USER MOD reduce.3.24.130724 H: found=0, std=0, add=251, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 253 hydrogens (139 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 DT C7 :methyl 150:sc= -0.192 (180deg=-0.192) USER MOD Single : A 10 DT O3' : rot 180:sc= 0 USER MOD Single : B 13 DT C7 :methyl -30:sc= -2.38 (180deg=-3.75!) USER MOD Single : B 20 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 C5' XTY A 1 -14.097 -11.626 -11.473 1.00 0.00 C HETATM 2 C4' XTY A 1 -13.600 -12.112 -10.111 1.00 0.00 C HETATM 3 O4' XTY A 1 -12.462 -12.964 -10.307 1.00 0.00 O HETATM 4 C3' XTY A 1 -13.116 -11.010 -9.176 1.00 0.00 C HETATM 5 C2' XTY A 1 -11.618 -10.957 -9.424 1.00 0.00 C HETATM 6 C1' XTY A 1 -11.286 -12.428 -9.680 1.00 0.00 C HETATM 7 O5' XTY A 1 -13.698 -10.277 -11.733 1.00 0.00 O HETATM 8 C2 XTY A 1 -7.965 -14.872 -8.834 1.00 0.00 C HETATM 9 O2 XTY A 1 -7.899 -15.499 -7.778 1.00 0.00 O HETATM 10 N3 XTY A 1 -6.951 -14.948 -9.773 1.00 0.00 N HETATM 11 C4 XTY A 1 -6.948 -14.278 -10.978 1.00 0.00 C HETATM 12 O4 XTY A 1 -6.009 -14.411 -11.763 1.00 0.00 O HETATM 13 C5 XTY A 1 -8.047 -13.461 -11.274 1.00 0.00 C HETATM 14 C6 XTY A 1 -9.106 -13.357 -10.333 1.00 0.00 C HETATM 15 N XTY A 1 -9.064 -14.061 -9.120 1.00 0.00 N HETATM 16 CP XTY A 1 -8.096 -12.748 -12.494 1.00 0.00 C HETATM 17 CD XTY A 1 -10.250 -11.831 -11.848 1.00 0.00 C HETATM 18 C8 XTY A 1 -10.231 -12.532 -10.614 1.00 0.00 C HETATM 19 C7 XTY A 1 -9.197 -11.937 -12.770 1.00 0.00 C HETATM 20 C7A XTY A 1 -9.262 -11.158 -14.081 1.00 0.00 C HETATM 21 O3' XTY A 1 -13.305 -11.482 -7.839 1.00 0.00 O HETATM 0 H7A3 XTY A 1 -8.412 -10.478 -14.143 1.00 0.00 H new HETATM 0 H7A2 XTY A 1 -9.231 -11.854 -14.920 1.00 0.00 H new HETATM 0 H7A1 XTY A 1 -10.189 -10.585 -14.118 1.00 0.00 H new HETATM 0 H5'2 XTY A 1 -13.708 -12.277 -12.256 1.00 0.00 H new HETATM 0 H5'1 XTY A 1 -15.184 -11.697 -11.510 1.00 0.00 H new HETATM 0 H2'2 XTY A 1 -11.368 -10.328 -10.278 1.00 0.00 H new HETATM 0 H2'1 XTY A 1 -11.076 -10.560 -8.566 1.00 0.00 H new HETATM 0 HP XTY A 1 -7.281 -12.831 -13.213 1.00 0.00 H new HETATM 0 HN3 XTY A 1 -6.150 -15.541 -9.558 1.00 0.00 H new HETATM 0 HN XTY A 1 -9.831 -13.981 -8.452 1.00 0.00 H new HETATM 0 HD XTY A 1 -11.103 -11.195 -12.085 1.00 0.00 H new HETATM 0 H4' XTY A 1 -14.461 -12.602 -9.657 1.00 0.00 H new HETATM 0 H3' XTY A 1 -13.619 -10.055 -9.324 1.00 0.00 H new HETATM 0 H1' XTY A 1 -11.000 -12.937 -8.760 1.00 0.00 H new ATOM 37 P DG A 2 -13.812 -10.486 -6.677 1.00 0.00 P ATOM 38 OP1 DG A 2 -13.941 -9.127 -7.248 1.00 0.00 O ATOM 39 OP2 DG A 2 -14.969 -11.116 -6.003 1.00 0.00 O ATOM 40 O5' DG A 2 -12.570 -10.485 -5.651 1.00 0.00 O ATOM 41 C5' DG A 2 -12.141 -11.698 -5.026 1.00 0.00 C ATOM 42 C4' DG A 2 -11.022 -11.449 -4.018 1.00 0.00 C ATOM 43 O4' DG A 2 -9.761 -11.505 -4.700 1.00 0.00 O ATOM 44 C3' DG A 2 -11.057 -10.079 -3.344 1.00 0.00 C ATOM 45 O3' DG A 2 -10.467 -10.238 -2.051 1.00 0.00 O ATOM 46 C2' DG A 2 -10.101 -9.234 -4.175 1.00 0.00 C ATOM 47 C1' DG A 2 -9.057 -10.260 -4.601 1.00 0.00 C ATOM 48 N9 DG A 2 -8.450 -9.963 -5.917 1.00 0.00 N ATOM 49 C8 DG A 2 -8.846 -9.054 -6.866 1.00 0.00 C ATOM 50 N7 DG A 2 -8.092 -9.045 -7.930 1.00 0.00 N ATOM 51 C5 DG A 2 -7.129 -10.013 -7.669 1.00 0.00 C ATOM 52 C6 DG A 2 -6.034 -10.451 -8.467 1.00 0.00 C ATOM 53 O6 DG A 2 -5.695 -10.055 -9.580 1.00 0.00 O ATOM 54 N1 DG A 2 -5.307 -11.445 -7.832 1.00 0.00 N ATOM 55 C2 DG A 2 -5.592 -11.960 -6.588 1.00 0.00 C ATOM 56 N2 DG A 2 -4.792 -12.921 -6.129 1.00 0.00 N ATOM 57 N3 DG A 2 -6.616 -11.556 -5.833 1.00 0.00 N ATOM 58 C4 DG A 2 -7.339 -10.582 -6.437 1.00 0.00 C ATOM 0 H5' DG A 2 -11.796 -12.397 -5.787 1.00 0.00 H new ATOM 0 H5'' DG A 2 -12.987 -12.167 -4.523 1.00 0.00 H new ATOM 0 H4' DG A 2 -11.157 -12.214 -3.254 1.00 0.00 H new ATOM 0 H3' DG A 2 -12.057 -9.653 -3.266 1.00 0.00 H new ATOM 0 H2' DG A 2 -10.598 -8.779 -5.031 1.00 0.00 H new ATOM 0 H2'' DG A 2 -9.662 -8.423 -3.593 1.00 0.00 H new ATOM 0 H1' DG A 2 -8.242 -10.266 -3.878 1.00 0.00 H new ATOM 0 H8 DG A 2 -9.702 -8.407 -6.743 1.00 0.00 H new ATOM 0 H1 DG A 2 -4.498 -11.824 -8.324 1.00 0.00 H new ATOM 0 H21 DG A 2 -4.964 -13.333 -5.212 1.00 0.00 H new ATOM 0 H22 DG A 2 -4.007 -13.245 -6.695 1.00 0.00 H new HETATM 70 P XTY A 3 -10.940 -9.324 -0.809 1.00 0.00 P HETATM 71 OP1 XTY A 3 -11.113 -10.201 0.372 1.00 0.00 O HETATM 72 OP2 XTY A 3 -12.058 -8.464 -1.258 1.00 0.00 O HETATM 73 C5' XTY A 3 -8.341 -8.946 -0.487 1.00 0.00 C HETATM 74 C4' XTY A 3 -7.305 -7.902 -0.073 1.00 0.00 C HETATM 75 O4' XTY A 3 -6.390 -7.698 -1.158 1.00 0.00 O HETATM 76 C3' XTY A 3 -7.878 -6.527 0.229 1.00 0.00 C HETATM 77 C2' XTY A 3 -7.766 -5.786 -1.092 1.00 0.00 C HETATM 78 C1' XTY A 3 -6.486 -6.370 -1.702 1.00 0.00 C HETATM 79 O5' XTY A 3 -9.657 -8.387 -0.557 1.00 0.00 O HETATM 80 C2 XTY A 3 -3.563 -8.519 -3.691 1.00 0.00 C HETATM 81 O2 XTY A 3 -2.628 -9.010 -3.060 1.00 0.00 O HETATM 82 N3 XTY A 3 -3.666 -8.683 -5.063 1.00 0.00 N HETATM 83 C4 XTY A 3 -4.689 -8.167 -5.835 1.00 0.00 C HETATM 84 O4 XTY A 3 -4.718 -8.360 -7.047 1.00 0.00 O HETATM 85 C5 XTY A 3 -5.686 -7.427 -5.191 1.00 0.00 C HETATM 86 C6 XTY A 3 -5.607 -7.241 -3.792 1.00 0.00 C HETATM 87 N XTY A 3 -4.560 -7.780 -3.046 1.00 0.00 N HETATM 88 CP XTY A 3 -6.751 -6.873 -5.931 1.00 0.00 C HETATM 89 CD XTY A 3 -7.667 -5.954 -3.875 1.00 0.00 C HETATM 90 C8 XTY A 3 -6.600 -6.503 -3.108 1.00 0.00 C HETATM 91 C7 XTY A 3 -7.736 -6.138 -5.267 1.00 0.00 C HETATM 92 C7A XTY A 3 -8.892 -5.528 -6.054 1.00 0.00 C HETATM 93 O3' XTY A 3 -7.004 -5.890 1.163 1.00 0.00 O HETATM 0 H7A3 XTY A 3 -8.500 -4.833 -6.796 1.00 0.00 H new HETATM 0 H7A2 XTY A 3 -9.448 -6.320 -6.556 1.00 0.00 H new HETATM 0 H7A1 XTY A 3 -9.555 -4.995 -5.372 1.00 0.00 H new HETATM 0 H5'2 XTY A 3 -8.070 -9.362 -1.457 1.00 0.00 H new HETATM 0 H5'1 XTY A 3 -8.333 -9.770 0.227 1.00 0.00 H new HETATM 0 H2'2 XTY A 3 -8.633 -5.961 -1.728 1.00 0.00 H new HETATM 0 H2'1 XTY A 3 -7.689 -4.709 -0.946 1.00 0.00 H new HETATM 0 HP XTY A 3 -6.805 -7.017 -7.010 1.00 0.00 H new HETATM 0 HN3 XTY A 3 -2.938 -9.220 -5.534 1.00 0.00 H new HETATM 0 HN XTY A 3 -4.521 -7.636 -2.037 1.00 0.00 H new HETATM 0 HD XTY A 3 -8.446 -5.380 -3.373 1.00 0.00 H new HETATM 0 H4' XTY A 3 -6.849 -8.300 0.834 1.00 0.00 H new HETATM 0 H3' XTY A 3 -8.893 -6.555 0.625 1.00 0.00 H new HETATM 0 H1' XTY A 3 -5.632 -5.729 -1.484 1.00 0.00 H new ATOM 108 P DA A 4 -7.569 -5.409 2.593 1.00 0.00 P ATOM 109 OP1 DA A 4 -8.164 -4.064 2.423 1.00 0.00 O ATOM 110 OP2 DA A 4 -8.382 -6.507 3.163 1.00 0.00 O ATOM 111 O5' DA A 4 -6.235 -5.260 3.478 1.00 0.00 O ATOM 112 C5' DA A 4 -5.291 -6.334 3.580 1.00 0.00 C ATOM 113 C4' DA A 4 -3.875 -5.803 3.785 1.00 0.00 C ATOM 114 O4' DA A 4 -3.300 -5.535 2.497 1.00 0.00 O ATOM 115 C3' DA A 4 -3.799 -4.473 4.524 1.00 0.00 C ATOM 116 O3' DA A 4 -2.465 -4.331 5.017 1.00 0.00 O ATOM 117 C2' DA A 4 -3.959 -3.459 3.406 1.00 0.00 C ATOM 118 C1' DA A 4 -3.177 -4.122 2.273 1.00 0.00 C ATOM 119 N9 DA A 4 -3.740 -3.809 0.943 1.00 0.00 N ATOM 120 C8 DA A 4 -4.794 -2.984 0.634 1.00 0.00 C ATOM 121 N7 DA A 4 -5.071 -2.944 -0.636 1.00 0.00 N ATOM 122 C5 DA A 4 -4.137 -3.797 -1.209 1.00 0.00 C ATOM 123 C6 DA A 4 -3.899 -4.185 -2.533 1.00 0.00 C ATOM 124 N6 DA A 4 -4.631 -3.762 -3.563 1.00 0.00 N ATOM 125 N1 DA A 4 -2.893 -5.043 -2.764 1.00 0.00 N ATOM 126 C2 DA A 4 -2.172 -5.483 -1.740 1.00 0.00 C ATOM 127 N3 DA A 4 -2.294 -5.196 -0.451 1.00 0.00 N ATOM 128 C4 DA A 4 -3.316 -4.330 -0.258 1.00 0.00 C ATOM 0 H5' DA A 4 -5.328 -6.942 2.676 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.563 -6.984 4.412 1.00 0.00 H new ATOM 0 H4' DA A 4 -3.363 -6.566 4.371 1.00 0.00 H new ATOM 0 H3' DA A 4 -4.520 -4.375 5.336 1.00 0.00 H new ATOM 0 H2' DA A 4 -5.005 -3.301 3.144 1.00 0.00 H new ATOM 0 H2'' DA A 4 -3.547 -2.486 3.674 1.00 0.00 H new ATOM 0 H1' DA A 4 -2.147 -3.766 2.276 1.00 0.00 H new ATOM 0 H8 DA A 4 -5.341 -2.421 1.376 1.00 0.00 H new ATOM 0 H61 DA A 4 -4.412 -4.078 -4.508 1.00 0.00 H new ATOM 0 H62 DA A 4 -5.410 -3.123 -3.406 1.00 0.00 H new ATOM 0 H2 DA A 4 -1.377 -6.169 -1.991 1.00 0.00 H new HETATM 140 P XCS A 5 -2.108 -4.577 6.569 1.00 0.00 P HETATM 141 OP2 XCS A 5 -2.287 -3.301 7.296 1.00 0.00 O HETATM 142 C6 XCS A 5 0.222 -2.256 2.198 1.00 0.00 C HETATM 143 C2 XCS A 5 0.937 -2.497 -0.086 1.00 0.00 C HETATM 144 O2 XCS A 5 1.716 -2.988 -0.898 1.00 0.00 O HETATM 145 N3 XCS A 5 -0.077 -1.662 -0.490 1.00 0.00 N HETATM 146 C4 XCS A 5 -0.933 -1.122 0.395 1.00 0.00 C HETATM 147 N4 XCS A 5 -1.888 -0.317 -0.071 1.00 0.00 N HETATM 148 C5 XCS A 5 -0.813 -1.405 1.790 1.00 0.00 C HETATM 149 OP1 XCS A 5 -2.808 -5.798 7.027 1.00 0.00 O HETATM 150 O5' XCS A 5 -0.535 -4.895 6.480 1.00 0.00 O HETATM 151 C5' XCS A 5 -0.070 -5.940 5.620 1.00 0.00 C HETATM 152 C4' XCS A 5 1.257 -5.582 4.965 1.00 0.00 C HETATM 153 O4' XCS A 5 0.968 -4.796 3.802 1.00 0.00 O HETATM 154 C1' XCS A 5 1.466 -3.455 3.917 1.00 0.00 C HETATM 155 ND XCS A 5 1.091 -2.798 1.269 1.00 0.00 N HETATM 156 CP XCS A 5 -1.709 -0.845 2.726 1.00 0.00 C HETATM 157 CD XCS A 5 -0.521 -2.004 4.498 1.00 0.00 C HETATM 158 C8 XCS A 5 0.396 -2.580 3.565 1.00 0.00 C HETATM 159 C7 XCS A 5 -1.556 -1.149 4.076 1.00 0.00 C HETATM 160 C7A XCS A 5 -2.514 -0.553 5.105 1.00 0.00 C HETATM 161 C2' XCS A 5 1.876 -3.296 5.390 1.00 0.00 C HETATM 162 C3' XCS A 5 2.191 -4.723 5.809 1.00 0.00 C HETATM 163 O3' XCS A 5 3.528 -5.006 5.386 1.00 0.00 O HETATM 0 HN42 XCS A 5 -2.554 0.110 0.573 1.00 0.00 H new HETATM 0 HN41 XCS A 5 -1.952 -0.128 -1.071 1.00 0.00 H new HETATM 0 H7A3 XCS A 5 -2.453 0.535 5.071 1.00 0.00 H new HETATM 0 H7A2 XCS A 5 -3.533 -0.867 4.878 1.00 0.00 H new HETATM 0 H7A1 XCS A 5 -2.241 -0.901 6.101 1.00 0.00 H new HETATM 0 H5'2 XCS A 5 0.044 -6.860 6.194 1.00 0.00 H new HETATM 0 H5'1 XCS A 5 -0.815 -6.135 4.849 1.00 0.00 H new HETATM 0 H2'2 XCS A 5 2.741 -2.642 5.501 1.00 0.00 H new HETATM 0 H2'1 XCS A 5 1.073 -2.867 5.989 1.00 0.00 H new HETATM 0 HP XCS A 5 -2.510 -0.183 2.396 1.00 0.00 H new HETATM 0 HND XCS A 5 1.843 -3.416 1.573 1.00 0.00 H new HETATM 0 HD XCS A 5 -0.416 -2.232 5.559 1.00 0.00 H new HETATM 0 H4' XCS A 5 1.756 -6.533 4.778 1.00 0.00 H new HETATM 0 H3' XCS A 5 2.082 -4.892 6.880 1.00 0.00 H new HETATM 0 H1' XCS A 5 2.315 -3.232 3.271 1.00 0.00 H new HETATM 179 P XGA A 6 4.619 -5.559 6.436 1.00 0.00 P HETATM 180 OP1 XGA A 6 5.159 -6.836 5.914 1.00 0.00 O HETATM 181 OP2 XGA A 6 4.030 -5.508 7.794 1.00 0.00 O HETATM 182 C5' XGA A 6 6.423 -4.149 5.108 1.00 0.00 C HETATM 183 O5' XGA A 6 5.784 -4.450 6.354 1.00 0.00 O HETATM 184 C4' XGA A 6 6.945 -2.715 5.075 1.00 0.00 C HETATM 185 O4' XGA A 6 5.896 -1.849 4.613 1.00 0.00 O HETATM 186 C3' XGA A 6 7.365 -2.152 6.434 1.00 0.00 C HETATM 187 C2' XGA A 6 6.167 -1.329 6.878 1.00 0.00 C HETATM 188 C1' XGA A 6 5.660 -0.791 5.548 1.00 0.00 C HETATM 189 N9 XGA A 6 4.251 -0.434 5.547 1.00 0.00 N HETATM 190 C8 XGA A 6 3.358 -0.599 6.579 1.00 0.00 C HETATM 191 N7 XGA A 6 2.159 -0.167 6.267 1.00 0.00 N HETATM 192 C4 XGA A 6 2.979 1.123 2.371 1.00 0.00 C HETATM 193 C5 XGA A 6 1.659 1.290 2.839 1.00 0.00 C HETATM 194 N3 XGA A 6 3.357 1.499 1.143 1.00 0.00 N HETATM 195 C2 XGA A 6 2.413 2.054 0.351 1.00 0.00 C HETATM 196 N2 XGA A 6 2.774 2.439 -0.897 1.00 0.00 N HETATM 197 N1 XGA A 6 1.132 2.250 0.721 1.00 0.00 N HETATM 198 C6 XGA A 6 0.719 1.869 1.984 1.00 0.00 C HETATM 199 O6 XGA A 6 -0.451 2.039 2.330 1.00 0.00 O HETATM 200 C10 XGA A 6 3.568 0.147 4.500 1.00 0.00 C HETATM 201 C11 XGA A 6 2.269 0.299 4.983 1.00 0.00 C HETATM 202 CP XGA A 6 1.299 0.875 4.151 1.00 0.00 C HETATM 203 CD XGA A 6 3.939 0.552 3.205 1.00 0.00 C HETATM 204 O3' XGA A 6 8.432 -1.229 6.191 1.00 0.00 O HETATM 0 HN22 XGA A 6 2.085 2.861 -1.520 1.00 0.00 H new HETATM 0 HN21 XGA A 6 3.734 2.307 -1.214 1.00 0.00 H new HETATM 0 H5'2 XGA A 6 7.249 -4.841 4.946 1.00 0.00 H new HETATM 0 H5'1 XGA A 6 5.717 -4.298 4.291 1.00 0.00 H new HETATM 0 H2'2 XGA A 6 5.418 -1.936 7.387 1.00 0.00 H new HETATM 0 H2'1 XGA A 6 6.449 -0.530 7.563 1.00 0.00 H new HETATM 0 HP XGA A 6 0.277 1.004 4.507 1.00 0.00 H new HETATM 0 HN1 XGA A 6 0.471 2.677 0.073 1.00 0.00 H new HETATM 0 HD XGA A 6 4.964 0.421 2.858 1.00 0.00 H new HETATM 0 H8 XGA A 6 3.616 -1.037 7.543 1.00 0.00 H new HETATM 0 H4' XGA A 6 7.822 -2.749 4.428 1.00 0.00 H new HETATM 0 H3' XGA A 6 7.662 -2.918 7.151 1.00 0.00 H new HETATM 0 H1' XGA A 6 6.177 0.138 5.307 1.00 0.00 H new ATOM 218 P DC A 7 9.965 -1.655 6.436 1.00 0.00 P ATOM 219 OP1 DC A 7 10.299 -2.748 5.496 1.00 0.00 O ATOM 220 OP2 DC A 7 10.168 -1.845 7.890 1.00 0.00 O ATOM 221 O5' DC A 7 10.767 -0.334 5.982 1.00 0.00 O ATOM 222 C5' DC A 7 10.934 -0.018 4.596 1.00 0.00 C ATOM 223 C4' DC A 7 10.997 1.491 4.364 1.00 0.00 C ATOM 224 O4' DC A 7 9.663 1.986 4.150 1.00 0.00 O ATOM 225 C3' DC A 7 11.538 2.297 5.545 1.00 0.00 C ATOM 226 O3' DC A 7 12.164 3.467 5.005 1.00 0.00 O ATOM 227 C2' DC A 7 10.284 2.757 6.270 1.00 0.00 C ATOM 228 C1' DC A 7 9.335 3.005 5.103 1.00 0.00 C ATOM 229 N1 DC A 7 7.900 2.881 5.471 1.00 0.00 N ATOM 230 C2 DC A 7 6.961 2.937 4.444 1.00 0.00 C ATOM 231 O2 DC A 7 7.319 3.087 3.275 1.00 0.00 O ATOM 232 N3 DC A 7 5.642 2.831 4.759 1.00 0.00 N ATOM 233 C4 DC A 7 5.250 2.677 6.030 1.00 0.00 C ATOM 234 N4 DC A 7 3.943 2.585 6.273 1.00 0.00 N ATOM 235 C5 DC A 7 6.204 2.619 7.091 1.00 0.00 C ATOM 236 C6 DC A 7 7.506 2.724 6.774 1.00 0.00 C ATOM 0 H5' DC A 7 10.107 -0.440 4.024 1.00 0.00 H new ATOM 0 H5'' DC A 7 11.848 -0.482 4.225 1.00 0.00 H new ATOM 0 H4' DC A 7 11.669 1.618 3.515 1.00 0.00 H new ATOM 0 H3' DC A 7 12.233 1.742 6.175 1.00 0.00 H new ATOM 0 H2' DC A 7 9.904 1.999 6.954 1.00 0.00 H new ATOM 0 H2'' DC A 7 10.457 3.659 6.858 1.00 0.00 H new ATOM 0 H1' DC A 7 9.456 4.023 4.733 1.00 0.00 H new ATOM 0 H41 DC A 7 3.609 2.467 7.230 1.00 0.00 H new ATOM 0 H42 DC A 7 3.276 2.632 5.502 1.00 0.00 H new ATOM 0 H5 DC A 7 5.889 2.495 8.117 1.00 0.00 H new ATOM 0 H6 DC A 7 8.250 2.684 7.555 1.00 0.00 H new HETATM 248 P XAE A 8 13.585 3.974 5.570 1.00 0.00 P HETATM 249 OP1 XAE A 8 14.656 3.318 4.787 1.00 0.00 O HETATM 250 OP2 XAE A 8 13.570 3.850 7.046 1.00 0.00 O HETATM 251 C5' XAE A 8 13.102 5.991 3.923 1.00 0.00 C HETATM 252 C4' XAE A 8 12.488 7.385 4.012 1.00 0.00 C HETATM 253 O4' XAE A 8 11.100 7.259 4.362 1.00 0.00 O HETATM 254 C3' XAE A 8 13.095 8.283 5.093 1.00 0.00 C HETATM 255 C2' XAE A 8 12.140 8.133 6.267 1.00 0.00 C HETATM 256 C1' XAE A 8 10.804 8.003 5.548 1.00 0.00 C HETATM 257 O5' XAE A 8 13.575 5.541 5.198 1.00 0.00 O HETATM 258 N9 XAE A 8 9.778 7.320 6.321 1.00 0.00 N HETATM 259 C8 XAE A 8 9.980 6.349 7.272 1.00 0.00 C HETATM 260 N7 XAE A 8 8.850 5.922 7.785 1.00 0.00 N HETATM 261 C5 XAE A 8 5.661 7.449 6.518 1.00 0.00 C HETATM 262 C4 XAE A 8 6.231 8.342 5.585 1.00 0.00 C HETATM 263 C6 XAE A 8 4.239 7.444 6.635 1.00 0.00 C HETATM 264 N6 XAE A 8 3.600 6.637 7.482 1.00 0.00 N HETATM 265 N1 XAE A 8 3.517 8.269 5.871 1.00 0.00 N HETATM 266 C2 XAE A 8 4.169 9.067 5.025 1.00 0.00 C HETATM 267 N3 XAE A 8 5.487 9.183 4.806 1.00 0.00 N HETATM 268 C10 XAE A 8 8.418 7.528 6.222 1.00 0.00 C HETATM 269 C11 XAE A 8 7.872 6.640 7.149 1.00 0.00 C HETATM 270 CP XAE A 8 6.478 6.594 7.305 1.00 0.00 C HETATM 271 CD XAE A 8 7.618 8.381 5.437 1.00 0.00 C HETATM 272 O3' XAE A 8 12.981 9.634 4.629 1.00 0.00 O HETATM 0 HN62 XAE A 8 2.582 6.661 7.539 1.00 0.00 H new HETATM 0 HN61 XAE A 8 4.129 5.996 8.073 1.00 0.00 H new HETATM 0 H5'2 XAE A 8 12.360 5.290 3.541 1.00 0.00 H new HETATM 0 H5'1 XAE A 8 13.927 6.001 3.211 1.00 0.00 H new HETATM 0 H2'2 XAE A 8 12.368 7.256 6.873 1.00 0.00 H new HETATM 0 H2'1 XAE A 8 12.167 8.996 6.932 1.00 0.00 H new HETATM 0 HP XAE A 8 6.027 5.909 8.023 1.00 0.00 H new HETATM 0 HD XAE A 8 8.077 9.064 4.722 1.00 0.00 H new HETATM 0 H8 XAE A 8 10.962 5.978 7.565 1.00 0.00 H new HETATM 0 H4' XAE A 8 12.671 7.838 3.038 1.00 0.00 H new HETATM 0 H3' XAE A 8 14.130 8.042 5.335 1.00 0.00 H new HETATM 0 H2 XAE A 8 3.538 9.721 4.423 1.00 0.00 H new HETATM 0 H1' XAE A 8 10.389 8.993 5.357 1.00 0.00 H new HETATM 286 P XGA A 9 13.995 10.772 5.150 1.00 0.00 P HETATM 287 OP1 XGA A 9 15.136 10.842 4.208 1.00 0.00 O HETATM 288 OP2 XGA A 9 14.244 10.549 6.592 1.00 0.00 O HETATM 289 C5' XGA A 9 12.202 12.278 3.912 1.00 0.00 C HETATM 290 O5' XGA A 9 13.130 12.123 4.992 1.00 0.00 O HETATM 291 C4' XGA A 9 11.063 13.227 4.277 1.00 0.00 C HETATM 292 O4' XGA A 9 10.023 12.475 4.923 1.00 0.00 O HETATM 293 C3' XGA A 9 11.434 14.332 5.268 1.00 0.00 C HETATM 294 C2' XGA A 9 10.967 13.794 6.612 1.00 0.00 C HETATM 295 C1' XGA A 9 9.719 13.024 6.210 1.00 0.00 C HETATM 296 N9 XGA A 9 9.371 11.959 7.133 1.00 0.00 N HETATM 297 C8 XGA A 9 10.216 10.991 7.615 1.00 0.00 C HETATM 298 N7 XGA A 9 9.601 10.159 8.424 1.00 0.00 N HETATM 299 C4 XGA A 9 5.785 11.867 8.257 1.00 0.00 C HETATM 300 C5 XGA A 9 5.941 10.726 9.070 1.00 0.00 C HETATM 301 N3 XGA A 9 4.612 12.498 8.127 1.00 0.00 N HETATM 302 C2 XGA A 9 3.561 11.995 8.814 1.00 0.00 C HETATM 303 N2 XGA A 9 2.365 12.618 8.688 1.00 0.00 N HETATM 304 N1 XGA A 9 3.625 10.910 9.613 1.00 0.00 N HETATM 305 C6 XGA A 9 4.827 10.243 9.761 1.00 0.00 C HETATM 306 O6 XGA A 9 4.896 9.244 10.475 1.00 0.00 O HETATM 307 C10 XGA A 9 8.124 11.728 7.674 1.00 0.00 C HETATM 308 C11 XGA A 9 8.305 10.599 8.473 1.00 0.00 C HETATM 309 CP XGA A 9 7.207 10.086 9.181 1.00 0.00 C HETATM 310 CD XGA A 9 6.878 12.371 7.555 1.00 0.00 C HETATM 311 O3' XGA A 9 10.610 15.462 4.959 1.00 0.00 O HETATM 0 HN22 XGA A 9 1.551 12.266 9.192 1.00 0.00 H new HETATM 0 HN21 XGA A 9 2.278 13.439 8.089 1.00 0.00 H new HETATM 0 H5'2 XGA A 9 12.725 12.658 3.035 1.00 0.00 H new HETATM 0 H5'1 XGA A 9 11.792 11.305 3.642 1.00 0.00 H new HETATM 0 H2'2 XGA A 9 11.713 13.151 7.079 1.00 0.00 H new HETATM 0 H2'1 XGA A 9 10.746 14.593 7.320 1.00 0.00 H new HETATM 0 HP XGA A 9 7.323 9.204 9.811 1.00 0.00 H new HETATM 0 HN1 XGA A 9 2.793 10.584 10.104 1.00 0.00 H new HETATM 0 HD XGA A 9 6.769 13.252 6.922 1.00 0.00 H new HETATM 0 H8 XGA A 9 11.273 10.921 7.357 1.00 0.00 H new HETATM 0 H4' XGA A 9 10.772 13.691 3.335 1.00 0.00 H new HETATM 0 H3' XGA A 9 12.490 14.601 5.249 1.00 0.00 H new HETATM 0 H1' XGA A 9 8.855 13.689 6.209 1.00 0.00 H new ATOM 325 P DT A 10 11.066 16.957 5.356 1.00 0.00 P ATOM 326 OP1 DT A 10 10.870 17.828 4.175 1.00 0.00 O ATOM 327 OP2 DT A 10 12.394 16.884 6.005 1.00 0.00 O ATOM 328 O5' DT A 10 9.980 17.370 6.472 1.00 0.00 O ATOM 329 C5' DT A 10 8.581 17.178 6.233 1.00 0.00 C ATOM 330 C4' DT A 10 7.716 17.977 7.207 1.00 0.00 C ATOM 331 O4' DT A 10 7.040 17.063 8.083 1.00 0.00 O ATOM 332 C3' DT A 10 8.483 18.938 8.125 1.00 0.00 C ATOM 333 O3' DT A 10 7.704 20.109 8.387 1.00 0.00 O ATOM 334 C2' DT A 10 8.657 18.118 9.396 1.00 0.00 C ATOM 335 C1' DT A 10 7.347 17.347 9.448 1.00 0.00 C ATOM 336 N1 DT A 10 7.456 16.071 10.191 1.00 0.00 N ATOM 337 C2 DT A 10 6.474 15.789 11.130 1.00 0.00 C ATOM 338 O2 DT A 10 5.526 16.543 11.346 1.00 0.00 O ATOM 339 N3 DT A 10 6.611 14.595 11.811 1.00 0.00 N ATOM 340 C4 DT A 10 7.623 13.669 11.641 1.00 0.00 C ATOM 341 O4 DT A 10 7.637 12.637 12.309 1.00 0.00 O ATOM 342 C5 DT A 10 8.600 14.040 10.644 1.00 0.00 C ATOM 343 C7 DT A 10 9.774 13.108 10.359 1.00 0.00 C ATOM 344 C6 DT A 10 8.492 15.200 9.964 1.00 0.00 C ATOM 0 H5' DT A 10 8.341 16.118 6.321 1.00 0.00 H new ATOM 0 H5'' DT A 10 8.344 17.475 5.211 1.00 0.00 H new ATOM 0 H4' DT A 10 7.056 18.569 6.573 1.00 0.00 H new ATOM 0 H3' DT A 10 9.424 19.288 7.700 1.00 0.00 H new ATOM 0 H2' DT A 10 9.520 17.455 9.340 1.00 0.00 H new ATOM 0 H2'' DT A 10 8.796 18.749 10.274 1.00 0.00 H new ATOM 0 HO3' DT A 10 8.206 20.711 8.975 1.00 0.00 H new ATOM 0 H1' DT A 10 6.586 17.932 9.964 1.00 0.00 H new ATOM 0 H3 DT A 10 5.897 14.376 12.506 1.00 0.00 H new ATOM 0 H71 DT A 10 10.081 13.217 9.319 1.00 0.00 H new ATOM 0 H72 DT A 10 10.608 13.364 11.012 1.00 0.00 H new ATOM 0 H73 DT A 10 9.473 12.077 10.542 1.00 0.00 H new ATOM 0 H6 DT A 10 9.238 15.449 9.224 1.00 0.00 H new TER 358 DT A 10 HETATM 359 C5' XAE B 11 -3.178 9.384 18.722 1.00 0.00 C HETATM 360 C4' XAE B 11 -3.372 10.312 17.525 1.00 0.00 C HETATM 361 O4' XAE B 11 -2.178 11.083 17.335 1.00 0.00 O HETATM 362 C3' XAE B 11 -3.605 9.601 16.196 1.00 0.00 C HETATM 363 C2' XAE B 11 -2.220 9.513 15.574 1.00 0.00 C HETATM 364 C1' XAE B 11 -1.555 10.787 16.077 1.00 0.00 C HETATM 365 O5' XAE B 11 -3.879 8.149 18.554 1.00 0.00 O HETATM 366 N9 XAE B 11 -0.123 10.645 16.261 1.00 0.00 N HETATM 367 C8 XAE B 11 0.501 9.920 17.246 1.00 0.00 C HETATM 368 N7 XAE B 11 1.808 9.983 17.151 1.00 0.00 N HETATM 369 C5 XAE B 11 3.262 12.024 14.358 1.00 0.00 C HETATM 370 C4 XAE B 11 2.051 12.455 13.778 1.00 0.00 C HETATM 371 C6 XAE B 11 4.474 12.464 13.750 1.00 0.00 C HETATM 372 N6 XAE B 11 5.673 12.119 14.222 1.00 0.00 N HETATM 373 N1 XAE B 11 4.416 13.254 12.675 1.00 0.00 N HETATM 374 C2 XAE B 11 3.215 13.598 12.215 1.00 0.00 C HETATM 375 N3 XAE B 11 1.999 13.265 12.674 1.00 0.00 N HETATM 376 C10 XAE B 11 0.861 11.214 15.479 1.00 0.00 C HETATM 377 C11 XAE B 11 2.050 10.779 16.063 1.00 0.00 C HETATM 378 CP XAE B 11 3.269 11.184 15.502 1.00 0.00 C HETATM 379 CD XAE B 11 0.841 12.047 14.343 1.00 0.00 C HETATM 380 O3' XAE B 11 -4.378 10.487 15.378 1.00 0.00 O HETATM 0 HN62 XAE B 11 6.519 12.454 13.760 1.00 0.00 H new HETATM 0 HN61 XAE B 11 5.744 11.521 15.045 1.00 0.00 H new HETATM 0 H5'2 XAE B 11 -2.115 9.183 18.858 1.00 0.00 H new HETATM 0 H5'1 XAE B 11 -3.527 9.880 19.627 1.00 0.00 H new HETATM 0 H2'2 XAE B 11 -1.685 8.620 15.898 1.00 0.00 H new HETATM 0 H2'1 XAE B 11 -2.265 9.480 14.485 1.00 0.00 H new HETATM 0 HP XAE B 11 4.212 10.857 15.940 1.00 0.00 H new HETATM 0 HD XAE B 11 -0.107 12.369 13.911 1.00 0.00 H new HETATM 0 H8 XAE B 11 -0.027 9.358 18.016 1.00 0.00 H new HETATM 0 H4' XAE B 11 -4.257 10.900 17.766 1.00 0.00 H new HETATM 0 H3' XAE B 11 -4.098 8.634 16.298 1.00 0.00 H new HETATM 0 H2 XAE B 11 3.220 14.245 11.337 1.00 0.00 H new HETATM 0 H1' XAE B 11 -1.682 11.582 15.342 1.00 0.00 H new ATOM 395 P DC B 12 -5.555 9.923 14.431 1.00 0.00 P ATOM 396 OP1 DC B 12 -5.619 8.452 14.590 1.00 0.00 O ATOM 397 OP2 DC B 12 -6.766 10.743 14.662 1.00 0.00 O ATOM 398 O5' DC B 12 -5.006 10.243 12.949 1.00 0.00 O ATOM 399 C5' DC B 12 -4.030 11.270 12.734 1.00 0.00 C ATOM 400 C4' DC B 12 -3.765 11.500 11.247 1.00 0.00 C ATOM 401 O4' DC B 12 -2.353 11.400 11.005 1.00 0.00 O ATOM 402 C3' DC B 12 -4.414 10.483 10.307 1.00 0.00 C ATOM 403 O3' DC B 12 -4.769 11.184 9.112 1.00 0.00 O ATOM 404 C2' DC B 12 -3.288 9.529 9.947 1.00 0.00 C ATOM 405 C1' DC B 12 -2.076 10.449 9.972 1.00 0.00 C ATOM 406 N1 DC B 12 -0.819 9.735 10.300 1.00 0.00 N ATOM 407 C2 DC B 12 0.288 9.971 9.495 1.00 0.00 C ATOM 408 O2 DC B 12 0.218 10.761 8.554 1.00 0.00 O ATOM 409 N3 DC B 12 1.450 9.320 9.776 1.00 0.00 N ATOM 410 C4 DC B 12 1.528 8.470 10.808 1.00 0.00 C ATOM 411 N4 DC B 12 2.696 7.868 11.031 1.00 0.00 N ATOM 412 C5 DC B 12 0.394 8.222 11.642 1.00 0.00 C ATOM 413 C6 DC B 12 -0.751 8.870 11.357 1.00 0.00 C ATOM 0 H5' DC B 12 -3.099 10.996 13.231 1.00 0.00 H new ATOM 0 H5'' DC B 12 -4.373 12.199 13.190 1.00 0.00 H new ATOM 0 H4' DC B 12 -4.192 12.481 11.036 1.00 0.00 H new ATOM 0 H3' DC B 12 -5.281 9.985 10.740 1.00 0.00 H new ATOM 0 H2' DC B 12 -3.197 8.715 10.666 1.00 0.00 H new ATOM 0 H2'' DC B 12 -3.435 9.074 8.967 1.00 0.00 H new ATOM 0 H1' DC B 12 -1.925 10.896 8.989 1.00 0.00 H new ATOM 0 H41 DC B 12 2.793 7.214 11.808 1.00 0.00 H new ATOM 0 H42 DC B 12 3.493 8.061 10.425 1.00 0.00 H new ATOM 0 H5 DC B 12 0.454 7.536 12.474 1.00 0.00 H new ATOM 0 H6 DC B 12 -1.625 8.705 11.970 1.00 0.00 H new ATOM 425 P DT B 13 -6.043 10.730 8.238 1.00 0.00 P ATOM 426 OP1 DT B 13 -7.156 11.665 8.522 1.00 0.00 O ATOM 427 OP2 DT B 13 -6.239 9.274 8.419 1.00 0.00 O ATOM 428 O5' DT B 13 -5.542 10.987 6.731 1.00 0.00 O ATOM 429 C5' DT B 13 -4.774 12.150 6.405 1.00 0.00 C ATOM 430 C4' DT B 13 -3.896 11.921 5.178 1.00 0.00 C ATOM 431 O4' DT B 13 -2.634 11.375 5.597 1.00 0.00 O ATOM 432 C3' DT B 13 -4.455 10.919 4.165 1.00 0.00 C ATOM 433 O3' DT B 13 -4.077 11.385 2.865 1.00 0.00 O ATOM 434 C2' DT B 13 -3.669 9.643 4.429 1.00 0.00 C ATOM 435 C1' DT B 13 -2.316 10.211 4.832 1.00 0.00 C ATOM 436 N1 DT B 13 -1.510 9.286 5.665 1.00 0.00 N ATOM 437 C2 DT B 13 -0.151 9.213 5.400 1.00 0.00 C ATOM 438 O2 DT B 13 0.383 9.873 4.511 1.00 0.00 O ATOM 439 N3 DT B 13 0.578 8.347 6.193 1.00 0.00 N ATOM 440 C4 DT B 13 0.078 7.558 7.213 1.00 0.00 C ATOM 441 O4 DT B 13 0.828 6.826 7.855 1.00 0.00 O ATOM 442 C5 DT B 13 -1.345 7.695 7.421 1.00 0.00 C ATOM 443 C7 DT B 13 -2.030 6.872 8.509 1.00 0.00 C ATOM 444 C6 DT B 13 -2.081 8.535 6.662 1.00 0.00 C ATOM 0 H5' DT B 13 -4.148 12.423 7.255 1.00 0.00 H new ATOM 0 H5'' DT B 13 -5.445 12.989 6.221 1.00 0.00 H new ATOM 0 H4' DT B 13 -3.827 12.898 4.699 1.00 0.00 H new ATOM 0 H3' DT B 13 -5.535 10.786 4.233 1.00 0.00 H new ATOM 0 H2' DT B 13 -4.115 9.041 5.220 1.00 0.00 H new ATOM 0 H2'' DT B 13 -3.603 9.009 3.545 1.00 0.00 H new ATOM 0 H1' DT B 13 -1.711 10.405 3.946 1.00 0.00 H new ATOM 0 H3 DT B 13 1.579 8.284 6.009 1.00 0.00 H new ATOM 0 H71 DT B 13 -1.498 5.930 8.642 1.00 0.00 H new ATOM 0 H72 DT B 13 -2.022 7.429 9.446 1.00 0.00 H new ATOM 0 H73 DT B 13 -3.060 6.668 8.217 1.00 0.00 H new ATOM 0 H6 DT B 13 -3.142 8.618 6.843 1.00 0.00 H new HETATM 457 P XGA B 14 -5.077 11.231 1.611 1.00 0.00 P HETATM 458 OP1 XGA B 14 -5.509 12.584 1.196 1.00 0.00 O HETATM 459 OP2 XGA B 14 -6.088 10.202 1.943 1.00 0.00 O HETATM 460 C5' XGA B 14 -2.842 11.237 0.195 1.00 0.00 C HETATM 461 O5' XGA B 14 -4.114 10.637 0.467 1.00 0.00 O HETATM 462 C4' XGA B 14 -1.998 10.370 -0.736 1.00 0.00 C HETATM 463 O4' XGA B 14 -1.149 9.529 0.059 1.00 0.00 O HETATM 464 C3' XGA B 14 -2.800 9.420 -1.622 1.00 0.00 C HETATM 465 C2' XGA B 14 -2.751 8.090 -0.885 1.00 0.00 C HETATM 466 C1' XGA B 14 -1.380 8.144 -0.221 1.00 0.00 C HETATM 467 N9 XGA B 14 -1.300 7.375 1.010 1.00 0.00 N HETATM 468 C8 XGA B 14 -2.295 7.231 1.944 1.00 0.00 C HETATM 469 N7 XGA B 14 -1.920 6.483 2.954 1.00 0.00 N HETATM 470 C4 XGA B 14 1.977 5.643 1.678 1.00 0.00 C HETATM 471 C5 XGA B 14 1.567 5.087 2.907 1.00 0.00 C HETATM 472 N3 XGA B 14 3.203 5.440 1.175 1.00 0.00 N HETATM 473 C2 XGA B 14 4.048 4.670 1.902 1.00 0.00 C HETATM 474 N2 XGA B 14 5.292 4.452 1.413 1.00 0.00 N HETATM 475 N1 XGA B 14 3.732 4.103 3.082 1.00 0.00 N HETATM 476 C6 XGA B 14 2.473 4.300 3.618 1.00 0.00 C HETATM 477 O6 XGA B 14 2.169 3.781 4.691 1.00 0.00 O HETATM 478 C10 XGA B 14 -0.205 6.663 1.458 1.00 0.00 C HETATM 479 C11 XGA B 14 -0.630 6.122 2.672 1.00 0.00 C HETATM 480 CP XGA B 14 0.259 5.326 3.409 1.00 0.00 C HETATM 481 CD XGA B 14 1.090 6.436 0.949 1.00 0.00 C HETATM 482 O3' XGA B 14 -2.064 9.254 -2.838 1.00 0.00 O HETATM 0 HN22 XGA B 14 5.952 3.877 1.936 1.00 0.00 H new HETATM 0 HN21 XGA B 14 5.569 4.863 0.522 1.00 0.00 H new HETATM 0 H5'2 XGA B 14 -2.991 12.218 -0.256 1.00 0.00 H new HETATM 0 H5'1 XGA B 14 -2.306 11.395 1.131 1.00 0.00 H new HETATM 0 H2'2 XGA B 14 -3.555 7.999 -0.154 1.00 0.00 H new HETATM 0 H2'1 XGA B 14 -2.841 7.243 -1.565 1.00 0.00 H new HETATM 0 HP XGA B 14 -0.051 4.894 4.360 1.00 0.00 H new HETATM 0 HN1 XGA B 14 4.417 3.532 3.577 1.00 0.00 H new HETATM 0 HD XGA B 14 1.394 6.874 -0.002 1.00 0.00 H new HETATM 0 H8 XGA B 14 -3.282 7.685 1.857 1.00 0.00 H new HETATM 0 H4' XGA B 14 -1.464 11.072 -1.376 1.00 0.00 H new HETATM 0 H3' XGA B 14 -3.813 9.768 -1.825 1.00 0.00 H new HETATM 0 H1' XGA B 14 -0.634 7.704 -0.883 1.00 0.00 H new ATOM 496 P DC B 15 -2.832 9.002 -4.234 1.00 0.00 P ATOM 497 OP1 DC B 15 -2.692 10.220 -5.065 1.00 0.00 O ATOM 498 OP2 DC B 15 -4.178 8.463 -3.936 1.00 0.00 O ATOM 499 O5' DC B 15 -1.960 7.829 -4.909 1.00 0.00 O ATOM 500 C5' DC B 15 -0.529 7.883 -4.904 1.00 0.00 C ATOM 501 C4' DC B 15 0.087 6.560 -5.353 1.00 0.00 C ATOM 502 O4' DC B 15 0.311 5.737 -4.198 1.00 0.00 O ATOM 503 C3' DC B 15 -0.795 5.725 -6.281 1.00 0.00 C ATOM 504 O3' DC B 15 0.079 4.975 -7.130 1.00 0.00 O ATOM 505 C2' DC B 15 -1.473 4.730 -5.350 1.00 0.00 C ATOM 506 C1' DC B 15 -0.388 4.492 -4.307 1.00 0.00 C ATOM 507 N1 DC B 15 -0.937 4.139 -2.977 1.00 0.00 N ATOM 508 C2 DC B 15 -0.394 3.040 -2.325 1.00 0.00 C ATOM 509 O2 DC B 15 0.517 2.394 -2.841 1.00 0.00 O ATOM 510 N3 DC B 15 -0.880 2.705 -1.100 1.00 0.00 N ATOM 511 C4 DC B 15 -1.858 3.419 -0.529 1.00 0.00 C ATOM 512 N4 DC B 15 -2.272 3.048 0.683 1.00 0.00 N ATOM 513 C5 DC B 15 -2.424 4.550 -1.193 1.00 0.00 C ATOM 514 C6 DC B 15 -1.937 4.874 -2.406 1.00 0.00 C ATOM 0 H5' DC B 15 -0.177 8.127 -3.901 1.00 0.00 H new ATOM 0 H5'' DC B 15 -0.193 8.683 -5.563 1.00 0.00 H new ATOM 0 H4' DC B 15 0.992 6.838 -5.893 1.00 0.00 H new ATOM 0 H3' DC B 15 -1.494 6.319 -6.870 1.00 0.00 H new ATOM 0 H2' DC B 15 -2.383 5.137 -4.908 1.00 0.00 H new ATOM 0 H2'' DC B 15 -1.753 3.812 -5.866 1.00 0.00 H new ATOM 0 H1' DC B 15 0.242 3.657 -4.614 1.00 0.00 H new ATOM 0 H41 DC B 15 -3.015 3.568 1.149 1.00 0.00 H new ATOM 0 H42 DC B 15 -1.845 2.244 1.144 1.00 0.00 H new ATOM 0 H5 DC B 15 -3.216 5.126 -0.738 1.00 0.00 H new ATOM 0 H6 DC B 15 -2.342 5.725 -2.934 1.00 0.00 H new ATOM 526 P DG B 16 -0.349 4.621 -8.644 1.00 0.00 P ATOM 527 OP1 DG B 16 -0.014 5.779 -9.501 1.00 0.00 O ATOM 528 OP2 DG B 16 -1.731 4.093 -8.622 1.00 0.00 O ATOM 529 O5' DG B 16 0.646 3.410 -9.021 1.00 0.00 O ATOM 530 C5' DG B 16 1.966 3.350 -8.473 1.00 0.00 C ATOM 531 C4' DG B 16 2.451 1.911 -8.318 1.00 0.00 C ATOM 532 O4' DG B 16 2.011 1.409 -7.050 1.00 0.00 O ATOM 533 C3' DG B 16 1.902 0.929 -9.353 1.00 0.00 C ATOM 534 O3' DG B 16 2.909 -0.070 -9.544 1.00 0.00 O ATOM 535 C2' DG B 16 0.732 0.252 -8.651 1.00 0.00 C ATOM 536 C1' DG B 16 1.202 0.237 -7.203 1.00 0.00 C ATOM 537 N9 DG B 16 0.091 0.310 -6.236 1.00 0.00 N ATOM 538 C8 DG B 16 -0.926 1.228 -6.161 1.00 0.00 C ATOM 539 N7 DG B 16 -1.722 1.045 -5.143 1.00 0.00 N ATOM 540 C5 DG B 16 -1.197 -0.073 -4.502 1.00 0.00 C ATOM 541 C6 DG B 16 -1.638 -0.744 -3.329 1.00 0.00 C ATOM 542 O6 DG B 16 -2.610 -0.483 -2.625 1.00 0.00 O ATOM 543 N1 DG B 16 -0.823 -1.822 -3.021 1.00 0.00 N ATOM 544 C2 DG B 16 0.277 -2.215 -3.753 1.00 0.00 C ATOM 545 N2 DG B 16 0.928 -3.302 -3.340 1.00 0.00 N ATOM 546 N3 DG B 16 0.696 -1.593 -4.855 1.00 0.00 N ATOM 547 C4 DG B 16 -0.087 -0.532 -5.166 1.00 0.00 C ATOM 0 H5' DG B 16 1.979 3.844 -7.502 1.00 0.00 H new ATOM 0 H5'' DG B 16 2.653 3.897 -9.119 1.00 0.00 H new ATOM 0 H4' DG B 16 3.533 1.966 -8.435 1.00 0.00 H new ATOM 0 H3' DG B 16 1.625 1.399 -10.297 1.00 0.00 H new ATOM 0 H2' DG B 16 -0.196 0.810 -8.774 1.00 0.00 H new ATOM 0 H2'' DG B 16 0.553 -0.753 -9.033 1.00 0.00 H new ATOM 0 H1' DG B 16 1.730 -0.695 -7.003 1.00 0.00 H new ATOM 0 H8 DG B 16 -1.056 2.026 -6.877 1.00 0.00 H new ATOM 0 H1 DG B 16 -1.055 -2.366 -2.190 1.00 0.00 H new ATOM 0 H21 DG B 16 1.748 -3.630 -3.851 1.00 0.00 H new ATOM 0 H22 DG B 16 0.606 -3.806 -2.513 1.00 0.00 H new HETATM 559 P XTY B 17 3.368 -0.518 -11.023 1.00 0.00 P HETATM 560 OP1 XTY B 17 2.528 0.201 -12.009 1.00 0.00 O HETATM 561 OP2 XTY B 17 4.843 -0.418 -11.101 1.00 0.00 O HETATM 562 C5' XTY B 17 3.176 -2.905 -9.904 1.00 0.00 C HETATM 563 C4' XTY B 17 2.433 -4.232 -10.019 1.00 0.00 C HETATM 564 O4' XTY B 17 1.338 -4.228 -9.092 1.00 0.00 O HETATM 565 C3' XTY B 17 1.810 -4.498 -11.388 1.00 0.00 C HETATM 566 C2' XTY B 17 0.359 -4.081 -11.209 1.00 0.00 C HETATM 567 C1' XTY B 17 0.092 -4.468 -9.753 1.00 0.00 C HETATM 568 O5' XTY B 17 2.966 -2.076 -11.054 1.00 0.00 O HETATM 569 C2 XTY B 17 -0.764 -5.019 -5.737 1.00 0.00 C HETATM 570 O2 XTY B 17 -0.188 -5.893 -5.090 1.00 0.00 O HETATM 571 N3 XTY B 17 -1.713 -4.205 -5.143 1.00 0.00 N HETATM 572 C4 XTY B 17 -2.407 -3.205 -5.789 1.00 0.00 C HETATM 573 O4 XTY B 17 -3.241 -2.534 -5.187 1.00 0.00 O HETATM 574 C5 XTY B 17 -2.134 -2.993 -7.145 1.00 0.00 C HETATM 575 C6 XTY B 17 -1.169 -3.807 -7.786 1.00 0.00 C HETATM 576 N XTY B 17 -0.487 -4.811 -7.093 1.00 0.00 N HETATM 577 CP XTY B 17 -2.814 -1.982 -7.856 1.00 0.00 C HETATM 578 CD XTY B 17 -1.571 -2.590 -9.853 1.00 0.00 C HETATM 579 C8 XTY B 17 -0.871 -3.618 -9.154 1.00 0.00 C HETATM 580 C7 XTY B 17 -2.527 -1.787 -9.207 1.00 0.00 C HETATM 581 C7A XTY B 17 -3.242 -0.688 -9.987 1.00 0.00 C HETATM 582 O3' XTY B 17 1.829 -5.913 -11.604 1.00 0.00 O HETATM 0 H7A3 XTY B 17 -4.317 -0.870 -9.970 1.00 0.00 H new HETATM 0 H7A2 XTY B 17 -3.030 0.279 -9.531 1.00 0.00 H new HETATM 0 H7A1 XTY B 17 -2.891 -0.687 -11.019 1.00 0.00 H new HETATM 0 H5'2 XTY B 17 2.842 -2.378 -9.010 1.00 0.00 H new HETATM 0 H5'1 XTY B 17 4.242 -3.095 -9.783 1.00 0.00 H new HETATM 0 H2'2 XTY B 17 0.218 -3.014 -11.380 1.00 0.00 H new HETATM 0 H2'1 XTY B 17 -0.304 -4.605 -11.898 1.00 0.00 H new HETATM 0 HP XTY B 17 -3.556 -1.360 -7.355 1.00 0.00 H new HETATM 0 HN3 XTY B 17 -1.913 -4.357 -4.154 1.00 0.00 H new HETATM 0 HN XTY B 17 0.206 -5.387 -7.571 1.00 0.00 H new HETATM 0 HD XTY B 17 -1.360 -2.424 -10.909 1.00 0.00 H new HETATM 0 H4' XTY B 17 3.184 -4.999 -9.827 1.00 0.00 H new HETATM 0 H3' XTY B 17 2.316 -3.986 -12.207 1.00 0.00 H new HETATM 0 H1' XTY B 17 -0.275 -5.492 -9.686 1.00 0.00 H new ATOM 597 P DA B 18 2.644 -6.551 -12.846 1.00 0.00 P ATOM 598 OP1 DA B 18 3.462 -5.482 -13.465 1.00 0.00 O ATOM 599 OP2 DA B 18 1.693 -7.323 -13.676 1.00 0.00 O ATOM 600 O5' DA B 18 3.640 -7.591 -12.118 1.00 0.00 O ATOM 601 C5' DA B 18 4.572 -7.133 -11.131 1.00 0.00 C ATOM 602 C4' DA B 18 4.855 -8.193 -10.067 1.00 0.00 C ATOM 603 O4' DA B 18 3.813 -8.131 -9.082 1.00 0.00 O ATOM 604 C3' DA B 18 4.827 -9.634 -10.554 1.00 0.00 C ATOM 605 O3' DA B 18 5.557 -10.401 -9.590 1.00 0.00 O ATOM 606 C2' DA B 18 3.363 -10.025 -10.419 1.00 0.00 C ATOM 607 C1' DA B 18 2.958 -9.290 -9.147 1.00 0.00 C ATOM 608 N9 DA B 18 1.557 -8.821 -9.205 1.00 0.00 N ATOM 609 C8 DA B 18 0.888 -8.284 -10.276 1.00 0.00 C ATOM 610 N7 DA B 18 -0.315 -7.881 -9.995 1.00 0.00 N ATOM 611 C5 DA B 18 -0.458 -8.172 -8.645 1.00 0.00 C ATOM 612 C6 DA B 18 -1.515 -7.985 -7.747 1.00 0.00 C ATOM 613 N6 DA B 18 -2.671 -7.430 -8.098 1.00 0.00 N ATOM 614 N1 DA B 18 -1.343 -8.390 -6.476 1.00 0.00 N ATOM 615 C2 DA B 18 -0.183 -8.940 -6.130 1.00 0.00 C ATOM 616 N3 DA B 18 0.890 -9.166 -6.880 1.00 0.00 N ATOM 617 C4 DA B 18 0.675 -8.749 -8.147 1.00 0.00 C ATOM 0 H5' DA B 18 4.180 -6.236 -10.652 1.00 0.00 H new ATOM 0 H5'' DA B 18 5.506 -6.852 -11.618 1.00 0.00 H new ATOM 0 H4' DA B 18 5.860 -7.966 -9.710 1.00 0.00 H new ATOM 0 H3' DA B 18 5.229 -9.777 -11.557 1.00 0.00 H new ATOM 0 H2' DA B 18 2.774 -9.707 -11.280 1.00 0.00 H new ATOM 0 H2'' DA B 18 3.235 -11.103 -10.326 1.00 0.00 H new ATOM 0 H1' DA B 18 3.050 -9.953 -8.287 1.00 0.00 H new ATOM 0 H8 DA B 18 1.321 -8.204 -11.262 1.00 0.00 H new ATOM 0 H61 DA B 18 -3.412 -7.315 -7.407 1.00 0.00 H new ATOM 0 H62 DA B 18 -2.817 -7.119 -9.059 1.00 0.00 H new ATOM 0 H2 DA B 18 -0.102 -9.245 -5.097 1.00 0.00 H new HETATM 629 P XCS B 19 6.442 -11.675 -10.026 1.00 0.00 P HETATM 630 OP2 XCS B 19 7.741 -11.595 -9.322 1.00 0.00 O HETATM 631 C6 XCS B 19 -0.380 -12.205 -9.843 1.00 0.00 C HETATM 632 C2 XCS B 19 -1.801 -12.250 -7.903 1.00 0.00 C HETATM 633 O2 XCS B 19 -2.056 -12.714 -6.795 1.00 0.00 O HETATM 634 N3 XCS B 19 -2.594 -11.281 -8.466 1.00 0.00 N HETATM 635 C4 XCS B 19 -2.320 -10.766 -9.679 1.00 0.00 C HETATM 636 N4 XCS B 19 -3.143 -9.831 -10.160 1.00 0.00 N HETATM 637 C5 XCS B 19 -1.183 -11.216 -10.422 1.00 0.00 C HETATM 638 OP1 XCS B 19 6.409 -11.790 -11.502 1.00 0.00 O HETATM 639 O5' XCS B 19 5.611 -12.910 -9.407 1.00 0.00 O HETATM 640 C5' XCS B 19 4.552 -12.688 -8.466 1.00 0.00 C HETATM 641 C4' XCS B 19 3.476 -13.768 -8.564 1.00 0.00 C HETATM 642 O4' XCS B 19 2.190 -13.148 -8.759 1.00 0.00 O HETATM 643 C1' XCS B 19 1.517 -13.718 -9.889 1.00 0.00 C HETATM 644 ND XCS B 19 -0.681 -12.720 -8.597 1.00 0.00 N HETATM 645 CP XCS B 19 -0.882 -10.684 -11.694 1.00 0.00 C HETATM 646 CD XCS B 19 1.053 -12.156 -11.802 1.00 0.00 C HETATM 647 C8 XCS B 19 0.756 -12.699 -10.519 1.00 0.00 C HETATM 648 C7 XCS B 19 0.240 -11.159 -12.377 1.00 0.00 C HETATM 649 C7A XCS B 19 0.583 -10.599 -13.755 1.00 0.00 C HETATM 650 C2' XCS B 19 2.659 -14.209 -10.775 1.00 0.00 C HETATM 651 C3' XCS B 19 3.640 -14.731 -9.739 1.00 0.00 C HETATM 652 O3' XCS B 19 3.163 -16.009 -9.309 1.00 0.00 O HETATM 0 HN42 XCS B 19 -2.966 -9.418 -11.076 1.00 0.00 H new HETATM 0 HN41 XCS B 19 -3.948 -9.529 -9.611 1.00 0.00 H new HETATM 0 H7A3 XCS B 19 -0.244 -10.787 -14.440 1.00 0.00 H new HETATM 0 H7A2 XCS B 19 0.754 -9.525 -13.679 1.00 0.00 H new HETATM 0 H7A1 XCS B 19 1.484 -11.084 -14.131 1.00 0.00 H new HETATM 0 H5'2 XCS B 19 4.960 -12.671 -7.455 1.00 0.00 H new HETATM 0 H5'1 XCS B 19 4.104 -11.710 -8.645 1.00 0.00 H new HETATM 0 H2'2 XCS B 19 2.337 -14.989 -11.465 1.00 0.00 H new HETATM 0 H2'1 XCS B 19 3.086 -13.407 -11.377 1.00 0.00 H new HETATM 0 HP XCS B 19 -1.515 -9.915 -12.136 1.00 0.00 H new HETATM 0 HND XCS B 19 -0.089 -13.441 -8.184 1.00 0.00 H new HETATM 0 HD XCS B 19 1.924 -12.518 -12.348 1.00 0.00 H new HETATM 0 H4' XCS B 19 3.565 -14.329 -7.634 1.00 0.00 H new HETATM 0 H3' XCS B 19 4.664 -14.807 -10.104 1.00 0.00 H new HETATM 0 H1' XCS B 19 0.824 -14.525 -9.649 1.00 0.00 H new ATOM 668 P DA B 20 4.189 -17.136 -8.788 1.00 0.00 P ATOM 669 OP1 DA B 20 4.306 -18.175 -9.835 1.00 0.00 O ATOM 670 OP2 DA B 20 5.405 -16.460 -8.280 1.00 0.00 O ATOM 671 O5' DA B 20 3.406 -17.773 -7.533 1.00 0.00 O ATOM 672 C5' DA B 20 2.720 -16.932 -6.597 1.00 0.00 C ATOM 673 C4' DA B 20 1.536 -17.650 -5.953 1.00 0.00 C ATOM 674 O4' DA B 20 0.317 -17.153 -6.535 1.00 0.00 O ATOM 675 C3' DA B 20 1.502 -19.165 -6.179 1.00 0.00 C ATOM 676 O3' DA B 20 0.870 -19.825 -5.079 1.00 0.00 O ATOM 677 C2' DA B 20 0.646 -19.280 -7.433 1.00 0.00 C ATOM 678 C1' DA B 20 -0.404 -18.212 -7.170 1.00 0.00 C ATOM 679 N9 DA B 20 -1.023 -17.702 -8.411 1.00 0.00 N ATOM 680 C8 DA B 20 -0.419 -17.368 -9.598 1.00 0.00 C ATOM 681 N7 DA B 20 -1.253 -16.960 -10.513 1.00 0.00 N ATOM 682 C5 DA B 20 -2.495 -17.028 -9.889 1.00 0.00 C ATOM 683 C6 DA B 20 -3.797 -16.729 -10.324 1.00 0.00 C ATOM 684 N6 DA B 20 -4.082 -16.296 -11.553 1.00 0.00 N ATOM 685 N1 DA B 20 -4.803 -16.906 -9.452 1.00 0.00 N ATOM 686 C2 DA B 20 -4.529 -17.352 -8.231 1.00 0.00 C ATOM 687 N3 DA B 20 -3.356 -17.669 -7.704 1.00 0.00 N ATOM 688 C4 DA B 20 -2.367 -17.478 -8.606 1.00 0.00 C ATOM 0 H5' DA B 20 2.368 -16.034 -7.105 1.00 0.00 H new ATOM 0 H5'' DA B 20 3.415 -16.608 -5.822 1.00 0.00 H new ATOM 0 H4' DA B 20 1.639 -17.460 -4.885 1.00 0.00 H new ATOM 0 H3' DA B 20 2.489 -19.619 -6.273 1.00 0.00 H new ATOM 0 H2' DA B 20 1.216 -19.082 -8.341 1.00 0.00 H new ATOM 0 H2'' DA B 20 0.207 -20.272 -7.542 1.00 0.00 H new ATOM 0 HO3' DA B 20 0.856 -20.791 -5.242 1.00 0.00 H new ATOM 0 H1' DA B 20 -1.221 -18.616 -6.571 1.00 0.00 H new ATOM 0 H8 DA B 20 0.647 -17.437 -9.758 1.00 0.00 H new ATOM 0 H61 DA B 20 -5.048 -16.095 -11.812 1.00 0.00 H new ATOM 0 H62 DA B 20 -3.334 -16.166 -12.234 1.00 0.00 H new ATOM 0 H2 DA B 20 -5.381 -17.473 -7.578 1.00 0.00 H new TER 701 DA B 20