0.454 1.00 0.00 C ATOM 375 N2 DG A 12 -1.917 5.300 -0.162 1.00 0.00 N ATOM 376 N3 DG A 12 0.242 6.113 -0.347 1.00 0.00 N ATOM 377 C4 DG A 12 1.499 5.741 -0.685 1.00 0.00 C ATOM 0 H5' DG A 12 5.926 9.879 -1.654 1.00 0.00 H new ATOM 0 H5'' DG A 12 6.603 9.956 -0.039 1.00 0.00 H new ATOM 0 H4' DG A 12 4.287 10.354 0.058 1.00 0.00 H new ATOM 0 H3' DG A 12 5.107 7.765 1.377 1.00 0.00 H new ATOM 0 H2' DG A 12 2.813 7.244 1.809 1.00 0.00 H new ATOM 0 H2'' DG A 12 2.314 8.920 1.697 1.00 0.00 H new ATOM 0 H1' DG A 12 1.656 8.390 -0.424 1.00 0.00 H new ATOM 0 H8 DG A 12 4.649 6.111 -1.191 1.00 0.00 H new ATOM 0 H1 DG A 12 -1.025 3.133 -0.909 1.00 0.00 H new ATOM 0 H21 DG A 12 -2.236 6.219 0.145 1.00 0.00 H new ATOM 0 H22 DG A 12 -2.582 4.531 -0.245 1.00 0.00 H new ATOM 389 P DG A 13 5.181 8.994 3.765 1.00 0.00 P ATOM 390 OP1 DG A 13 5.663 10.155 4.542 1.00 0.00 O ATOM 391 OP2 DG A 13 6.057 7.817 3.569 1.00 0.00 O ATOM 392 O5' DG A 13 3.800 8.488 4.421 1.00 0.00 O ATOM 393 C5' DG A 13 2.758 9.444 4.620 1.00 0.00 C ATOM 394 C4' DG A 13 1.453 8.827 5.121 1.00 0.00 C ATOM 395 O4' DG A 13 0.995 7.869 4.185 1.00 0.00 O ATOM 396 C3' DG A 13 1.479 8.118 6.471 1.00 0.00 C ATOM 397 O3' DG A 13 1.255 9.137 7.462 1.00 0.00 O ATOM 398 C2' DG A 13 0.334 7.114 6.368 1.00 0.00 C ATOM 399 C1' DG A 13 0.182 6.902 4.855 1.00 0.00 C ATOM 400 N9 DG A 13 0.612 5.580 4.376 1.00 0.00 N ATOM 401 C8 DG A 13 1.833 5.202 3.930 1.00 0.00 C ATOM 402 N7 DG A 13 1.927 3.970 3.543 1.00 0.00 N ATOM 403 C5 DG A 13 0.650 3.471 3.756 1.00 0.00 C ATOM 404 C6 DG A 13 0.134 2.171 3.523 1.00 0.00 C ATOM 405 O6 DG A 13 0.717 1.187 3.066 1.00 0.00 O ATOM 406 N1 DG A 13 -1.202 2.086 3.886 1.00 0.00 N ATOM 407 C2 DG A 13 -1.946 3.126 4.409 1.00 0.00 C ATOM 408 N2 DG A 13 -3.199 2.846 4.736 1.00 0.00 N ATOM 409 N3 DG A 13 -1.465 4.354 4.616 1.00 0.00 N ATOM 410 C4 DG A 13 -0.166 4.454 4.272 1.00 0.00 C ATOM 0 H5' DG A 13 2.568 9.964 3.681 1.00 0.00 H new ATOM 0 H5'' DG A 13 3.095 10.193 5.336 1.00 0.00 H new ATOM 0 H4' DG A 13 0.808 9.697 5.244 1.00 0.00 H new ATOM 0 H3' DG A 13 2.402 7.602 6.735 1.00 0.00 H new ATOM 0 H2' DG A 13 0.569 6.182 6.883 1.00 0.00 H new ATOM 0 H2'' DG A 13 -0.582 7.502 6.813 1.00 0.00 H new ATOM 0 H1' DG A 13 -0.883 6.996 4.643 1.00 0.00 H new ATOM 0 H8 DG A 13 2.672 5.882 3.899 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.670 1.189 3.757 1.00 0.00 H new ATOM 0 H21 DG A 13 -3.799 3.573 5.127 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.564 1.904 4.597 1.00 0.00 H new ATOM 422 P DG A 14 1.478 8.966 9.056 1.00 0.00 P ATOM 423 OP1 DG A 14 1.673 10.311 9.644 1.00 0.00 O ATOM 424 OP2 DG A 14 2.494 7.913 9.268 1.00 0.00 O ATOM 425 O5' DG A 14 0.048 8.395 9.544 1.00 0.00 O ATOM 426 C5' DG A 14 -1.088 9.166 9.149 1.00 0.00 C ATOM 427 C4' DG A 14 -2.451 8.706 9.692 1.00 0.00 C ATOM 428 O4' DG A 14 -2.605 7.292 9.515 1.00 0.00 O ATOM 429 C3' DG A 14 -2.687 8.960 11.167 1.00 0.00 C ATOM 430 O3' DG A 14 -3.263 10.297 11.314 1.00 0.00 O ATOM 431 C2' DG A 14 -3.643 7.859 11.611 1.00 0.00 C ATOM 432 C1' DG A 14 -3.448 6.769 10.563 1.00 0.00 C ATOM 433 N9 DG A 14 -2.819 5.550 11.114 1.00 0.00 N ATOM 434 C8 DG A 14 -1.497 5.209 11.172 1.00 0.00 C ATOM 435 N7 DG A 14 -1.243 4.075 11.754 1.00 0.00 N ATOM 436 C5 DG A 14 -2.506 3.614 12.121 1.00 0.00 C ATOM 437 C6 DG A 14 -2.878 2.421 12.800 1.00 0.00 C ATOM 438 O6 DG A 14 -2.150 1.523 13.218 1.00 0.00 O ATOM 439 N1 DG A 14 -4.252 2.341 12.977 1.00 0.00 N ATOM 440 C2 DG A 14 -5.161 3.288 12.555 1.00 0.00 C ATOM 441 N2 DG A 14 -6.442 3.030 12.823 1.00 0.00 N ATOM 442 N3 DG A 14 -4.817 4.412 11.915 1.00 0.00 N ATOM 443 C4 DG A 14 -3.478 4.510 11.732 1.00 0.00 C ATOM 0 H5' DG A 14 -1.137 9.168 8.060 1.00 0.00 H new ATOM 0 H5'' DG A 14 -0.926 10.197 9.462 1.00 0.00 H new ATOM 0 H4' DG A 14 -3.165 9.301 9.123 1.00 0.00 H new ATOM 0 H3' DG A 14 -1.783 8.935 11.775 1.00 0.00 H new ATOM 0 H2' DG A 14 -3.404 7.500 12.612 1.00 0.00 H new ATOM 0 H2'' DG A 14 -4.675 8.210 11.637 1.00 0.00 H new ATOM 0 H1' DG A 14 -4.433 6.487 10.190 1.00 0.00 H new ATOM 0 H8 DG A 14 -0.719 5.837 10.763 1.00 0.00 H new ATOM 0 H1 DG A 14 -4.618 1.518 13.456 1.00 0.00 H new ATOM 0 H21 DG A 14 -7.166 3.690 12.538 1.00 0.00 H new ATOM 0 H22 DG A 14 -6.698 2.173 13.313 1.00 0.00 H new ATOM 455 P DC A 15 -4.618 10.818 10.533 1.00 0.00 P ATOM 456 OP1 DC A 15 -4.883 12.205 10.975 1.00 0.00 O ATOM 457 OP2 DC A 15 -5.689 9.808 10.645 1.00 0.00 O ATOM 458 O5' DC A 15 -4.147 10.881 8.982 1.00 0.00 O ATOM 459 C5' DC A 15 -3.066 11.740 8.624 1.00 0.00 C ATOM 460 C4' DC A 15 -2.566 11.559 7.183 1.00 0.00 C ATOM 461 O4' DC A 15 -2.258 10.157 7.004 1.00 0.00 O ATOM 462 C3' DC A 15 -3.553 11.924 6.071 1.00 0.00 C ATOM 463 O3' DC A 15 -2.823 12.625 5.051 1.00 0.00 O ATOM 464 C2' DC A 15 -4.073 10.626 5.503 1.00 0.00 C ATOM 465 C1' DC A 15 -3.055 9.597 5.938 1.00 0.00 C ATOM 466 N1 DC A 15 -3.663 8.315 6.384 1.00 0.00 N ATOM 467 C2 DC A 15 -3.182 7.146 5.816 1.00 0.00 C ATOM 468 O2 DC A 15 -2.334 7.200 4.938 1.00 0.00 O ATOM 469 N3 DC A 15 -3.717 5.959 6.216 1.00 0.00 N ATOM 470 C4 DC A 15 -4.689 5.918 7.135 1.00 0.00 C ATOM 471 N4 DC A 15 -5.192 4.737 7.504 1.00 0.00 N ATOM 472 C5 DC A 15 -5.193 7.120 7.721 1.00 0.00 C ATOM 473 C6 DC A 15 -4.653 8.286 7.319 1.00 0.00 C ATOM 0 H5' DC A 15 -2.236 11.565 9.309 1.00 0.00 H new ATOM 0 H5'' DC A 15 -3.379 12.775 8.760 1.00 0.00 H new ATOM 0 H4' DC A 15 -1.722 12.242 7.085 1.00 0.00 H new ATOM 0 H3' DC A 15 -4.373 12.543 6.436 1.00 0.00 H new ATOM 0 H2' DC A 15 -5.065 10.392 5.888 1.00 0.00 H new ATOM 0 H2'' DC A 15 -4.155 10.671 4.417 1.00 0.00 H new ATOM 0 H1' DC A 15 -2.441 9.358 5.070 1.00 0.00 H new ATOM 0 H41 DC A 15 -5.933 4.694 8.204 1.00 0.00 H new ATOM 0 H42 DC A 15 -4.835 3.878 7.086 1.00 0.00 H new ATOM 0 H5 DC A 15 -5.980 7.094 8.461 1.00 0.00 H new ATOM 0 H6 DC A 15 -5.010 9.212 7.744 1.00 0.00 H new ATOM 485 P DG A 16 -3.571 13.230 3.760 1.00 0.00 P ATOM 486 OP1 DG A 16 -2.787 14.385 3.266 1.00 0.00 O ATOM 487 OP2 DG A 16 -5.004 13.391 4.086 1.00 0.00 O ATOM 488 O5' DG A 16 -3.430 12.034 2.690 1.00 0.00 O ATOM 489 C5' DG A 16 -2.122 11.628 2.254 1.00 0.00 C ATOM 490 C4' DG A 16 -2.171 10.431 1.306 1.00 0.00 C ATOM 491 O4' DG A 16 -2.604 9.272 2.024 1.00 0.00 O ATOM 492 C3' DG A 16 -3.113 10.625 0.119 1.00 0.00 C ATOM 493 O3' DG A 16 -2.557 10.055 -1.077 1.00 0.00 O ATOM 494 C2' DG A 16 -4.342 9.835 0.530 1.00 0.00 C ATOM 495 C1' DG A 16 -3.744 8.719 1.377 1.00 0.00 C ATOM 496 N9 DG A 16 -4.632 8.185 2.431 1.00 0.00 N ATOM 497 C8 DG A 16 -5.503 8.844 3.255 1.00 0.00 C ATOM 498 N7 DG A 16 -6.123 8.095 4.115 1.00 0.00 N ATOM 499 C5 DG A 16 -5.629 6.823 3.845 1.00 0.00 C ATOM 500 C6 DG A 16 -5.931 5.580 4.467 1.00 0.00 C ATOM 501 O6 DG A 16 -6.701 5.365 5.402 1.00 0.00 O ATOM 502 N1 DG A 16 -5.213 4.536 3.898 1.00 0.00 N ATOM 503 C2 DG A 16 -4.313 4.669 2.855 1.00 0.00 C ATOM 504 N2 DG A 16 -3.716 3.553 2.434 1.00 0.00 N ATOM 505 N3 DG A 16 -4.028 5.837 2.270 1.00 0.00 N ATOM 506 C4 DG A 16 -4.718 6.866 2.814 1.00 0.00 C ATOM 0 H5' DG A 16 -1.514 11.376 3.123 1.00 0.00 H new ATOM 0 H5'' DG A 16 -1.632 12.464 1.755 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.161 10.317 0.913 1.00 0.00 H new ATOM 0 H3' DG A 16 -3.308 11.675 -0.098 1.00 0.00 H new ATOM 0 H2' DG A 16 -5.045 10.444 1.098 1.00 0.00 H new ATOM 0 H2'' DG A 16 -4.882 9.445 -0.333 1.00 0.00 H new ATOM 0 H1' DG A 16 -3.533 7.886 0.706 1.00 0.00 H new ATOM 0 H8 DG A 16 -5.663 9.910 3.194 1.00 0.00 H new ATOM 0 H1 DG A 16 -5.360 3.601 4.277 1.00 0.00 H new ATOM 0 H21 DG A 16 -3.043 3.592 1.668 1.00 0.00 H new ATOM 0 H22 DG A 16 -3.932 2.660 2.878 1.00 0.00 H new ATOM 518 P DG A 17 -3.230 10.411 -2.499 1.00 0.00 P ATOM 519 OP1 DG A 17 -2.259 10.088 -3.571 1.00 0.00 O ATOM 520 OP2 DG A 17 -3.805 11.772 -2.412 1.00 0.00 O ATOM 521 O5' DG A 17 -4.444 9.357 -2.579 1.00 0.00 O ATOM 522 C5' DG A 17 -5.718 9.753 -3.088 1.00 0.00 C ATOM 523 C4' DG A 17 -6.673 8.567 -3.202 1.00 0.00 C ATOM 524 O4' DG A 17 -6.192 7.623 -4.146 1.00 0.00 O ATOM 525 C3' DG A 17 -6.906 7.781 -1.915 1.00 0.00 C ATOM 526 O3' DG A 17 -7.982 8.348 -1.142 1.00 0.00 O ATOM 527 C2' DG A 17 -7.280 6.389 -2.416 1.00 0.00 C ATOM 528 C1' DG A 17 -6.891 6.409 -3.896 1.00 0.00 C ATOM 529 N9 DG A 17 -6.041 5.278 -4.317 1.00 0.00 N ATOM 530 C8 DG A 17 -6.417 3.993 -4.583 1.00 0.00 C ATOM 531 N7 DG A 17 -5.454 3.192 -4.913 1.00 0.00 N ATOM 532 C5 DG A 17 -4.328 4.004 -4.869 1.00 0.00 C ATOM 533 C6 DG A 17 -2.971 3.682 -5.142 1.00 0.00 C ATOM 534 O6 DG A 17 -2.496 2.595 -5.472 1.00 0.00 O ATOM 535 N1 DG A 17 -2.146 4.787 -4.988 1.00 0.00 N ATOM 536 C2 DG A 17 -2.570 6.047 -4.616 1.00 0.00 C ATOM 537 N2 DG A 17 -1.625 6.983 -4.522 1.00 0.00 N ATOM 538 N3 DG A 17 -3.850 6.354 -4.357 1.00 0.00 N ATOM 539 C4 DG A 17 -4.672 5.289 -4.504 1.00 0.00 C ATOM 0 H5' DG A 17 -5.591 10.214 -4.068 1.00 0.00 H new ATOM 0 H5'' DG A 17 -6.153 10.509 -2.434 1.00 0.00 H new ATOM 0 H4' DG A 17 -7.613 9.034 -3.495 1.00 0.00 H new ATOM 0 H3' DG A 17 -6.037 7.785 -1.257 1.00 0.00 H new ATOM 0 H2' DG A 17 -6.742 5.612 -1.873 1.00 0.00 H new ATOM 0 H2'' DG A 17 -8.344 6.191 -2.286 1.00 0.00 H new ATOM 0 H1' DG A 17 -7.814 6.325 -4.470 1.00 0.00 H new ATOM 0 H8 DG A 17 -7.445 3.667 -4.523 1.00 0.00 H new ATOM 0 H1 DG A 17 -1.149 4.658 -5.163 1.00 0.00 H new ATOM 0 H21 DG A 17 -1.875 7.934 -4.251 1.00 0.00 H new ATOM 0 H22 DG A 17 -0.653 6.748 -4.721 1.00 0.00 H new ATOM 551 P DG A 18 -7.929 8.254 0.469 1.00 0.00 P ATOM 552 OP1 DG A 18 -9.070 9.021 1.017 1.00 0.00 O ATOM 553 OP2 DG A 18 -6.561 8.561 0.904 1.00 0.00 O ATOM 554 O5' DG A 18 -8.189 6.690 0.742 1.00 0.00 O ATOM 555 C5' DG A 18 -9.445 6.093 0.431 1.00 0.00 C ATOM 556 C4' DG A 18 -9.370 4.569 0.508 1.00 0.00 C ATOM 557 O4' DG A 18 -8.402 4.112 -0.418 1.00 0.00 O ATOM 558 C3' DG A 18 -8.968 3.962 1.844 1.00 0.00 C ATOM 559 O3' DG A 18 -10.127 3.797 2.678 1.00 0.00 O ATOM 560 C2' DG A 18 -8.370 2.615 1.451 1.00 0.00 C ATOM 561 C1' DG A 18 -7.923 2.831 -0.002 1.00 0.00 C ATOM 562 N9 DG A 18 -6.460 2.830 -0.188 1.00 0.00 N ATOM 563 C8 DG A 18 -5.572 3.865 -0.097 1.00 0.00 C ATOM 564 N7 DG A 18 -4.329 3.545 -0.311 1.00 0.00 N ATOM 565 C5 DG A 18 -4.394 2.177 -0.570 1.00 0.00 C ATOM 566 C6 DG A 18 -3.354 1.259 -0.887 1.00 0.00 C ATOM 567 O6 DG A 18 -2.148 1.481 -0.997 1.00 0.00 O ATOM 568 N1 DG A 18 -3.853 -0.026 -1.080 1.00 0.00 N ATOM 569 C2 DG A 18 -5.186 -0.380 -0.976 1.00 0.00 C ATOM 570 N2 DG A 18 -5.481 -1.659 -1.188 1.00 0.00 N ATOM 571 N3 DG A 18 -6.159 0.481 -0.678 1.00 0.00 N ATOM 572 C4 DG A 18 -5.694 1.734 -0.491 1.00 0.00 C ATOM 0 H5' DG A 18 -9.755 6.394 -0.570 1.00 0.00 H new ATOM 0 H5'' DG A 18 -10.204 6.457 1.123 1.00 0.00 H new ATOM 0 H4' DG A 18 -10.395 4.255 0.310 1.00 0.00 H new ATOM 0 H3' DG A 18 -8.272 4.577 2.414 1.00 0.00 H new ATOM 0 H2' DG A 18 -7.531 2.346 2.093 1.00 0.00 H new ATOM 0 H2'' DG A 18 -9.103 1.812 1.530 1.00 0.00 H new ATOM 0 H1' DG A 18 -8.325 2.001 -0.584 1.00 0.00 H new ATOM 0 H8 DG A 18 -5.879 4.874 0.135 1.00 0.00 H new ATOM 0 H1 DG A 18 -3.186 -0.761 -1.316 1.00 0.00 H new ATOM 0 H21 DG A 18 -6.448 -1.977 -1.124 1.00 0.00 H new ATOM 0 H22 DG A 18 -4.740 -2.323 -1.414 1.00 0.00 H new ATOM 584 P DG A 19 -9.965 3.630 4.274 1.00 0.00 P ATOM 585 OP1 DG A 19 -11.303 3.766 4.893 1.00 0.00 O ATOM 586 OP2 DG A 19 -8.848 4.489 4.721 1.00 0.00 O ATOM 587 O5' DG A 19 -9.500 2.091 4.405 1.00 0.00 O ATOM 588 C5' DG A 19 -10.392 1.048 3.990 1.00 0.00 C ATOM 589 C4' DG A 19 -9.743 -0.341 4.039 1.00 0.00 C ATOM 590 O4' DG A 19 -8.590 -0.352 3.213 1.00 0.00 O ATOM 591 C3' DG A 19 -9.251 -0.803 5.398 1.00 0.00 C ATOM 592 O3' DG A 19 -10.313 -1.423 6.140 1.00 0.00 O ATOM 593 C2' DG A 19 -8.204 -1.856 5.022 1.00 0.00 C ATOM 594 C1' DG A 19 -7.746 -1.435 3.625 1.00 0.00 C ATOM 595 N9 DG A 19 -6.349 -0.965 3.584 1.00 0.00 N ATOM 596 C8 DG A 19 -5.860 0.279 3.844 1.00 0.00 C ATOM 597 N7 DG A 19 -4.572 0.390 3.768 1.00 0.00 N ATOM 598 C5 DG A 19 -4.157 -0.890 3.425 1.00 0.00 C ATOM 599 C6 DG A 19 -2.848 -1.383 3.189 1.00 0.00 C ATOM 600 O6 DG A 19 -1.780 -0.774 3.256 1.00 0.00 O ATOM 601 N1 DG A 19 -2.865 -2.730 2.856 1.00 0.00 N ATOM 602 C2 DG A 19 -3.997 -3.512 2.766 1.00 0.00 C ATOM 603 N2 DG A 19 -3.805 -4.791 2.431 1.00 0.00 N ATOM 604 N3 DG A 19 -5.234 -3.050 2.992 1.00 0.00 N ATOM 605 C4 DG A 19 -5.237 -1.734 3.313 1.00 0.00 C ATOM 0 H5' DG A 19 -10.733 1.250 2.974 1.00 0.00 H new ATOM 0 H5'' DG A 19 -11.275 1.055 4.629 1.00 0.00 H new ATOM 0 H4' DG A 19 -10.545 -1.008 3.723 1.00 0.00 H new ATOM 0 H3' DG A 19 -8.872 0.008 6.020 1.00 0.00 H new ATOM 0 H2' DG A 19 -7.374 -1.865 5.729 1.00 0.00 H new ATOM 0 H2'' DG A 19 -8.630 -2.859 5.018 1.00 0.00 H new ATOM 0 H1' DG A 19 -7.811 -2.306 2.973 1.00 0.00 H new ATOM 0 H8 DG A 19 -6.500 1.112 4.095 1.00 0.00 H new ATOM 0 H1 DG A 19 -1.969 -3.177 2.662 1.00 0.00 H new ATOM 0 H21 DG A 19 -4.602 -5.422 2.348 1.00 0.00 H new ATOM 0 H22 DG A 19 -2.861 -5.137 2.258 1.00 0.00 H new ATOM 617 P DT A 20 -10.340 -1.327 7.753 1.00 0.00 P ATOM 618 OP1 DT A 20 -11.573 -1.994 8.228 1.00 0.00 O ATOM 619 OP2 DT A 20 -10.069 0.074 8.137 1.00 0.00 O ATOM 620 O5' DT A 20 -9.077 -2.230 8.198 1.00 0.00 O ATOM 621 C5' DT A 20 -9.030 -3.627 7.904 1.00 0.00 C ATOM 622 C4' DT A 20 -7.682 -4.241 8.270 1.00 0.00 C ATOM 623 O4' DT A 20 -6.670 -3.634 7.463 1.00 0.00 O ATOM 624 C3' DT A 20 -7.276 -4.062 9.729 1.00 0.00 C ATOM 625 O3' DT A 20 -6.655 -5.249 10.226 1.00 0.00 O ATOM 626 C2' DT A 20 -6.288 -2.899 9.722 1.00 0.00 C ATOM 627 C1' DT A 20 -5.841 -2.787 8.265 1.00 0.00 C ATOM 628 N1 DT A 20 -5.884 -1.417 7.686 1.00 0.00 N ATOM 629 C2 DT A 20 -4.838 -1.066 6.856 1.00 0.00 C ATOM 630 O2 DT A 20 -3.932 -1.847 6.588 1.00 0.00 O ATOM 631 N3 DT A 20 -4.868 0.216 6.343 1.00 0.00 N ATOM 632 C4 DT A 20 -5.838 1.168 6.585 1.00 0.00 C ATOM 633 O4 DT A 20 -5.772 2.278 6.057 1.00 0.00 O ATOM 634 C5 DT A 20 -6.893 0.720 7.461 1.00 0.00 C ATOM 635 C7 DT A 20 -8.031 1.675 7.810 1.00 0.00 C ATOM 636 C6 DT A 20 -6.891 -0.529 7.972 1.00 0.00 C ATOM 0 H5' DT A 20 -9.223 -3.781 6.842 1.00 0.00 H new ATOM 0 H5'' DT A 20 -9.822 -4.140 8.449 1.00 0.00 H new ATOM 0 H4' DT A 20 -7.785 -5.312 8.097 1.00 0.00 H new ATOM 0 H3' DT A 20 -8.133 -3.867 10.374 1.00 0.00 H new ATOM 0 H2' DT A 20 -6.757 -1.977 10.065 1.00 0.00 H new ATOM 0 H2'' DT A 20 -5.443 -3.092 10.383 1.00 0.00 H new ATOM 0 HO3' DT A 20 -6.399 -5.117 11.163 1.00 0.00 H new ATOM 0 H1' DT A 20 -4.792 -3.085 8.260 1.00 0.00 H new ATOM 0 H3 DT A 20 -4.101 0.485 5.727 1.00 0.00 H new ATOM 0 H71 DT A 20 -7.663 2.701 7.794 1.00 0.00 H new ATOM 0 H72 DT A 20 -8.834 1.566 7.081 1.00 0.00 H new ATOM 0 H73 DT A 20 -8.410 1.441 8.805 1.00 0.00 H new ATOM 0 H6 DT A 20 -7.699 -0.836 8.620 1.00 0.00 H new TER 650 DT A 20 HETATM 651 O4 LOC A 101 7.082 4.933 7.150 1.00 0.00 O HETATM 652 C12 LOC A 101 5.894 4.655 6.996 1.00 0.00 C HETATM 653 C13 LOC A 101 4.794 5.599 7.484 1.00 0.00 C HETATM 654 N1 LOC A 101 5.458 3.561 6.357 1.00 0.00 N HETATM 655 C11 LOC A 101 4.232 2.854 6.752 1.00 0.00 C HETATM 656 C14 LOC A 101 4.430 1.487 6.588 1.00 0.00 C HETATM 657 C15 LOC A 101 5.809 1.379 6.727 1.00 0.00 C HETATM 658 C10 LOC A 101 3.097 3.311 5.849 1.00 0.00 C HETATM 659 C9 LOC A 101 1.752 3.056 6.511 1.00 0.00 C HETATM 660 C8 LOC A 101 1.345 1.752 6.252 1.00 0.00 C HETATM 661 C7 LOC A 101 -0.039 1.646 6.346 1.00 0.00 C HETATM 662 C5 LOC A 101 -0.634 0.392 6.392 1.00 0.00 C HETATM 663 C3 LOC A 101 0.152 -0.752 6.367 1.00 0.00 C HETATM 664 C1 LOC A 101 1.529 -0.635 6.233 1.00 0.00 C HETATM 665 O1 LOC A 101 2.277 -1.702 6.620 1.00 0.00 O HETATM 666 C2 LOC A 101 2.235 -1.816 8.044 1.00 0.00 C HETATM 667 O2 LOC A 101 -0.424 -1.903 5.929 1.00 0.00 O HETATM 668 C4 LOC A 101 -1.337 -2.405 6.910 1.00 0.00 C HETATM 669 O3 LOC A 101 -1.980 0.224 6.483 1.00 0.00 O HETATM 670 C6 LOC A 101 -2.454 0.895 7.653 1.00 0.00 C HETATM 671 C22 LOC A 101 2.138 0.613 6.165 1.00 0.00 C HETATM 672 C21 LOC A 101 3.526 0.548 6.111 1.00 0.00 C HETATM 673 C20 LOC A 101 3.792 -0.526 5.266 1.00 0.00 C HETATM 674 C19 LOC A 101 5.012 -1.168 5.098 1.00 0.00 C HETATM 675 C17 LOC A 101 6.275 -0.733 5.484 1.00 0.00 C HETATM 676 C16 LOC A 101 6.646 0.416 6.175 1.00 0.00 C HETATM 677 O5 LOC A 101 7.849 0.588 6.371 1.00 0.00 O HETATM 678 O6 LOC A 101 7.329 -1.551 5.217 1.00 0.00 O HETATM 679 C18 LOC A 101 7.605 -2.349 6.371 1.00 0.00 C HETATM 0 H18B LOC A 101 7.848 -1.700 7.212 1.00 0.00 H new HETATM 0 H18A LOC A 101 6.729 -2.949 6.617 1.00 0.00 H new HETATM 0 H13B LOC A 101 4.884 5.736 8.562 1.00 0.00 H new HETATM 0 H13A LOC A 101 4.895 6.563 6.986 1.00 0.00 H new HETATM 0 H10A LOC A 101 3.205 4.373 5.629 1.00 0.00 H new HETATM 0 HN1 LOC A 101 5.997 3.206 5.567 1.00 0.00 H new HETATM 0 H9A LOC A 101 1.828 3.217 7.586 1.00 0.00 H new HETATM 0 H9 LOC A 101 1.011 3.761 6.135 1.00 0.00 H new HETATM 0 H7 LOC A 101 -0.655 2.545 6.383 1.00 0.00 H new HETATM 0 H6B LOC A 101 -1.971 0.474 8.535 1.00 0.00 H new HETATM 0 H6A LOC A 101 -2.220 1.957 7.583 1.00 0.00 H new HETATM 0 H6 LOC A 101 -3.533 0.766 7.734 1.00 0.00 H new HETATM 0 H4B LOC A 101 -0.800 -2.606 7.837 1.00 0.00 H new HETATM 0 H4A LOC A 101 -2.116 -1.665 7.095 1.00 0.00 H new HETATM 0 H4 LOC A 101 -1.791 -3.327 6.546 1.00 0.00 H new HETATM 0 H2B LOC A 101 2.635 -0.907 8.494 1.00 0.00 H new HETATM 0 H2A LOC A 101 1.204 -1.957 8.367 1.00 0.00 H new HETATM 0 H20 LOC A 101 2.957 -0.902 4.675 1.00 0.00 H new HETATM 0 H2 LOC A 101 2.834 -2.671 8.358 1.00 0.00 H new HETATM 0 H19 LOC A 101 4.975 -2.137 4.600 1.00 0.00 H new HETATM 0 H18 LOC A 101 8.449 -3.007 6.165 1.00 0.00 H new HETATM 0 H15 LOC A 101 6.291 2.139 7.342 1.00 0.00 H new HETATM 0 H13 LOC A 101 3.818 5.171 7.253 1.00 0.00 H new HETATM 0 H11 LOC A 101 3.988 3.067 7.793 1.00 0.00 H new HETATM 0 H10 LOC A 101 3.146 2.782 4.897 1.00 0.00 H new