USER MOD reduce.3.24.130724 H: found=0, std=0, add=272, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 274 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 Single : A 4 A O2' : rot -154:sc= 1.06 USER MOD Single : A 5 A O2' : rot -22:sc= -0.248 USER MOD Single : A 6 A O2' : rot -147:sc= -1.52! USER MOD Single : A 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.0711 (180deg=-1.37!) USER MOD Single : A 9 DT C7 :methyl -30:sc= 0 (180deg=-0.0531) USER MOD Single : A 12 DG O3' : rot -30:sc= 0.0917 USER MOD Single : B 16 A O2' : rot -153:sc= 0.597 USER MOD Single : B 17 A O2' : rot -24:sc= -0.105 USER MOD Single : B 18 A O2' : rot -144:sc= -1.53! USER MOD Single : B 19 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DT C7 :methyl -30:sc= -0.574 (180deg=-1.43!) USER MOD Single : B 21 DT C7 :methyl -30:sc=-0.00168 (180deg=-0.0602) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 DC A 1 4.203 10.492 11.883 1.00 0.16 O ATOM 2 P DC A 1 3.703 11.273 10.577 1.00 0.15 P ATOM 3 OP1 DC A 1 2.890 10.338 9.769 1.00 0.20 O ATOM 4 OP2 DC A 1 3.151 12.584 10.987 1.00 0.16 O ATOM 5 O5' DC A 1 5.104 11.510 9.826 1.00 0.12 O ATOM 6 C5' DC A 1 6.279 11.899 10.553 1.00 0.10 C ATOM 7 C4' DC A 1 7.270 10.746 10.651 1.00 0.10 C ATOM 8 O4' DC A 1 6.662 9.558 11.211 1.00 0.12 O ATOM 9 C3' DC A 1 7.797 10.402 9.264 1.00 0.10 C ATOM 10 O3' DC A 1 9.228 10.426 9.297 1.00 0.11 O ATOM 11 C2' DC A 1 7.278 8.893 9.084 1.00 0.10 C ATOM 12 C1' DC A 1 7.182 8.406 10.524 1.00 0.11 C ATOM 13 N1 DC A 1 6.257 7.260 10.720 1.00 0.10 N ATOM 14 C2 DC A 1 6.736 6.031 11.173 1.00 0.08 C ATOM 15 O2 DC A 1 7.927 5.827 11.397 1.00 0.09 O ATOM 16 N3 DC A 1 5.841 5.025 11.363 1.00 0.07 N ATOM 17 C4 DC A 1 4.538 5.206 11.123 1.00 0.08 C ATOM 18 N4 DC A 1 3.703 4.196 11.333 1.00 0.08 N ATOM 19 C5 DC A 1 4.042 6.459 10.656 1.00 0.09 C ATOM 20 C6 DC A 1 4.935 7.438 10.474 1.00 0.09 C ATOM 0 H5' DC A 1 5.999 12.228 11.554 1.00 0.10 H new ATOM 0 H5'' DC A 1 6.752 12.748 10.059 1.00 0.10 H new ATOM 0 H4' DC A 1 8.078 11.069 11.307 1.00 0.10 H new ATOM 0 H3' DC A 1 7.477 11.076 8.469 1.00 0.10 H new ATOM 0 H2' DC A 1 6.314 8.853 8.576 1.00 0.10 H new ATOM 0 H2'' DC A 1 7.973 8.292 8.497 1.00 0.10 H new ATOM 0 H1' DC A 1 8.147 8.040 10.876 1.00 0.11 H new ATOM 0 H41 DC A 1 2.705 4.314 11.156 1.00 0.08 H new ATOM 0 H42 DC A 1 4.059 3.302 11.671 1.00 0.08 H new ATOM 0 H5 DC A 1 2.991 6.611 10.458 1.00 0.09 H new ATOM 0 H6 DC A 1 4.593 8.399 10.120 1.00 0.09 H new ATOM 33 P DG A 2 10.090 10.235 7.947 1.00 0.10 P ATOM 34 OP1 DG A 2 11.499 10.577 8.246 1.00 0.12 O ATOM 35 OP2 DG A 2 9.386 10.912 6.834 1.00 0.12 O ATOM 36 O5' DG A 2 9.967 8.639 7.743 1.00 0.09 O ATOM 37 C5' DG A 2 10.687 7.726 8.584 1.00 0.09 C ATOM 38 C4' DG A 2 10.307 6.264 8.341 1.00 0.09 C ATOM 39 O4' DG A 2 8.987 5.883 8.799 1.00 0.09 O ATOM 40 C3' DG A 2 10.386 5.885 6.855 1.00 0.09 C ATOM 41 O3' DG A 2 11.415 4.898 6.666 1.00 0.09 O ATOM 42 C2' DG A 2 8.966 5.435 6.605 1.00 0.10 C ATOM 43 C1' DG A 2 8.529 4.845 7.918 1.00 0.10 C ATOM 44 N9 DG A 2 7.082 4.604 8.029 1.00 0.09 N ATOM 45 C8 DG A 2 6.056 5.448 7.772 1.00 0.10 C ATOM 46 N7 DG A 2 4.838 4.906 7.993 1.00 0.09 N ATOM 47 C5 DG A 2 5.129 3.645 8.409 1.00 0.08 C ATOM 48 C6 DG A 2 4.260 2.583 8.790 1.00 0.08 C ATOM 49 O6 DG A 2 3.033 2.545 8.842 1.00 0.10 O ATOM 50 N1 DG A 2 4.961 1.456 9.144 1.00 0.07 N ATOM 51 C2 DG A 2 6.326 1.341 9.141 1.00 0.06 C ATOM 52 N2 DG A 2 6.823 0.170 9.492 1.00 0.07 N ATOM 53 N3 DG A 2 7.156 2.320 8.793 1.00 0.06 N ATOM 54 C4 DG A 2 6.488 3.441 8.438 1.00 0.07 C ATOM 0 H5' DG A 2 10.498 7.976 9.628 1.00 0.09 H new ATOM 0 H5'' DG A 2 11.757 7.851 8.415 1.00 0.09 H new ATOM 0 H4' DG A 2 11.045 5.726 8.936 1.00 0.09 H new ATOM 0 H3' DG A 2 10.677 6.662 6.148 1.00 0.09 H new ATOM 0 H2' DG A 2 8.329 6.270 6.312 1.00 0.10 H new ATOM 0 H2'' DG A 2 8.917 4.700 5.802 1.00 0.10 H new ATOM 0 H1' DG A 2 8.922 3.847 8.111 1.00 0.10 H new ATOM 0 H8 DG A 2 6.197 6.460 7.423 1.00 0.10 H new ATOM 0 H1 DG A 2 4.422 0.639 9.432 1.00 0.07 H new ATOM 0 H21 DG A 2 7.833 0.029 9.507 1.00 0.07 H new ATOM 0 H22 DG A 2 6.197 -0.594 9.748 1.00 0.07 H new ATOM 66 P DC A 3 11.618 3.954 5.368 1.00 0.10 P ATOM 67 OP1 DC A 3 13.068 3.848 5.090 1.00 0.13 O ATOM 68 OP2 DC A 3 10.690 4.398 4.303 1.00 0.13 O ATOM 69 O5' DC A 3 11.088 2.534 5.930 1.00 0.08 O ATOM 70 C5' DC A 3 11.728 1.864 7.036 1.00 0.08 C ATOM 71 C4' DC A 3 11.339 0.384 7.165 1.00 0.07 C ATOM 72 O4' DC A 3 9.931 0.178 7.407 1.00 0.07 O ATOM 73 C3' DC A 3 11.711 -0.379 5.901 1.00 0.06 C ATOM 74 O3' DC A 3 12.038 -1.750 6.170 1.00 0.07 O ATOM 75 C2' DC A 3 10.381 -0.243 5.127 1.00 0.06 C ATOM 76 C1' DC A 3 9.308 -0.423 6.254 1.00 0.06 C ATOM 77 N1 DC A 3 7.973 0.243 6.131 1.00 0.06 N ATOM 78 C2 DC A 3 6.834 -0.527 6.372 1.00 0.06 C ATOM 79 O2 DC A 3 6.882 -1.720 6.662 1.00 0.06 O ATOM 80 N3 DC A 3 5.617 0.066 6.283 1.00 0.06 N ATOM 81 C4 DC A 3 5.495 1.356 5.972 1.00 0.07 C ATOM 82 N4 DC A 3 4.268 1.864 5.910 1.00 0.07 N ATOM 83 C5 DC A 3 6.644 2.171 5.721 1.00 0.07 C ATOM 84 C6 DC A 3 7.851 1.573 5.811 1.00 0.06 C ATOM 0 H5' DC A 3 11.471 2.381 7.961 1.00 0.08 H new ATOM 0 H5'' DC A 3 12.809 1.938 6.919 1.00 0.08 H new ATOM 0 H4' DC A 3 11.892 0.014 8.029 1.00 0.07 H new ATOM 0 H3' DC A 3 12.595 -0.010 5.381 1.00 0.06 H new ATOM 0 H2' DC A 3 10.295 0.727 4.637 1.00 0.06 H new ATOM 0 H2'' DC A 3 10.285 -1.002 4.351 1.00 0.06 H new ATOM 0 H1' DC A 3 9.063 -1.485 6.256 1.00 0.06 H new ATOM 0 H41 DC A 3 4.135 2.848 5.675 1.00 0.07 H new ATOM 0 H42 DC A 3 3.460 1.270 6.097 1.00 0.07 H new ATOM 0 H5 DC A 3 6.550 3.217 5.471 1.00 0.07 H new ATOM 0 H6 DC A 3 8.742 2.155 5.627 1.00 0.06 H new ATOM 96 P A A 4 12.659 -2.704 5.021 1.00 0.07 P ATOM 97 OP1 A A 4 13.324 -3.847 5.688 1.00 0.11 O ATOM 98 OP2 A A 4 13.432 -1.862 4.078 1.00 0.09 O ATOM 99 O5' A A 4 11.343 -3.242 4.248 1.00 0.08 O ATOM 100 C5' A A 4 10.654 -4.429 4.675 1.00 0.08 C ATOM 101 C4' A A 4 9.210 -4.518 4.186 1.00 0.07 C ATOM 102 O4' A A 4 8.376 -3.444 4.652 1.00 0.06 O ATOM 103 C3' A A 4 9.037 -4.440 2.673 1.00 0.06 C ATOM 104 O3' A A 4 9.528 -5.602 1.970 1.00 0.07 O ATOM 105 C2' A A 4 7.527 -4.260 2.602 1.00 0.05 C ATOM 106 O2' A A 4 6.808 -5.480 2.691 1.00 0.07 O ATOM 107 C1' A A 4 7.158 -3.611 3.909 1.00 0.06 C ATOM 108 N9 A A 4 6.316 -2.416 3.740 1.00 0.05 N ATOM 109 C8 A A 4 6.664 -1.137 3.447 1.00 0.05 C ATOM 110 N7 A A 4 5.611 -0.292 3.384 1.00 0.05 N ATOM 111 C5 A A 4 4.551 -1.098 3.655 1.00 0.05 C ATOM 112 C6 A A 4 3.174 -0.853 3.748 1.00 0.07 C ATOM 113 N6 A A 4 2.622 0.344 3.581 1.00 0.07 N ATOM 114 N1 A A 4 2.381 -1.894 4.035 1.00 0.08 N ATOM 115 C2 A A 4 2.907 -3.100 4.222 1.00 0.07 C ATOM 116 N3 A A 4 4.179 -3.454 4.164 1.00 0.06 N ATOM 117 C4 A A 4 4.956 -2.388 3.871 1.00 0.05 C ATOM 0 H5' A A 4 10.661 -4.469 5.764 1.00 0.08 H new ATOM 0 H5'' A A 4 11.202 -5.302 4.320 1.00 0.08 H new ATOM 0 H4' A A 4 8.923 -5.492 4.582 1.00 0.07 H new ATOM 0 H3' A A 4 9.611 -3.653 2.184 1.00 0.06 H new ATOM 0 H2' A A 4 7.299 -3.740 1.672 1.00 0.05 H new ATOM 0 HO2' A A 4 5.939 -5.381 2.249 1.00 0.07 H new ATOM 0 H1' A A 4 6.496 -4.243 4.501 1.00 0.06 H new ATOM 0 H8 A A 4 7.684 -0.825 3.280 1.00 0.05 H new ATOM 0 H61 A A 4 1.611 0.455 3.662 1.00 0.07 H new ATOM 0 H62 A A 4 3.209 1.152 3.372 1.00 0.07 H new ATOM 0 H2 A A 4 2.207 -3.890 4.450 1.00 0.07 H new ATOM 129 P A A 5 9.329 -5.830 0.375 1.00 0.08 P ATOM 130 OP1 A A 5 10.443 -6.679 -0.104 1.00 0.10 O ATOM 131 OP2 A A 5 9.099 -4.507 -0.252 1.00 0.11 O ATOM 132 O5' A A 5 7.949 -6.675 0.249 1.00 0.07 O ATOM 133 C5' A A 5 7.872 -8.077 0.571 1.00 0.07 C ATOM 134 C4' A A 5 6.437 -8.592 0.754 1.00 0.07 C ATOM 135 O4' A A 5 5.768 -7.868 1.812 1.00 0.08 O ATOM 136 C3' A A 5 5.544 -8.466 -0.490 1.00 0.08 C ATOM 137 O3' A A 5 5.659 -9.565 -1.415 1.00 0.08 O ATOM 138 C2' A A 5 4.194 -8.488 0.223 1.00 0.09 C ATOM 139 O2' A A 5 3.917 -9.786 0.767 1.00 0.09 O ATOM 140 C1' A A 5 4.440 -7.520 1.376 1.00 0.09 C ATOM 141 N9 A A 5 4.375 -6.078 0.986 1.00 0.07 N ATOM 142 C8 A A 5 5.323 -5.261 0.392 1.00 0.07 C ATOM 143 N7 A A 5 4.896 -3.992 0.229 1.00 0.08 N ATOM 144 C5 A A 5 3.637 -4.005 0.735 1.00 0.08 C ATOM 145 C6 A A 5 2.666 -3.002 0.859 1.00 0.09 C ATOM 146 N6 A A 5 2.859 -1.747 0.469 1.00 0.09 N ATOM 147 N1 A A 5 1.492 -3.333 1.411 1.00 0.10 N ATOM 148 C2 A A 5 1.282 -4.581 1.821 1.00 0.10 C ATOM 149 N3 A A 5 2.118 -5.609 1.759 1.00 0.10 N ATOM 150 C4 A A 5 3.295 -5.249 1.197 1.00 0.08 C ATOM 0 H5' A A 5 8.434 -8.262 1.487 1.00 0.07 H new ATOM 0 H5'' A A 5 8.355 -8.649 -0.221 1.00 0.07 H new ATOM 0 H4' A A 5 6.563 -9.651 0.981 1.00 0.07 H new ATOM 0 H3' A A 5 5.767 -7.608 -1.124 1.00 0.08 H new ATOM 0 H2' A A 5 3.359 -8.237 -0.431 1.00 0.09 H new ATOM 0 HO2' A A 5 4.448 -10.460 0.293 1.00 0.09 H new ATOM 0 H1' A A 5 3.670 -7.615 2.142 1.00 0.09 H new ATOM 0 H8 A A 5 6.302 -5.604 0.091 1.00 0.07 H new ATOM 0 H61 A A 5 2.116 -1.057 0.583 1.00 0.09 H new ATOM 0 H62 A A 5 3.750 -1.473 0.055 1.00 0.09 H new ATOM 0 H2 A A 5 0.314 -4.781 2.257 1.00 0.10 H new ATOM 162 P A A 6 5.162 -9.473 -2.958 1.00 0.09 P ATOM 163 OP1 A A 6 5.309 -10.815 -3.566 1.00 0.11 O ATOM 164 OP2 A A 6 5.844 -8.314 -3.579 1.00 0.10 O ATOM 165 O5' A A 6 3.582 -9.136 -2.874 1.00 0.10 O ATOM 166 C5' A A 6 2.618 -10.001 -2.245 1.00 0.09 C ATOM 167 C4' A A 6 1.355 -9.233 -1.849 1.00 0.09 C ATOM 168 O4' A A 6 1.757 -8.096 -1.058 1.00 0.10 O ATOM 169 C3' A A 6 0.609 -8.663 -3.054 1.00 0.10 C ATOM 170 O3' A A 6 -0.312 -9.618 -3.621 1.00 0.11 O ATOM 171 C2' A A 6 -0.107 -7.510 -2.360 1.00 0.10 C ATOM 172 O2' A A 6 -1.340 -7.863 -1.756 1.00 0.11 O ATOM 173 C1' A A 6 0.882 -6.998 -1.340 1.00 0.09 C ATOM 174 N9 A A 6 1.567 -5.778 -1.827 1.00 0.08 N ATOM 175 C8 A A 6 2.827 -5.602 -2.335 1.00 0.08 C ATOM 176 N7 A A 6 3.102 -4.315 -2.633 1.00 0.09 N ATOM 177 C5 A A 6 1.963 -3.660 -2.300 1.00 0.07 C ATOM 178 C6 A A 6 1.603 -2.312 -2.367 1.00 0.08 C ATOM 179 N6 A A 6 2.440 -1.379 -2.803 1.00 0.10 N ATOM 180 N1 A A 6 0.373 -1.969 -1.957 1.00 0.09 N ATOM 181 C2 A A 6 -0.449 -2.913 -1.506 1.00 0.08 C ATOM 182 N3 A A 6 -0.224 -4.209 -1.391 1.00 0.07 N ATOM 183 C4 A A 6 1.019 -4.521 -1.812 1.00 0.07 C ATOM 0 H5' A A 6 3.060 -10.459 -1.360 1.00 0.09 H new ATOM 0 H5'' A A 6 2.355 -10.811 -2.925 1.00 0.09 H new ATOM 0 H4' A A 6 0.704 -9.930 -1.321 1.00 0.09 H new ATOM 0 H3' A A 6 1.229 -8.384 -3.906 1.00 0.10 H new ATOM 0 H2' A A 6 -0.396 -6.755 -3.092 1.00 0.10 H new ATOM 0 HO2' A A 6 -1.961 -7.107 -1.814 1.00 0.11 H new ATOM 0 H1' A A 6 0.403 -6.675 -0.416 1.00 0.09 H new ATOM 0 H8 A A 6 3.528 -6.410 -2.482 1.00 0.08 H new ATOM 0 H61 A A 6 2.143 -0.404 -2.838 1.00 0.10 H new ATOM 0 H62 A A 6 3.380 -1.637 -3.103 1.00 0.10 H new ATOM 0 H2 A A 6 -1.426 -2.576 -1.194 1.00 0.08 H new ATOM 195 P DT A 7 -1.124 -9.402 -5.007 1.00 0.12 P ATOM 196 OP1 DT A 7 -1.851 -10.658 -5.313 1.00 0.15 O ATOM 197 OP2 DT A 7 -0.179 -8.847 -6.002 1.00 0.14 O ATOM 198 O5' DT A 7 -2.218 -8.259 -4.681 1.00 0.11 O ATOM 199 C5' DT A 7 -3.262 -8.420 -3.705 1.00 0.11 C ATOM 200 C4' DT A 7 -3.927 -7.080 -3.384 1.00 0.09 C ATOM 201 O4' DT A 7 -2.887 -6.123 -3.073 1.00 0.09 O ATOM 202 C3' DT A 7 -4.721 -6.554 -4.584 1.00 0.10 C ATOM 203 O3' DT A 7 -6.115 -6.386 -4.280 1.00 0.11 O ATOM 204 C2' DT A 7 -4.090 -5.162 -4.836 1.00 0.09 C ATOM 205 C1' DT A 7 -3.207 -4.848 -3.652 1.00 0.08 C ATOM 206 N1 DT A 7 -1.996 -4.195 -4.210 1.00 0.07 N ATOM 207 C2 DT A 7 -1.889 -2.820 -4.163 1.00 0.07 C ATOM 208 O2 DT A 7 -2.765 -2.097 -3.707 1.00 0.09 O ATOM 209 N3 DT A 7 -0.728 -2.287 -4.670 1.00 0.08 N ATOM 210 C4 DT A 7 0.323 -2.994 -5.207 1.00 0.08 C ATOM 211 C5 DT A 7 0.134 -4.428 -5.223 1.00 0.07 C ATOM 212 C6 DT A 7 -1.004 -4.961 -4.737 1.00 0.08 C ATOM 213 O4 DT A 7 1.310 -2.385 -5.604 1.00 0.09 O ATOM 226 C7 DT A 7 1.244 -5.347 -5.764 1.00 0.09 C ATOM 0 H5' DT A 7 -2.849 -8.852 -2.794 1.00 0.11 H new ATOM 0 H5'' DT A 7 -4.009 -9.120 -4.079 1.00 0.11 H new ATOM 0 H4' DT A 7 -4.611 -7.219 -2.546 1.00 0.09 H new ATOM 0 H3' DT A 7 -4.675 -7.238 -5.431 1.00 0.10 H new ATOM 0 H2' DT A 7 -3.509 -5.165 -5.758 1.00 0.09 H new ATOM 0 H2'' DT A 7 -4.865 -4.404 -4.949 1.00 0.09 H new ATOM 0 H1' DT A 7 -3.657 -4.198 -2.902 1.00 0.08 H new ATOM 0 H3 DT A 7 -0.637 -1.271 -4.646 1.00 0.08 H new ATOM 0 H71 DT A 7 1.203 -6.308 -5.251 1.00 0.09 H new ATOM 0 H72 DT A 7 1.100 -5.500 -6.834 1.00 0.09 H new ATOM 0 H73 DT A 7 2.216 -4.885 -5.591 1.00 0.09 H new ATOM 0 H6 DT A 7 -1.133 -6.033 -4.767 1.00 0.08 H new ATOM 227 P DT A 8 -7.195 -5.934 -5.404 1.00 0.10 P ATOM 228 OP1 DT A 8 -8.549 -6.178 -4.857 1.00 0.14 O ATOM 229 OP2 DT A 8 -6.807 -6.556 -6.693 1.00 0.13 O ATOM 230 O5' DT A 8 -6.982 -4.338 -5.530 1.00 0.09 O ATOM 231 C5' DT A 8 -7.268 -3.445 -4.439 1.00 0.11 C ATOM 232 C4' DT A 8 -7.083 -1.975 -4.825 1.00 0.12 C ATOM 233 O4' DT A 8 -5.723 -1.726 -5.197 1.00 0.11 O ATOM 234 C3' DT A 8 -7.990 -1.522 -5.976 1.00 0.11 C ATOM 235 O3' DT A 8 -8.740 -0.365 -5.557 1.00 0.09 O ATOM 236 C2' DT A 8 -6.957 -1.209 -7.064 1.00 0.14 C ATOM 237 C1' DT A 8 -5.720 -0.825 -6.304 1.00 0.13 C ATOM 238 N1 DT A 8 -4.423 -1.018 -6.987 1.00 0.11 N ATOM 239 C2 DT A 8 -3.616 0.075 -7.225 1.00 0.11 C ATOM 240 O2 DT A 8 -3.929 1.229 -6.947 1.00 0.12 O ATOM 241 N3 DT A 8 -2.401 -0.195 -7.803 1.00 0.11 N ATOM 242 C4 DT A 8 -1.924 -1.435 -8.160 1.00 0.10 C ATOM 243 C5 DT A 8 -2.833 -2.527 -7.884 1.00 0.11 C ATOM 244 C6 DT A 8 -4.026 -2.276 -7.320 1.00 0.12 C ATOM 245 O4 DT A 8 -0.805 -1.527 -8.650 1.00 0.10 O ATOM 258 C7 DT A 8 -2.440 -3.978 -8.219 1.00 0.13 C ATOM 0 H5' DT A 8 -6.616 -3.682 -3.598 1.00 0.11 H new ATOM 0 H5'' DT A 8 -8.293 -3.603 -4.102 1.00 0.11 H new ATOM 0 H4' DT A 8 -7.360 -1.402 -3.940 1.00 0.12 H new ATOM 0 H3' DT A 8 -8.740 -2.239 -6.310 1.00 0.11 H new ATOM 0 H2' DT A 8 -6.778 -2.074 -7.703 1.00 0.14 H new ATOM 0 H2'' DT A 8 -7.294 -0.399 -7.711 1.00 0.14 H new ATOM 0 H1' DT A 8 -5.774 0.245 -6.102 1.00 0.13 H new ATOM 0 H3 DT A 8 -1.792 0.602 -7.986 1.00 0.11 H new ATOM 0 H71 DT A 8 -1.769 -3.984 -9.078 1.00 0.13 H new ATOM 0 H72 DT A 8 -1.937 -4.426 -7.362 1.00 0.13 H new ATOM 0 H73 DT A 8 -3.336 -4.552 -8.455 1.00 0.13 H new ATOM 0 H6 DT A 8 -4.694 -3.102 -7.124 1.00 0.12 H new ATOM 259 P DT A 9 -10.008 0.227 -6.371 1.00 0.10 P ATOM 260 OP1 DT A 9 -10.759 1.127 -5.466 1.00 0.12 O ATOM 261 OP2 DT A 9 -10.712 -0.902 -7.023 1.00 0.15 O ATOM 262 O5' DT A 9 -9.330 1.126 -7.531 1.00 0.12 O ATOM 263 C5' DT A 9 -8.708 2.399 -7.271 1.00 0.12 C ATOM 264 C4' DT A 9 -7.773 2.823 -8.410 1.00 0.13 C ATOM 265 O4' DT A 9 -6.743 1.850 -8.593 1.00 0.13 O ATOM 266 C3' DT A 9 -8.484 2.940 -9.761 1.00 0.14 C ATOM 267 O3' DT A 9 -8.858 4.306 -10.018 1.00 0.15 O ATOM 268 C2' DT A 9 -7.423 2.361 -10.723 1.00 0.11 C ATOM 269 C1' DT A 9 -6.192 2.153 -9.874 1.00 0.11 C ATOM 270 N1 DT A 9 -5.335 1.005 -10.239 1.00 0.11 N ATOM 271 C2 DT A 9 -3.998 1.229 -10.501 1.00 0.10 C ATOM 272 O2 DT A 9 -3.470 2.336 -10.487 1.00 0.12 O ATOM 273 N3 DT A 9 -3.250 0.119 -10.791 1.00 0.12 N ATOM 274 C4 DT A 9 -3.691 -1.178 -10.846 1.00 0.13 C ATOM 275 C5 DT A 9 -5.104 -1.333 -10.563 1.00 0.13 C ATOM 276 C6 DT A 9 -5.860 -0.256 -10.279 1.00 0.12 C ATOM 277 O4 DT A 9 -2.882 -2.063 -11.110 1.00 0.13 O ATOM 290 C7 DT A 9 -5.756 -2.720 -10.562 1.00 0.15 C ATOM 0 H5' DT A 9 -8.144 2.344 -6.340 1.00 0.12 H new ATOM 0 H5'' DT A 9 -9.478 3.158 -7.132 1.00 0.12 H new ATOM 0 H4' DT A 9 -7.383 3.797 -8.114 1.00 0.13 H new ATOM 0 H3' DT A 9 -9.433 2.410 -9.847 1.00 0.14 H new ATOM 0 H2' DT A 9 -7.761 1.423 -11.164 1.00 0.11 H new ATOM 0 H2'' DT A 9 -7.222 3.046 -11.547 1.00 0.11 H new ATOM 0 H1' DT A 9 -5.551 3.030 -9.965 1.00 0.11 H new ATOM 0 H3 DT A 9 -2.261 0.273 -10.987 1.00 0.12 H new ATOM 0 H71 DT A 9 -5.232 -3.369 -11.264 1.00 0.15 H new ATOM 0 H72 DT A 9 -5.700 -3.148 -9.561 1.00 0.15 H new ATOM 0 H73 DT A 9 -6.801 -2.631 -10.860 1.00 0.15 H new ATOM 0 H6 DT A 9 -6.912 -0.393 -10.077 1.00 0.12 H new ATOM 291 P DG A 10 -9.355 4.866 -11.452 1.00 0.15 P ATOM 292 OP1 DG A 10 -9.956 6.205 -11.251 1.00 0.18 O ATOM 293 OP2 DG A 10 -10.132 3.802 -12.131 1.00 0.17 O ATOM 294 O5' DG A 10 -7.946 5.039 -12.215 1.00 0.12 O ATOM 295 C5' DG A 10 -6.947 5.957 -11.741 1.00 0.13 C ATOM 296 C4' DG A 10 -5.654 5.869 -12.549 1.00 0.11 C ATOM 297 O4' DG A 10 -5.001 4.581 -12.451 1.00 0.12 O ATOM 298 C3' DG A 10 -5.907 6.135 -14.038 1.00 0.09 C ATOM 299 O3' DG A 10 -5.173 7.289 -14.482 1.00 0.12 O ATOM 300 C2' DG A 10 -5.403 4.833 -14.634 1.00 0.12 C ATOM 301 C1' DG A 10 -4.320 4.375 -13.695 1.00 0.12 C ATOM 302 N9 DG A 10 -3.953 2.957 -13.895 1.00 0.10 N ATOM 303 C8 DG A 10 -4.754 1.865 -13.823 1.00 0.11 C ATOM 304 N7 DG A 10 -4.103 0.698 -14.024 1.00 0.12 N ATOM 305 C5 DG A 10 -2.818 1.088 -14.241 1.00 0.12 C ATOM 306 C6 DG A 10 -1.656 0.310 -14.520 1.00 0.13 C ATOM 307 O6 DG A 10 -1.513 -0.906 -14.621 1.00 0.16 O ATOM 308 N1 DG A 10 -0.544 1.099 -14.684 1.00 0.12 N ATOM 309 C2 DG A 10 -0.523 2.468 -14.595 1.00 0.11 C ATOM 310 N2 DG A 10 0.642 3.058 -14.793 1.00 0.13 N ATOM 311 N3 DG A 10 -1.594 3.208 -14.332 1.00 0.11 N ATOM 312 C4 DG A 10 -2.705 2.459 -14.169 1.00 0.11 C ATOM 0 H5' DG A 10 -6.733 5.749 -10.693 1.00 0.13 H new ATOM 0 H5'' DG A 10 -7.337 6.974 -11.792 1.00 0.13 H new ATOM 0 H4' DG A 10 -5.006 6.631 -12.116 1.00 0.11 H new ATOM 0 H3' DG A 10 -6.936 6.368 -14.313 1.00 0.09 H new ATOM 0 H2' DG A 10 -6.202 4.095 -14.706 1.00 0.12 H new ATOM 0 H2'' DG A 10 -5.016 4.983 -15.642 1.00 0.12 H new ATOM 0 H1' DG A 10 -3.366 4.890 -13.805 1.00 0.12 H new ATOM 0 H8 DG A 10 -5.814 1.923 -13.624 1.00 0.11 H new ATOM 0 H1 DG A 10 0.338 0.629 -14.889 1.00 0.12 H new ATOM 0 H21 DG A 10 0.715 4.074 -14.739 1.00 0.13 H new ATOM 0 H22 DG A 10 1.469 2.498 -15.000 1.00 0.13 H new ATOM 324 P DC A 11 -5.222 7.896 -15.984 1.00 0.13 P ATOM 325 OP1 DC A 11 -4.842 9.325 -15.913 1.00 0.20 O ATOM 326 OP2 DC A 11 -6.510 7.512 -16.606 1.00 0.13 O ATOM 327 O5' DC A 11 -4.046 7.096 -16.740 1.00 0.12 O ATOM 328 C5' DC A 11 -2.686 7.193 -16.295 1.00 0.14 C ATOM 329 C4' DC A 11 -1.805 6.099 -16.892 1.00 0.11 C ATOM 330 O4' DC A 11 -2.319 4.793 -16.585 1.00 0.10 O ATOM 331 C3' DC A 11 -1.619 6.163 -18.416 1.00 0.07 C ATOM 332 O3' DC A 11 -0.200 6.334 -18.622 1.00 0.10 O ATOM 333 C2' DC A 11 -2.185 4.790 -18.837 1.00 0.07 C ATOM 334 C1' DC A 11 -1.864 3.956 -17.644 1.00 0.09 C ATOM 335 N1 DC A 11 -2.498 2.623 -17.581 1.00 0.08 N ATOM 336 C2 DC A 11 -1.673 1.525 -17.525 1.00 0.11 C ATOM 337 O2 DC A 11 -0.455 1.643 -17.575 1.00 0.12 O ATOM 338 N3 DC A 11 -2.226 0.295 -17.416 1.00 0.13 N ATOM 339 C4 DC A 11 -3.549 0.142 -17.363 1.00 0.12 C ATOM 340 N4 DC A 11 -4.025 -1.092 -17.257 1.00 0.15 N ATOM 341 C5 DC A 11 -4.428 1.273 -17.421 1.00 0.10 C ATOM 342 C6 DC A 11 -3.850 2.488 -17.535 1.00 0.09 C ATOM 0 H5' DC A 11 -2.656 7.128 -15.207 1.00 0.14 H new ATOM 0 H5'' DC A 11 -2.285 8.169 -16.568 1.00 0.14 H new ATOM 0 H4' DC A 11 -0.834 6.279 -16.430 1.00 0.11 H new ATOM 0 H3' DC A 11 -2.104 6.959 -18.981 1.00 0.07 H new ATOM 0 H2' DC A 11 -3.257 4.831 -19.032 1.00 0.07 H new ATOM 0 H2'' DC A 11 -1.710 4.411 -19.742 1.00 0.07 H new ATOM 0 H1' DC A 11 -0.808 3.688 -17.628 1.00 0.09 H new ATOM 0 H41 DC A 11 -5.032 -1.248 -17.214 1.00 0.15 H new ATOM 0 H42 DC A 11 -3.384 -1.884 -17.219 1.00 0.15 H new ATOM 0 H5 DC A 11 -5.501 1.159 -17.376 1.00 0.10 H new ATOM 0 H6 DC A 11 -4.473 3.368 -17.591 1.00 0.09 H new ATOM 354 P DG A 12 0.756 5.679 -19.755 1.00 0.08 P ATOM 355 OP1 DG A 12 1.892 6.602 -19.970 1.00 0.12 O ATOM 356 OP2 DG A 12 -0.080 5.278 -20.909 1.00 0.09 O ATOM 357 O5' DG A 12 1.350 4.324 -19.091 1.00 0.09 O ATOM 358 C5' DG A 12 2.251 4.297 -17.961 1.00 0.10 C ATOM 359 C4' DG A 12 3.494 3.395 -18.150 1.00 0.08 C ATOM 360 O4' DG A 12 3.111 2.065 -18.555 1.00 0.08 O ATOM 361 C3' DG A 12 4.491 3.823 -19.230 1.00 0.10 C ATOM 362 O3' DG A 12 5.730 3.135 -19.004 1.00 0.11 O ATOM 363 C2' DG A 12 3.802 3.264 -20.449 1.00 0.11 C ATOM 364 C1' DG A 12 3.378 1.890 -19.964 1.00 0.09 C ATOM 365 N9 DG A 12 2.172 1.312 -20.581 1.00 0.10 N ATOM 366 C8 DG A 12 0.946 1.867 -20.805 1.00 0.11 C ATOM 367 N7 DG A 12 0.055 1.009 -21.343 1.00 0.13 N ATOM 368 C5 DG A 12 0.764 -0.142 -21.462 1.00 0.13 C ATOM 369 C6 DG A 12 0.359 -1.401 -21.963 1.00 0.16 C ATOM 370 O6 DG A 12 -0.733 -1.753 -22.397 1.00 0.18 O ATOM 371 N1 DG A 12 1.379 -2.319 -21.912 1.00 0.16 N ATOM 372 C2 DG A 12 2.642 -2.078 -21.444 1.00 0.14 C ATOM 373 N2 DG A 12 3.483 -3.096 -21.476 1.00 0.15 N ATOM 374 N3 DG A 12 3.045 -0.905 -20.970 1.00 0.12 N ATOM 375 C4 DG A 12 2.052 0.017 -21.009 1.00 0.11 C ATOM 0 H5' DG A 12 1.702 3.957 -17.083 1.00 0.10 H new ATOM 0 H5'' DG A 12 2.584 5.314 -17.754 1.00 0.10 H new ATOM 0 H4' DG A 12 3.967 3.463 -17.170 1.00 0.08 H new ATOM 0 H3' DG A 12 4.722 4.887 -19.281 1.00 0.10 H new ATOM 0 H2' DG A 12 2.949 3.872 -20.751 1.00 0.11 H new ATOM 0 H2'' DG A 12 4.472 3.206 -21.307 1.00 0.11 H new ATOM 0 HO3' DG A 12 5.842 2.969 -18.045 1.00 0.11 H new ATOM 0 H1' DG A 12 4.174 1.193 -20.224 1.00 0.09 H new ATOM 0 H8 DG A 12 0.711 2.895 -20.574 1.00 0.11 H new ATOM 0 H1 DG A 12 1.178 -3.260 -22.252 1.00 0.16 H new ATOM 0 H21 DG A 12 4.439 -2.978 -21.141 1.00 0.15 H new ATOM 0 H22 DG A 12 3.176 -4.000 -21.836 1.00 0.15 H new TER 388 DG A 12 ATOM 389 OP3 DC B 13 -1.366 -10.435 -22.083 1.00 0.25 O ATOM 390 P DC B 13 -1.326 -11.344 -20.764 1.00 0.25 P ATOM 391 OP1 DC B 13 -1.834 -10.531 -19.636 1.00 0.25 O ATOM 392 OP2 DC B 13 -1.931 -12.659 -21.073 1.00 0.28 O ATOM 393 O5' DC B 13 0.260 -11.530 -20.583 1.00 0.25 O ATOM 394 C5' DC B 13 1.112 -11.799 -21.707 1.00 0.25 C ATOM 395 C4' DC B 13 1.947 -10.577 -22.066 1.00 0.23 C ATOM 396 O4' DC B 13 1.125 -9.411 -22.312 1.00 0.24 O ATOM 397 C3' DC B 13 2.905 -10.253 -20.923 1.00 0.23 C ATOM 398 O3' DC B 13 4.226 -10.049 -21.438 1.00 0.25 O ATOM 399 C2' DC B 13 2.325 -8.846 -20.432 1.00 0.21 C ATOM 400 C1' DC B 13 1.788 -8.275 -21.731 1.00 0.21 C ATOM 401 N1 DC B 13 0.863 -7.126 -21.566 1.00 0.21 N ATOM 402 C2 DC B 13 1.214 -5.878 -22.075 1.00 0.19 C ATOM 403 O2 DC B 13 2.289 -5.673 -22.632 1.00 0.19 O ATOM 404 N3 DC B 13 0.332 -4.855 -21.930 1.00 0.17 N ATOM 405 C4 DC B 13 -0.840 -5.032 -21.315 1.00 0.19 C ATOM 406 N4 DC B 13 -1.665 -3.996 -21.210 1.00 0.18 N ATOM 407 C5 DC B 13 -1.204 -6.309 -20.787 1.00 0.20 C ATOM 408 C6 DC B 13 -0.326 -7.308 -20.938 1.00 0.19 C ATOM 0 H5' DC B 13 0.507 -12.094 -22.564 1.00 0.25 H new ATOM 0 H5'' DC B 13 1.769 -12.638 -21.477 1.00 0.25 H new ATOM 0 H4' DC B 13 2.494 -10.818 -22.978 1.00 0.23 H new ATOM 0 H3' DC B 13 2.970 -11.026 -20.158 1.00 0.23 H new ATOM 0 H2' DC B 13 1.544 -8.963 -19.681 1.00 0.21 H new ATOM 0 H2'' DC B 13 3.097 -8.214 -19.993 1.00 0.21 H new ATOM 0 H1' DC B 13 2.582 -7.848 -22.344 1.00 0.21 H new ATOM 0 H41 DC B 13 -2.566 -4.107 -20.745 1.00 0.18 H new ATOM 0 H42 DC B 13 -1.398 -3.090 -21.595 1.00 0.18 H new ATOM 0 H5 DC B 13 -2.149 -6.462 -20.287 1.00 0.20 H new ATOM 0 H6 DC B 13 -0.571 -8.286 -20.549 1.00 0.19 H new ATOM 421 P DG B 14 5.470 -9.789 -20.444 1.00 0.26 P ATOM 422 OP1 DG B 14 6.713 -9.829 -21.248 1.00 0.29 O ATOM 423 OP2 DG B 14 5.326 -10.678 -19.268 1.00 0.30 O ATOM 424 O5' DG B 14 5.211 -8.267 -19.970 1.00 0.21 O ATOM 425 C5' DG B 14 5.581 -7.152 -20.795 1.00 0.19 C ATOM 426 C4' DG B 14 5.269 -5.801 -20.150 1.00 0.15 C ATOM 427 O4' DG B 14 3.863 -5.477 -20.060 1.00 0.16 O ATOM 428 C3' DG B 14 5.840 -5.668 -18.728 1.00 0.12 C ATOM 429 O3' DG B 14 6.790 -4.586 -18.720 1.00 0.14 O ATOM 430 C2' DG B 14 4.574 -5.451 -17.937 1.00 0.12 C ATOM 431 C1' DG B 14 3.697 -4.682 -18.876 1.00 0.13 C ATOM 432 N9 DG B 14 2.288 -4.619 -18.473 1.00 0.14 N ATOM 433 C8 DG B 14 1.437 -5.634 -18.232 1.00 0.15 C ATOM 434 N7 DG B 14 0.185 -5.233 -17.912 1.00 0.18 N ATOM 435 C5 DG B 14 0.278 -3.876 -17.955 1.00 0.16 C ATOM 436 C6 DG B 14 -0.707 -2.875 -17.706 1.00 0.17 C ATOM 437 O6 DG B 14 -1.894 -2.984 -17.404 1.00 0.20 O ATOM 438 N1 DG B 14 -0.187 -1.612 -17.851 1.00 0.15 N ATOM 439 C2 DG B 14 1.108 -1.322 -18.190 1.00 0.13 C ATOM 440 N2 DG B 14 1.432 -0.050 -18.240 1.00 0.12 N ATOM 441 N3 DG B 14 2.038 -2.236 -18.432 1.00 0.12 N ATOM 442 C4 DG B 14 1.553 -3.486 -18.294 1.00 0.14 C ATOM 0 H5' DG B 14 5.057 -7.223 -21.748 1.00 0.19 H new ATOM 0 H5'' DG B 14 6.648 -7.207 -21.013 1.00 0.19 H new ATOM 0 H4' DG B 14 5.752 -5.105 -20.836 1.00 0.15 H new ATOM 0 H3' DG B 14 6.409 -6.504 -18.320 1.00 0.12 H new ATOM 0 H2' DG B 14 4.117 -6.397 -17.646 1.00 0.12 H new ATOM 0 H2'' DG B 14 4.765 -4.893 -17.020 1.00 0.12 H new ATOM 0 H1' DG B 14 3.964 -3.628 -18.955 1.00 0.13 H new ATOM 0 H8 DG B 14 1.727 -6.673 -18.289 1.00 0.15 H new ATOM 0 H1 DG B 14 -0.817 -0.825 -17.693 1.00 0.15 H new ATOM 0 H21 DG B 14 2.383 0.225 -18.487 1.00 0.12 H new ATOM 0 H22 DG B 14 0.733 0.663 -18.032 1.00 0.12 H new ATOM 454 P DC B 15 7.470 -3.894 -17.427 1.00 0.07 P ATOM 455 OP1 DC B 15 8.920 -3.741 -17.685 1.00 0.13 O ATOM 456 OP2 DC B 15 7.002 -4.599 -16.209 1.00 0.08 O ATOM 457 O5' DC B 15 6.774 -2.429 -17.447 1.00 0.08 O ATOM 458 C5' DC B 15 6.962 -1.493 -18.529 1.00 0.07 C ATOM 459 C4' DC B 15 6.585 -0.038 -18.181 1.00 0.06 C ATOM 460 O4' DC B 15 5.194 0.164 -17.854 1.00 0.07 O ATOM 461 C3' DC B 15 7.394 0.484 -17.004 1.00 0.08 C ATOM 462 O3' DC B 15 7.562 1.908 -17.083 1.00 0.09 O ATOM 463 C2' DC B 15 6.458 0.057 -15.850 1.00 0.08 C ATOM 464 C1' DC B 15 5.034 0.323 -16.426 1.00 0.08 C ATOM 465 N1 DC B 15 3.900 -0.565 -16.010 1.00 0.08 N ATOM 466 C2 DC B 15 2.717 0.044 -15.591 1.00 0.10 C ATOM 467 O2 DC B 15 2.578 1.264 -15.541 1.00 0.11 O ATOM 468 N3 DC B 15 1.671 -0.736 -15.224 1.00 0.12 N ATOM 469 C4 DC B 15 1.753 -2.067 -15.256 1.00 0.11 C ATOM 470 N4 DC B 15 0.675 -2.755 -14.888 1.00 0.15 N ATOM 471 C5 DC B 15 2.953 -2.724 -15.682 1.00 0.10 C ATOM 472 C6 DC B 15 3.991 -1.937 -16.046 1.00 0.10 C ATOM 0 H5' DC B 15 6.365 -1.817 -19.382 1.00 0.07 H new ATOM 0 H5'' DC B 15 8.006 -1.521 -18.841 1.00 0.07 H new ATOM 0 H4' DC B 15 6.807 0.507 -19.099 1.00 0.06 H new ATOM 0 H3' DC B 15 8.415 0.112 -16.921 1.00 0.08 H new ATOM 0 H2' DC B 15 6.596 -0.992 -15.587 1.00 0.08 H new ATOM 0 H2'' DC B 15 6.642 0.639 -14.947 1.00 0.08 H new ATOM 0 H1' DC B 15 4.735 1.299 -16.045 1.00 0.08 H new ATOM 0 H41 DC B 15 0.693 -3.775 -14.897 1.00 0.15 H new ATOM 0 H42 DC B 15 -0.169 -2.262 -14.597 1.00 0.15 H new ATOM 0 H5 DC B 15 3.025 -3.801 -15.711 1.00 0.10 H new ATOM 0 H6 DC B 15 4.912 -2.396 -16.372 1.00 0.10 H new ATOM 484 P A B 16 8.478 2.727 -16.031 1.00 0.09 P ATOM 485 OP1 A B 16 8.828 4.030 -16.641 1.00 0.10 O ATOM 486 OP2 A B 16 9.558 1.835 -15.545 1.00 0.11 O ATOM 487 O5' A B 16 7.452 2.983 -14.809 1.00 0.10 O ATOM 488 C5' A B 16 6.524 4.078 -14.831 1.00 0.11 C ATOM 489 C4' A B 16 5.366 3.912 -13.850 1.00 0.11 C ATOM 490 O4' A B 16 4.556 2.753 -14.113 1.00 0.10 O ATOM 491 C3' A B 16 5.787 3.704 -12.397 1.00 0.11 C ATOM 492 O3' A B 16 6.372 4.879 -11.793 1.00 0.12 O ATOM 493 C2' A B 16 4.448 3.275 -11.808 1.00 0.11 C ATOM 494 O2' A B 16 3.591 4.359 -11.497 1.00 0.13 O ATOM 495 C1' A B 16 3.697 2.674 -12.964 1.00 0.10 C ATOM 496 N9 A B 16 3.080 1.370 -12.668 1.00 0.10 N ATOM 497 C8 A B 16 3.595 0.117 -12.760 1.00 0.09 C ATOM 498 N7 A B 16 2.714 -0.852 -12.414 1.00 0.09 N ATOM 499 C5 A B 16 1.592 -0.156 -12.092 1.00 0.08 C ATOM 500 C6 A B 16 0.317 -0.551 -11.655 1.00 0.09 C ATOM 501 N6 A B 16 -0.051 -1.816 -11.467 1.00 0.08 N ATOM 502 N1 A B 16 -0.581 0.417 -11.422 1.00 0.09 N ATOM 503 C2 A B 16 -0.249 1.688 -11.605 1.00 0.10 C ATOM 504 N3 A B 16 0.908 2.185 -12.009 1.00 0.10 N ATOM 505 C4 A B 16 1.794 1.192 -12.238 1.00 0.09 C ATOM 0 H5' A B 16 6.124 4.185 -15.839 1.00 0.11 H new ATOM 0 H5'' A B 16 7.057 5.001 -14.600 1.00 0.11 H new ATOM 0 H4' A B 16 4.834 4.853 -13.992 1.00 0.11 H new ATOM 0 H3' A B 16 6.592 2.986 -12.239 1.00 0.11 H new ATOM 0 H2' A B 16 4.660 2.667 -10.929 1.00 0.11 H new ATOM 0 HO2' A B 16 2.980 4.097 -10.777 1.00 0.13 H new ATOM 0 H1' A B 16 2.797 3.246 -13.190 1.00 0.10 H new ATOM 0 H8 A B 16 4.607 -0.087 -13.078 1.00 0.09 H new ATOM 0 H61 A B 16 -0.996 -2.030 -11.147 1.00 0.08 H new ATOM 0 H62 A B 16 0.612 -2.571 -11.643 1.00 0.08 H new ATOM 0 H2 A B 16 -1.024 2.411 -11.397 1.00 0.10 H new ATOM 517 P A B 17 6.777 4.980 -10.224 1.00 0.11 P ATOM 518 OP1 A B 17 7.951 5.876 -10.113 1.00 0.12 O ATOM 519 OP2 A B 17 6.854 3.605 -9.678 1.00 0.12 O ATOM 520 O5' A B 17 5.506 5.713 -9.528 1.00 0.12 O ATOM 521 C5' A B 17 5.230 7.114 -9.718 1.00 0.12 C ATOM 522 C4' A B 17 3.774 7.503 -9.425 1.00 0.11 C ATOM 523 O4' A B 17 2.872 6.734 -10.254 1.00 0.11 O ATOM 524 C3' A B 17 3.314 7.278 -7.977 1.00 0.10 C ATOM 525 O3' A B 17 3.647 8.344 -7.067 1.00 0.11 O ATOM 526 C2' A B 17 1.812 7.219 -8.249 1.00 0.09 C ATOM 527 O2' A B 17 1.301 8.497 -8.660 1.00 0.11 O ATOM 528 C1' A B 17 1.768 6.273 -9.449 1.00 0.10 C ATOM 529 N9 A B 17 1.952 4.833 -9.086 1.00 0.09 N ATOM 530 C8 A B 17 3.108 4.101 -8.868 1.00 0.10 C ATOM 531 N7 A B 17 2.866 2.805 -8.587 1.00 0.10 N ATOM 532 C5 A B 17 1.515 2.709 -8.627 1.00 0.09 C ATOM 533 C6 A B 17 0.647 1.629 -8.424 1.00 0.09 C ATOM 534 N6 A B 17 1.066 0.401 -8.143 1.00 0.09 N ATOM 535 N1 A B 17 -0.668 1.856 -8.531 1.00 0.08 N ATOM 536 C2 A B 17 -1.108 3.076 -8.824 1.00 0.08 C ATOM 537 N3 A B 17 -0.390 4.170 -9.039 1.00 0.09 N ATOM 538 C4 A B 17 0.934 3.917 -8.923 1.00 0.09 C ATOM 0 H5' A B 17 5.469 7.386 -10.746 1.00 0.12 H new ATOM 0 H5'' A B 17 5.889 7.695 -9.073 1.00 0.12 H new ATOM 0 H4' A B 17 3.745 8.573 -9.630 1.00 0.11 H new ATOM 0 H3' A B 17 3.771 6.421 -7.483 1.00 0.10 H new ATOM 0 H2' A B 17 1.229 6.917 -7.379 1.00 0.09 H new ATOM 0 HO2' A B 17 1.893 9.206 -8.334 1.00 0.11 H new ATOM 0 H1' A B 17 0.798 6.298 -9.945 1.00 0.10 H new ATOM 0 H8 A B 17 4.100 4.525 -8.918 1.00 0.10 H new ATOM 0 H61 A B 17 0.389 -0.350 -8.005 1.00 0.09 H new ATOM 0 H62 A B 17 2.065 0.208 -8.066 1.00 0.09 H new ATOM 0 H2 A B 17 -2.180 3.190 -8.896 1.00 0.08 H new ATOM 550 P A B 18 3.666 8.137 -5.457 1.00 0.14 P ATOM 551 OP1 A B 18 3.982 9.441 -4.830 1.00 0.20 O ATOM 552 OP2 A B 18 4.515 6.961 -5.164 1.00 0.17 O ATOM 553 O5' A B 18 2.146 7.755 -5.066 1.00 0.11 O ATOM 554 C5' A B 18 1.017 8.611 -5.327 1.00 0.10 C ATOM 555 C4' A B 18 -0.282 7.807 -5.330 1.00 0.07 C ATOM 556 O4' A B 18 -0.103 6.718 -6.260 1.00 0.07 O ATOM 557 C3' A B 18 -0.570 7.177 -3.966 1.00 0.06 C ATOM 558 O3' A B 18 -1.369 8.038 -3.127 1.00 0.05 O ATOM 559 C2' A B 18 -1.343 5.948 -4.421 1.00 0.06 C ATOM 560 O2' A B 18 -2.738 6.148 -4.579 1.00 0.07 O ATOM 561 C1' A B 18 -0.685 5.531 -5.712 1.00 0.06 C ATOM 562 N9 A B 18 0.267 4.418 -5.500 1.00 0.06 N ATOM 563 C8 A B 18 1.634 4.408 -5.409 1.00 0.07 C ATOM 564 N7 A B 18 2.143 3.170 -5.247 1.00 0.07 N ATOM 565 C5 A B 18 1.047 2.373 -5.233 1.00 0.06 C ATOM 566 C6 A B 18 0.898 0.993 -5.098 1.00 0.08 C ATOM 567 N6 A B 18 1.943 0.187 -4.967 1.00 0.10 N ATOM 568 N1 A B 18 -0.345 0.490 -5.119 1.00 0.09 N ATOM 569 C2 A B 18 -1.377 1.315 -5.268 1.00 0.10 C ATOM 570 N3 A B 18 -1.363 2.628 -5.409 1.00 0.08 N ATOM 571 C4 A B 18 -0.099 3.102 -5.381 1.00 0.06 C ATOM 0 H5' A B 18 1.145 9.107 -6.289 1.00 0.10 H new ATOM 0 H5'' A B 18 0.965 9.393 -4.569 1.00 0.10 H new ATOM 0 H4' A B 18 -1.103 8.475 -5.590 1.00 0.07 H new ATOM 0 H3' A B 18 0.308 6.975 -3.353 1.00 0.06 H new ATOM 0 H2' A B 18 -1.298 5.176 -3.653 1.00 0.06 H new ATOM 0 HO2' A B 18 -3.217 5.336 -4.312 1.00 0.07 H new ATOM 0 H1' A B 18 -1.397 5.120 -6.428 1.00 0.06 H new ATOM 0 H8 A B 18 2.241 5.300 -5.462 1.00 0.07 H new ATOM 0 H61 A B 18 1.802 -0.819 -4.870 1.00 0.10 H new ATOM 0 H62 A B 18 2.887 0.573 -4.963 1.00 0.10 H new ATOM 0 H2 A B 18 -2.353 0.852 -5.275 1.00 0.10 H new ATOM 583 P DT B 19 -1.661 7.769 -1.556 1.00 0.06 P ATOM 584 OP1 DT B 19 -2.412 8.930 -1.024 1.00 0.10 O ATOM 585 OP2 DT B 19 -0.380 7.380 -0.922 1.00 0.09 O ATOM 586 O5' DT B 19 -2.635 6.480 -1.516 1.00 0.08 O ATOM 587 C5' DT B 19 -3.961 6.464 -2.077 1.00 0.08 C ATOM 588 C4' DT B 19 -4.499 5.033 -2.185 1.00 0.07 C ATOM 589 O4' DT B 19 -3.502 4.233 -2.860 1.00 0.08 O ATOM 590 C3' DT B 19 -4.743 4.427 -0.797 1.00 0.08 C ATOM 591 O3' DT B 19 -6.123 4.089 -0.582 1.00 0.09 O ATOM 592 C2' DT B 19 -3.915 3.116 -0.842 1.00 0.09 C ATOM 593 C1' DT B 19 -3.437 2.927 -2.264 1.00 0.08 C ATOM 594 N1 DT B 19 -2.033 2.454 -2.153 1.00 0.07 N ATOM 595 C2 DT B 19 -1.764 1.108 -2.282 1.00 0.09 C ATOM 596 O2 DT B 19 -2.634 0.267 -2.461 1.00 0.11 O ATOM 597 N3 DT B 19 -0.441 0.745 -2.193 1.00 0.07 N ATOM 598 C4 DT B 19 0.623 1.592 -1.994 1.00 0.06 C ATOM 599 C5 DT B 19 0.260 2.987 -1.865 1.00 0.06 C ATOM 600 C6 DT B 19 -1.034 3.355 -1.943 1.00 0.07 C ATOM 601 O4 DT B 19 1.755 1.121 -1.956 1.00 0.06 O ATOM 614 C7 DT B 19 1.347 4.056 -1.667 1.00 0.06 C ATOM 0 H5' DT B 19 -3.947 6.926 -3.064 1.00 0.08 H new ATOM 0 H5'' DT B 19 -4.629 7.061 -1.456 1.00 0.08 H new ATOM 0 H4' DT B 19 -5.443 5.049 -2.729 1.00 0.07 H new ATOM 0 H3' DT B 19 -4.472 5.122 -0.002 1.00 0.08 H new ATOM 0 H2' DT B 19 -3.068 3.174 -0.158 1.00 0.09 H new ATOM 0 H2'' DT B 19 -4.523 2.268 -0.526 1.00 0.09 H new ATOM 0 H1' DT B 19 -4.015 2.219 -2.858 1.00 0.08 H new ATOM 0 H3 DT B 19 -0.229 -0.249 -2.283 1.00 0.07 H new ATOM 0 H71 DT B 19 1.015 4.998 -2.104 1.00 0.06 H new ATOM 0 H72 DT B 19 1.530 4.196 -0.602 1.00 0.06 H new ATOM 0 H73 DT B 19 2.267 3.734 -2.154 1.00 0.06 H new ATOM 0 H6 DT B 19 -1.287 4.399 -1.835 1.00 0.07 H new ATOM 615 P DT B 20 -6.663 3.534 0.847 1.00 0.08 P ATOM 616 OP1 DT B 20 -8.142 3.601 0.827 1.00 0.11 O ATOM 617 OP2 DT B 20 -5.917 4.231 1.921 1.00 0.09 O ATOM 618 O5' DT B 20 -6.229 1.977 0.859 1.00 0.09 O ATOM 619 C5' DT B 20 -6.791 1.018 -0.054 1.00 0.08 C ATOM 620 C4' DT B 20 -6.289 -0.406 0.208 1.00 0.09 C ATOM 621 O4' DT B 20 -4.869 -0.475 0.034 1.00 0.10 O ATOM 622 C3' DT B 20 -6.628 -0.940 1.609 1.00 0.09 C ATOM 623 O3' DT B 20 -7.307 -2.204 1.485 1.00 0.10 O ATOM 624 C2' DT B 20 -5.231 -1.084 2.220 1.00 0.11 C ATOM 625 C1' DT B 20 -4.340 -1.340 1.041 1.00 0.09 C ATOM 626 N1 DT B 20 -2.915 -0.982 1.201 1.00 0.09 N ATOM 627 C2 DT B 20 -1.956 -1.972 1.124 1.00 0.11 C ATOM 628 O2 DT B 20 -2.212 -3.163 0.976 1.00 0.13 O ATOM 629 N3 DT B 20 -0.654 -1.548 1.222 1.00 0.11 N ATOM 630 C4 DT B 20 -0.229 -0.252 1.384 1.00 0.09 C ATOM 631 C5 DT B 20 -1.293 0.723 1.464 1.00 0.09 C ATOM 632 C6 DT B 20 -2.573 0.322 1.373 1.00 0.09 C ATOM 633 O4 DT B 20 0.973 -0.022 1.427 1.00 0.11 O ATOM 646 C7 DT B 20 -0.971 2.217 1.651 1.00 0.08 C ATOM 0 H5' DT B 20 -6.543 1.305 -1.076 1.00 0.08 H new ATOM 0 H5'' DT B 20 -7.878 1.037 0.027 1.00 0.08 H new ATOM 0 H4' DT B 20 -6.809 -1.032 -0.518 1.00 0.09 H new ATOM 0 H3' DT B 20 -7.290 -0.315 2.208 1.00 0.09 H new ATOM 0 H2' DT B 20 -4.935 -0.181 2.755 1.00 0.11 H new ATOM 0 H2'' DT B 20 -5.192 -1.906 2.935 1.00 0.11 H new ATOM 0 H1' DT B 20 -4.340 -2.412 0.841 1.00 0.09 H new ATOM 0 H3 DT B 20 0.069 -2.266 1.169 1.00 0.11 H new ATOM 0 H71 DT B 20 -0.042 2.322 2.212 1.00 0.08 H new ATOM 0 H72 DT B 20 -0.861 2.690 0.675 1.00 0.08 H new ATOM 0 H73 DT B 20 -1.781 2.698 2.199 1.00 0.08 H new ATOM 0 H6 DT B 20 -3.357 1.062 1.439 1.00 0.09 H new ATOM 647 P DT B 21 -8.156 -2.893 2.680 1.00 0.09 P ATOM 648 OP1 DT B 21 -9.047 -3.913 2.080 1.00 0.12 O ATOM 649 OP2 DT B 21 -8.741 -1.817 3.513 1.00 0.11 O ATOM 650 O5' DT B 21 -7.038 -3.657 3.568 1.00 0.11 O ATOM 651 C5' DT B 21 -6.399 -4.875 3.136 1.00 0.12 C ATOM 652 C4' DT B 21 -5.064 -5.127 3.853 1.00 0.13 C ATOM 653 O4' DT B 21 -4.173 -4.031 3.620 1.00 0.11 O ATOM 654 C3' DT B 21 -5.189 -5.263 5.377 1.00 0.13 C ATOM 655 O3' DT B 21 -5.094 -6.638 5.789 1.00 0.16 O ATOM 656 C2' DT B 21 -4.014 -4.401 5.871 1.00 0.14 C ATOM 657 C1' DT B 21 -3.182 -4.154 4.637 1.00 0.12 C ATOM 658 N1 DT B 21 -2.388 -2.907 4.626 1.00 0.09 N ATOM 659 C2 DT B 21 -1.033 -3.000 4.379 1.00 0.10 C ATOM 660 O2 DT B 21 -0.437 -4.057 4.201 1.00 0.13 O ATOM 661 N3 DT B 21 -0.349 -1.814 4.346 1.00 0.10 N ATOM 662 C4 DT B 21 -0.869 -0.560 4.528 1.00 0.09 C ATOM 663 C5 DT B 21 -2.295 -0.544 4.783 1.00 0.08 C ATOM 664 C6 DT B 21 -2.990 -1.696 4.824 1.00 0.08 C ATOM 665 O4 DT B 21 -0.113 0.404 4.453 1.00 0.09 O ATOM 678 C7 DT B 21 -3.036 0.781 4.996 1.00 0.09 C ATOM 0 H5' DT B 21 -6.227 -4.829 2.061 1.00 0.12 H new ATOM 0 H5'' DT B 21 -7.069 -5.716 3.316 1.00 0.12 H new ATOM 0 H4' DT B 21 -4.697 -6.069 3.446 1.00 0.13 H new ATOM 0 H3' DT B 21 -6.148 -4.940 5.782 1.00 0.13 H new ATOM 0 H2' DT B 21 -4.364 -3.466 6.308 1.00 0.14 H new ATOM 0 H2'' DT B 21 -3.439 -4.917 6.641 1.00 0.14 H new ATOM 0 H1' DT B 21 -2.444 -4.950 4.536 1.00 0.12 H new ATOM 0 H3 DT B 21 0.654 -1.870 4.167 1.00 0.10 H new ATOM 0 H71 DT B 21 -2.359 1.509 5.443 1.00 0.09 H new ATOM 0 H72 DT B 21 -3.392 1.157 4.037 1.00 0.09 H new ATOM 0 H73 DT B 21 -3.885 0.620 5.660 1.00 0.09 H new ATOM 0 H6 DT B 21 -4.052 -1.663 5.019 1.00 0.08 H new ATOM 679 P DG B 22 -5.101 -7.107 7.339 1.00 0.19 P ATOM 680 OP1 DG B 22 -5.410 -8.555 7.383 1.00 0.23 O ATOM 681 OP2 DG B 22 -5.932 -6.155 8.111 1.00 0.21 O ATOM 682 O5' DG B 22 -3.558 -6.893 7.766 1.00 0.16 O ATOM 683 C5' DG B 22 -2.523 -7.796 7.338 1.00 0.14 C ATOM 684 C4' DG B 22 -1.126 -7.355 7.778 1.00 0.11 C ATOM 685 O4' DG B 22 -0.695 -6.116 7.170 1.00 0.11 O ATOM 686 C3' DG B 22 -1.017 -7.170 9.301 1.00 0.11 C ATOM 687 O3' DG B 22 -0.043 -8.066 9.866 1.00 0.10 O ATOM 688 C2' DG B 22 -0.588 -5.713 9.373 1.00 0.12 C ATOM 689 C1' DG B 22 0.196 -5.493 8.102 1.00 0.10 C ATOM 690 N9 DG B 22 0.403 -4.064 7.792 1.00 0.10 N ATOM 691 C8 DG B 22 -0.526 -3.082 7.681 1.00 0.10 C ATOM 692 N7 DG B 22 -0.006 -1.875 7.367 1.00 0.11 N ATOM 693 C5 DG B 22 1.328 -2.122 7.280 1.00 0.09 C ATOM 694 C6 DG B 22 2.404 -1.237 6.978 1.00 0.09 C ATOM 695 O6 DG B 22 2.397 -0.038 6.716 1.00 0.10 O ATOM 696 N1 DG B 22 3.614 -1.888 6.993 1.00 0.09 N ATOM 697 C2 DG B 22 3.795 -3.221 7.261 1.00 0.08 C ATOM 698 N2 DG B 22 5.038 -3.668 7.231 1.00 0.09 N ATOM 699 N3 DG B 22 2.804 -4.062 7.543 1.00 0.09 N ATOM 700 C4 DG B 22 1.600 -3.447 7.535 1.00 0.09 C ATOM 0 H5' DG B 22 -2.547 -7.878 6.251 1.00 0.14 H new ATOM 0 H5'' DG B 22 -2.727 -8.789 7.737 1.00 0.14 H new ATOM 0 H4' DG B 22 -0.483 -8.169 7.445 1.00 0.11 H new ATOM 0 H3' DG B 22 -1.925 -7.390 9.863 1.00 0.11 H new ATOM 0 H2' DG B 22 -1.449 -5.047 9.430 1.00 0.12 H new ATOM 0 H2'' DG B 22 0.022 -5.521 10.255 1.00 0.12 H new ATOM 0 H1' DG B 22 1.213 -5.886 8.121 1.00 0.10 H new ATOM 0 H8 DG B 22 -1.583 -3.249 7.830 1.00 0.10 H new ATOM 0 H1 DG B 22 4.446 -1.335 6.788 1.00 0.09 H new ATOM 0 H21 DG B 22 5.231 -4.651 7.423 1.00 0.09 H new ATOM 0 H22 DG B 22 5.804 -3.030 7.016 1.00 0.09 H new ATOM 712 P DC B 23 0.297 -8.152 11.449 1.00 0.10 P ATOM 713 OP1 DC B 23 0.795 -9.517 11.735 1.00 0.12 O ATOM 714 OP2 DC B 23 -0.858 -7.621 12.208 1.00 0.12 O ATOM 715 O5' DC B 23 1.524 -7.118 11.627 1.00 0.13 O ATOM 716 C5' DC B 23 2.825 -7.381 11.074 1.00 0.14 C ATOM 717 C4' DC B 23 3.771 -6.184 11.210 1.00 0.16 C ATOM 718 O4' DC B 23 3.233 -5.031 10.541 1.00 0.17 O ATOM 719 C3' DC B 23 4.082 -5.780 12.666 1.00 0.15 C ATOM 720 O3' DC B 23 5.508 -5.856 12.873 1.00 0.13 O ATOM 721 C2' DC B 23 3.556 -4.332 12.673 1.00 0.15 C ATOM 722 C1' DC B 23 3.744 -3.899 11.240 1.00 0.14 C ATOM 723 N1 DC B 23 3.013 -2.675 10.829 1.00 0.13 N ATOM 724 C2 DC B 23 3.733 -1.625 10.284 1.00 0.12 C ATOM 725 O2 DC B 23 4.953 -1.658 10.158 1.00 0.12 O ATOM 726 N3 DC B 23 3.059 -0.520 9.882 1.00 0.11 N ATOM 727 C4 DC B 23 1.732 -0.435 10.001 1.00 0.14 C ATOM 728 N4 DC B 23 1.137 0.675 9.580 1.00 0.14 N ATOM 729 C5 DC B 23 0.970 -1.507 10.561 1.00 0.15 C ATOM 730 C6 DC B 23 1.655 -2.599 10.960 1.00 0.15 C ATOM 0 H5' DC B 23 2.723 -7.642 10.021 1.00 0.14 H new ATOM 0 H5'' DC B 23 3.262 -8.245 11.575 1.00 0.14 H new ATOM 0 H4' DC B 23 4.702 -6.517 10.751 1.00 0.16 H new ATOM 0 H3' DC B 23 3.643 -6.396 13.451 1.00 0.15 H new ATOM 0 H2' DC B 23 2.510 -4.283 12.976 1.00 0.15 H new ATOM 0 H2'' DC B 23 4.117 -3.701 13.363 1.00 0.15 H new ATOM 0 H1' DC B 23 4.781 -3.626 11.046 1.00 0.14 H new ATOM 0 H41 DC B 23 0.124 0.771 9.657 1.00 0.14 H new ATOM 0 H42 DC B 23 1.693 1.431 9.180 1.00 0.14 H new ATOM 0 H5 DC B 23 -0.104 -1.446 10.660 1.00 0.15 H new ATOM 0 H6 DC B 23 1.118 -3.431 11.392 1.00 0.15 H new ATOM 742 P DG B 24 6.288 -5.509 14.253 1.00 0.12 P ATOM 743 OP1 DG B 24 6.774 -6.774 14.854 1.00 0.15 O ATOM 744 OP2 DG B 24 5.455 -4.584 15.054 1.00 0.13 O ATOM 745 O5' DG B 24 7.572 -4.668 13.731 1.00 0.10 O ATOM 746 C5' DG B 24 8.545 -5.241 12.834 1.00 0.13 C ATOM 747 C4' DG B 24 9.695 -4.291 12.439 1.00 0.11 C ATOM 748 O4' DG B 24 9.171 -3.089 11.834 1.00 0.11 O ATOM 749 C3' DG B 24 10.596 -3.819 13.591 1.00 0.10 C ATOM 750 O3' DG B 24 11.865 -3.391 13.083 1.00 0.14 O ATOM 751 C2' DG B 24 9.815 -2.614 14.041 1.00 0.09 C ATOM 752 C1' DG B 24 9.401 -1.971 12.717 1.00 0.07 C ATOM 753 N9 DG B 24 8.156 -1.186 12.800 1.00 0.06 N ATOM 754 C8 DG B 24 6.940 -1.592 13.254 1.00 0.08 C ATOM 755 N7 DG B 24 5.989 -0.643 13.181 1.00 0.08 N ATOM 756 C5 DG B 24 6.647 0.418 12.652 1.00 0.06 C ATOM 757 C6 DG B 24 6.161 1.708 12.342 1.00 0.08 C ATOM 758 O6 DG B 24 5.027 2.154 12.472 1.00 0.11 O ATOM 759 N1 DG B 24 7.137 2.519 11.816 1.00 0.07 N ATOM 760 C2 DG B 24 8.439 2.151 11.601 1.00 0.05 C ATOM 761 N2 DG B 24 9.241 3.067 11.082 1.00 0.06 N ATOM 762 N3 DG B 24 8.920 0.938 11.885 1.00 0.05 N ATOM 763 C4 DG B 24 7.969 0.121 12.409 1.00 0.05 C ATOM 0 H5' DG B 24 8.035 -5.569 11.928 1.00 0.13 H new ATOM 0 H5'' DG B 24 8.970 -6.130 13.300 1.00 0.13 H new ATOM 0 H4' DG B 24 10.298 -4.896 11.762 1.00 0.11 H new ATOM 0 H3' DG B 24 10.804 -4.570 14.354 1.00 0.10 H new ATOM 0 H2' DG B 24 8.951 -2.893 14.644 1.00 0.09 H new ATOM 0 H2'' DG B 24 10.422 -1.941 14.646 1.00 0.09 H new ATOM 0 HO3' DG B 24 12.430 -3.091 13.825 1.00 0.14 H new ATOM 0 H1' DG B 24 10.172 -1.274 12.390 1.00 0.07 H new ATOM 0 H8 DG B 24 6.755 -2.584 13.638 1.00 0.08 H new ATOM 0 H1 DG B 24 6.871 3.471 11.565 1.00 0.07 H new ATOM 0 H21 DG B 24 10.220 2.845 10.902 1.00 0.06 H new ATOM 0 H22 DG B 24 8.880 3.995 10.862 1.00 0.06 H new TER 776 DG B 24