USER MOD reduce.3.24.130724 H: found=0, std=0, add=286, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 286 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 1 DT C7 :methyl -30:sc= -5.91! (180deg=-11.4!) USER MOD Set 1.2: A 12 DT C7 :methyl 150:sc= -4.84! (180deg=-4.69!) USER MOD Single : A 1 DT O5' : rot -4:sc= 0.187 USER MOD Single : A 6 DT C7 :methyl 150:sc= -1.63 (180deg=-1.63) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.116 (180deg=-0.978) USER MOD Single : A 13 DT C7 :methyl -30:sc= -0.131 (180deg=-0.949) USER MOD Single : A 18 DT C7 :methyl 150:sc= -2.08 (180deg=-2.08) USER MOD Single : A 19 DT C7 :methyl 150:sc= -0.147 (180deg=-0.147) USER MOD Single : A 24 DT C7 :methyl -30:sc= -2.33 (180deg=-2.75!) USER MOD Single : A 25 DT C7 :methyl 150:sc= -0.446 (180deg=-0.446) USER MOD Single : A 25 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 7.521 5.290 -3.986 1.00 0.00 O ATOM 2 C5' DT A 1 6.370 5.549 -3.199 1.00 0.00 C ATOM 3 C4' DT A 1 5.114 5.460 -4.034 1.00 0.00 C ATOM 4 O4' DT A 1 3.960 5.495 -3.170 1.00 0.00 O ATOM 5 C3' DT A 1 4.925 6.600 -5.032 1.00 0.00 C ATOM 6 O3' DT A 1 4.986 6.080 -6.372 1.00 0.00 O ATOM 7 C2' DT A 1 3.530 7.152 -4.740 1.00 0.00 C ATOM 8 C1' DT A 1 2.891 6.094 -3.871 1.00 0.00 C ATOM 9 N1 DT A 1 1.909 6.627 -2.898 1.00 0.00 N ATOM 10 C2 DT A 1 0.635 6.935 -3.356 1.00 0.00 C ATOM 11 O2 DT A 1 0.288 6.782 -4.516 1.00 0.00 O ATOM 12 N3 DT A 1 -0.224 7.428 -2.394 1.00 0.00 N ATOM 13 C4 DT A 1 0.061 7.638 -1.051 1.00 0.00 C ATOM 14 O4 DT A 1 -0.806 8.090 -0.306 1.00 0.00 O ATOM 15 C5 DT A 1 1.414 7.291 -0.641 1.00 0.00 C ATOM 16 C7 DT A 1 1.808 7.457 0.797 1.00 0.00 C ATOM 17 C6 DT A 1 2.260 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1.00 0.00 C ATOM 37 O4' DA A 2 3.065 7.354 -7.927 1.00 0.00 O ATOM 38 C3' DA A 2 2.804 7.937 -10.185 1.00 0.00 C ATOM 39 O3' DA A 2 1.572 7.278 -10.544 1.00 0.00 O ATOM 40 C2' DA A 2 2.535 9.172 -9.343 1.00 0.00 C ATOM 41 C1' DA A 2 2.352 8.586 -7.947 1.00 0.00 C ATOM 42 N9 DA A 2 2.862 9.431 -6.854 1.00 0.00 N ATOM 43 C8 DA A 2 4.158 9.538 -6.409 1.00 0.00 C ATOM 44 N7 DA A 2 4.309 10.368 -5.402 1.00 0.00 N ATOM 45 C5 DA A 2 3.023 10.836 -5.161 1.00 0.00 C ATOM 46 C6 DA A 2 2.493 11.750 -4.212 1.00 0.00 C ATOM 47 N6 DA A 2 3.225 12.382 -3.291 1.00 0.00 N ATOM 48 N1 DA A 2 1.161 11.993 -4.246 1.00 0.00 N ATOM 49 C2 DA A 2 0.416 11.362 -5.167 1.00 0.00 C ATOM 50 N3 DA A 2 0.791 10.488 -6.107 1.00 0.00 N ATOM 51 C4 DA A 2 2.121 10.264 -6.052 1.00 0.00 C ATOM 0 H5' DA A 2 5.435 7.542 -10.253 1.00 0.00 H new ATOM 0 H5'' DA A 2 5.325 8.205 -8.634 1.00 0.00 H new ATOM 0 H4' DA A 2 3.521 6.023 -9.540 1.00 0.00 H new ATOM 0 H3' DA A 2 3.310 8.156 -11.125 1.00 0.00 H new ATOM 0 H2' DA A 2 3.365 9.878 -9.381 1.00 0.00 H new ATOM 0 H2'' DA A 2 1.646 9.706 -9.679 1.00 0.00 H new ATOM 0 H1' DA A 2 1.281 8.483 -7.771 1.00 0.00 H new ATOM 0 H8 DA A 2 4.978 8.989 -6.848 1.00 0.00 H new ATOM 0 H61 DA A 2 2.778 13.027 -2.639 1.00 0.00 H new ATOM 0 H62 DA A 2 4.231 12.220 -3.240 1.00 0.00 H new ATOM 0 H2 DA A 2 -0.639 11.594 -5.146 1.00 0.00 H new ATOM 63 P DG A 3 1.522 6.252 -11.790 1.00 0.00 P ATOM 64 OP1 DG A 3 1.722 7.013 -13.049 1.00 0.00 O ATOM 65 OP2 DG A 3 0.293 5.428 -11.674 1.00 0.00 O ATOM 66 O5' DG A 3 2.800 5.326 -11.540 1.00 0.00 O ATOM 67 C5' DG A 3 2.679 3.959 -11.152 1.00 0.00 C ATOM 68 C4' DG A 3 4.033 3.401 -10.763 1.00 0.00 C ATOM 69 O4' DG A 3 4.221 3.546 -9.327 1.00 0.00 O ATOM 70 C3' DG A 3 4.231 1.909 -11.053 1.00 0.00 C ATOM 71 O3' DG A 3 5.576 1.681 -11.519 1.00 0.00 O ATOM 72 C2' DG A 3 4.013 1.271 -9.691 1.00 0.00 C ATOM 73 C1' DG A 3 4.646 2.306 -8.792 1.00 0.00 C ATOM 74 N9 DG A 3 4.253 2.240 -7.375 1.00 0.00 N ATOM 75 C8 DG A 3 5.099 2.167 -6.293 1.00 0.00 C ATOM 76 N7 DG A 3 4.473 2.144 -5.150 1.00 0.00 N ATOM 77 C5 DG A 3 3.132 2.200 -5.488 1.00 0.00 C ATOM 78 C6 DG A 3 1.976 2.205 -4.655 1.00 0.00 C ATOM 79 O6 DG A 3 1.925 2.165 -3.421 1.00 0.00 O ATOM 80 N1 DG A 3 0.797 2.265 -5.404 1.00 0.00 N ATOM 81 C2 DG A 3 0.743 2.313 -6.784 1.00 0.00 C ATOM 82 N2 DG A 3 -0.480 2.343 -7.336 1.00 0.00 N ATOM 83 N3 DG A 3 1.818 2.316 -7.570 1.00 0.00 N ATOM 84 C4 DG A 3 2.974 2.258 -6.861 1.00 0.00 C ATOM 0 H5' DG A 3 2.260 3.377 -11.973 1.00 0.00 H new ATOM 0 H5'' DG A 3 1.988 3.872 -10.314 1.00 0.00 H new ATOM 0 H4' DG A 3 4.743 3.966 -11.367 1.00 0.00 H new ATOM 0 H3' DG A 3 3.566 1.511 -11.820 1.00 0.00 H new ATOM 0 H2' DG A 3 2.956 1.121 -9.469 1.00 0.00 H new ATOM 0 H2'' DG A 3 4.498 0.298 -9.607 1.00 0.00 H new ATOM 0 H1' DG A 3 5.724 2.147 -8.780 1.00 0.00 H new ATOM 0 H8 DG A 3 6.175 2.132 -6.382 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.087 2.274 -4.895 1.00 0.00 H new ATOM 0 H21 DG A 3 -0.581 2.379 -8.350 1.00 0.00 H new ATOM 0 H22 DG A 3 -1.308 2.330 -6.741 1.00 0.00 H new ATOM 96 P DG A 4 6.072 0.201 -11.921 1.00 0.00 P ATOM 97 OP1 DG A 4 7.309 0.312 -12.737 1.00 0.00 O ATOM 98 OP2 DG A 4 4.929 -0.545 -12.505 1.00 0.00 O ATOM 99 O5' DG A 4 6.442 -0.437 -10.505 1.00 0.00 O ATOM 100 C5' DG A 4 7.596 -0.025 -9.777 1.00 0.00 C ATOM 101 C4' DG A 4 7.760 -0.850 -8.516 1.00 0.00 C ATOM 102 O4' DG A 4 6.775 -0.423 -7.534 1.00 0.00 O ATOM 103 C3' DG A 4 7.524 -2.364 -8.708 1.00 0.00 C ATOM 104 O3' DG A 4 8.401 -3.169 -7.894 1.00 0.00 O ATOM 105 C2' DG A 4 6.125 -2.529 -8.184 1.00 0.00 C ATOM 106 C1' DG A 4 6.168 -1.576 -7.011 1.00 0.00 C ATOM 107 N9 DG A 4 4.857 -1.237 -6.485 1.00 0.00 N ATOM 108 C8 DG A 4 3.711 -1.123 -7.216 1.00 0.00 C ATOM 109 N7 DG A 4 2.650 -0.966 -6.481 1.00 0.00 N ATOM 110 C5 DG A 4 3.125 -0.972 -5.181 1.00 0.00 C ATOM 111 C6 DG A 4 2.425 -0.849 -3.953 1.00 0.00 C ATOM 112 O6 DG A 4 1.216 -0.713 -3.786 1.00 0.00 O ATOM 113 N1 DG A 4 3.284 -0.909 -2.851 1.00 0.00 N ATOM 114 C2 DG A 4 4.654 -1.064 -2.928 1.00 0.00 C ATOM 115 N2 DG A 4 5.330 -1.086 -1.758 1.00 0.00 N ATOM 116 N3 DG A 4 5.319 -1.185 -4.079 1.00 0.00 N ATOM 117 C4 DG A 4 4.494 -1.132 -5.160 1.00 0.00 C ATOM 0 H5' DG A 4 7.510 1.030 -9.518 1.00 0.00 H new ATOM 0 H5'' DG A 4 8.482 -0.129 -10.403 1.00 0.00 H new ATOM 0 H4' DG A 4 8.793 -0.693 -8.206 1.00 0.00 H new ATOM 0 H3' DG A 4 7.693 -2.675 -9.739 1.00 0.00 H new ATOM 0 H2' DG A 4 5.370 -2.251 -8.919 1.00 0.00 H new ATOM 0 H2'' DG A 4 5.912 -3.554 -7.880 1.00 0.00 H new ATOM 0 H1' DG A 4 6.699 -2.028 -6.173 1.00 0.00 H new ATOM 0 H8 DG A 4 3.687 -1.159 -8.295 1.00 0.00 H new ATOM 0 H1 DG A 4 2.868 -0.833 -1.923 1.00 0.00 H new ATOM 0 H21 DG A 4 6.344 -1.198 -1.757 1.00 0.00 H new ATOM 0 H22 DG A 4 4.826 -0.990 -0.876 1.00 0.00 H new ATOM 129 P DG A 5 9.997 -3.090 -8.026 1.00 0.00 P ATOM 130 OP1 DG A 5 10.350 -2.435 -9.312 1.00 0.00 O ATOM 131 OP2 DG A 5 10.575 -4.427 -7.749 1.00 0.00 O ATOM 132 O5' DG A 5 10.323 -2.097 -6.822 1.00 0.00 O ATOM 133 C5' DG A 5 11.267 -2.378 -5.789 1.00 0.00 C ATOM 134 C4' DG A 5 10.687 -3.205 -4.642 1.00 0.00 C ATOM 135 O4' DG A 5 9.240 -3.042 -4.541 1.00 0.00 O ATOM 136 C3' DG A 5 10.909 -4.723 -4.722 1.00 0.00 C ATOM 137 O3' DG A 5 11.659 -5.125 -3.561 1.00 0.00 O ATOM 138 C2' DG A 5 9.501 -5.320 -4.695 1.00 0.00 C ATOM 139 C1' DG A 5 8.724 -4.238 -3.988 1.00 0.00 C ATOM 140 N9 DG A 5 7.258 -4.277 -4.185 1.00 0.00 N ATOM 141 C8 DG A 5 6.567 -4.251 -5.374 1.00 0.00 C ATOM 142 N7 DG A 5 5.264 -4.300 -5.219 1.00 0.00 N ATOM 143 C5 DG A 5 5.085 -4.364 -3.846 1.00 0.00 C ATOM 144 C6 DG A 5 3.885 -4.437 -3.071 1.00 0.00 C ATOM 145 O6 DG A 5 2.715 -4.437 -3.467 1.00 0.00 O ATOM 146 N1 DG A 5 4.156 -4.498 -1.702 1.00 0.00 N ATOM 147 C2 DG A 5 5.423 -4.484 -1.151 1.00 0.00 C ATOM 148 N2 DG A 5 5.498 -4.565 0.182 1.00 0.00 N ATOM 149 N3 DG A 5 6.544 -4.408 -1.863 1.00 0.00 N ATOM 150 C4 DG A 5 6.305 -4.353 -3.194 1.00 0.00 C ATOM 0 H5' DG A 5 11.649 -1.438 -5.391 1.00 0.00 H new ATOM 0 H5'' DG A 5 12.115 -2.911 -6.218 1.00 0.00 H new ATOM 0 H4' DG A 5 11.234 -2.813 -3.784 1.00 0.00 H new ATOM 0 H3' DG A 5 11.458 -5.045 -5.607 1.00 0.00 H new ATOM 0 H2' DG A 5 9.118 -5.511 -5.697 1.00 0.00 H new ATOM 0 H2'' DG A 5 9.468 -6.267 -4.156 1.00 0.00 H new ATOM 0 H1' DG A 5 8.844 -4.348 -2.910 1.00 0.00 H new ATOM 0 H8 DG A 5 7.048 -4.196 -6.339 1.00 0.00 H new ATOM 0 H1 DG A 5 3.362 -4.557 -1.064 1.00 0.00 H new ATOM 0 H21 DG A 5 6.408 -4.559 0.643 1.00 0.00 H new ATOM 0 H22 DG A 5 4.645 -4.633 0.738 1.00 0.00 H new ATOM 162 P DT A 6 12.436 -6.532 -3.502 1.00 0.00 P ATOM 163 OP1 DT A 6 13.892 -6.286 -3.662 1.00 0.00 O ATOM 164 OP2 DT A 6 11.789 -7.486 -4.438 1.00 0.00 O ATOM 165 O5' DT A 6 12.147 -6.990 -2.002 1.00 0.00 O ATOM 166 C5' DT A 6 10.812 -7.155 -1.541 1.00 0.00 C ATOM 167 C4' DT A 6 10.705 -6.914 -0.050 1.00 0.00 C ATOM 168 O4' DT A 6 10.739 -5.482 0.224 1.00 0.00 O ATOM 169 C3' DT A 6 9.389 -7.396 0.554 1.00 0.00 C ATOM 170 O3' DT A 6 9.575 -7.797 1.924 1.00 0.00 O ATOM 171 C2' DT A 6 8.531 -6.154 0.471 1.00 0.00 C ATOM 172 C1' DT A 6 9.528 -5.099 0.874 1.00 0.00 C ATOM 173 N1 DT A 6 9.162 -3.730 0.461 1.00 0.00 N ATOM 174 C2 DT A 6 8.083 -3.128 1.096 1.00 0.00 C ATOM 175 O2 DT A 6 7.461 -3.662 2.000 1.00 0.00 O ATOM 176 N3 DT A 6 7.770 -1.867 0.640 1.00 0.00 N ATOM 177 C4 DT A 6 8.425 -1.155 -0.351 1.00 0.00 C ATOM 178 O4 DT A 6 8.039 -0.027 -0.648 1.00 0.00 O ATOM 179 C5 DT A 6 9.550 -1.837 -0.969 1.00 0.00 C ATOM 180 C7 DT A 6 10.321 -1.125 -2.033 1.00 0.00 C ATOM 181 C6 DT A 6 9.858 -3.081 -0.544 1.00 0.00 C ATOM 0 H5' DT A 6 10.468 -8.163 -1.773 1.00 0.00 H new ATOM 0 H5'' DT A 6 10.155 -6.464 -2.070 1.00 0.00 H new ATOM 0 H4' DT A 6 11.539 -7.464 0.385 1.00 0.00 H new ATOM 0 H3' DT A 6 8.961 -8.262 0.049 1.00 0.00 H new ATOM 0 H2' DT A 6 8.137 -5.989 -0.532 1.00 0.00 H new ATOM 0 H2'' DT A 6 7.676 -6.195 1.146 1.00 0.00 H new ATOM 0 H1' DT A 6 9.594 -5.054 1.961 1.00 0.00 H new ATOM 0 H3 DT A 6 6.971 -1.409 1.079 1.00 0.00 H new ATOM 0 H71 DT A 6 11.357 -1.464 -2.020 1.00 0.00 H new ATOM 0 H72 DT A 6 9.881 -1.340 -3.007 1.00 0.00 H new ATOM 0 H73 DT A 6 10.289 -0.051 -1.849 1.00 0.00 H new ATOM 0 H6 DT A 6 10.686 -3.594 -1.010 1.00 0.00 H new ATOM 194 P DT A 7 8.518 -8.786 2.632 1.00 0.00 P ATOM 195 OP1 DT A 7 8.554 -8.557 4.100 1.00 0.00 O ATOM 196 OP2 DT A 7 8.760 -10.166 2.147 1.00 0.00 O ATOM 197 O5' DT A 7 7.121 -8.268 2.051 1.00 0.00 O ATOM 198 C5' DT A 7 6.100 -7.721 2.885 1.00 0.00 C ATOM 199 C4' DT A 7 4.751 -8.296 2.515 1.00 0.00 C ATOM 200 O4' DT A 7 4.319 -7.718 1.259 1.00 0.00 O ATOM 201 C3' DT A 7 4.752 -9.817 2.314 1.00 0.00 C ATOM 202 O3' DT A 7 3.621 -10.438 2.959 1.00 0.00 O ATOM 203 C2' DT A 7 4.652 -9.995 0.816 1.00 0.00 C ATOM 204 C1' DT A 7 3.946 -8.736 0.353 1.00 0.00 C ATOM 205 N1 DT A 7 4.350 -8.332 -0.991 1.00 0.00 N ATOM 206 C2 DT A 7 3.380 -8.031 -1.930 1.00 0.00 C ATOM 207 O2 DT A 7 2.193 -7.992 -1.665 1.00 0.00 O ATOM 208 N3 DT A 7 3.864 -7.767 -3.196 1.00 0.00 N ATOM 209 C4 DT A 7 5.199 -7.765 -3.590 1.00 0.00 C ATOM 210 O4 DT A 7 5.494 -7.510 -4.755 1.00 0.00 O ATOM 211 C5 DT A 7 6.154 -8.085 -2.534 1.00 0.00 C ATOM 212 C7 DT A 7 7.612 -8.130 -2.833 1.00 0.00 C ATOM 213 C6 DT A 7 5.687 -8.345 -1.311 1.00 0.00 C ATOM 0 H5' DT A 7 6.080 -6.636 2.782 1.00 0.00 H new ATOM 0 H5'' DT A 7 6.320 -7.938 3.930 1.00 0.00 H new ATOM 0 H4' DT A 7 4.092 -8.061 3.351 1.00 0.00 H new ATOM 0 H3' DT A 7 5.640 -10.280 2.745 1.00 0.00 H new ATOM 0 H2' DT A 7 5.636 -10.094 0.358 1.00 0.00 H new ATOM 0 H2'' DT A 7 4.087 -10.890 0.556 1.00 0.00 H new ATOM 0 H1' DT A 7 2.871 -8.914 0.325 1.00 0.00 H new ATOM 0 H3 DT A 7 3.173 -7.552 -3.915 1.00 0.00 H new ATOM 0 H71 DT A 7 7.762 -8.430 -3.870 1.00 0.00 H new ATOM 0 H72 DT A 7 8.047 -7.143 -2.674 1.00 0.00 H new ATOM 0 H73 DT A 7 8.097 -8.850 -2.174 1.00 0.00 H new ATOM 0 H6 DT A 7 6.397 -8.578 -0.531 1.00 0.00 H new ATOM 226 P DA A 8 3.458 -10.437 4.565 1.00 0.00 P ATOM 227 OP1 DA A 8 4.655 -9.811 5.182 1.00 0.00 O ATOM 228 OP2 DA A 8 3.094 -11.808 5.006 1.00 0.00 O ATOM 229 O5' DA A 8 2.199 -9.476 4.775 1.00 0.00 O ATOM 230 C5' DA A 8 1.327 -9.165 3.693 1.00 0.00 C ATOM 231 C4' DA A 8 0.144 -8.349 4.163 1.00 0.00 C ATOM 232 O4' DA A 8 -0.427 -7.659 3.023 1.00 0.00 O ATOM 233 C3' DA A 8 -1.009 -9.162 4.752 1.00 0.00 C ATOM 234 O3' DA A 8 -1.757 -8.367 5.695 1.00 0.00 O ATOM 235 C2' DA A 8 -1.850 -9.446 3.524 1.00 0.00 C ATOM 236 C1' DA A 8 -1.749 -8.122 2.790 1.00 0.00 C ATOM 237 N9 DA A 8 -1.971 -8.198 1.338 1.00 0.00 N ATOM 238 C8 DA A 8 -1.030 -8.238 0.334 1.00 0.00 C ATOM 239 N7 DA A 8 -1.543 -8.283 -0.872 1.00 0.00 N ATOM 240 C5 DA A 8 -2.913 -8.269 -0.653 1.00 0.00 C ATOM 241 C6 DA A 8 -4.020 -8.297 -1.532 1.00 0.00 C ATOM 242 N6 DA A 8 -3.908 -8.328 -2.859 1.00 0.00 N ATOM 243 N1 DA A 8 -5.264 -8.277 -0.987 1.00 0.00 N ATOM 244 C2 DA A 8 -5.375 -8.229 0.352 1.00 0.00 C ATOM 245 N3 DA A 8 -4.412 -8.196 1.280 1.00 0.00 N ATOM 246 C4 DA A 8 -3.190 -8.220 0.707 1.00 0.00 C ATOM 0 H5' DA A 8 0.975 -10.087 3.229 1.00 0.00 H new ATOM 0 H5'' DA A 8 1.874 -8.612 2.929 1.00 0.00 H new ATOM 0 H4' DA A 8 0.544 -7.698 4.941 1.00 0.00 H new ATOM 0 H3' DA A 8 -0.691 -10.054 5.292 1.00 0.00 H new ATOM 0 H2' DA A 8 -1.455 -10.274 2.936 1.00 0.00 H new ATOM 0 H2'' DA A 8 -2.879 -9.699 3.779 1.00 0.00 H new ATOM 0 H1' DA A 8 -2.534 -7.464 3.163 1.00 0.00 H new ATOM 0 H8 DA A 8 0.033 -8.233 0.522 1.00 0.00 H new ATOM 0 H61 DA A 8 -4.745 -8.347 -3.441 1.00 0.00 H new ATOM 0 H62 DA A 8 -2.985 -8.333 -3.293 1.00 0.00 H new ATOM 0 H2 DA A 8 -6.386 -8.215 0.733 1.00 0.00 H new ATOM 258 P DG A 9 -1.549 -8.539 7.285 1.00 0.00 P ATOM 259 OP1 DG A 9 -0.968 -9.878 7.561 1.00 0.00 O ATOM 260 OP2 DG A 9 -2.819 -8.189 7.970 1.00 0.00 O ATOM 261 O5' DG A 9 -0.457 -7.424 7.616 1.00 0.00 O ATOM 262 C5' DG A 9 -0.682 -6.047 7.321 1.00 0.00 C ATOM 263 C4' DG A 9 0.635 -5.303 7.236 1.00 0.00 C ATOM 264 O4' DG A 9 1.422 -5.839 6.158 1.00 0.00 O ATOM 265 C3' DG A 9 0.533 -3.823 6.899 1.00 0.00 C ATOM 266 O3' DG A 9 0.294 -3.036 8.081 1.00 0.00 O ATOM 267 C2' DG A 9 1.912 -3.526 6.330 1.00 0.00 C ATOM 268 C1' DG A 9 2.359 -4.859 5.739 1.00 0.00 C ATOM 269 N9 DG A 9 2.433 -4.870 4.271 1.00 0.00 N ATOM 270 C8 DG A 9 3.579 -4.924 3.520 1.00 0.00 C ATOM 271 N7 DG A 9 3.355 -4.897 2.240 1.00 0.00 N ATOM 272 C5 DG A 9 1.981 -4.821 2.128 1.00 0.00 C ATOM 273 C6 DG A 9 1.167 -4.764 0.966 1.00 0.00 C ATOM 274 O6 DG A 9 1.531 -4.766 -0.214 1.00 0.00 O ATOM 275 N1 DG A 9 -0.193 -4.697 1.285 1.00 0.00 N ATOM 276 C2 DG A 9 -0.702 -4.683 2.571 1.00 0.00 C ATOM 277 N2 DG A 9 -2.045 -4.633 2.696 1.00 0.00 N ATOM 278 N3 DG A 9 0.059 -4.733 3.668 1.00 0.00 N ATOM 279 C4 DG A 9 1.385 -4.801 3.373 1.00 0.00 C ATOM 0 H5' DG A 9 -1.310 -5.601 8.093 1.00 0.00 H new ATOM 0 H5'' DG A 9 -1.221 -5.954 6.378 1.00 0.00 H new ATOM 0 H4' DG A 9 1.059 -5.422 8.233 1.00 0.00 H new ATOM 0 H3' DG A 9 -0.287 -3.588 6.220 1.00 0.00 H new ATOM 0 H2' DG A 9 1.871 -2.746 5.570 1.00 0.00 H new ATOM 0 H2'' DG A 9 2.598 -3.182 7.104 1.00 0.00 H new ATOM 0 H1' DG A 9 3.371 -5.056 6.093 1.00 0.00 H new ATOM 0 H8 DG A 9 4.568 -4.983 3.949 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.858 -4.655 0.513 1.00 0.00 H new ATOM 0 H21 DG A 9 -2.471 -4.621 3.623 1.00 0.00 H new ATOM 0 H22 DG A 9 -2.634 -4.608 1.864 1.00 0.00 H new ATOM 291 P DG A 10 0.387 -1.428 8.007 1.00 0.00 P ATOM 292 OP1 DG A 10 -0.282 -0.847 9.200 1.00 0.00 O ATOM 293 OP2 DG A 10 -0.092 -0.998 6.672 1.00 0.00 O ATOM 294 O5' DG A 10 1.962 -1.162 8.111 1.00 0.00 O ATOM 295 C5' DG A 10 2.626 -0.207 7.282 1.00 0.00 C ATOM 296 C4' DG A 10 4.052 -0.636 6.992 1.00 0.00 C ATOM 297 O4' DG A 10 4.096 -1.347 5.721 1.00 0.00 O ATOM 298 C3' DG A 10 5.046 0.517 6.832 1.00 0.00 C ATOM 299 O3' DG A 10 6.360 0.119 7.264 1.00 0.00 O ATOM 300 C2' DG A 10 5.023 0.751 5.344 1.00 0.00 C ATOM 301 C1' DG A 10 4.973 -0.665 4.835 1.00 0.00 C ATOM 302 N9 DG A 10 4.475 -0.792 3.455 1.00 0.00 N ATOM 303 C8 DG A 10 5.243 -0.755 2.322 1.00 0.00 C ATOM 304 N7 DG A 10 4.549 -0.850 1.216 1.00 0.00 N ATOM 305 C5 DG A 10 3.234 -0.954 1.653 1.00 0.00 C ATOM 306 C6 DG A 10 2.023 -1.082 0.911 1.00 0.00 C ATOM 307 O6 DG A 10 1.886 -1.121 -0.310 1.00 0.00 O ATOM 308 N1 DG A 10 0.903 -1.156 1.746 1.00 0.00 N ATOM 309 C2 DG A 10 0.950 -1.110 3.127 1.00 0.00 C ATOM 310 N2 DG A 10 -0.217 -1.191 3.778 1.00 0.00 N ATOM 311 N3 DG A 10 2.074 -0.991 3.825 1.00 0.00 N ATOM 312 C4 DG A 10 3.170 -0.920 3.035 1.00 0.00 C ATOM 0 H5' DG A 10 2.628 0.766 7.773 1.00 0.00 H new ATOM 0 H5'' DG A 10 2.080 -0.091 6.346 1.00 0.00 H new ATOM 0 H4' DG A 10 4.338 -1.238 7.855 1.00 0.00 H new ATOM 0 H3' DG A 10 4.795 1.400 7.421 1.00 0.00 H new ATOM 0 H2' DG A 10 4.156 1.333 5.031 1.00 0.00 H new ATOM 0 H2'' DG A 10 5.908 1.284 4.996 1.00 0.00 H new ATOM 0 H1' DG A 10 5.983 -1.075 4.808 1.00 0.00 H new ATOM 0 H8 DG A 10 6.318 -0.657 2.339 1.00 0.00 H new ATOM 0 H1 DG A 10 -0.012 -1.250 1.305 1.00 0.00 H new ATOM 0 H21 DG A 10 -0.235 -1.162 4.797 1.00 0.00 H new ATOM 0 H22 DG A 10 -1.088 -1.282 3.255 1.00 0.00 H new ATOM 324 P DG A 11 7.491 1.228 7.566 1.00 0.00 P ATOM 325 OP1 DG A 11 8.731 0.543 8.013 1.00 0.00 O ATOM 326 OP2 DG A 11 6.917 2.261 8.465 1.00 0.00 O ATOM 327 O5' DG A 11 7.742 1.873 6.128 1.00 0.00 O ATOM 328 C5' DG A 11 8.712 1.341 5.229 1.00 0.00 C ATOM 329 C4' DG A 11 8.849 2.218 4.000 1.00 0.00 C ATOM 330 O4' DG A 11 7.772 1.921 3.074 1.00 0.00 O ATOM 331 C3' DG A 11 8.767 3.725 4.274 1.00 0.00 C ATOM 332 O3' DG A 11 9.832 4.412 3.592 1.00 0.00 O ATOM 333 C2' DG A 11 7.416 4.130 3.702 1.00 0.00 C ATOM 334 C1' DG A 11 7.225 3.127 2.582 1.00 0.00 C ATOM 335 N9 DG A 11 5.824 2.884 2.204 1.00 0.00 N ATOM 336 C8 DG A 11 4.732 2.856 3.038 1.00 0.00 C ATOM 337 N7 DG A 11 3.622 2.590 2.423 1.00 0.00 N ATOM 338 C5 DG A 11 3.983 2.444 1.104 1.00 0.00 C ATOM 339 C6 DG A 11 3.178 2.163 -0.029 1.00 0.00 C ATOM 340 O6 DG A 11 1.958 1.969 -0.060 1.00 0.00 O ATOM 341 N1 DG A 11 3.936 2.117 -1.204 1.00 0.00 N ATOM 342 C2 DG A 11 5.306 2.310 -1.264 1.00 0.00 C ATOM 343 N2 DG A 11 5.869 2.257 -2.480 1.00 0.00 N ATOM 344 N3 DG A 11 6.066 2.566 -0.201 1.00 0.00 N ATOM 345 C4 DG A 11 5.343 2.623 0.943 1.00 0.00 C ATOM 0 H5' DG A 11 8.423 0.333 4.931 1.00 0.00 H new ATOM 0 H5'' DG A 11 9.675 1.261 5.733 1.00 0.00 H new ATOM 0 H4' DG A 11 9.841 1.995 3.607 1.00 0.00 H new ATOM 0 H3' DG A 11 8.864 3.971 5.331 1.00 0.00 H new ATOM 0 H2' DG A 11 6.623 4.064 4.447 1.00 0.00 H new ATOM 0 H2'' DG A 11 7.422 5.156 3.333 1.00 0.00 H new ATOM 0 H1' DG A 11 7.701 3.514 1.681 1.00 0.00 H new ATOM 0 H8 DG A 11 4.793 3.038 4.101 1.00 0.00 H new ATOM 0 H1 DG A 11 3.445 1.928 -2.078 1.00 0.00 H new ATOM 0 H21 DG A 11 6.875 2.392 -2.583 1.00 0.00 H new ATOM 0 H22 DG A 11 5.291 2.081 -3.302 1.00 0.00 H new ATOM 357 P DT A 12 11.053 5.072 4.417 1.00 0.00 P ATOM 358 OP1 DT A 12 12.330 4.736 3.736 1.00 0.00 O ATOM 359 OP2 DT A 12 10.927 4.709 5.851 1.00 0.00 O ATOM 360 O5' DT A 12 10.779 6.636 4.249 1.00 0.00 O ATOM 361 C5' DT A 12 9.555 7.237 4.666 1.00 0.00 C ATOM 362 C4' DT A 12 9.024 8.160 3.591 1.00 0.00 C ATOM 363 O4' DT A 12 8.585 7.388 2.456 1.00 0.00 O ATOM 364 C3' DT A 12 7.791 8.965 3.966 1.00 0.00 C ATOM 365 O3' DT A 12 8.153 10.137 4.720 1.00 0.00 O ATOM 366 C2' DT A 12 7.239 9.341 2.602 1.00 0.00 C ATOM 367 C1' DT A 12 7.619 8.137 1.730 1.00 0.00 C ATOM 368 N1 DT A 12 6.492 7.247 1.390 1.00 0.00 N ATOM 369 C2 DT A 12 6.338 6.871 0.066 1.00 0.00 C ATOM 370 O2 DT A 12 7.118 7.204 -0.812 1.00 0.00 O ATOM 371 N3 DT A 12 5.233 6.088 -0.191 1.00 0.00 N ATOM 372 C4 DT A 12 4.289 5.650 0.726 1.00 0.00 C ATOM 373 O4 DT A 12 3.336 4.966 0.343 1.00 0.00 O ATOM 374 C5 DT A 12 4.515 6.077 2.098 1.00 0.00 C ATOM 375 C7 DT A 12 3.546 5.657 3.159 1.00 0.00 C ATOM 376 C6 DT A 12 5.590 6.844 2.362 1.00 0.00 C ATOM 0 H5' DT A 12 9.713 7.796 5.588 1.00 0.00 H new ATOM 0 H5'' DT A 12 8.819 6.463 4.885 1.00 0.00 H new ATOM 0 H4' DT A 12 9.861 8.834 3.405 1.00 0.00 H new ATOM 0 H3' DT A 12 7.083 8.426 4.595 1.00 0.00 H new ATOM 0 H2' DT A 12 6.160 9.493 2.632 1.00 0.00 H new ATOM 0 H2'' DT A 12 7.681 10.265 2.229 1.00 0.00 H new ATOM 0 H1' DT A 12 7.990 8.523 0.781 1.00 0.00 H new ATOM 0 H3 DT A 12 5.095 5.800 -1.160 1.00 0.00 H new ATOM 0 H71 DT A 12 4.066 5.569 4.113 1.00 0.00 H new ATOM 0 H72 DT A 12 2.755 6.402 3.245 1.00 0.00 H new ATOM 0 H73 DT A 12 3.110 4.694 2.893 1.00 0.00 H new ATOM 0 H6 DT A 12 5.757 7.161 3.381 1.00 0.00 H new ATOM 389 P DT A 13 7.675 10.306 6.253 1.00 0.00 P ATOM 390 OP1 DT A 13 8.391 11.458 6.857 1.00 0.00 O ATOM 391 OP2 DT A 13 7.789 8.993 6.938 1.00 0.00 O ATOM 392 O5' DT A 13 6.132 10.680 6.100 1.00 0.00 O ATOM 393 C5' DT A 13 5.727 11.892 5.476 1.00 0.00 C ATOM 394 C4' DT A 13 4.236 11.896 5.213 1.00 0.00 C ATOM 395 O4' DT A 13 3.963 12.865 4.178 1.00 0.00 O ATOM 396 C3' DT A 13 3.668 10.566 4.722 1.00 0.00 C ATOM 397 O3' DT A 13 3.017 9.881 5.814 1.00 0.00 O ATOM 398 C2' DT A 13 2.638 10.958 3.665 1.00 0.00 C ATOM 399 C1' DT A 13 3.063 12.356 3.208 1.00 0.00 C ATOM 400 N1 DT A 13 3.716 12.449 1.877 1.00 0.00 N ATOM 401 C2 DT A 13 3.722 13.691 1.250 1.00 0.00 C ATOM 402 O2 DT A 13 3.222 14.687 1.746 1.00 0.00 O ATOM 403 N3 DT A 13 4.339 13.720 0.016 1.00 0.00 N ATOM 404 C4 DT A 13 4.934 12.655 -0.643 1.00 0.00 C ATOM 405 O4 DT A 13 5.455 12.827 -1.743 1.00 0.00 O ATOM 406 C5 DT A 13 4.889 11.388 0.065 1.00 0.00 C ATOM 407 C7 DT A 13 5.484 10.180 -0.581 1.00 0.00 C ATOM 408 C6 DT A 13 4.298 11.342 1.271 1.00 0.00 C ATOM 0 H5' DT A 13 6.266 12.019 4.537 1.00 0.00 H new ATOM 0 H5'' DT A 13 5.990 12.738 6.111 1.00 0.00 H new ATOM 0 H4' DT A 13 3.766 12.120 6.171 1.00 0.00 H new ATOM 0 H3' DT A 13 4.436 9.900 4.329 1.00 0.00 H new ATOM 0 H2' DT A 13 2.636 10.253 2.834 1.00 0.00 H new ATOM 0 H2'' DT A 13 1.630 10.966 4.079 1.00 0.00 H new ATOM 0 H1' DT A 13 2.139 12.926 3.108 1.00 0.00 H new ATOM 0 H3 DT A 13 4.360 14.621 -0.462 1.00 0.00 H new ATOM 0 H71 DT A 13 5.403 10.270 -1.664 1.00 0.00 H new ATOM 0 H72 DT A 13 6.534 10.098 -0.301 1.00 0.00 H new ATOM 0 H73 DT A 13 4.949 9.290 -0.250 1.00 0.00 H new ATOM 0 H6 DT A 13 4.274 10.398 1.795 1.00 0.00 H new ATOM 421 P DA A 14 3.337 8.332 6.145 1.00 0.00 P ATOM 422 OP1 DA A 14 3.670 8.209 7.588 1.00 0.00 O ATOM 423 OP2 DA A 14 4.331 7.823 5.172 1.00 0.00 O ATOM 424 O5' DA A 14 1.930 7.620 5.878 1.00 0.00 O ATOM 425 C5' DA A 14 0.842 7.790 6.782 1.00 0.00 C ATOM 426 C4' DA A 14 -0.315 6.864 6.454 1.00 0.00 C ATOM 427 O4' DA A 14 -0.823 7.132 5.136 1.00 0.00 O ATOM 428 C3' DA A 14 0.009 5.379 6.394 1.00 0.00 C ATOM 429 O3' DA A 14 0.038 4.802 7.714 1.00 0.00 O ATOM 430 C2' DA A 14 -1.168 4.834 5.593 1.00 0.00 C ATOM 431 C1' DA A 14 -1.630 6.028 4.754 1.00 0.00 C ATOM 432 N9 DA A 14 -1.507 5.826 3.301 1.00 0.00 N ATOM 433 C8 DA A 14 -0.363 5.633 2.565 1.00 0.00 C ATOM 434 N7 DA A 14 -0.580 5.441 1.284 1.00 0.00 N ATOM 435 C5 DA A 14 -1.963 5.515 1.166 1.00 0.00 C ATOM 436 C6 DA A 14 -2.839 5.397 0.057 1.00 0.00 C ATOM 437 N6 DA A 14 -2.428 5.178 -1.194 1.00 0.00 N ATOM 438 N1 DA A 14 -4.171 5.522 0.286 1.00 0.00 N ATOM 439 C2 DA A 14 -4.587 5.750 1.545 1.00 0.00 C ATOM 440 N3 DA A 14 -3.865 5.882 2.663 1.00 0.00 N ATOM 441 C4 DA A 14 -2.546 5.753 2.403 1.00 0.00 C ATOM 0 H5' DA A 14 0.500 8.824 6.748 1.00 0.00 H new ATOM 0 H5'' DA A 14 1.182 7.600 7.800 1.00 0.00 H new ATOM 0 H4' DA A 14 -1.004 7.063 7.274 1.00 0.00 H new ATOM 0 H3' DA A 14 0.984 5.158 5.959 1.00 0.00 H new ATOM 0 H2' DA A 14 -0.869 3.996 4.964 1.00 0.00 H new ATOM 0 H2'' DA A 14 -1.963 4.474 6.246 1.00 0.00 H new ATOM 0 H1' DA A 14 -2.692 6.184 4.943 1.00 0.00 H new ATOM 0 H8 DA A 14 0.625 5.639 3.000 1.00 0.00 H new ATOM 0 H61 DA A 14 -3.110 5.103 -1.949 1.00 0.00 H new ATOM 0 H62 DA A 14 -1.432 5.086 -1.395 1.00 0.00 H new ATOM 0 H2 DA A 14 -5.656 5.839 1.671 1.00 0.00 H new ATOM 453 P DG A 15 0.430 3.247 7.920 1.00 0.00 P ATOM 454 OP1 DG A 15 0.829 3.030 9.335 1.00 0.00 O ATOM 455 OP2 DG A 15 1.395 2.852 6.868 1.00 0.00 O ATOM 456 O5' DG A 15 -0.948 2.489 7.650 1.00 0.00 O ATOM 457 C5' DG A 15 -2.125 2.795 8.391 1.00 0.00 C ATOM 458 C4' DG A 15 -3.368 2.268 7.696 1.00 0.00 C ATOM 459 O4' DG A 15 -3.411 2.752 6.325 1.00 0.00 O ATOM 460 C3' DG A 15 -3.465 0.736 7.597 1.00 0.00 C ATOM 461 O3' DG A 15 -4.725 0.288 8.133 1.00 0.00 O ATOM 462 C2' DG A 15 -3.382 0.458 6.105 1.00 0.00 C ATOM 463 C1' DG A 15 -3.943 1.727 5.520 1.00 0.00 C ATOM 464 N9 DG A 15 -3.573 1.968 4.117 1.00 0.00 N ATOM 465 C8 DG A 15 -4.436 2.034 3.054 1.00 0.00 C ATOM 466 N7 DG A 15 -3.831 2.162 1.906 1.00 0.00 N ATOM 467 C5 DG A 15 -2.485 2.184 2.226 1.00 0.00 C ATOM 468 C6 DG A 15 -1.347 2.301 1.380 1.00 0.00 C ATOM 469 O6 DG A 15 -1.323 2.412 0.155 1.00 0.00 O ATOM 470 N1 DG A 15 -0.153 2.283 2.107 1.00 0.00 N ATOM 471 C2 DG A 15 -0.077 2.173 3.482 1.00 0.00 C ATOM 472 N2 DG A 15 1.149 2.210 4.018 1.00 0.00 N ATOM 473 N3 DG A 15 -1.137 2.058 4.279 1.00 0.00 N ATOM 474 C4 DG A 15 -2.304 2.071 3.590 1.00 0.00 C ATOM 0 H5' DG A 15 -2.207 3.874 8.518 1.00 0.00 H new ATOM 0 H5'' DG A 15 -2.052 2.361 9.388 1.00 0.00 H new ATOM 0 H4' DG A 15 -4.189 2.626 8.317 1.00 0.00 H new ATOM 0 H3' DG A 15 -2.686 0.219 8.158 1.00 0.00 H new ATOM 0 H2' DG A 15 -2.358 0.277 5.780 1.00 0.00 H new ATOM 0 H2'' DG A 15 -3.967 -0.417 5.819 1.00 0.00 H new ATOM 0 H1' DG A 15 -5.032 1.674 5.513 1.00 0.00 H new ATOM 0 H8 DG A 15 -5.510 1.985 3.157 1.00 0.00 H new ATOM 0 H1 DG A 15 0.721 2.356 1.587 1.00 0.00 H new ATOM 0 H21 DG A 15 1.266 2.133 5.028 1.00 0.00 H new ATOM 0 H22 DG A 15 1.966 2.315 3.416 1.00 0.00 H new ATOM 486 P DG A 16 -5.106 -1.281 8.136 1.00 0.00 P ATOM 487 OP1 DG A 16 -6.075 -1.538 9.231 1.00 0.00 O ATOM 488 OP2 DG A 16 -3.854 -2.080 8.126 1.00 0.00 O ATOM 489 O5' DG A 16 -5.849 -1.457 6.735 1.00 0.00 O ATOM 490 C5' DG A 16 -7.049 -0.744 6.441 1.00 0.00 C ATOM 491 C4' DG A 16 -7.639 -1.179 5.114 1.00 0.00 C ATOM 492 O4' DG A 16 -6.782 -0.733 4.024 1.00 0.00 O ATOM 493 C3' DG A 16 -7.783 -2.694 4.929 1.00 0.00 C ATOM 494 O3' DG A 16 -9.008 -2.995 4.240 1.00 0.00 O ATOM 495 C2' DG A 16 -6.586 -3.043 4.079 1.00 0.00 C ATOM 496 C1' DG A 16 -6.478 -1.834 3.184 1.00 0.00 C ATOM 497 N9 DG A 16 -5.138 -1.648 2.629 1.00 0.00 N ATOM 498 C8 DG A 16 -3.972 -1.628 3.341 1.00 0.00 C ATOM 499 N7 DG A 16 -2.913 -1.542 2.590 1.00 0.00 N ATOM 500 C5 DG A 16 -3.407 -1.505 1.300 1.00 0.00 C ATOM 501 C6 DG A 16 -2.715 -1.423 0.063 1.00 0.00 C ATOM 502 O6 DG A 16 -1.493 -1.369 -0.119 1.00 0.00 O ATOM 503 N1 DG A 16 -3.596 -1.415 -1.026 1.00 0.00 N ATOM 504 C2 DG A 16 -4.976 -1.479 -0.923 1.00 0.00 C ATOM 505 N2 DG A 16 -5.674 -1.481 -2.075 1.00 0.00 N ATOM 506 N3 DG A 16 -5.629 -1.554 0.238 1.00 0.00 N ATOM 507 C4 DG A 16 -4.787 -1.565 1.301 1.00 0.00 C ATOM 0 H5' DG A 16 -6.842 0.326 6.416 1.00 0.00 H new ATOM 0 H5'' DG A 16 -7.776 -0.909 7.236 1.00 0.00 H new ATOM 0 H4' DG A 16 -8.634 -0.734 5.107 1.00 0.00 H new ATOM 0 H3' DG A 16 -7.818 -3.250 5.866 1.00 0.00 H new ATOM 0 H2' DG A 16 -5.688 -3.189 4.679 1.00 0.00 H new ATOM 0 H2'' DG A 16 -6.742 -3.960 3.510 1.00 0.00 H new ATOM 0 H1' DG A 16 -7.146 -1.942 2.329 1.00 0.00 H new ATOM 0 H8 DG A 16 -3.933 -1.679 4.419 1.00 0.00 H new ATOM 0 H1 DG A 16 -3.193 -1.358 -1.961 1.00 0.00 H new ATOM 0 H21 DG A 16 -6.693 -1.527 -2.054 1.00 0.00 H new ATOM 0 H22 DG A 16 -5.184 -1.437 -2.968 1.00 0.00 H new ATOM 519 P DG A 17 -9.757 -4.403 4.470 1.00 0.00 P ATOM 520 OP1 DG A 17 -11.125 -4.142 4.986 1.00 0.00 O ATOM 521 OP2 DG A 17 -8.878 -5.296 5.267 1.00 0.00 O ATOM 522 O5' DG A 17 -9.863 -4.970 2.986 1.00 0.00 O ATOM 523 C5' DG A 17 -10.456 -4.199 1.947 1.00 0.00 C ATOM 524 C4' DG A 17 -9.885 -4.580 0.600 1.00 0.00 C ATOM 525 O4' DG A 17 -8.515 -4.151 0.521 1.00 0.00 O ATOM 526 C3' DG A 17 -9.851 -6.084 0.313 1.00 0.00 C ATOM 527 O3' DG A 17 -10.861 -6.430 -0.654 1.00 0.00 O ATOM 528 C2' DG A 17 -8.456 -6.340 -0.262 1.00 0.00 C ATOM 529 C1' DG A 17 -7.879 -4.945 -0.448 1.00 0.00 C ATOM 530 N9 DG A 17 -6.422 -4.852 -0.258 1.00 0.00 N ATOM 531 C8 DG A 17 -5.730 -4.796 0.936 1.00 0.00 C ATOM 532 N7 DG A 17 -4.429 -4.738 0.771 1.00 0.00 N ATOM 533 C5 DG A 17 -4.259 -4.754 -0.608 1.00 0.00 C ATOM 534 C6 DG A 17 -3.069 -4.710 -1.391 1.00 0.00 C ATOM 535 O6 DG A 17 -1.903 -4.657 -0.999 1.00 0.00 O ATOM 536 N1 DG A 17 -3.341 -4.742 -2.762 1.00 0.00 N ATOM 537 C2 DG A 17 -4.604 -4.814 -3.314 1.00 0.00 C ATOM 538 N2 DG A 17 -4.682 -4.843 -4.660 1.00 0.00 N ATOM 539 N3 DG A 17 -5.722 -4.858 -2.592 1.00 0.00 N ATOM 540 C4 DG A 17 -5.478 -4.823 -1.255 1.00 0.00 C ATOM 0 H5' DG A 17 -10.285 -3.139 2.132 1.00 0.00 H new ATOM 0 H5'' DG A 17 -11.535 -4.352 1.946 1.00 0.00 H new ATOM 0 H4' DG A 17 -10.548 -4.101 -0.120 1.00 0.00 H new ATOM 0 H3' DG A 17 -10.046 -6.680 1.205 1.00 0.00 H new ATOM 0 H2' DG A 17 -7.847 -6.938 0.416 1.00 0.00 H new ATOM 0 H2'' DG A 17 -8.506 -6.882 -1.207 1.00 0.00 H new ATOM 0 H1' DG A 17 -8.051 -4.629 -1.477 1.00 0.00 H new ATOM 0 H8 DG A 17 -6.209 -4.800 1.904 1.00 0.00 H new ATOM 0 H1 DG A 17 -2.547 -4.710 -3.402 1.00 0.00 H new ATOM 0 H21 DG A 17 -5.592 -4.896 -5.117 1.00 0.00 H new ATOM 0 H22 DG A 17 -3.831 -4.812 -5.221 1.00 0.00 H new ATOM 552 P DT A 18 -12.268 -7.058 -0.182 1.00 0.00 P ATOM 553 OP1 DT A 18 -12.589 -6.568 1.183 1.00 0.00 O ATOM 554 OP2 DT A 18 -12.228 -8.526 -0.393 1.00 0.00 O ATOM 555 O5' DT A 18 -13.297 -6.413 -1.218 1.00 0.00 O ATOM 556 C5' DT A 18 -13.198 -5.050 -1.624 1.00 0.00 C ATOM 557 C4' DT A 18 -14.386 -4.254 -1.130 1.00 0.00 C ATOM 558 O4' DT A 18 -14.194 -3.925 0.271 1.00 0.00 O ATOM 559 C3' DT A 18 -14.599 -2.913 -1.846 1.00 0.00 C ATOM 560 O3' DT A 18 -15.980 -2.763 -2.226 1.00 0.00 O ATOM 561 C2' DT A 18 -14.226 -1.876 -0.795 1.00 0.00 C ATOM 562 C1' DT A 18 -14.593 -2.589 0.479 1.00 0.00 C ATOM 563 N1 DT A 18 -13.944 -2.083 1.706 1.00 0.00 N ATOM 564 C2 DT A 18 -14.689 -2.081 2.878 1.00 0.00 C ATOM 565 O2 DT A 18 -15.837 -2.490 2.937 1.00 0.00 O ATOM 566 N3 DT A 18 -14.033 -1.581 3.983 1.00 0.00 N ATOM 567 C4 DT A 18 -12.736 -1.092 4.029 1.00 0.00 C ATOM 568 O4 DT A 18 -12.279 -0.675 5.090 1.00 0.00 O ATOM 569 C5 DT A 18 -12.013 -1.123 2.768 1.00 0.00 C ATOM 570 C7 DT A 18 -10.608 -0.607 2.730 1.00 0.00 C ATOM 571 C6 DT A 18 -12.639 -1.611 1.680 1.00 0.00 C ATOM 0 H5' DT A 18 -13.143 -4.993 -2.711 1.00 0.00 H new ATOM 0 H5'' DT A 18 -12.277 -4.616 -1.235 1.00 0.00 H new ATOM 0 H4' DT A 18 -15.250 -4.891 -1.321 1.00 0.00 H new ATOM 0 H3' DT A 18 -14.011 -2.822 -2.759 1.00 0.00 H new ATOM 0 H2' DT A 18 -13.167 -1.620 -0.830 1.00 0.00 H new ATOM 0 H2'' DT A 18 -14.783 -0.948 -0.920 1.00 0.00 H new ATOM 0 H1' DT A 18 -15.658 -2.444 0.659 1.00 0.00 H new ATOM 0 H3 DT A 18 -14.557 -1.570 4.858 1.00 0.00 H new ATOM 0 H71 DT A 18 -10.045 -1.141 1.965 1.00 0.00 H new ATOM 0 H72 DT A 18 -10.618 0.458 2.496 1.00 0.00 H new ATOM 0 H73 DT A 18 -10.137 -0.761 3.701 1.00 0.00 H new ATOM 0 H6 DT A 18 -12.101 -1.636 0.744 1.00 0.00 H new ATOM 584 P DT A 19 -16.395 -1.765 -3.424 1.00 0.00 P ATOM 585 OP1 DT A 19 -17.848 -1.916 -3.696 1.00 0.00 O ATOM 586 OP2 DT A 19 -15.462 -1.969 -4.561 1.00 0.00 O ATOM 587 O5' DT A 19 -16.135 -0.323 -2.790 1.00 0.00 O ATOM 588 C5' DT A 19 -17.087 0.295 -1.927 1.00 0.00 C ATOM 589 C4' DT A 19 -16.461 1.448 -1.166 1.00 0.00 C ATOM 590 O4' DT A 19 -15.384 0.954 -0.334 1.00 0.00 O ATOM 591 C3' DT A 19 -15.817 2.520 -2.034 1.00 0.00 C ATOM 592 O3' DT A 19 -16.786 3.521 -2.404 1.00 0.00 O ATOM 593 C2' DT A 19 -14.770 3.104 -1.104 1.00 0.00 C ATOM 594 C1' DT A 19 -14.325 1.905 -0.280 1.00 0.00 C ATOM 595 N1 DT A 19 -13.081 1.253 -0.752 1.00 0.00 N ATOM 596 C2 DT A 19 -11.963 1.294 0.072 1.00 0.00 C ATOM 597 O2 DT A 19 -11.955 1.853 1.155 1.00 0.00 O ATOM 598 N3 DT A 19 -10.851 0.646 -0.420 1.00 0.00 N ATOM 599 C4 DT A 19 -10.748 -0.031 -1.625 1.00 0.00 C ATOM 600 O4 DT A 19 -9.684 -0.570 -1.934 1.00 0.00 O ATOM 601 C5 DT A 19 -11.956 -0.038 -2.436 1.00 0.00 C ATOM 602 C7 DT A 19 -11.951 -0.768 -3.736 1.00 0.00 C ATOM 603 C6 DT A 19 -13.047 0.597 -1.972 1.00 0.00 C ATOM 0 H5' DT A 19 -17.477 -0.441 -1.224 1.00 0.00 H new ATOM 0 H5'' DT A 19 -17.933 0.657 -2.512 1.00 0.00 H new ATOM 0 H4' DT A 19 -17.294 1.887 -0.617 1.00 0.00 H new ATOM 0 H3' DT A 19 -15.407 2.141 -2.970 1.00 0.00 H new ATOM 0 H2' DT A 19 -13.940 3.542 -1.658 1.00 0.00 H new ATOM 0 H2'' DT A 19 -15.185 3.892 -0.476 1.00 0.00 H new ATOM 0 H1' DT A 19 -14.105 2.263 0.726 1.00 0.00 H new ATOM 0 H3 DT A 19 -10.015 0.667 0.164 1.00 0.00 H new ATOM 0 H71 DT A 19 -12.954 -1.136 -3.951 1.00 0.00 H new ATOM 0 H72 DT A 19 -11.634 -0.093 -4.531 1.00 0.00 H new ATOM 0 H73 DT A 19 -11.261 -1.610 -3.678 1.00 0.00 H new ATOM 0 H6 DT A 19 -13.940 0.596 -2.580 1.00 0.00 H new ATOM 616 P DA A 20 -16.723 4.241 -3.847 1.00 0.00 P ATOM 617 OP1 DA A 20 -18.040 4.869 -4.127 1.00 0.00 O ATOM 618 OP2 DA A 20 -16.201 3.274 -4.846 1.00 0.00 O ATOM 619 O5' DA A 20 -15.643 5.395 -3.620 1.00 0.00 O ATOM 620 C5' DA A 20 -14.246 5.142 -3.764 1.00 0.00 C ATOM 621 C4' DA A 20 -13.418 6.066 -2.894 1.00 0.00 C ATOM 622 O4' DA A 20 -14.021 6.181 -1.594 1.00 0.00 O ATOM 623 C3' DA A 20 -12.008 5.557 -2.620 1.00 0.00 C ATOM 624 O3' DA A 20 -11.087 6.097 -3.587 1.00 0.00 O ATOM 625 C2' DA A 20 -11.681 6.080 -1.226 1.00 0.00 C ATOM 626 C1' DA A 20 -13.029 6.488 -0.634 1.00 0.00 C ATOM 627 N9 DA A 20 -13.357 5.780 0.605 1.00 0.00 N ATOM 628 C8 DA A 20 -12.885 4.559 1.009 1.00 0.00 C ATOM 629 N7 DA A 20 -13.349 4.170 2.173 1.00 0.00 N ATOM 630 C5 DA A 20 -14.186 5.207 2.563 1.00 0.00 C ATOM 631 C6 DA A 20 -14.988 5.410 3.715 1.00 0.00 C ATOM 632 N6 DA A 20 -15.076 4.535 4.720 1.00 0.00 N ATOM 633 N1 DA A 20 -15.705 6.560 3.792 1.00 0.00 N ATOM 634 C2 DA A 20 -15.616 7.442 2.778 1.00 0.00 C ATOM 635 N3 DA A 20 -14.901 7.363 1.649 1.00 0.00 N ATOM 636 C4 DA A 20 -14.199 6.209 1.602 1.00 0.00 C ATOM 0 H5' DA A 20 -13.958 5.270 -4.808 1.00 0.00 H new ATOM 0 H5'' DA A 20 -14.034 4.106 -3.499 1.00 0.00 H new ATOM 0 H4' DA A 20 -13.374 7.004 -3.448 1.00 0.00 H new ATOM 0 H3' DA A 20 -11.934 4.471 -2.685 1.00 0.00 H new ATOM 0 H2' DA A 20 -11.199 5.314 -0.619 1.00 0.00 H new ATOM 0 H2'' DA A 20 -10.997 6.927 -1.272 1.00 0.00 H new ATOM 0 H1' DA A 20 -12.982 7.550 -0.392 1.00 0.00 H new ATOM 0 H8 DA A 20 -12.194 3.971 0.423 1.00 0.00 H new ATOM 0 H61 DA A 20 -15.671 4.739 5.523 1.00 0.00 H new ATOM 0 H62 DA A 20 -14.548 3.663 4.685 1.00 0.00 H new ATOM 0 H2 DA A 20 -16.205 8.340 2.892 1.00 0.00 H new ATOM 648 P DG A 21 -10.593 5.219 -4.845 1.00 0.00 P ATOM 649 OP1 DG A 21 -10.287 6.130 -5.977 1.00 0.00 O ATOM 650 OP2 DG A 21 -11.572 4.128 -5.089 1.00 0.00 O ATOM 651 O5' DG A 21 -9.227 4.589 -4.310 1.00 0.00 O ATOM 652 C5' DG A 21 -9.095 3.193 -4.058 1.00 0.00 C ATOM 653 C4' DG A 21 -8.785 2.441 -5.336 1.00 0.00 C ATOM 654 O4' DG A 21 -7.427 2.752 -5.757 1.00 0.00 O ATOM 655 C3' DG A 21 -8.828 0.917 -5.205 1.00 0.00 C ATOM 656 O3' DG A 21 -9.288 0.320 -6.434 1.00 0.00 O ATOM 657 C2' DG A 21 -7.381 0.574 -4.945 1.00 0.00 C ATOM 658 C1' DG A 21 -6.681 1.552 -5.863 1.00 0.00 C ATOM 659 N9 DG A 21 -5.280 1.835 -5.520 1.00 0.00 N ATOM 660 C8 DG A 21 -4.242 1.999 -6.400 1.00 0.00 C ATOM 661 N7 DG A 21 -3.095 2.217 -5.813 1.00 0.00 N ATOM 662 C5 DG A 21 -3.393 2.197 -4.459 1.00 0.00 C ATOM 663 C6 DG A 21 -2.545 2.373 -3.326 1.00 0.00 C ATOM 664 O6 DG A 21 -1.329 2.602 -3.307 1.00 0.00 O ATOM 665 N1 DG A 21 -3.259 2.269 -2.126 1.00 0.00 N ATOM 666 C2 DG A 21 -4.618 2.031 -2.034 1.00 0.00 C ATOM 667 N2 DG A 21 -5.140 1.962 -0.800 1.00 0.00 N ATOM 668 N3 DG A 21 -5.412 1.870 -3.087 1.00 0.00 N ATOM 669 C4 DG A 21 -4.741 1.961 -4.260 1.00 0.00 C ATOM 0 H5' DG A 21 -10.016 2.810 -3.620 1.00 0.00 H new ATOM 0 H5'' DG A 21 -8.302 3.024 -3.330 1.00 0.00 H new ATOM 0 H4' DG A 21 -9.555 2.755 -6.040 1.00 0.00 H new ATOM 0 H3' DG A 21 -9.504 0.558 -4.429 1.00 0.00 H new ATOM 0 H2' DG A 21 -7.104 0.719 -3.901 1.00 0.00 H new ATOM 0 H2'' DG A 21 -7.152 -0.462 -5.195 1.00 0.00 H new ATOM 0 H1' DG A 21 -6.642 1.122 -6.864 1.00 0.00 H new ATOM 0 H8 DG A 21 -4.360 1.953 -7.472 1.00 0.00 H new ATOM 0 H1 DG A 21 -2.738 2.377 -1.256 1.00 0.00 H new ATOM 0 H21 DG A 21 -6.138 1.788 -0.677 1.00 0.00 H new ATOM 0 H22 DG A 21 -4.539 2.083 0.015 1.00 0.00 H new ATOM 681 P DG A 22 -9.579 -1.266 -6.522 1.00 0.00 P ATOM 682 OP1 DG A 22 -10.928 -1.477 -7.107 1.00 0.00 O ATOM 683 OP2 DG A 22 -9.299 -1.884 -5.201 1.00 0.00 O ATOM 684 O5' DG A 22 -8.481 -1.762 -7.567 1.00 0.00 O ATOM 685 C5' DG A 22 -8.500 -1.324 -8.924 1.00 0.00 C ATOM 686 C4' DG A 22 -7.179 -1.606 -9.613 1.00 0.00 C ATOM 687 O4' DG A 22 -6.092 -1.055 -8.822 1.00 0.00 O ATOM 688 C3' DG A 22 -6.842 -3.087 -9.800 1.00 0.00 C ATOM 689 O3' DG A 22 -6.188 -3.290 -11.067 1.00 0.00 O ATOM 690 C2' DG A 22 -5.905 -3.381 -8.655 1.00 0.00 C ATOM 691 C1' DG A 22 -5.159 -2.074 -8.508 1.00 0.00 C ATOM 692 N9 DG A 22 -4.651 -1.841 -7.156 1.00 0.00 N ATOM 693 C8 DG A 22 -5.374 -1.850 -5.992 1.00 0.00 C ATOM 694 N7 DG A 22 -4.640 -1.656 -4.927 1.00 0.00 N ATOM 695 C5 DG A 22 -3.354 -1.514 -5.425 1.00 0.00 C ATOM 696 C6 DG A 22 -2.122 -1.287 -4.746 1.00 0.00 C ATOM 697 O6 DG A 22 -1.930 -1.170 -3.530 1.00 0.00 O ATOM 698 N1 DG A 22 -1.048 -1.210 -5.640 1.00 0.00 N ATOM 699 C2 DG A 22 -1.155 -1.336 -7.014 1.00 0.00 C ATOM 700 N2 DG A 22 -0.020 -1.252 -7.716 1.00 0.00 N ATOM 701 N3 DG A 22 -2.300 -1.544 -7.650 1.00 0.00 N ATOM 702 C4 DG A 22 -3.350 -1.623 -6.803 1.00 0.00 C ATOM 0 H5' DG A 22 -8.711 -0.255 -8.960 1.00 0.00 H new ATOM 0 H5'' DG A 22 -9.306 -1.826 -9.459 1.00 0.00 H new ATOM 0 H4' DG A 22 -7.288 -1.153 -10.599 1.00 0.00 H new ATOM 0 H3' DG A 22 -7.719 -3.735 -9.802 1.00 0.00 H new ATOM 0 H2' DG A 22 -6.444 -3.646 -7.746 1.00 0.00 H new ATOM 0 H2'' DG A 22 -5.234 -4.210 -8.881 1.00 0.00 H new ATOM 0 H1' DG A 22 -4.288 -2.089 -9.163 1.00 0.00 H new ATOM 0 H8 DG A 22 -6.443 -2.002 -5.957 1.00 0.00 H new ATOM 0 H1 DG A 22 -0.119 -1.049 -5.251 1.00 0.00 H new ATOM 0 H21 DG A 22 -0.041 -1.338 -8.732 1.00 0.00 H new ATOM 0 H22 DG A 22 0.867 -1.102 -7.235 1.00 0.00 H new ATOM 714 P DG A 23 -6.050 -4.769 -11.693 1.00 0.00 P ATOM 715 OP1 DG A 23 -6.435 -4.723 -13.128 1.00 0.00 O ATOM 716 OP2 DG A 23 -6.769 -5.731 -10.820 1.00 0.00 O ATOM 717 O5' DG A 23 -4.483 -5.042 -11.582 1.00 0.00 O ATOM 718 C5' DG A 23 -3.571 -4.531 -12.552 1.00 0.00 C ATOM 719 C4' DG A 23 -2.171 -5.057 -12.306 1.00 0.00 C ATOM 720 O4' DG A 23 -1.656 -4.491 -11.071 1.00 0.00 O ATOM 721 C3' DG A 23 -2.074 -6.576 -12.137 1.00 0.00 C ATOM 722 O3' DG A 23 -0.863 -7.076 -12.747 1.00 0.00 O ATOM 723 C2' DG A 23 -2.038 -6.745 -10.637 1.00 0.00 C ATOM 724 C1' DG A 23 -1.244 -5.538 -10.212 1.00 0.00 C ATOM 725 N9 DG A 23 -1.501 -5.145 -8.834 1.00 0.00 N ATOM 726 C8 DG A 23 -2.729 -5.034 -8.237 1.00 0.00 C ATOM 727 N7 DG A 23 -2.653 -4.772 -6.954 1.00 0.00 N ATOM 728 C5 DG A 23 -1.286 -4.708 -6.705 1.00 0.00 C ATOM 729 C6 DG A 23 -0.579 -4.462 -5.495 1.00 0.00 C ATOM 730 O6 DG A 23 -1.045 -4.254 -4.379 1.00 0.00 O ATOM 731 N1 DG A 23 0.809 -4.492 -5.682 1.00 0.00 N ATOM 732 C2 DG A 23 1.435 -4.722 -6.892 1.00 0.00 C ATOM 733 N2 DG A 23 2.784 -4.707 -6.903 1.00 0.00 N ATOM 734 N3 DG A 23 0.779 -4.950 -8.026 1.00 0.00 N ATOM 735 C4 DG A 23 -0.566 -4.932 -7.860 1.00 0.00 C ATOM 0 H5' DG A 23 -3.567 -3.442 -12.515 1.00 0.00 H new ATOM 0 H5'' DG A 23 -3.900 -4.814 -13.552 1.00 0.00 H new ATOM 0 H4' DG A 23 -1.608 -4.773 -13.195 1.00 0.00 H new ATOM 0 H3' DG A 23 -2.891 -7.122 -12.609 1.00 0.00 H new ATOM 0 H2' DG A 23 -3.037 -6.751 -10.202 1.00 0.00 H new ATOM 0 H2'' DG A 23 -1.556 -7.677 -10.342 1.00 0.00 H new ATOM 0 H1' DG A 23 -0.179 -5.761 -10.274 1.00 0.00 H new ATOM 0 H8 DG A 23 -3.663 -5.150 -8.768 1.00 0.00 H new ATOM 0 H1 DG A 23 1.400 -4.333 -4.866 1.00 0.00 H new ATOM 0 H21 DG A 23 3.289 -4.872 -7.774 1.00 0.00 H new ATOM 0 H22 DG A 23 3.299 -4.531 -6.040 1.00 0.00 H new ATOM 747 P DT A 24 -0.412 -8.618 -12.564 1.00 0.00 P ATOM 748 OP1 DT A 24 0.429 -9.013 -13.723 1.00 0.00 O ATOM 749 OP2 DT A 24 -1.615 -9.440 -12.280 1.00 0.00 O ATOM 750 O5' DT A 24 0.506 -8.565 -11.254 1.00 0.00 O ATOM 751 C5' DT A 24 1.798 -7.959 -11.280 1.00 0.00 C ATOM 752 C4' DT A 24 2.577 -8.240 -10.006 1.00 0.00 C ATOM 753 O4' DT A 24 1.906 -7.628 -8.878 1.00 0.00 O ATOM 754 C3' DT A 24 2.745 -9.720 -9.648 1.00 0.00 C ATOM 755 O3' DT A 24 4.091 -9.974 -9.209 1.00 0.00 O ATOM 756 C2' DT A 24 1.759 -9.927 -8.511 1.00 0.00 C ATOM 757 C1' DT A 24 1.749 -8.570 -7.832 1.00 0.00 C ATOM 758 N1 DT A 24 0.497 -8.269 -7.128 1.00 0.00 N ATOM 759 C2 DT A 24 0.546 -7.829 -5.807 1.00 0.00 C ATOM 760 O2 DT A 24 1.587 -7.662 -5.183 1.00 0.00 O ATOM 761 N3 DT A 24 -0.688 -7.588 -5.241 1.00 0.00 N ATOM 762 C4 DT A 24 -1.926 -7.734 -5.848 1.00 0.00 C ATOM 763 O4 DT A 24 -2.944 -7.463 -5.228 1.00 0.00 O ATOM 764 C5 DT A 24 -1.897 -8.201 -7.221 1.00 0.00 C ATOM 765 C7 DT A 24 -3.198 -8.409 -7.932 1.00 0.00 C ATOM 766 C6 DT A 24 -0.702 -8.440 -7.790 1.00 0.00 C ATOM 0 H5' DT A 24 1.692 -6.882 -11.412 1.00 0.00 H new ATOM 0 H5'' DT A 24 2.357 -8.332 -12.138 1.00 0.00 H new ATOM 0 H4' DT A 24 3.567 -7.830 -10.205 1.00 0.00 H new ATOM 0 H3' DT A 24 2.563 -10.390 -10.489 1.00 0.00 H new ATOM 0 H2' DT A 24 0.771 -10.205 -8.877 1.00 0.00 H new ATOM 0 H2'' DT A 24 2.082 -10.717 -7.833 1.00 0.00 H new ATOM 0 H1' DT A 24 2.535 -8.544 -7.077 1.00 0.00 H new ATOM 0 H3 DT A 24 -0.690 -7.268 -4.272 1.00 0.00 H new ATOM 0 H71 DT A 24 -3.966 -8.687 -7.211 1.00 0.00 H new ATOM 0 H72 DT A 24 -3.489 -7.487 -8.435 1.00 0.00 H new ATOM 0 H73 DT A 24 -3.087 -9.205 -8.669 1.00 0.00 H new ATOM 0 H6 DT A 24 -0.680 -8.782 -8.814 1.00 0.00 H new ATOM 779 P DT A 25 4.604 -11.485 -8.972 1.00 0.00 P ATOM 780 OP1 DT A 25 6.037 -11.573 -9.352 1.00 0.00 O ATOM 781 OP2 DT A 25 3.661 -12.422 -9.630 1.00 0.00 O ATOM 782 O5' DT A 25 4.479 -11.646 -7.389 1.00 0.00 O ATOM 783 C5' DT A 25 5.339 -10.934 -6.507 1.00 0.00 C ATOM 784 C4' DT A 25 5.094 -11.332 -5.066 1.00 0.00 C ATOM 785 O4' DT A 25 3.858 -10.737 -4.624 1.00 0.00 O ATOM 786 C3' DT A 25 4.960 -12.839 -4.825 1.00 0.00 C ATOM 787 O3' DT A 25 5.905 -13.277 -3.844 1.00 0.00 O ATOM 788 C2' DT A 25 3.535 -13.034 -4.323 1.00 0.00 C ATOM 789 C1' DT A 25 3.138 -11.652 -3.831 1.00 0.00 C ATOM 790 N1 DT A 25 1.706 -11.347 -3.966 1.00 0.00 N ATOM 791 C2 DT A 25 1.053 -10.760 -2.893 1.00 0.00 C ATOM 792 O2 DT A 25 1.599 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