USER MOD reduce.3.24.130724 H: found=0, std=0, add=238, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 238 hydrogens (148 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 10 DG O3' : rot 180:sc= 0 USER MOD Single : B 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 5CM A 1 -11.870 -1.440 -13.931 1.00 0.00 N HETATM 2 C2 5CM A 1 -10.691 -1.128 -14.619 1.00 0.00 C HETATM 3 N3 5CM A 1 -10.178 0.120 -14.522 1.00 0.00 N HETATM 4 C4 5CM A 1 -10.795 1.038 -13.775 1.00 0.00 C HETATM 5 C5 5CM A 1 -11.994 0.747 -13.060 1.00 0.00 C HETATM 6 C5A 5CM A 1 -12.642 1.743 -12.435 1.00 0.00 C HETATM 7 C6 5CM A 1 -12.493 -0.492 -13.168 1.00 0.00 C HETATM 8 O2 5CM A 1 -10.144 -2.006 -15.302 1.00 0.00 O HETATM 9 N4 5CM A 1 -10.253 2.255 -13.713 1.00 0.00 N HETATM 10 C1' 5CM A 1 -12.420 -2.802 -14.052 1.00 0.00 C HETATM 11 C2' 5CM A 1 -13.049 -3.357 -12.786 1.00 0.00 C HETATM 12 C3' 5CM A 1 -14.148 -4.260 -13.316 1.00 0.00 C HETATM 13 C4' 5CM A 1 -14.569 -3.586 -14.623 1.00 0.00 C HETATM 14 O4' 5CM A 1 -13.447 -2.765 -15.029 1.00 0.00 O HETATM 15 O3' 5CM A 1 -13.644 -5.575 -13.575 1.00 0.00 O HETATM 16 C5' 5CM A 1 -15.797 -2.711 -14.525 1.00 0.00 C HETATM 17 O5' 5CM A 1 -16.991 -3.501 -14.532 1.00 0.00 O HETATM 0 HN42 5CM A 1 -10.696 2.983 -13.152 1.00 0.00 H new HETATM 0 HN41 5CM A 1 -9.395 2.458 -14.226 1.00 0.00 H new HETATM 0 H5A3 5CM A 1 -11.985 2.194 -11.691 1.00 0.00 H new HETATM 0 H5A2 5CM A 1 -12.937 2.498 -13.163 1.00 0.00 H new HETATM 0 H5A1 5CM A 1 -13.530 1.347 -11.943 1.00 0.00 H new HETATM 0 H5'' 5CM A 1 -15.754 -2.119 -13.611 1.00 0.00 H new HETATM 0 H2'' 5CM A 1 -12.327 -3.910 -12.186 1.00 0.00 H new HETATM 0 H6 5CM A 1 -13.411 -0.748 -12.639 1.00 0.00 H new HETATM 0 H5' 5CM A 1 -15.816 -2.010 -15.359 1.00 0.00 H new HETATM 0 H4' 5CM A 1 -14.833 -4.370 -15.333 1.00 0.00 H new HETATM 0 H3' 5CM A 1 -14.971 -4.380 -12.611 1.00 0.00 H new HETATM 0 H2' 5CM A 1 -13.448 -2.564 -12.153 1.00 0.00 H new HETATM 0 H1' 5CM A 1 -11.577 -3.446 -14.302 1.00 0.00 H new ATOM 31 P DG A 2 -13.544 -6.643 -12.376 1.00 0.00 P ATOM 32 OP1 DG A 2 -13.796 -7.985 -12.962 1.00 0.00 O ATOM 33 OP2 DG A 2 -14.380 -6.171 -11.242 1.00 0.00 O ATOM 34 O5' DG A 2 -12.016 -6.577 -11.930 1.00 0.00 O ATOM 35 C5' DG A 2 -10.987 -7.139 -12.747 1.00 0.00 C ATOM 36 C4' DG A 2 -9.626 -6.746 -12.220 1.00 0.00 C ATOM 37 O4' DG A 2 -9.452 -5.321 -12.405 1.00 0.00 O ATOM 38 C3' DG A 2 -9.403 -7.020 -10.728 1.00 0.00 C ATOM 39 O3' DG A 2 -8.206 -7.782 -10.542 1.00 0.00 O ATOM 40 C2' DG A 2 -9.254 -5.639 -10.109 1.00 0.00 C ATOM 41 C1' DG A 2 -8.799 -4.788 -11.274 1.00 0.00 C ATOM 42 N9 DG A 2 -9.150 -3.375 -11.173 1.00 0.00 N ATOM 43 C8 DG A 2 -10.344 -2.844 -10.750 1.00 0.00 C ATOM 44 N7 DG A 2 -10.361 -1.541 -10.762 1.00 0.00 N ATOM 45 C5 DG A 2 -9.100 -1.187 -11.223 1.00 0.00 C ATOM 46 C6 DG A 2 -8.530 0.091 -11.449 1.00 0.00 C ATOM 47 O6 DG A 2 -9.042 1.202 -11.279 1.00 0.00 O ATOM 48 N1 DG A 2 -7.225 -0.006 -11.923 1.00 0.00 N ATOM 49 C2 DG A 2 -6.556 -1.184 -12.146 1.00 0.00 C ATOM 50 N2 DG A 2 -5.302 -1.077 -12.599 1.00 0.00 N ATOM 51 N3 DG A 2 -7.076 -2.381 -11.940 1.00 0.00 N ATOM 52 C4 DG A 2 -8.342 -2.308 -11.483 1.00 0.00 C ATOM 0 H5' DG A 2 -11.100 -6.794 -13.775 1.00 0.00 H new ATOM 0 H5'' DG A 2 -11.079 -8.225 -12.763 1.00 0.00 H new ATOM 0 H4' DG A 2 -8.915 -7.357 -12.776 1.00 0.00 H new ATOM 0 H3' DG A 2 -10.216 -7.591 -10.279 1.00 0.00 H new ATOM 0 H2' DG A 2 -10.195 -5.281 -9.691 1.00 0.00 H new ATOM 0 H2'' DG A 2 -8.525 -5.637 -9.299 1.00 0.00 H new ATOM 0 H1' DG A 2 -7.710 -4.818 -11.315 1.00 0.00 H new ATOM 0 H8 DG A 2 -11.185 -3.446 -10.439 1.00 0.00 H new ATOM 0 H1 DG A 2 -6.728 0.863 -12.119 1.00 0.00 H new ATOM 0 H21 DG A 2 -4.753 -1.917 -12.784 1.00 0.00 H new ATOM 0 H22 DG A 2 -4.895 -0.156 -12.760 1.00 0.00 H new HETATM 64 N1 5CM A 3 -5.168 -4.361 -8.313 1.00 0.00 N HETATM 65 C2 5CM A 3 -4.864 -3.005 -8.477 1.00 0.00 C HETATM 66 N3 5CM A 3 -5.835 -2.082 -8.289 1.00 0.00 N HETATM 67 C4 5CM A 3 -7.066 -2.470 -7.947 1.00 0.00 C HETATM 68 C5 5CM A 3 -7.404 -3.844 -7.768 1.00 0.00 C HETATM 69 C5A 5CM A 3 -8.576 -4.152 -7.189 1.00 0.00 C HETATM 70 C6 5CM A 3 -6.433 -4.747 -7.963 1.00 0.00 C HETATM 71 O2 5CM A 3 -3.709 -2.681 -8.790 1.00 0.00 O HETATM 72 N4 5CM A 3 -7.989 -1.523 -7.772 1.00 0.00 N HETATM 73 C1' 5CM A 3 -4.106 -5.359 -8.526 1.00 0.00 C HETATM 74 C2' 5CM A 3 -4.056 -6.471 -7.490 1.00 0.00 C HETATM 75 C3' 5CM A 3 -3.559 -7.662 -8.288 1.00 0.00 C HETATM 76 C4' 5CM A 3 -4.113 -7.410 -9.690 1.00 0.00 C HETATM 77 O4' 5CM A 3 -4.345 -5.984 -9.778 1.00 0.00 O HETATM 78 O3' 5CM A 3 -2.129 -7.696 -8.328 1.00 0.00 O HETATM 79 C5' 5CM A 3 -5.400 -8.134 -10.010 1.00 0.00 C HETATM 80 O5' 5CM A 3 -6.305 -8.045 -8.908 1.00 0.00 O HETATM 81 P 5CM A 3 -7.852 -8.380 -9.090 1.00 0.00 P HETATM 82 OP1 5CM A 3 -7.995 -9.855 -9.171 1.00 0.00 O HETATM 83 OP2 5CM A 3 -8.610 -7.625 -8.058 1.00 0.00 O HETATM 0 HN42 5CM A 3 -8.941 -1.781 -7.510 1.00 0.00 H new HETATM 0 HN41 5CM A 3 -7.743 -0.541 -7.900 1.00 0.00 H new HETATM 0 H5A3 5CM A 3 -8.609 -3.728 -6.185 1.00 0.00 H new HETATM 0 H5A2 5CM A 3 -9.394 -3.743 -7.782 1.00 0.00 H new HETATM 0 H5A1 5CM A 3 -8.678 -5.236 -7.129 1.00 0.00 H new HETATM 0 H5'' 5CM A 3 -5.857 -7.702 -10.900 1.00 0.00 H new HETATM 0 H2'' 5CM A 3 -3.383 -6.227 -6.669 1.00 0.00 H new HETATM 0 H6 5CM A 3 -6.655 -5.807 -7.841 1.00 0.00 H new HETATM 0 H5' 5CM A 3 -5.191 -9.180 -10.234 1.00 0.00 H new HETATM 0 H4' 5CM A 3 -3.388 -7.791 -10.409 1.00 0.00 H new HETATM 0 H3' 5CM A 3 -3.876 -8.612 -7.858 1.00 0.00 H new HETATM 0 H2' 5CM A 3 -5.037 -6.659 -7.053 1.00 0.00 H new HETATM 0 H1' 5CM A 3 -3.163 -4.815 -8.464 1.00 0.00 H new ATOM 97 P DG A 4 -1.311 -8.369 -7.118 1.00 0.00 P ATOM 98 OP1 DG A 4 -0.710 -9.624 -7.639 1.00 0.00 O ATOM 99 OP2 DG A 4 -2.185 -8.419 -5.918 1.00 0.00 O ATOM 100 O5' DG A 4 -0.131 -7.339 -6.830 1.00 0.00 O ATOM 101 C5' DG A 4 0.186 -6.303 -7.764 1.00 0.00 C ATOM 102 C4' DG A 4 0.488 -5.017 -7.031 1.00 0.00 C ATOM 103 O4' DG A 4 -0.760 -4.337 -6.760 1.00 0.00 O ATOM 104 C3' DG A 4 1.185 -5.198 -5.677 1.00 0.00 C ATOM 105 O3' DG A 4 2.404 -4.447 -5.642 1.00 0.00 O ATOM 106 C2' DG A 4 0.193 -4.648 -4.662 1.00 0.00 C ATOM 107 C1' DG A 4 -0.675 -3.728 -5.493 1.00 0.00 C ATOM 108 N9 DG A 4 -2.032 -3.542 -4.986 1.00 0.00 N ATOM 109 C8 DG A 4 -2.919 -4.521 -4.608 1.00 0.00 C ATOM 110 N7 DG A 4 -4.058 -4.047 -4.181 1.00 0.00 N ATOM 111 C5 DG A 4 -3.916 -2.670 -4.289 1.00 0.00 C ATOM 112 C6 DG A 4 -4.823 -1.622 -3.974 1.00 0.00 C ATOM 113 O6 DG A 4 -5.968 -1.704 -3.516 1.00 0.00 O ATOM 114 N1 DG A 4 -4.273 -0.373 -4.242 1.00 0.00 N ATOM 115 C2 DG A 4 -3.012 -0.158 -4.741 1.00 0.00 C ATOM 116 N2 DG A 4 -2.659 1.118 -4.928 1.00 0.00 N ATOM 117 N3 DG A 4 -2.157 -1.122 -5.033 1.00 0.00 N ATOM 118 C4 DG A 4 -2.672 -2.344 -4.786 1.00 0.00 C ATOM 0 H5' DG A 4 -0.648 -6.153 -8.449 1.00 0.00 H new ATOM 0 H5'' DG A 4 1.045 -6.597 -8.367 1.00 0.00 H new ATOM 0 H4' DG A 4 1.164 -4.462 -7.681 1.00 0.00 H new ATOM 0 H3' DG A 4 1.449 -6.237 -5.479 1.00 0.00 H new ATOM 0 H2' DG A 4 -0.391 -5.443 -4.198 1.00 0.00 H new ATOM 0 H2'' DG A 4 0.695 -4.110 -3.858 1.00 0.00 H new ATOM 0 H1' DG A 4 -0.223 -2.736 -5.489 1.00 0.00 H new ATOM 0 H8 DG A 4 -2.696 -5.577 -4.659 1.00 0.00 H new ATOM 0 H1 DG A 4 -4.851 0.446 -4.053 1.00 0.00 H new ATOM 0 H21 DG A 4 -1.735 1.343 -5.296 1.00 0.00 H new ATOM 0 H22 DG A 4 -3.314 1.867 -4.702 1.00 0.00 H new HETATM 130 P 0DC A 5 3.645 -4.977 -4.766 1.00 0.00 P HETATM 131 OP1 0DC A 5 4.776 -5.261 -5.685 1.00 0.00 O HETATM 132 OP2 0DC A 5 3.142 -6.050 -3.869 1.00 0.00 O HETATM 133 O5' 0DC A 5 4.040 -3.724 -3.864 1.00 0.00 O HETATM 134 C5' 0DC A 5 3.347 -3.444 -2.644 1.00 0.00 C HETATM 135 C4' 0DC A 5 3.179 -1.952 -2.469 1.00 0.00 C HETATM 136 O4' 0DC A 5 2.101 -1.707 -1.532 1.00 0.00 O HETATM 137 C3' 0DC A 5 2.803 -1.190 -3.739 1.00 0.00 C HETATM 138 O3' 0DC A 5 3.371 0.123 -3.720 1.00 0.00 O HETATM 139 C2' 0DC A 5 1.289 -1.117 -3.666 1.00 0.00 C HETATM 140 C1' 0DC A 5 1.031 -1.026 -2.172 1.00 0.00 C HETATM 141 N1 0DC A 5 -0.228 -1.653 -1.737 1.00 0.00 N HETATM 142 C2 0DC A 5 -1.338 -0.841 -1.483 1.00 0.00 C HETATM 143 O2 0DC A 5 -1.232 0.386 -1.631 1.00 0.00 O HETATM 144 N3 0DC A 5 -2.496 -1.411 -1.082 1.00 0.00 N HETATM 145 C4 0DC A 5 -2.570 -2.735 -0.936 1.00 0.00 C HETATM 146 N4 0DC A 5 -3.730 -3.254 -0.540 1.00 0.00 N HETATM 147 C5 0DC A 5 -1.456 -3.587 -1.191 1.00 0.00 C HETATM 148 C6 0DC A 5 -0.316 -3.009 -1.585 1.00 0.00 C HETATM 0 H5'' 0DC A 5 2.371 -3.929 -2.652 1.00 0.00 H new HETATM 0 H2'' 0DC A 5 0.899 -0.249 -4.198 1.00 0.00 H new HETATM 0 H6 0DC A 5 0.557 -3.629 -1.788 1.00 0.00 H new HETATM 0 H5' 0DC A 5 3.900 -3.856 -1.800 1.00 0.00 H new HETATM 0 H5 0DC A 5 -1.530 -4.668 -1.070 1.00 0.00 H new HETATM 0 H42 0DC A 5 -3.822 -4.262 -0.418 1.00 0.00 H new HETATM 0 H41 0DC A 5 -4.527 -2.643 -0.359 1.00 0.00 H new HETATM 0 H4' 0DC A 5 4.154 -1.598 -2.136 1.00 0.00 H new HETATM 0 H3' 0DC A 5 3.165 -1.667 -4.650 1.00 0.00 H new HETATM 0 H2' 0DC A 5 0.819 -1.997 -4.105 1.00 0.00 H new HETATM 0 H1' 0DC A 5 0.957 0.030 -1.912 1.00 0.00 H new HETATM 160 P 0DG A 6 4.399 0.569 -4.874 1.00 0.00 P HETATM 161 OP1 0DG A 6 4.306 2.044 -5.021 1.00 0.00 O HETATM 162 OP2 0DG A 6 4.168 -0.300 -6.059 1.00 0.00 O HETATM 163 O5' 0DG A 6 5.832 0.218 -4.273 1.00 0.00 O HETATM 164 C5' 0DG A 6 6.234 0.708 -2.991 1.00 0.00 C HETATM 165 C4' 0DG A 6 7.649 0.275 -2.691 1.00 0.00 C HETATM 166 O4' 0DG A 6 7.649 -1.134 -2.360 1.00 0.00 O HETATM 167 C3' 0DG A 6 8.306 0.969 -1.498 1.00 0.00 C HETATM 168 O3' 0DG A 6 9.724 1.045 -1.702 1.00 0.00 O HETATM 169 C2' 0DG A 6 7.949 0.054 -0.342 1.00 0.00 C HETATM 170 C1' 0DG A 6 7.977 -1.323 -0.990 1.00 0.00 C HETATM 171 N9 0DG A 6 7.023 -2.275 -0.431 1.00 0.00 N HETATM 172 C8 0DG A 6 7.184 -3.633 -0.310 1.00 0.00 C HETATM 173 N7 0DG A 6 6.155 -4.228 0.227 1.00 0.00 N HETATM 174 C5 0DG A 6 5.256 -3.200 0.476 1.00 0.00 C HETATM 175 C6 0DG A 6 3.959 -3.230 1.048 1.00 0.00 C HETATM 176 O6 0DG A 6 3.323 -4.205 1.464 1.00 0.00 O HETATM 177 N1 0DG A 6 3.398 -1.959 1.113 1.00 0.00 N HETATM 178 C2 0DG A 6 4.008 -0.807 0.688 1.00 0.00 C HETATM 179 N2 0DG A 6 3.310 0.324 0.842 1.00 0.00 N HETATM 180 N3 0DG A 6 5.215 -0.763 0.153 1.00 0.00 N HETATM 181 C4 0DG A 6 5.778 -1.987 0.077 1.00 0.00 C HETATM 0 H5'' 0DG A 6 6.166 1.796 -2.971 1.00 0.00 H new HETATM 0 H2'' 0DG A 6 8.667 0.133 0.474 1.00 0.00 H new HETATM 0 H8 0DG A 6 8.082 -4.161 -0.631 1.00 0.00 H new HETATM 0 H5' 0DG A 6 5.560 0.332 -2.222 1.00 0.00 H new HETATM 0 H4' 0DG A 6 8.211 0.533 -3.589 1.00 0.00 H new HETATM 0 H3' 0DG A 6 7.976 1.995 -1.334 1.00 0.00 H new HETATM 0 H22 0DG A 6 3.710 1.214 0.545 1.00 0.00 H new HETATM 0 H21 0DG A 6 2.378 0.296 1.256 1.00 0.00 H new HETATM 0 H2' 0DG A 6 6.968 0.288 0.072 1.00 0.00 H new HETATM 0 H1' 0DG A 6 8.967 -1.745 -0.820 1.00 0.00 H new HETATM 0 H1 0DG A 6 2.461 -1.878 1.507 1.00 0.00 H new HETATM 193 N1 5CM A 7 7.523 1.049 3.762 1.00 0.00 N HETATM 194 C2 5CM A 7 6.221 0.763 4.188 1.00 0.00 C HETATM 195 N3 5CM A 7 5.802 -0.523 4.215 1.00 0.00 N HETATM 196 C4 5CM A 7 6.629 -1.501 3.838 1.00 0.00 C HETATM 197 C5 5CM A 7 7.959 -1.237 3.394 1.00 0.00 C HETATM 198 C5A 5CM A 7 8.669 -2.231 2.838 1.00 0.00 C HETATM 199 C6 5CM A 7 8.360 0.040 3.371 1.00 0.00 C HETATM 200 O2 5CM A 7 5.481 1.697 4.528 1.00 0.00 O HETATM 201 N4 5CM A 7 6.175 -2.755 3.892 1.00 0.00 N HETATM 202 C1' 5CM A 7 7.975 2.450 3.746 1.00 0.00 C HETATM 203 C2' 5CM A 7 9.258 2.715 4.505 1.00 0.00 C HETATM 204 C3' 5CM A 7 9.774 3.961 3.809 1.00 0.00 C HETATM 205 C4' 5CM A 7 9.334 3.764 2.357 1.00 0.00 C HETATM 206 O4' 5CM A 7 8.244 2.808 2.402 1.00 0.00 O HETATM 207 O3' 5CM A 7 9.163 5.132 4.363 1.00 0.00 O HETATM 208 C5' 5CM A 7 10.416 3.246 1.438 1.00 0.00 C HETATM 209 O5' 5CM A 7 9.840 2.547 0.331 1.00 0.00 O HETATM 210 P 5CM A 7 10.690 1.479 -0.492 1.00 0.00 P HETATM 211 OP1 5CM A 7 11.866 2.176 -1.071 1.00 0.00 O HETATM 212 OP2 5CM A 7 10.896 0.284 0.367 1.00 0.00 O HETATM 0 HN42 5CM A 7 6.778 -3.528 3.612 1.00 0.00 H new HETATM 0 HN41 5CM A 7 5.225 -2.940 4.213 1.00 0.00 H new HETATM 0 H5A3 5CM A 7 8.777 -3.046 3.554 1.00 0.00 H new HETATM 0 H5A2 5CM A 7 8.152 -2.595 1.950 1.00 0.00 H new HETATM 0 H5A1 5CM A 7 9.655 -1.861 2.558 1.00 0.00 H new HETATM 0 H5'' 5CM A 7 11.022 4.076 1.076 1.00 0.00 H new HETATM 0 H2'' 5CM A 7 9.078 2.884 5.567 1.00 0.00 H new HETATM 0 H6 5CM A 7 9.369 0.280 3.036 1.00 0.00 H new HETATM 0 H5' 5CM A 7 11.082 2.582 1.989 1.00 0.00 H new HETATM 0 H4' 5CM A 7 9.054 4.733 1.944 1.00 0.00 H new HETATM 0 H3' 5CM A 7 10.850 4.096 3.915 1.00 0.00 H new HETATM 0 H2' 5CM A 7 9.958 1.883 4.428 1.00 0.00 H new HETATM 0 H1' 5CM A 7 7.178 3.022 4.222 1.00 0.00 H new ATOM 226 P DG A 8 10.077 6.261 5.053 1.00 0.00 P ATOM 227 OP1 DG A 8 10.319 7.335 4.057 1.00 0.00 O ATOM 228 OP2 DG A 8 11.231 5.581 5.693 1.00 0.00 O ATOM 229 O5' DG A 8 9.156 6.851 6.211 1.00 0.00 O ATOM 230 C5' DG A 8 7.900 7.463 5.915 1.00 0.00 C ATOM 231 C4' DG A 8 7.075 7.601 7.174 1.00 0.00 C ATOM 232 O4' DG A 8 6.434 6.334 7.453 1.00 0.00 O ATOM 233 C3' DG A 8 7.869 7.949 8.432 1.00 0.00 C ATOM 234 O3' DG A 8 7.079 8.750 9.319 1.00 0.00 O ATOM 235 C2' DG A 8 8.162 6.594 9.050 1.00 0.00 C ATOM 236 C1' DG A 8 6.970 5.745 8.630 1.00 0.00 C ATOM 237 N9 DG A 8 7.301 4.357 8.320 1.00 0.00 N ATOM 238 C8 DG A 8 8.412 3.901 7.657 1.00 0.00 C ATOM 239 N7 DG A 8 8.440 2.603 7.527 1.00 0.00 N ATOM 240 C5 DG A 8 7.271 2.173 8.142 1.00 0.00 C ATOM 241 C6 DG A 8 6.751 0.866 8.312 1.00 0.00 C ATOM 242 O6 DG A 8 7.238 -0.209 7.948 1.00 0.00 O ATOM 243 N1 DG A 8 5.536 0.880 8.987 1.00 0.00 N ATOM 244 C2 DG A 8 4.903 2.011 9.444 1.00 0.00 C ATOM 245 N2 DG A 8 3.741 1.819 10.077 1.00 0.00 N ATOM 246 N3 DG A 8 5.376 3.236 9.293 1.00 0.00 N ATOM 247 C4 DG A 8 6.556 3.244 8.636 1.00 0.00 C ATOM 0 H5' DG A 8 7.360 6.864 5.182 1.00 0.00 H new ATOM 0 H5'' DG A 8 8.062 8.444 5.469 1.00 0.00 H new ATOM 0 H4' DG A 8 6.385 8.420 6.971 1.00 0.00 H new ATOM 0 H3' DG A 8 8.770 8.525 8.224 1.00 0.00 H new ATOM 0 H2' DG A 8 9.100 6.179 8.681 1.00 0.00 H new ATOM 0 H2'' DG A 8 8.247 6.658 10.135 1.00 0.00 H new ATOM 0 H1' DG A 8 6.275 5.721 9.470 1.00 0.00 H new ATOM 0 H8 DG A 8 9.187 4.552 7.280 1.00 0.00 H new ATOM 0 H1 DG A 8 5.080 -0.017 9.156 1.00 0.00 H new ATOM 0 H21 DG A 8 3.220 2.617 10.441 1.00 0.00 H new ATOM 0 H22 DG A 8 3.375 0.874 10.196 1.00 0.00 H new HETATM 259 N1 5CM A 9 7.660 4.255 12.344 1.00 0.00 N HETATM 260 C2 5CM A 9 7.310 2.905 12.248 1.00 0.00 C HETATM 261 N3 5CM A 9 8.109 2.059 11.557 1.00 0.00 N HETATM 262 C4 5CM A 9 9.218 2.519 10.974 1.00 0.00 C HETATM 263 C5 5CM A 9 9.599 3.891 11.055 1.00 0.00 C HETATM 264 C5A 5CM A 9 10.782 4.273 10.548 1.00 0.00 C HETATM 265 C6 5CM A 9 8.798 4.716 11.744 1.00 0.00 C HETATM 266 O2 5CM A 9 6.273 2.516 12.800 1.00 0.00 O HETATM 267 N4 5CM A 9 9.973 1.648 10.303 1.00 0.00 N HETATM 268 C1' 5CM A 9 6.782 5.163 13.102 1.00 0.00 C HETATM 269 C2' 5CM A 9 7.442 5.836 14.300 1.00 0.00 C HETATM 270 C3' 5CM A 9 7.002 7.294 14.234 1.00 0.00 C HETATM 271 C4' 5CM A 9 6.035 7.342 13.049 1.00 0.00 C HETATM 272 O4' 5CM A 9 6.377 6.202 12.238 1.00 0.00 O HETATM 273 O3' 5CM A 9 6.324 7.667 15.440 1.00 0.00 O HETATM 274 C5' 5CM A 9 6.113 8.592 12.203 1.00 0.00 C HETATM 275 O5' 5CM A 9 7.464 8.841 11.812 1.00 0.00 O HETATM 276 P 5CM A 9 7.799 9.622 10.465 1.00 0.00 P HETATM 277 OP1 5CM A 9 7.115 10.940 10.512 1.00 0.00 O HETATM 278 OP2 5CM A 9 9.268 9.566 10.254 1.00 0.00 O HETATM 0 HN42 5CM A 9 10.828 1.962 9.844 1.00 0.00 H new HETATM 0 HN41 5CM A 9 9.695 0.668 10.249 1.00 0.00 H new HETATM 0 H5A3 5CM A 9 11.585 3.738 11.055 1.00 0.00 H new HETATM 0 H5A2 5CM A 9 10.812 4.046 9.482 1.00 0.00 H new HETATM 0 H5A1 5CM A 9 10.911 5.345 10.694 1.00 0.00 H new HETATM 0 H5'' 5CM A 9 5.486 8.481 11.319 1.00 0.00 H new HETATM 0 H2'' 5CM A 9 7.127 5.372 15.235 1.00 0.00 H new HETATM 0 H6 5CM A 9 9.058 5.771 11.827 1.00 0.00 H new HETATM 0 H5' 5CM A 9 5.726 9.443 12.763 1.00 0.00 H new HETATM 0 H4' 5CM A 9 5.016 7.337 13.435 1.00 0.00 H new HETATM 0 H3' 5CM A 9 7.843 7.978 14.120 1.00 0.00 H new HETATM 0 H2' 5CM A 9 8.527 5.750 14.251 1.00 0.00 H new HETATM 0 H1' 5CM A 9 5.966 4.545 13.477 1.00 0.00 H new ATOM 292 P DG A 10 7.141 7.756 16.824 1.00 0.00 P ATOM 293 OP1 DG A 10 6.457 8.737 17.704 1.00 0.00 O ATOM 294 OP2 DG A 10 8.577 7.945 16.492 1.00 0.00 O ATOM 295 O5' DG A 10 6.973 6.306 17.465 1.00 0.00 O ATOM 296 C5' DG A 10 5.678 5.778 17.762 1.00 0.00 C ATOM 297 C4' DG A 10 5.803 4.450 18.473 1.00 0.00 C ATOM 298 O4' DG A 10 6.202 3.442 17.511 1.00 0.00 O ATOM 299 C3' DG A 10 6.851 4.404 19.587 1.00 0.00 C ATOM 300 O3' DG A 10 6.401 3.586 20.671 1.00 0.00 O ATOM 301 C2' DG A 10 8.057 3.776 18.913 1.00 0.00 C ATOM 302 C1' DG A 10 7.417 2.832 17.912 1.00 0.00 C ATOM 303 N9 DG A 10 8.214 2.589 16.712 1.00 0.00 N ATOM 304 C8 DG A 10 8.848 3.527 15.936 1.00 0.00 C ATOM 305 N7 DG A 10 9.490 3.010 14.925 1.00 0.00 N ATOM 306 C5 DG A 10 9.268 1.645 15.041 1.00 0.00 C ATOM 307 C6 DG A 10 9.715 0.568 14.232 1.00 0.00 C ATOM 308 O6 DG A 10 10.417 0.609 13.215 1.00 0.00 O ATOM 309 N1 DG A 10 9.259 -0.656 14.712 1.00 0.00 N ATOM 310 C2 DG A 10 8.471 -0.821 15.823 1.00 0.00 C ATOM 311 N2 DG A 10 8.131 -2.078 16.124 1.00 0.00 N ATOM 312 N3 DG A 10 8.045 0.172 16.584 1.00 0.00 N ATOM 313 C4 DG A 10 8.479 1.369 16.139 1.00 0.00 C ATOM 0 H5' DG A 10 5.109 5.653 16.841 1.00 0.00 H new ATOM 0 H5'' DG A 10 5.125 6.481 18.385 1.00 0.00 H new ATOM 0 H4' DG A 10 4.826 4.280 18.925 1.00 0.00 H new ATOM 0 H3' DG A 10 7.061 5.385 20.013 1.00 0.00 H new ATOM 0 H2' DG A 10 8.684 4.522 18.424 1.00 0.00 H new ATOM 0 H2'' DG A 10 8.689 3.245 19.625 1.00 0.00 H new ATOM 0 HO3' DG A 10 7.085 3.567 21.373 1.00 0.00 H new ATOM 0 H1' DG A 10 7.297 1.864 18.398 1.00 0.00 H new ATOM 0 H8 DG A 10 8.818 4.587 16.142 1.00 0.00 H new ATOM 0 H1 DG A 10 9.531 -1.494 14.199 1.00 0.00 H new ATOM 0 H21 DG A 10 7.546 -2.267 16.938 1.00 0.00 H new ATOM 0 H22 DG A 10 8.456 -2.848 15.540 1.00 0.00 H new TER 326 DG A 10 HETATM 327 N1 5CM B 11 10.470 -5.347 13.152 1.00 0.00 N HETATM 328 C2 5CM B 11 9.911 -4.215 13.757 1.00 0.00 C HETATM 329 N3 5CM B 11 10.317 -2.987 13.363 1.00 0.00 N HETATM 330 C4 5CM B 11 11.237 -2.864 12.404 1.00 0.00 C HETATM 331 C5 5CM B 11 11.820 -4.000 11.766 1.00 0.00 C HETATM 332 C5A 5CM B 11 12.850 -3.821 10.925 1.00 0.00 C HETATM 333 C6 5CM B 11 11.412 -5.211 12.170 1.00 0.00 C HETATM 334 O2 5CM B 11 9.057 -4.368 14.641 1.00 0.00 O HETATM 335 N4 5CM B 11 11.605 -1.631 12.048 1.00 0.00 N HETATM 336 C1' 5CM B 11 10.025 -6.681 13.593 1.00 0.00 C HETATM 337 C2' 5CM B 11 9.741 -7.660 12.466 1.00 0.00 C HETATM 338 C3' 5CM B 11 10.098 -9.000 13.083 1.00 0.00 C HETATM 339 C4' 5CM B 11 11.228 -8.654 14.053 1.00 0.00 C HETATM 340 O4' 5CM B 11 11.066 -7.250 14.369 1.00 0.00 O HETATM 341 O3' 5CM B 11 8.981 -9.547 13.795 1.00 0.00 O HETATM 342 C5' 5CM B 11 12.623 -8.871 13.515 1.00 0.00 C HETATM 343 O5' 5CM B 11 13.356 -9.777 14.345 1.00 0.00 O HETATM 0 HN42 5CM B 11 12.306 -1.498 11.319 1.00 0.00 H new HETATM 0 HN41 5CM B 11 11.186 -0.822 12.505 1.00 0.00 H new HETATM 0 H5A3 5CM B 11 12.540 -3.177 10.102 1.00 0.00 H new HETATM 0 H5A2 5CM B 11 13.678 -3.355 11.458 1.00 0.00 H new HETATM 0 H5A1 5CM B 11 13.170 -4.786 10.531 1.00 0.00 H new HETATM 0 H5'' 5CM B 11 12.568 -9.265 12.500 1.00 0.00 H new HETATM 0 H2'' 5CM B 11 8.697 -7.624 12.153 1.00 0.00 H new HETATM 0 H6 5CM B 11 11.838 -6.102 11.708 1.00 0.00 H new HETATM 0 H5' 5CM B 11 13.148 -7.917 13.459 1.00 0.00 H new HETATM 0 H4' 5CM B 11 11.148 -9.321 14.912 1.00 0.00 H new HETATM 0 H3' 5CM B 11 10.380 -9.746 12.340 1.00 0.00 H new HETATM 0 H2' 5CM B 11 10.345 -7.447 11.584 1.00 0.00 H new HETATM 0 H1' 5CM B 11 9.092 -6.527 14.135 1.00 0.00 H new ATOM 357 P DG B 12 7.737 -10.160 12.981 1.00 0.00 P ATOM 358 OP1 DG B 12 7.122 -11.203 13.840 1.00 0.00 O ATOM 359 OP2 DG B 12 8.192 -10.513 11.612 1.00 0.00 O ATOM 360 O5' DG B 12 6.713 -8.945 12.870 1.00 0.00 O ATOM 361 C5' DG B 12 6.194 -8.314 14.043 1.00 0.00 C ATOM 362 C4' DG B 12 5.219 -7.222 13.664 1.00 0.00 C ATOM 363 O4' DG B 12 5.961 -5.998 13.445 1.00 0.00 O ATOM 364 C3' DG B 12 4.417 -7.475 12.383 1.00 0.00 C ATOM 365 O3' DG B 12 3.030 -7.193 12.608 1.00 0.00 O ATOM 366 C2' DG B 12 5.003 -6.494 11.380 1.00 0.00 C ATOM 367 C1' DG B 12 5.499 -5.373 12.265 1.00 0.00 C ATOM 368 N9 DG B 12 6.598 -4.588 11.712 1.00 0.00 N ATOM 369 C8 DG B 12 7.703 -5.059 11.045 1.00 0.00 C ATOM 370 N7 DG B 12 8.518 -4.112 10.669 1.00 0.00 N ATOM 371 C5 DG B 12 7.914 -2.944 11.115 1.00 0.00 C ATOM 372 C6 DG B 12 8.330 -1.592 11.002 1.00 0.00 C ATOM 373 O6 DG B 12 9.348 -1.140 10.467 1.00 0.00 O ATOM 374 N1 DG B 12 7.419 -0.725 11.597 1.00 0.00 N ATOM 375 C2 DG B 12 6.257 -1.109 12.216 1.00 0.00 C ATOM 376 N2 DG B 12 5.503 -0.128 12.723 1.00 0.00 N ATOM 377 N3 DG B 12 5.857 -2.363 12.329 1.00 0.00 N ATOM 378 C4 DG B 12 6.729 -3.222 11.760 1.00 0.00 C ATOM 0 H5' DG B 12 7.011 -7.894 14.630 1.00 0.00 H new ATOM 0 H5'' DG B 12 5.697 -9.053 14.672 1.00 0.00 H new ATOM 0 H4' DG B 12 4.509 -7.175 14.489 1.00 0.00 H new ATOM 0 H3' DG B 12 4.478 -8.508 12.041 1.00 0.00 H new ATOM 0 H2' DG B 12 5.811 -6.941 10.801 1.00 0.00 H new ATOM 0 H2'' DG B 12 4.254 -6.147 10.668 1.00 0.00 H new ATOM 0 H1' DG B 12 4.679 -4.669 12.406 1.00 0.00 H new ATOM 0 H8 DG B 12 7.879 -6.107 10.852 1.00 0.00 H new ATOM 0 H1 DG B 12 7.632 0.272 11.571 1.00 0.00 H new ATOM 0 H21 DG B 12 4.627 -0.350 13.195 1.00 0.00 H new ATOM 0 H22 DG B 12 5.804 0.843 12.637 1.00 0.00 H new HETATM 390 N1 5CM B 13 2.387 -2.910 9.786 1.00 0.00 N HETATM 391 C2 5CM B 13 3.039 -1.681 9.635 1.00 0.00 C HETATM 392 N3 5CM B 13 4.296 -1.655 9.141 1.00 0.00 N HETATM 393 C4 5CM B 13 4.902 -2.794 8.801 1.00 0.00 C HETATM 394 C5 5CM B 13 4.263 -4.062 8.938 1.00 0.00 C HETATM 395 C5A 5CM B 13 4.802 -5.128 8.323 1.00 0.00 C HETATM 396 C6 5CM B 13 3.019 -4.072 9.437 1.00 0.00 C HETATM 397 O2 5CM B 13 2.445 -0.642 9.960 1.00 0.00 O HETATM 398 N4 5CM B 13 6.143 -2.718 8.322 1.00 0.00 N HETATM 399 C1' 5CM B 13 1.016 -2.923 10.325 1.00 0.00 C HETATM 400 C2' 5CM B 13 0.088 -3.954 9.703 1.00 0.00 C HETATM 401 C3' 5CM B 13 -0.831 -4.314 10.853 1.00 0.00 C HETATM 402 C4' 5CM B 13 0.077 -4.191 12.075 1.00 0.00 C HETATM 403 O4' 5CM B 13 1.099 -3.234 11.709 1.00 0.00 O HETATM 404 O3' 5CM B 13 -1.916 -3.384 10.943 1.00 0.00 O HETATM 405 C5' 5CM B 13 0.745 -5.476 12.506 1.00 0.00 C HETATM 406 O5' 5CM B 13 1.028 -6.293 11.368 1.00 0.00 O HETATM 407 P 5CM B 13 1.939 -7.594 11.496 1.00 0.00 P HETATM 408 OP1 5CM B 13 1.101 -8.690 12.043 1.00 0.00 O HETATM 409 OP2 5CM B 13 2.644 -7.786 10.202 1.00 0.00 O HETATM 0 HN42 5CM B 13 6.638 -3.568 8.052 1.00 0.00 H new HETATM 0 HN41 5CM B 13 6.598 -1.810 8.226 1.00 0.00 H new HETATM 0 H5A3 5CM B 13 4.833 -4.951 7.248 1.00 0.00 H new HETATM 0 H5A2 5CM B 13 5.814 -5.289 8.694 1.00 0.00 H new HETATM 0 H5A1 5CM B 13 4.196 -6.011 8.528 1.00 0.00 H new HETATM 0 H5'' 5CM B 13 1.668 -5.253 13.041 1.00 0.00 H new HETATM 0 H2'' 5CM B 13 -0.464 -3.544 8.857 1.00 0.00 H new HETATM 0 H6 5CM B 13 2.502 -5.023 9.567 1.00 0.00 H new HETATM 0 H5' 5CM B 13 0.099 -6.016 13.198 1.00 0.00 H new HETATM 0 H4' 5CM B 13 -0.536 -3.892 12.925 1.00 0.00 H new HETATM 0 H3' 5CM B 13 -1.283 -5.300 10.747 1.00 0.00 H new HETATM 0 H2' 5CM B 13 0.636 -4.822 9.336 1.00 0.00 H new HETATM 0 H1' 5CM B 13 0.597 -1.941 10.105 1.00 0.00 H new ATOM 423 P DG B 14 -3.366 -3.787 10.374 1.00 0.00 P ATOM 424 OP1 DG B 14 -4.281 -3.969 11.528 1.00 0.00 O ATOM 425 OP2 DG B 14 -3.182 -4.896 9.402 1.00 0.00 O ATOM 426 O5' DG B 14 -3.839 -2.500 9.561 1.00 0.00 O ATOM 427 C5' DG B 14 -3.315 -1.204 9.861 1.00 0.00 C ATOM 428 C4' DG B 14 -3.017 -0.454 8.584 1.00 0.00 C ATOM 429 O4' DG B 14 -1.662 -0.757 8.181 1.00 0.00 O ATOM 430 C3' DG B 14 -3.914 -0.817 7.393 1.00 0.00 C ATOM 431 O3' DG B 14 -4.602 0.345 6.917 1.00 0.00 O ATOM 432 C2' DG B 14 -2.954 -1.336 6.332 1.00 0.00 C ATOM 433 C1' DG B 14 -1.605 -0.804 6.773 1.00 0.00 C ATOM 434 N9 DG B 14 -0.467 -1.636 6.397 1.00 0.00 N ATOM 435 C8 DG B 14 -0.357 -2.997 6.538 1.00 0.00 C ATOM 436 N7 DG B 14 0.780 -3.471 6.107 1.00 0.00 N ATOM 437 C5 DG B 14 1.467 -2.352 5.655 1.00 0.00 C ATOM 438 C6 DG B 14 2.759 -2.236 5.080 1.00 0.00 C ATOM 439 O6 DG B 14 3.579 -3.130 4.842 1.00 0.00 O ATOM 440 N1 DG B 14 3.065 -0.915 4.771 1.00 0.00 N ATOM 441 C2 DG B 14 2.233 0.156 4.984 1.00 0.00 C ATOM 442 N2 DG B 14 2.707 1.352 4.618 1.00 0.00 N ATOM 443 N3 DG B 14 1.028 0.063 5.517 1.00 0.00 N ATOM 444 C4 DG B 14 0.711 -1.211 5.828 1.00 0.00 C ATOM 0 H5' DG B 14 -2.407 -1.300 10.456 1.00 0.00 H new ATOM 0 H5'' DG B 14 -4.032 -0.644 10.462 1.00 0.00 H new ATOM 0 H4' DG B 14 -3.190 0.597 8.818 1.00 0.00 H new ATOM 0 H3' DG B 14 -4.676 -1.551 7.656 1.00 0.00 H new ATOM 0 H2' DG B 14 -2.959 -2.425 6.286 1.00 0.00 H new ATOM 0 H2'' DG B 14 -3.222 -0.974 5.339 1.00 0.00 H new ATOM 0 H1' DG B 14 -1.442 0.157 6.286 1.00 0.00 H new ATOM 0 H8 DG B 14 -1.134 -3.614 6.963 1.00 0.00 H new ATOM 0 H1 DG B 14 3.977 -0.728 4.354 1.00 0.00 H new ATOM 0 H21 DG B 14 2.138 2.188 4.750 1.00 0.00 H new ATOM 0 H22 DG B 14 3.638 1.428 4.207 1.00 0.00 H new HETATM 456 P 0DC B 15 -5.943 0.180 6.043 1.00 0.00 P HETATM 457 OP1 0DC B 15 -7.054 0.851 6.767 1.00 0.00 O HETATM 458 OP2 0DC B 15 -6.072 -1.254 5.674 1.00 0.00 O HETATM 459 O5' 0DC B 15 -5.642 1.012 4.717 1.00 0.00 O HETATM 460 C5' 0DC B 15 -5.129 0.373 3.544 1.00 0.00 C HETATM 461 C4' 0DC B 15 -4.195 1.307 2.808 1.00 0.00 C HETATM 462 O4' 0DC B 15 -3.297 0.517 1.991 1.00 0.00 O HETATM 463 C3' 0DC B 15 -3.300 2.166 3.700 1.00 0.00 C HETATM 464 O3' 0DC B 15 -3.073 3.445 3.096 1.00 0.00 O HETATM 465 C2' 0DC B 15 -2.008 1.374 3.768 1.00 0.00 C HETATM 466 C1' 0DC B 15 -1.951 0.708 2.405 1.00 0.00 C HETATM 467 N1 0DC B 15 -1.284 -0.603 2.403 1.00 0.00 N HETATM 468 C2 0DC B 15 0.034 -0.691 1.944 1.00 0.00 C HETATM 469 O2 0DC B 15 0.602 0.336 1.545 1.00 0.00 O HETATM 470 N3 0DC B 15 0.655 -1.891 1.947 1.00 0.00 N HETATM 471 C4 0DC B 15 0.011 -2.975 2.384 1.00 0.00 C HETATM 472 N4 0DC B 15 0.665 -4.134 2.374 1.00 0.00 N HETATM 473 C5 0DC B 15 -1.332 -2.915 2.854 1.00 0.00 C HETATM 474 C6 0DC B 15 -1.936 -1.720 2.846 1.00 0.00 C HETATM 0 H5'' 0DC B 15 -4.600 -0.539 3.820 1.00 0.00 H new HETATM 0 H2'' 0DC B 15 -1.146 2.019 3.939 1.00 0.00 H new HETATM 0 H6 0DC B 15 -2.964 -1.636 3.198 1.00 0.00 H new HETATM 0 H5' 0DC B 15 -5.951 0.080 2.891 1.00 0.00 H new HETATM 0 H5 0DC B 15 -1.848 -3.808 3.207 1.00 0.00 H new HETATM 0 H42 0DC B 15 0.204 -4.983 2.701 1.00 0.00 H new HETATM 0 H41 0DC B 15 1.628 -4.173 2.039 1.00 0.00 H new HETATM 0 H4' 0DC B 15 -4.848 1.974 2.246 1.00 0.00 H new HETATM 0 H3' 0DC B 15 -3.733 2.362 4.681 1.00 0.00 H new HETATM 0 H2' 0DC B 15 -2.024 0.642 4.576 1.00 0.00 H new HETATM 0 H1' 0DC B 15 -1.370 1.350 1.743 1.00 0.00 H new HETATM 486 P 0DG B 16 -3.517 4.786 3.865 1.00 0.00 P HETATM 487 OP1 0DG B 16 -2.618 5.883 3.425 1.00 0.00 O HETATM 488 OP2 0DG B 16 -3.635 4.472 5.312 1.00 0.00 O HETATM 489 O5' 0DG B 16 -4.979 5.087 3.305 1.00 0.00 O HETATM 490 C5' 0DG B 16 -5.198 5.345 1.916 1.00 0.00 C HETATM 491 C4' 0DG B 16 -6.653 5.665 1.668 1.00 0.00 C HETATM 492 O4' 0DG B 16 -7.438 4.464 1.867 1.00 0.00 O HETATM 493 C3' 0DG B 16 -6.982 6.131 0.251 1.00 0.00 C HETATM 494 O3' 0DG B 16 -8.120 7.004 0.272 1.00 0.00 O HETATM 495 C2' 0DG B 16 -7.298 4.830 -0.462 1.00 0.00 C HETATM 496 C1' 0DG B 16 -7.978 4.018 0.630 1.00 0.00 C HETATM 497 N9 0DG B 16 -7.756 2.578 0.540 1.00 0.00 N HETATM 498 C8 0DG B 16 -8.657 1.583 0.830 1.00 0.00 C HETATM 499 N7 0DG B 16 -8.171 0.385 0.658 1.00 0.00 N HETATM 500 C5 0DG B 16 -6.868 0.601 0.229 1.00 0.00 C HETATM 501 C6 0DG B 16 -5.848 -0.323 -0.116 1.00 0.00 C HETATM 502 O6 0DG B 16 -5.895 -1.557 -0.111 1.00 0.00 O HETATM 503 N1 0DG B 16 -4.679 0.325 -0.497 1.00 0.00 N HETATM 504 C2 0DG B 16 -4.512 1.686 -0.544 1.00 0.00 C HETATM 505 N2 0DG B 16 -3.311 2.122 -0.940 1.00 0.00 N HETATM 506 N3 0DG B 16 -5.453 2.558 -0.226 1.00 0.00 N HETATM 507 C4 0DG B 16 -6.597 1.950 0.149 1.00 0.00 C HETATM 0 H5'' 0DG B 16 -4.574 6.178 1.591 1.00 0.00 H new HETATM 0 H2'' 0DG B 16 -7.952 4.985 -1.320 1.00 0.00 H new HETATM 0 H8 0DG B 16 -9.675 1.775 1.169 1.00 0.00 H new HETATM 0 H5' 0DG B 16 -4.903 4.477 1.327 1.00 0.00 H new HETATM 0 H4' 0DG B 16 -6.880 6.477 2.359 1.00 0.00 H new HETATM 0 H3' 0DG B 16 -6.182 6.695 -0.229 1.00 0.00 H new HETATM 0 H22 0DG B 16 -3.125 3.123 -0.996 1.00 0.00 H new HETATM 0 H21 0DG B 16 -2.581 1.453 -1.186 1.00 0.00 H new HETATM 0 H2' 0DG B 16 -6.397 4.340 -0.832 1.00 0.00 H new HETATM 0 H1' 0DG B 16 -9.053 4.171 0.530 1.00 0.00 H new HETATM 0 H1 0DG B 16 -3.884 -0.256 -0.762 1.00 0.00 H new HETATM 519 N1 5CM B 17 -6.466 4.138 -4.243 1.00 0.00 N HETATM 520 C2 5CM B 17 -5.601 3.042 -4.301 1.00 0.00 C HETATM 521 N3 5CM B 17 -5.989 1.863 -3.765 1.00 0.00 N HETATM 522 C4 5CM B 17 -7.187 1.754 -3.190 1.00 0.00 C HETATM 523 C5 5CM B 17 -8.092 2.856 -3.118 1.00 0.00 C HETATM 524 C5A 5CM B 17 -9.349 2.643 -2.697 1.00 0.00 C HETATM 525 C6 5CM B 17 -7.693 4.018 -3.653 1.00 0.00 C HETATM 526 O2 5CM B 17 -4.495 3.179 -4.843 1.00 0.00 O HETATM 527 N4 5CM B 17 -7.523 0.571 -2.674 1.00 0.00 N HETATM 528 C1' 5CM B 17 -6.031 5.417 -4.828 1.00 0.00 C HETATM 529 C2' 5CM B 17 -6.963 5.988 -5.880 1.00 0.00 C HETATM 530 C3' 5CM B 17 -6.709 7.478 -5.752 1.00 0.00 C HETATM 531 C4' 5CM B 17 -6.460 7.657 -4.254 1.00 0.00 C HETATM 532 O4' 5CM B 17 -5.974 6.376 -3.784 1.00 0.00 O HETATM 533 O3' 5CM B 17 -5.550 7.860 -6.499 1.00 0.00 O HETATM 534 C5' 5CM B 17 -7.680 8.048 -3.454 1.00 0.00 C HETATM 535 O5' 5CM B 17 -7.500 7.714 -2.076 1.00 0.00 O HETATM 536 P 5CM B 17 -8.753 7.534 -1.109 1.00 0.00 P HETATM 537 OP1 5CM B 17 -9.337 8.876 -0.859 1.00 0.00 O HETATM 538 OP2 5CM B 17 -9.611 6.452 -1.657 1.00 0.00 O HETATM 0 HN42 5CM B 17 -8.431 0.449 -2.226 1.00 0.00 H new HETATM 0 HN41 5CM B 17 -6.872 -0.212 -2.727 1.00 0.00 H new HETATM 0 H5A3 5CM B 17 -9.840 1.932 -3.361 1.00 0.00 H new HETATM 0 H5A2 5CM B 17 -9.330 2.240 -1.684 1.00 0.00 H new HETATM 0 H5A1 5CM B 17 -9.899 3.584 -2.703 1.00 0.00 H new HETATM 0 H5'' 5CM B 17 -7.861 9.118 -3.555 1.00 0.00 H new HETATM 0 H2'' 5CM B 17 -6.727 5.618 -6.878 1.00 0.00 H new HETATM 0 H6 5CM B 17 -8.358 4.881 -3.617 1.00 0.00 H new HETATM 0 H5' 5CM B 17 -8.559 7.537 -3.847 1.00 0.00 H new HETATM 0 H4' 5CM B 17 -5.757 8.479 -4.115 1.00 0.00 H new HETATM 0 H3' 5CM B 17 -7.529 8.087 -6.132 1.00 0.00 H new HETATM 0 H2' 5CM B 17 -8.005 5.733 -5.684 1.00 0.00 H new HETATM 0 H1' 5CM B 17 -5.075 5.215 -5.311 1.00 0.00 H new ATOM 552 P DG B 18 -5.714 8.733 -7.840 1.00 0.00 P ATOM 553 OP1 DG B 18 -5.726 10.162 -7.440 1.00 0.00 O ATOM 554 OP2 DG B 18 -6.849 8.181 -8.624 1.00 0.00 O ATOM 555 O5' DG B 18 -4.368 8.458 -8.648 1.00 0.00 O ATOM 556 C5' DG B 18 -3.149 8.153 -7.967 1.00 0.00 C ATOM 557 C4' DG B 18 -2.306 7.212 -8.796 1.00 0.00 C ATOM 558 O4' DG B 18 -2.724 5.851 -8.528 1.00 0.00 O ATOM 559 C3' DG B 18 -2.428 7.397 -10.308 1.00 0.00 C ATOM 560 O3' DG B 18 -1.172 7.133 -10.943 1.00 0.00 O ATOM 561 C2' DG B 18 -3.460 6.359 -10.708 1.00 0.00 C ATOM 562 C1' DG B 18 -3.221 5.240 -9.709 1.00 0.00 C ATOM 563 N9 DG B 18 -4.415 4.483 -9.348 1.00 0.00 N ATOM 564 C8 DG B 18 -5.658 4.988 -9.056 1.00 0.00 C ATOM 565 N7 DG B 18 -6.534 4.066 -8.766 1.00 0.00 N ATOM 566 C5 DG B 18 -5.826 2.876 -8.870 1.00 0.00 C ATOM 567 C6 DG B 18 -6.247 1.537 -8.670 1.00 0.00 C ATOM 568 O6 DG B 18 -7.365 1.122 -8.349 1.00 0.00 O ATOM 569 N1 DG B 18 -5.207 0.637 -8.879 1.00 0.00 N ATOM 570 C2 DG B 18 -3.929 0.981 -9.238 1.00 0.00 C ATOM 571 N2 DG B 18 -3.067 -0.030 -9.396 1.00 0.00 N ATOM 572 N3 DG B 18 -3.522 2.225 -9.430 1.00 0.00 N ATOM 573 C4 DG B 18 -4.517 3.116 -9.230 1.00 0.00 C ATOM 0 H5' DG B 18 -3.368 7.700 -7.000 1.00 0.00 H new ATOM 0 H5'' DG B 18 -2.595 9.071 -7.770 1.00 0.00 H new ATOM 0 H4' DG B 18 -1.276 7.429 -8.512 1.00 0.00 H new ATOM 0 H3' DG B 18 -2.711 8.409 -10.597 1.00 0.00 H new ATOM 0 H2' DG B 18 -4.475 6.751 -10.640 1.00 0.00 H new ATOM 0 H2'' DG B 18 -3.317 6.022 -11.734 1.00 0.00 H new ATOM 0 H1' DG B 18 -2.536 4.530 -10.171 1.00 0.00 H new ATOM 0 H8 DG B 18 -5.888 6.043 -9.065 1.00 0.00 H new ATOM 0 H1 DG B 18 -5.411 -0.355 -8.756 1.00 0.00 H new ATOM 0 H21 DG B 18 -2.101 0.160 -9.663 1.00 0.00 H new ATOM 0 H22 DG B 18 -3.376 -0.991 -9.250 1.00 0.00 H new HETATM 585 N1 5CM B 19 -4.127 3.566 -13.584 1.00 0.00 N HETATM 586 C2 5CM B 19 -4.782 2.372 -13.265 1.00 0.00 C HETATM 587 N3 5CM B 19 -5.986 2.419 -12.649 1.00 0.00 N HETATM 588 C4 5CM B 19 -6.537 3.599 -12.354 1.00 0.00 C HETATM 589 C5 5CM B 19 -5.893 4.832 -12.669 1.00 0.00 C HETATM 590 C5A 5CM B 19 -6.563 5.982 -12.496 1.00 0.00 C HETATM 591 C6 5CM B 19 -4.701 4.769 -13.276 1.00 0.00 C HETATM 592 O2 5CM B 19 -4.241 1.295 -13.555 1.00 0.00 O HETATM 593 N4 5CM B 19 -7.723 3.596 -11.746 1.00 0.00 N HETATM 594 C1' 5CM B 19 -2.819 3.501 -14.256 1.00 0.00 C HETATM 595 C2' 5CM B 19 -2.613 4.503 -15.372 1.00 0.00 C HETATM 596 C3' 5CM B 19 -1.102 4.667 -15.403 1.00 0.00 C HETATM 597 C4' 5CM B 19 -0.651 4.300 -13.984 1.00 0.00 C HETATM 598 O4' 5CM B 19 -1.825 3.799 -13.301 1.00 0.00 O HETATM 599 O3' 5CM B 19 -0.521 3.768 -16.355 1.00 0.00 O HETATM 600 C5' 5CM B 19 -0.083 5.447 -13.181 1.00 0.00 C HETATM 601 O5' 5CM B 19 -0.857 6.629 -13.395 1.00 0.00 O HETATM 602 P 5CM B 19 -0.824 7.832 -12.351 1.00 0.00 P HETATM 603 OP1 5CM B 19 0.567 8.344 -12.279 1.00 0.00 O HETATM 604 OP2 5CM B 19 -1.930 8.762 -12.693 1.00 0.00 O HETATM 0 HN42 5CM B 19 -8.175 4.478 -11.505 1.00 0.00 H new HETATM 0 HN41 5CM B 19 -8.179 2.712 -11.522 1.00 0.00 H new HETATM 0 H5A3 5CM B 19 -7.459 5.978 -13.116 1.00 0.00 H new HETATM 0 H5A2 5CM B 19 -6.847 6.084 -11.449 1.00 0.00 H new HETATM 0 H5A1 5CM B 19 -5.928 6.820 -12.783 1.00 0.00 H new HETATM 0 H5'' 5CM B 19 -0.080 5.192 -12.121 1.00 0.00 H new HETATM 0 H2'' 5CM B 19 -2.999 4.135 -16.322 1.00 0.00 H new HETATM 0 H6 5CM B 19 -4.179 5.692 -13.529 1.00 0.00 H new HETATM 0 H5' 5CM B 19 0.953 5.625 -13.469 1.00 0.00 H new HETATM 0 H4' 5CM B 19 0.159 3.576 -14.071 1.00 0.00 H new HETATM 0 H3' 5CM B 19 -0.798 5.673 -15.693 1.00 0.00 H new HETATM 0 H2' 5CM B 19 -3.118 5.447 -15.167 1.00 0.00 H new HETATM 0 H1' 5CM B 19 -2.767 2.502 -14.688 1.00 0.00 H new ATOM 618 P DG B 20 -0.298 4.247 -17.874 1.00 0.00 P ATOM 619 OP1 DG B 20 1.157 4.159 -18.159 1.00 0.00 O ATOM 620 OP2 DG B 20 -1.007 5.537 -18.075 1.00 0.00 O ATOM 621 O5' DG B 20 -1.040 3.135 -18.742 1.00 0.00 O ATOM 622 C5' DG B 20 -0.553 1.793 -18.790 1.00 0.00 C ATOM 623 C4' DG B 20 -1.556 0.897 -19.482 1.00 0.00 C ATOM 624 O4' DG B 20 -2.705 0.731 -18.615 1.00 0.00 O ATOM 625 C3' DG B 20 -2.100 1.434 -20.806 1.00 0.00 C ATOM 626 O3' DG B 20 -2.306 0.370 -21.739 1.00 0.00 O ATOM 627 C2' DG B 20 -3.428 2.058 -20.415 1.00 0.00 C ATOM 628 C1' DG B 20 -3.883 1.174 -19.269 1.00 0.00 C ATOM 629 N9 DG B 20 -4.718 1.845 -18.277 1.00 0.00 N ATOM 630 C8 DG B 20 -4.601 3.139 -17.833 1.00 0.00 C ATOM 631 N7 DG B 20 -5.495 3.461 -16.939 1.00 0.00 N ATOM 632 C5 DG B 20 -6.250 2.307 -16.781 1.00 0.00 C ATOM 633 C6 DG B 20 -7.365 2.046 -15.943 1.00 0.00 C ATOM 634 O6 DG B 20 -7.925 2.806 -15.146 1.00 0.00 O ATOM 635 N1 DG B 20 -7.829 0.744 -16.099 1.00 0.00 N ATOM 636 C2 DG B 20 -7.287 -0.188 -16.951 1.00 0.00 C ATOM 637 N2 DG B 20 -7.874 -1.390 -16.961 1.00 0.00 N ATOM 638 N3 DG B 20 -6.247 0.040 -17.733 1.00 0.00 N ATOM 639 C4 DG B 20 -5.783 1.300 -17.600 1.00 0.00 C ATOM 0 H5' DG B 20 -0.367 1.430 -17.779 1.00 0.00 H new ATOM 0 H5'' DG B 20 0.399 1.763 -19.320 1.00 0.00 H new ATOM 0 H4' DG B 20 -1.015 -0.026 -19.693 1.00 0.00 H new ATOM 0 H3' DG B 20 -1.420 2.136 -21.289 1.00 0.00 H new ATOM 0 H2' DG B 20 -3.312 3.097 -20.105 1.00 0.00 H new ATOM 0 H2'' DG B 20 -4.139 2.049 -21.241 1.00 0.00 H new ATOM 0 HO3' DG B 20 -2.656 0.734 -22.579 1.00 0.00 H new ATOM 0 H1' DG B 20 -4.494 0.376 -19.690 1.00 0.00 H new ATOM 0 H8 DG B 20 -3.844 3.822 -18.189 1.00 0.00 H new ATOM 0 H1 DG B 20 -8.632 0.460 -15.539 1.00 0.00 H new ATOM 0 H21 DG B 20 -7.519 -2.126 -17.572 1.00 0.00 H new ATOM 0 H22 DG B 20 -8.676 -1.571 -16.358 1.00 0.00 H new TER 652 DG B 20