USER MOD reduce.3.24.130724 H: found=0, std=0, add=234, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 234 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 1 DC O5' : rot -25:sc= 1.16 USER MOD Single : A 21 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 21 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 11.303 2.270 2.657 1.00 0.00 O ATOM 2 C5' DC A 1 10.196 3.038 3.101 1.00 0.00 C ATOM 3 C4' DC A 1 8.995 2.164 3.494 1.00 0.00 C ATOM 4 O4' DC A 1 7.886 3.031 3.689 1.00 0.00 O ATOM 5 C3' DC A 1 8.610 1.134 2.416 1.00 0.00 C ATOM 6 O3' DC A 1 8.589 -0.201 2.922 1.00 0.00 O ATOM 7 C2' DC A 1 7.217 1.603 2.004 1.00 0.00 C ATOM 8 C1' DC A 1 6.700 2.433 3.192 1.00 0.00 C ATOM 9 N1 DC A 1 5.714 3.522 2.861 1.00 0.00 N ATOM 10 C2 DC A 1 5.346 4.414 3.883 1.00 0.00 C ATOM 11 O2 DC A 1 5.672 4.229 5.053 1.00 0.00 O ATOM 12 N3 DC A 1 4.610 5.520 3.621 1.00 0.00 N ATOM 13 C4 DC A 1 4.186 5.711 2.392 1.00 0.00 C ATOM 14 N4 DC A 1 3.490 6.790 2.196 1.00 0.00 N ATOM 15 C5 DC A 1 4.405 4.788 1.338 1.00 0.00 C ATOM 16 C6 DC A 1 5.168 3.698 1.605 1.00 0.00 C ATOM 0 H5' DC A 1 9.897 3.728 2.312 1.00 0.00 H new ATOM 0 H5'' DC A 1 10.497 3.643 3.956 1.00 0.00 H new ATOM 0 H4' DC A 1 9.267 1.606 4.390 1.00 0.00 H new ATOM 0 H3' DC A 1 9.322 1.091 1.592 1.00 0.00 H new ATOM 0 H2' DC A 1 7.257 2.201 1.094 1.00 0.00 H new ATOM 0 H2'' DC A 1 6.561 0.756 1.801 1.00 0.00 H new ATOM 0 HO5' DC A 1 11.255 1.372 3.046 1.00 0.00 H new ATOM 0 H1' DC A 1 6.148 1.788 3.876 1.00 0.00 H new ATOM 0 H41 DC A 1 3.129 7.002 1.266 1.00 0.00 H new ATOM 0 H42 DC A 1 3.305 7.425 2.972 1.00 0.00 H new ATOM 0 H5 DC A 1 3.980 4.947 0.358 1.00 0.00 H new ATOM 0 H6 DC A 1 5.349 2.965 0.832 1.00 0.00 H new ATOM 29 P DG A 2 9.940 -1.049 3.145 1.00 0.00 P ATOM 30 OP1 DG A 2 11.015 -0.126 3.582 1.00 0.00 O ATOM 31 OP2 DG A 2 10.187 -1.896 1.953 1.00 0.00 O ATOM 32 O5' DG A 2 9.657 -1.993 4.405 1.00 0.00 O ATOM 33 C5' DG A 2 8.882 -3.185 4.324 1.00 0.00 C ATOM 34 C4' DG A 2 8.238 -3.451 5.698 1.00 0.00 C ATOM 35 O4' DG A 2 7.296 -2.429 5.982 1.00 0.00 O ATOM 36 C3' DG A 2 7.448 -4.765 5.818 1.00 0.00 C ATOM 37 O3' DG A 2 7.475 -5.384 7.113 1.00 0.00 O ATOM 38 C2' DG A 2 6.025 -4.380 5.431 1.00 0.00 C ATOM 39 C1' DG A 2 6.012 -2.850 5.544 1.00 0.00 C ATOM 40 N9 DG A 2 5.622 -2.159 4.294 1.00 0.00 N ATOM 41 C8 DG A 2 5.660 -2.607 2.992 1.00 0.00 C ATOM 42 N7 DG A 2 5.115 -1.802 2.125 1.00 0.00 N ATOM 43 C5 DG A 2 4.651 -0.753 2.916 1.00 0.00 C ATOM 44 C6 DG A 2 3.946 0.439 2.558 1.00 0.00 C ATOM 45 O6 DG A 2 3.669 0.834 1.429 1.00 0.00 O ATOM 46 N1 DG A 2 3.558 1.204 3.640 1.00 0.00 N ATOM 47 C2 DG A 2 3.912 0.920 4.921 1.00 0.00 C ATOM 48 N2 DG A 2 3.541 1.740 5.859 1.00 0.00 N ATOM 49 N3 DG A 2 4.658 -0.120 5.282 1.00 0.00 N ATOM 50 C4 DG A 2 4.971 -0.947 4.238 1.00 0.00 C ATOM 0 H5' DG A 2 9.512 -4.026 4.033 1.00 0.00 H new ATOM 0 H5'' DG A 2 8.112 -3.084 3.559 1.00 0.00 H new ATOM 0 H4' DG A 2 9.085 -3.494 6.382 1.00 0.00 H new ATOM 0 H3' DG A 2 7.898 -5.524 5.178 1.00 0.00 H new ATOM 0 H2' DG A 2 5.784 -4.708 4.420 1.00 0.00 H new ATOM 0 H2'' DG A 2 5.293 -4.836 6.097 1.00 0.00 H new ATOM 0 H1' DG A 2 5.244 -2.573 6.266 1.00 0.00 H new ATOM 0 H8 DG A 2 6.106 -3.550 2.712 1.00 0.00 H new ATOM 0 H1 DG A 2 2.976 2.024 3.469 1.00 0.00 H new ATOM 0 H21 DG A 2 3.792 1.552 6.829 1.00 0.00 H new ATOM 0 H22 DG A 2 2.998 2.571 5.624 1.00 0.00 H new ATOM 62 P DG A 3 7.184 -4.631 8.518 1.00 0.00 P ATOM 63 OP1 DG A 3 8.261 -3.636 8.733 1.00 0.00 O ATOM 64 OP2 DG A 3 7.006 -5.691 9.533 1.00 0.00 O ATOM 65 O5' DG A 3 5.760 -3.895 8.422 1.00 0.00 O ATOM 66 C5' DG A 3 5.496 -2.675 9.106 1.00 0.00 C ATOM 67 C4' DG A 3 4.028 -2.219 9.033 1.00 0.00 C ATOM 68 O4' DG A 3 3.656 -1.843 7.719 1.00 0.00 O ATOM 69 C3' DG A 3 3.010 -3.287 9.495 1.00 0.00 C ATOM 70 O3' DG A 3 2.144 -2.759 10.499 1.00 0.00 O ATOM 71 C2' DG A 3 2.255 -3.595 8.197 1.00 0.00 C ATOM 72 C1' DG A 3 2.315 -2.236 7.514 1.00 0.00 C ATOM 73 N9 DG A 3 2.026 -2.248 6.066 1.00 0.00 N ATOM 74 C8 DG A 3 2.504 -3.112 5.111 1.00 0.00 C ATOM 75 N7 DG A 3 2.186 -2.792 3.885 1.00 0.00 N ATOM 76 C5 DG A 3 1.408 -1.641 4.040 1.00 0.00 C ATOM 77 C6 DG A 3 0.784 -0.794 3.060 1.00 0.00 C ATOM 78 O6 DG A 3 0.827 -0.882 1.829 1.00 0.00 O ATOM 79 N1 DG A 3 0.061 0.248 3.608 1.00 0.00 N ATOM 80 C2 DG A 3 -0.025 0.473 4.951 1.00 0.00 C ATOM 81 N2 DG A 3 -0.827 1.423 5.334 1.00 0.00 N ATOM 82 N3 DG A 3 0.583 -0.251 5.892 1.00 0.00 N ATOM 83 C4 DG A 3 1.286 -1.308 5.373 1.00 0.00 C ATOM 0 H5' DG A 3 6.130 -1.892 8.689 1.00 0.00 H new ATOM 0 H5'' DG A 3 5.778 -2.789 10.153 1.00 0.00 H new ATOM 0 H4' DG A 3 3.989 -1.371 9.716 1.00 0.00 H new ATOM 0 H3' DG A 3 3.462 -4.169 9.948 1.00 0.00 H new ATOM 0 H2' DG A 3 2.739 -4.376 7.611 1.00 0.00 H new ATOM 0 H2'' DG A 3 1.232 -3.922 8.380 1.00 0.00 H new ATOM 0 H1' DG A 3 1.554 -1.573 7.926 1.00 0.00 H new ATOM 0 H8 DG A 3 3.094 -3.984 5.354 1.00 0.00 H new ATOM 0 H1 DG A 3 -0.433 0.880 2.978 1.00 0.00 H new ATOM 0 H21 DG A 3 -0.930 1.634 6.327 1.00 0.00 H new ATOM 0 H22 DG A 3 -1.353 1.957 4.642 1.00 0.00 H new ATOM 95 P DG A 4 0.978 -3.621 11.201 1.00 0.00 P ATOM 96 OP1 DG A 4 0.937 -3.232 12.626 1.00 0.00 O ATOM 97 OP2 DG A 4 1.142 -5.056 10.852 1.00 0.00 O ATOM 98 O5' DG A 4 -0.363 -3.068 10.498 1.00 0.00 O ATOM 99 C5' DG A 4 -0.825 -1.749 10.803 1.00 0.00 C ATOM 100 C4' DG A 4 -1.987 -1.197 9.964 1.00 0.00 C ATOM 101 O4' DG A 4 -1.656 -1.176 8.580 1.00 0.00 O ATOM 102 C3' DG A 4 -3.326 -1.945 10.116 1.00 0.00 C ATOM 103 O3' DG A 4 -4.425 -1.052 10.332 1.00 0.00 O ATOM 104 C2' DG A 4 -3.463 -2.628 8.761 1.00 0.00 C ATOM 105 C1' DG A 4 -2.793 -1.607 7.850 1.00 0.00 C ATOM 106 N9 DG A 4 -2.395 -2.172 6.542 1.00 0.00 N ATOM 107 C8 DG A 4 -1.526 -3.206 6.279 1.00 0.00 C ATOM 108 N7 DG A 4 -1.312 -3.423 5.006 1.00 0.00 N ATOM 109 C5 DG A 4 -2.135 -2.477 4.378 1.00 0.00 C ATOM 110 C6 DG A 4 -2.343 -2.174 2.988 1.00 0.00 C ATOM 111 O6 DG A 4 -1.798 -2.668 2.004 1.00 0.00 O ATOM 112 N1 DG A 4 -3.246 -1.159 2.762 1.00 0.00 N ATOM 113 C2 DG A 4 -3.870 -0.483 3.756 1.00 0.00 C ATOM 114 N2 DG A 4 -4.683 0.467 3.404 1.00 0.00 N ATOM 115 N3 DG A 4 -3.719 -0.724 5.059 1.00 0.00 N ATOM 116 C4 DG A 4 -2.822 -1.729 5.310 1.00 0.00 C ATOM 0 H5' DG A 4 0.018 -1.065 10.703 1.00 0.00 H new ATOM 0 H5'' DG A 4 -1.127 -1.731 11.850 1.00 0.00 H new ATOM 0 H4' DG A 4 -2.133 -0.192 10.361 1.00 0.00 H new ATOM 0 H3' DG A 4 -3.338 -2.620 10.972 1.00 0.00 H new ATOM 0 H2' DG A 4 -2.962 -3.596 8.735 1.00 0.00 H new ATOM 0 H2'' DG A 4 -4.505 -2.801 8.490 1.00 0.00 H new ATOM 0 H1' DG A 4 -3.477 -0.796 7.602 1.00 0.00 H new ATOM 0 H8 DG A 4 -1.059 -3.790 7.058 1.00 0.00 H new ATOM 0 H1 DG A 4 -3.455 -0.903 1.797 1.00 0.00 H new ATOM 0 H21 DG A 4 -5.177 1.005 4.116 1.00 0.00 H new ATOM 0 H22 DG A 4 -4.827 0.675 2.416 1.00 0.00 H new ATOM 128 P DC A 5 -4.720 -0.441 11.793 1.00 0.00 P ATOM 129 OP1 DC A 5 -4.426 -1.512 12.764 1.00 0.00 O ATOM 130 OP2 DC A 5 -6.076 0.145 11.804 1.00 0.00 O ATOM 131 O5' DC A 5 -3.658 0.753 11.967 1.00 0.00 O ATOM 132 C5' DC A 5 -3.673 1.893 11.103 1.00 0.00 C ATOM 133 C4' DC A 5 -2.669 3.014 11.461 1.00 0.00 C ATOM 134 O4' DC A 5 -3.226 3.838 12.485 1.00 0.00 O ATOM 135 C3' DC A 5 -1.300 2.522 11.972 1.00 0.00 C ATOM 136 O3' DC A 5 -0.223 3.424 11.721 1.00 0.00 O ATOM 137 C2' DC A 5 -1.533 2.537 13.478 1.00 0.00 C ATOM 138 C1' DC A 5 -2.374 3.805 13.622 1.00 0.00 C ATOM 139 N1 DC A 5 -3.142 3.830 14.898 1.00 0.00 N ATOM 140 C2 DC A 5 -2.618 4.523 15.998 1.00 0.00 C ATOM 141 O2 DC A 5 -1.549 5.131 15.929 1.00 0.00 O ATOM 142 N3 DC A 5 -3.267 4.549 17.184 1.00 0.00 N ATOM 143 C4 DC A 5 -4.412 3.915 17.275 1.00 0.00 C ATOM 144 N4 DC A 5 -4.991 3.984 18.440 1.00 0.00 N ATOM 145 C5 DC A 5 -4.999 3.181 16.206 1.00 0.00 C ATOM 146 C6 DC A 5 -4.329 3.151 15.025 1.00 0.00 C ATOM 0 H5' DC A 5 -4.678 2.315 11.105 1.00 0.00 H new ATOM 0 H5'' DC A 5 -3.470 1.559 10.086 1.00 0.00 H new ATOM 0 H4' DC A 5 -2.496 3.548 10.526 1.00 0.00 H new ATOM 0 H3' DC A 5 -1.020 1.580 11.501 1.00 0.00 H new ATOM 0 H2' DC A 5 -2.061 1.649 13.824 1.00 0.00 H new ATOM 0 H2'' DC A 5 -0.601 2.593 14.040 1.00 0.00 H new ATOM 0 H1' DC A 5 -1.740 4.691 13.664 1.00 0.00 H new ATOM 0 H41 DC A 5 -5.885 3.518 18.594 1.00 0.00 H new ATOM 0 H42 DC A 5 -4.550 4.504 19.199 1.00 0.00 H new ATOM 0 H5 DC A 5 -5.941 2.668 16.329 1.00 0.00 H new ATOM 0 H6 DC A 5 -4.728 2.595 14.189 1.00 0.00 H new ATOM 158 P DG A 6 0.497 3.578 10.304 1.00 0.00 P ATOM 159 OP1 DG A 6 0.333 2.324 9.540 1.00 0.00 O ATOM 160 OP2 DG A 6 1.863 4.098 10.561 1.00 0.00 O ATOM 161 O5' DG A 6 -0.318 4.701 9.520 1.00 0.00 O ATOM 162 C5' DG A 6 -0.363 6.034 10.000 1.00 0.00 C ATOM 163 C4' DG A 6 -0.708 7.059 8.912 1.00 0.00 C ATOM 164 O4' DG A 6 0.241 6.977 7.848 1.00 0.00 O ATOM 165 C3' DG A 6 -2.098 6.831 8.320 1.00 0.00 C ATOM 166 O3' DG A 6 -2.720 8.089 8.087 1.00 0.00 O ATOM 167 C2' DG A 6 -1.806 6.103 7.018 1.00 0.00 C ATOM 168 C1' DG A 6 -0.427 6.640 6.635 1.00 0.00 C ATOM 169 N9 DG A 6 0.333 5.642 5.846 1.00 0.00 N ATOM 170 C8 DG A 6 0.973 4.521 6.321 1.00 0.00 C ATOM 171 N7 DG A 6 1.447 3.735 5.392 1.00 0.00 N ATOM 172 C5 DG A 6 1.086 4.384 4.204 1.00 0.00 C ATOM 173 C6 DG A 6 1.267 3.999 2.833 1.00 0.00 C ATOM 174 O6 DG A 6 1.754 2.965 2.381 1.00 0.00 O ATOM 175 N1 DG A 6 0.823 4.926 1.918 1.00 0.00 N ATOM 176 C2 DG A 6 0.183 6.076 2.271 1.00 0.00 C ATOM 177 N2 DG A 6 -0.256 6.841 1.303 1.00 0.00 N ATOM 178 N3 DG A 6 -0.059 6.454 3.534 1.00 0.00 N ATOM 179 C4 DG A 6 0.430 5.569 4.466 1.00 0.00 C ATOM 0 H5' DG A 6 0.603 6.289 10.436 1.00 0.00 H new ATOM 0 H5'' DG A 6 -1.101 6.100 10.799 1.00 0.00 H new ATOM 0 H4' DG A 6 -0.685 8.040 9.387 1.00 0.00 H new ATOM 0 H3' DG A 6 -2.774 6.267 8.963 1.00 0.00 H new ATOM 0 H2' DG A 6 -1.796 5.021 7.152 1.00 0.00 H new ATOM 0 H2'' DG A 6 -2.553 6.323 6.255 1.00 0.00 H new ATOM 0 H1' DG A 6 -0.516 7.521 5.999 1.00 0.00 H new ATOM 0 H8 DG A 6 1.075 4.308 7.375 1.00 0.00 H new ATOM 0 H1 DG A 6 0.981 4.743 0.927 1.00 0.00 H new ATOM 0 H21 DG A 6 -0.741 7.711 1.521 1.00 0.00 H new ATOM 0 H22 DG A 6 -0.113 6.566 0.331 1.00 0.00 H new ATOM 191 P DG A 7 -4.300 8.279 8.189 1.00 0.00 P ATOM 192 OP1 DG A 7 -4.568 9.720 8.375 1.00 0.00 O ATOM 193 OP2 DG A 7 -4.829 7.337 9.197 1.00 0.00 O ATOM 194 O5' DG A 7 -4.871 7.840 6.760 1.00 0.00 O ATOM 195 C5' DG A 7 -4.728 8.693 5.626 1.00 0.00 C ATOM 196 C4' DG A 7 -4.855 7.980 4.271 1.00 0.00 C ATOM 197 O4' DG A 7 -3.792 7.069 4.047 1.00 0.00 O ATOM 198 C3' DG A 7 -6.151 7.186 4.050 1.00 0.00 C ATOM 199 O3' DG A 7 -7.027 7.952 3.238 1.00 0.00 O ATOM 200 C2' DG A 7 -5.670 5.916 3.340 1.00 0.00 C ATOM 201 C1' DG A 7 -4.219 6.236 2.989 1.00 0.00 C ATOM 202 N9 DG A 7 -3.383 5.022 2.870 1.00 0.00 N ATOM 203 C8 DG A 7 -2.841 4.257 3.874 1.00 0.00 C ATOM 204 N7 DG A 7 -2.137 3.235 3.462 1.00 0.00 N ATOM 205 C5 DG A 7 -2.256 3.306 2.068 1.00 0.00 C ATOM 206 C6 DG A 7 -1.735 2.455 1.032 1.00 0.00 C ATOM 207 O6 DG A 7 -1.039 1.444 1.147 1.00 0.00 O ATOM 208 N1 DG A 7 -2.063 2.861 -0.249 1.00 0.00 N ATOM 209 C2 DG A 7 -2.850 3.946 -0.503 1.00 0.00 C ATOM 210 N2 DG A 7 -3.224 4.153 -1.735 1.00 0.00 N ATOM 211 N3 DG A 7 -3.355 4.765 0.419 1.00 0.00 N ATOM 212 C4 DG A 7 -3.016 4.396 1.696 1.00 0.00 C ATOM 0 H5' DG A 7 -3.755 9.181 5.675 1.00 0.00 H new ATOM 0 H5'' DG A 7 -5.482 9.478 5.681 1.00 0.00 H new ATOM 0 H4' DG A 7 -4.841 8.817 3.573 1.00 0.00 H new ATOM 0 H3' DG A 7 -6.703 6.953 4.961 1.00 0.00 H new ATOM 0 H2' DG A 7 -5.744 5.042 3.987 1.00 0.00 H new ATOM 0 H2'' DG A 7 -6.262 5.705 2.449 1.00 0.00 H new ATOM 0 H1' DG A 7 -4.129 6.715 2.014 1.00 0.00 H new ATOM 0 H8 DG A 7 -2.985 4.482 4.920 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.701 2.326 -1.038 1.00 0.00 H new ATOM 0 H21 DG A 7 -3.813 4.955 -1.961 1.00 0.00 H new ATOM 0 H22 DG A 7 -2.928 3.513 -2.472 1.00 0.00 H new ATOM 224 P DG A 8 -8.543 7.536 2.970 1.00 0.00 P ATOM 225 OP1 DG A 8 -9.291 8.795 2.757 1.00 0.00 O ATOM 226 OP2 DG A 8 -8.992 6.602 4.021 1.00 0.00 O ATOM 227 O5' DG A 8 -8.513 6.677 1.630 1.00 0.00 O ATOM 228 C5' DG A 8 -8.479 7.241 0.330 1.00 0.00 C ATOM 229 C4' DG A 8 -8.431 6.119 -0.725 1.00 0.00 C ATOM 230 O4' DG A 8 -7.217 5.377 -0.629 1.00 0.00 O ATOM 231 C3' DG A 8 -9.576 5.098 -0.589 1.00 0.00 C ATOM 232 O3' DG A 8 -10.612 5.267 -1.548 1.00 0.00 O ATOM 233 C2' DG A 8 -8.901 3.745 -0.809 1.00 0.00 C ATOM 234 C1' DG A 8 -7.450 4.078 -1.155 1.00 0.00 C ATOM 235 N9 DG A 8 -6.517 3.089 -0.573 1.00 0.00 N ATOM 236 C8 DG A 8 -6.212 2.921 0.752 1.00 0.00 C ATOM 237 N7 DG A 8 -5.355 1.964 0.997 1.00 0.00 N ATOM 238 C5 DG A 8 -5.102 1.425 -0.271 1.00 0.00 C ATOM 239 C6 DG A 8 -4.245 0.345 -0.685 1.00 0.00 C ATOM 240 O6 DG A 8 -3.498 -0.345 0.009 1.00 0.00 O ATOM 241 N1 DG A 8 -4.264 0.098 -2.045 1.00 0.00 N ATOM 242 C2 DG A 8 -5.007 0.833 -2.921 1.00 0.00 C ATOM 243 N2 DG A 8 -4.982 0.498 -4.179 1.00 0.00 N ATOM 244 N3 DG A 8 -5.806 1.849 -2.584 1.00 0.00 N ATOM 245 C4 DG A 8 -5.814 2.103 -1.238 1.00 0.00 C ATOM 0 H5' DG A 8 -7.607 7.887 0.227 1.00 0.00 H new ATOM 0 H5'' DG A 8 -9.359 7.865 0.171 1.00 0.00 H new ATOM 0 H4' DG A 8 -8.518 6.636 -1.680 1.00 0.00 H new ATOM 0 H3' DG A 8 -10.064 5.209 0.380 1.00 0.00 H new ATOM 0 H2' DG A 8 -8.961 3.124 0.085 1.00 0.00 H new ATOM 0 H2'' DG A 8 -9.382 3.191 -1.615 1.00 0.00 H new ATOM 0 H1' DG A 8 -7.282 4.048 -2.232 1.00 0.00 H new ATOM 0 H8 DG A 8 -6.645 3.530 1.532 1.00 0.00 H new ATOM 0 H1 DG A 8 -3.697 -0.668 -2.409 1.00 0.00 H new ATOM 0 H21 DG A 8 -5.527 1.028 -4.859 1.00 0.00 H new ATOM 0 H22 DG A 8 -4.417 -0.295 -4.485 1.00 0.00 H new ATOM 257 P DC A 9 -11.781 6.344 -1.354 1.00 0.00 P ATOM 258 OP1 DC A 9 -12.177 6.379 0.074 1.00 0.00 O ATOM 259 OP2 DC A 9 -12.823 6.005 -2.344 1.00 0.00 O ATOM 260 O5' DC A 9 -11.100 7.725 -1.799 1.00 0.00 O ATOM 261 C5' DC A 9 -10.699 7.926 -3.156 1.00 0.00 C ATOM 262 C4' DC A 9 -10.367 9.380 -3.532 1.00 0.00 C ATOM 263 O4' DC A 9 -11.529 10.177 -3.332 1.00 0.00 O ATOM 264 C3' DC A 9 -9.230 10.041 -2.735 1.00 0.00 C ATOM 265 O3' DC A 9 -8.529 10.945 -3.600 1.00 0.00 O ATOM 266 C2' DC A 9 -10.005 10.757 -1.631 1.00 0.00 C ATOM 267 C1' DC A 9 -11.241 11.213 -2.406 1.00 0.00 C ATOM 268 N1 DC A 9 -12.463 11.469 -1.595 1.00 0.00 N ATOM 269 C2 DC A 9 -13.178 12.656 -1.809 1.00 0.00 C ATOM 270 O2 DC A 9 -12.751 13.550 -2.539 1.00 0.00 O ATOM 271 N3 DC A 9 -14.382 12.859 -1.225 1.00 0.00 N ATOM 272 C4 DC A 9 -14.861 11.919 -0.441 1.00 0.00 C ATOM 273 N4 DC A 9 -16.036 12.144 0.066 1.00 0.00 N ATOM 274 C5 DC A 9 -14.174 10.713 -0.149 1.00 0.00 C ATOM 275 C6 DC A 9 -12.977 10.510 -0.756 1.00 0.00 C ATOM 0 H5' DC A 9 -11.496 7.571 -3.810 1.00 0.00 H new ATOM 0 H5'' DC A 9 -9.824 7.307 -3.355 1.00 0.00 H new ATOM 0 H4' DC A 9 -10.031 9.329 -4.568 1.00 0.00 H new ATOM 0 H3' DC A 9 -8.470 9.370 -2.335 1.00 0.00 H new ATOM 0 H2' DC A 9 -10.256 10.093 -0.804 1.00 0.00 H new ATOM 0 H2'' DC A 9 -9.448 11.594 -1.210 1.00 0.00 H new ATOM 0 H1' DC A 9 -10.999 12.176 -2.855 1.00 0.00 H new ATOM 0 H41 DC A 9 -16.466 11.455 0.683 1.00 0.00 H new ATOM 0 H42 DC A 9 -16.529 13.010 -0.153 1.00 0.00 H new ATOM 0 H5 DC A 9 -14.588 9.983 0.531 1.00 0.00 H new ATOM 0 H6 DC A 9 -12.429 9.596 -0.580 1.00 0.00 H new ATOM 287 P DG A 10 -7.166 11.686 -3.182 1.00 0.00 P ATOM 288 OP1 DG A 10 -6.507 12.172 -4.417 1.00 0.00 O ATOM 289 OP2 DG A 10 -6.400 10.781 -2.298 1.00 0.00 O ATOM 290 O5' DG A 10 -7.644 12.963 -2.354 1.00 0.00 O ATOM 291 C5' DG A 10 -8.297 14.044 -3.018 1.00 0.00 C ATOM 292 C4' DG A 10 -9.049 14.974 -2.063 1.00 0.00 C ATOM 293 O4' DG A 10 -10.032 14.236 -1.350 1.00 0.00 O ATOM 294 C3' DG A 10 -8.147 15.653 -1.024 1.00 0.00 C ATOM 295 O3' DG A 10 -8.240 17.071 -1.071 1.00 0.00 O ATOM 296 C2' DG A 10 -8.728 15.186 0.308 1.00 0.00 C ATOM 297 C1' DG A 10 -10.159 14.810 -0.067 1.00 0.00 C ATOM 298 N9 DG A 10 -10.783 13.835 0.855 1.00 0.00 N ATOM 299 C8 DG A 10 -10.266 12.654 1.327 1.00 0.00 C ATOM 300 N7 DG A 10 -11.096 11.956 2.056 1.00 0.00 N ATOM 301 C5 DG A 10 -12.251 12.750 2.087 1.00 0.00 C ATOM 302 C6 DG A 10 -13.536 12.539 2.702 1.00 0.00 C ATOM 303 O6 DG A 10 -13.943 11.581 3.367 1.00 0.00 O ATOM 304 N1 DG A 10 -14.425 13.569 2.486 1.00 0.00 N ATOM 305 C2 DG A 10 -14.139 14.665 1.747 1.00 0.00 C ATOM 306 N2 DG A 10 -15.103 15.528 1.599 1.00 0.00 N ATOM 307 N3 DG A 10 -12.965 14.918 1.177 1.00 0.00 N ATOM 308 C4 DG A 10 -12.058 13.912 1.371 1.00 0.00 C ATOM 0 H5' DG A 10 -8.998 13.642 -3.750 1.00 0.00 H new ATOM 0 H5'' DG A 10 -7.557 14.623 -3.570 1.00 0.00 H new ATOM 0 H4' DG A 10 -9.488 15.749 -2.691 1.00 0.00 H new ATOM 0 H3' DG A 10 -7.099 15.401 -1.189 1.00 0.00 H new ATOM 0 H2' DG A 10 -8.179 14.337 0.714 1.00 0.00 H new ATOM 0 H2'' DG A 10 -8.700 15.974 1.061 1.00 0.00 H new ATOM 0 H1' DG A 10 -10.807 15.686 -0.024 1.00 0.00 H new ATOM 0 H8 DG A 10 -9.258 12.329 1.114 1.00 0.00 H new ATOM 0 H1 DG A 10 -15.351 13.501 2.907 1.00 0.00 H new ATOM 0 H21 DG A 10 -14.949 16.375 1.052 1.00 0.00 H new ATOM 0 H22 DG A 10 -16.012 15.357 2.030 1.00 0.00 H new ATOM 320 P DC A 11 -7.414 17.983 -2.104 1.00 0.00 P ATOM 321 OP1 DC A 11 -7.837 19.378 -1.842 1.00 0.00 O ATOM 322 OP2 DC A 11 -7.509 17.434 -3.472 1.00 0.00 O ATOM 323 O5' DC A 11 -5.907 17.835 -1.590 1.00 0.00 O ATOM 324 C5' DC A 11 -5.044 16.799 -2.046 1.00 0.00 C ATOM 325 C4' DC A 11 -4.170 16.310 -0.887 1.00 0.00 C ATOM 326 O4' DC A 11 -4.991 15.663 0.086 1.00 0.00 O ATOM 327 C3' DC A 11 -3.118 15.281 -1.331 1.00 0.00 C ATOM 328 O3' DC A 11 -1.935 15.558 -0.597 1.00 0.00 O ATOM 329 C2' DC A 11 -3.762 13.972 -0.889 1.00 0.00 C ATOM 330 C1' DC A 11 -4.372 14.438 0.431 1.00 0.00 C ATOM 331 N1 DC A 11 -5.304 13.501 1.131 1.00 0.00 N ATOM 332 C2 DC A 11 -5.511 13.702 2.502 1.00 0.00 C ATOM 333 O2 DC A 11 -5.027 14.666 3.094 1.00 0.00 O ATOM 334 N3 DC A 11 -6.264 12.843 3.235 1.00 0.00 N ATOM 335 C4 DC A 11 -6.766 11.785 2.632 1.00 0.00 C ATOM 336 N4 DC A 11 -7.456 10.996 3.397 1.00 0.00 N ATOM 337 C5 DC A 11 -6.616 11.528 1.246 1.00 0.00 C ATOM 338 C6 DC A 11 -5.874 12.406 0.523 1.00 0.00 C ATOM 0 H5' DC A 11 -4.416 17.166 -2.858 1.00 0.00 H new ATOM 0 H5'' DC A 11 -5.631 15.972 -2.446 1.00 0.00 H new ATOM 0 H4' DC A 11 -3.665 17.190 -0.488 1.00 0.00 H new ATOM 0 H3' DC A 11 -2.854 15.275 -2.389 1.00 0.00 H new ATOM 0 H2' DC A 11 -4.511 13.612 -1.595 1.00 0.00 H new ATOM 0 H2'' DC A 11 -3.036 13.169 -0.757 1.00 0.00 H new ATOM 0 H1' DC A 11 -3.591 14.516 1.187 1.00 0.00 H new ATOM 0 H41 DC A 11 -7.880 10.153 3.010 1.00 0.00 H new ATOM 0 H42 DC A 11 -7.574 11.219 4.385 1.00 0.00 H new ATOM 0 H5 DC A 11 -7.074 10.667 0.783 1.00 0.00 H new ATOM 0 H6 DC A 11 -5.730 12.244 -0.535 1.00 0.00 H new ATOM 350 P DG A 12 -0.504 14.969 -0.958 1.00 0.00 P ATOM 351 OP1 DG A 12 -0.527 13.491 -0.927 1.00 0.00 O ATOM 352 OP2 DG A 12 0.460 15.666 -0.079 1.00 0.00 O ATOM 353 O5' DG A 12 -0.221 15.428 -2.455 1.00 0.00 O ATOM 354 C5' DG A 12 -0.439 14.568 -3.570 1.00 0.00 C ATOM 355 C4' DG A 12 -0.375 15.336 -4.897 1.00 0.00 C ATOM 356 O4' DG A 12 -1.555 16.111 -5.086 1.00 0.00 O ATOM 357 C3' DG A 12 0.857 16.247 -5.014 1.00 0.00 C ATOM 358 O3' DG A 12 1.823 15.764 -5.940 1.00 0.00 O ATOM 359 C2' DG A 12 0.279 17.564 -5.513 1.00 0.00 C ATOM 360 C1' DG A 12 -1.218 17.485 -5.207 1.00 0.00 C ATOM 361 N9 DG A 12 -1.640 18.225 -3.988 1.00 0.00 N ATOM 362 C8 DG A 12 -1.035 18.345 -2.756 1.00 0.00 C ATOM 363 N7 DG A 12 -1.672 19.117 -1.910 1.00 0.00 N ATOM 364 C5 DG A 12 -2.779 19.564 -2.649 1.00 0.00 C ATOM 365 C6 DG A 12 -3.872 20.442 -2.313 1.00 0.00 C ATOM 366 O6 DG A 12 -4.134 20.983 -1.239 1.00 0.00 O ATOM 367 N1 DG A 12 -4.728 20.694 -3.365 1.00 0.00 N ATOM 368 C2 DG A 12 -4.560 20.168 -4.598 1.00 0.00 C ATOM 369 N2 DG A 12 -5.302 20.641 -5.553 1.00 0.00 N ATOM 370 N3 DG A 12 -3.636 19.276 -4.932 1.00 0.00 N ATOM 371 C4 DG A 12 -2.751 19.032 -3.919 1.00 0.00 C ATOM 0 H5' DG A 12 -1.412 14.087 -3.474 1.00 0.00 H new ATOM 0 H5'' DG A 12 0.310 13.776 -3.571 1.00 0.00 H new ATOM 0 H4' DG A 12 -0.294 14.579 -5.677 1.00 0.00 H new ATOM 0 H3' DG A 12 1.386 16.318 -4.064 1.00 0.00 H new ATOM 0 H2' DG A 12 0.740 18.413 -5.008 1.00 0.00 H new ATOM 0 H2'' DG A 12 0.457 17.693 -6.581 1.00 0.00 H new ATOM 0 H1' DG A 12 -1.749 17.971 -6.026 1.00 0.00 H new ATOM 0 H8 DG A 12 -0.111 17.844 -2.508 1.00 0.00 H new ATOM 0 H1 DG A 12 -5.527 21.307 -3.204 1.00 0.00 H new ATOM 0 H21 DG A 12 -5.210 20.274 -6.500 1.00 0.00 H new ATOM 0 H22 DG A 12 -5.977 21.380 -5.356 1.00 0.00 H new ATOM 383 P DA A 13 2.807 14.558 -5.568 1.00 0.00 P ATOM 384 OP1 DA A 13 3.000 14.533 -4.099 1.00 0.00 O ATOM 385 OP2 DA A 13 4.002 14.681 -6.435 1.00 0.00 O ATOM 386 O5' DA A 13 2.012 13.226 -5.967 1.00 0.00 O ATOM 387 C5' DA A 13 1.883 12.823 -7.326 1.00 0.00 C ATOM 388 C4' DA A 13 1.023 11.564 -7.517 1.00 0.00 C ATOM 389 O4' DA A 13 1.639 10.459 -6.864 1.00 0.00 O ATOM 390 C3' DA A 13 -0.406 11.700 -6.956 1.00 0.00 C ATOM 391 O3' DA A 13 -1.356 11.291 -7.943 1.00 0.00 O ATOM 392 C2' DA A 13 -0.335 10.788 -5.729 1.00 0.00 C ATOM 393 C1' DA A 13 0.635 9.709 -6.206 1.00 0.00 C ATOM 394 N9 DA A 13 1.247 8.891 -5.129 1.00 0.00 N ATOM 395 C8 DA A 13 1.203 9.077 -3.765 1.00 0.00 C ATOM 396 N7 DA A 13 1.946 8.248 -3.081 1.00 0.00 N ATOM 397 C5 DA A 13 2.501 7.432 -4.075 1.00 0.00 C ATOM 398 C6 DA A 13 3.396 6.338 -4.069 1.00 0.00 C ATOM 399 N6 DA A 13 3.966 5.857 -2.980 1.00 0.00 N ATOM 400 N1 DA A 13 3.722 5.710 -5.198 1.00 0.00 N ATOM 401 C2 DA A 13 3.193 6.156 -6.330 1.00 0.00 C ATOM 402 N3 DA A 13 2.352 7.172 -6.503 1.00 0.00 N ATOM 403 C4 DA A 13 2.047 7.783 -5.319 1.00 0.00 C ATOM 0 H5' DA A 13 2.876 12.640 -7.738 1.00 0.00 H new ATOM 0 H5'' DA A 13 1.446 13.641 -7.899 1.00 0.00 H new ATOM 0 H4' DA A 13 0.949 11.415 -8.594 1.00 0.00 H new ATOM 0 H3' DA A 13 -0.727 12.708 -6.694 1.00 0.00 H new ATOM 0 H2' DA A 13 0.036 11.313 -4.849 1.00 0.00 H new ATOM 0 H2'' DA A 13 -1.310 10.376 -5.467 1.00 0.00 H new ATOM 0 H1' DA A 13 0.114 8.975 -6.820 1.00 0.00 H new ATOM 0 H8 DA A 13 0.604 9.845 -3.299 1.00 0.00 H new ATOM 0 H61 DA A 13 4.604 5.064 -3.046 1.00 0.00 H new ATOM 0 H62 DA A 13 3.769 6.279 -2.072 1.00 0.00 H new ATOM 0 H2 DA A 13 3.482 5.626 -7.226 1.00 0.00 H new ATOM 415 P DG A 14 -2.934 11.233 -7.659 1.00 0.00 P ATOM 416 OP1 DG A 14 -3.642 11.298 -8.958 1.00 0.00 O ATOM 417 OP2 DG A 14 -3.270 12.235 -6.631 1.00 0.00 O ATOM 418 O5' DG A 14 -3.153 9.785 -7.023 1.00 0.00 O ATOM 419 C5' DG A 14 -2.855 8.612 -7.770 1.00 0.00 C ATOM 420 C4' DG A 14 -2.837 7.327 -6.926 1.00 0.00 C ATOM 421 O4' DG A 14 -1.710 7.248 -6.047 1.00 0.00 O ATOM 422 C3' DG A 14 -4.094 7.148 -6.051 1.00 0.00 C ATOM 423 O3' DG A 14 -4.764 5.922 -6.307 1.00 0.00 O ATOM 424 C2' DG A 14 -3.498 7.041 -4.649 1.00 0.00 C ATOM 425 C1' DG A 14 -2.136 6.431 -4.972 1.00 0.00 C ATOM 426 N9 DG A 14 -1.200 6.310 -3.818 1.00 0.00 N ATOM 427 C8 DG A 14 -1.328 6.830 -2.545 1.00 0.00 C ATOM 428 N7 DG A 14 -0.581 6.256 -1.635 1.00 0.00 N ATOM 429 C5 DG A 14 0.130 5.297 -2.371 1.00 0.00 C ATOM 430 C6 DG A 14 1.064 4.291 -1.942 1.00 0.00 C ATOM 431 O6 DG A 14 1.417 4.001 -0.797 1.00 0.00 O ATOM 432 N1 DG A 14 1.586 3.538 -2.975 1.00 0.00 N ATOM 433 C2 DG A 14 1.223 3.689 -4.276 1.00 0.00 C ATOM 434 N2 DG A 14 1.782 2.871 -5.130 1.00 0.00 N ATOM 435 N3 DG A 14 0.295 4.550 -4.712 1.00 0.00 N ATOM 436 C4 DG A 14 -0.207 5.349 -3.710 1.00 0.00 C ATOM 0 H5' DG A 14 -1.884 8.735 -8.249 1.00 0.00 H new ATOM 0 H5'' DG A 14 -3.591 8.503 -8.566 1.00 0.00 H new ATOM 0 H4' DG A 14 -2.790 6.538 -7.677 1.00 0.00 H new ATOM 0 H3' DG A 14 -4.814 7.949 -6.218 1.00 0.00 H new ATOM 0 H2' DG A 14 -3.412 8.011 -4.160 1.00 0.00 H new ATOM 0 H2'' DG A 14 -4.092 6.405 -3.993 1.00 0.00 H new ATOM 0 H1' DG A 14 -2.179 5.375 -5.239 1.00 0.00 H new ATOM 0 H8 DG A 14 -1.994 7.649 -2.317 1.00 0.00 H new ATOM 0 H1 DG A 14 2.283 2.829 -2.749 1.00 0.00 H new ATOM 0 H21 DG A 14 1.551 2.933 -6.122 1.00 0.00 H new ATOM 0 H22 DG A 14 2.449 2.171 -4.804 1.00 0.00 H new ATOM 448 P DG A 15 -5.768 5.711 -7.530 1.00 0.00 P ATOM 449 OP1 DG A 15 -5.546 6.705 -8.605 1.00 0.00 O ATOM 450 OP2 DG A 15 -7.127 5.529 -6.986 1.00 0.00 O ATOM 451 O5' DG A 15 -5.301 4.282 -8.044 1.00 0.00 O ATOM 452 C5' DG A 15 -4.422 4.125 -9.154 1.00 0.00 C ATOM 453 C4' DG A 15 -3.582 2.854 -9.025 1.00 0.00 C ATOM 454 O4' DG A 15 -2.667 3.037 -7.956 1.00 0.00 O ATOM 455 C3' DG A 15 -4.398 1.583 -8.730 1.00 0.00 C ATOM 456 O3' DG A 15 -4.722 0.869 -9.922 1.00 0.00 O ATOM 457 C2' DG A 15 -3.456 0.813 -7.808 1.00 0.00 C ATOM 458 C1' DG A 15 -2.301 1.761 -7.480 1.00 0.00 C ATOM 459 N9 DG A 15 -2.046 1.838 -6.029 1.00 0.00 N ATOM 460 C8 DG A 15 -2.703 2.592 -5.095 1.00 0.00 C ATOM 461 N7 DG A 15 -2.280 2.424 -3.867 1.00 0.00 N ATOM 462 C5 DG A 15 -1.282 1.447 -4.005 1.00 0.00 C ATOM 463 C6 DG A 15 -0.454 0.788 -3.031 1.00 0.00 C ATOM 464 O6 DG A 15 -0.438 0.946 -1.807 1.00 0.00 O ATOM 465 N1 DG A 15 0.418 -0.141 -3.575 1.00 0.00 N ATOM 466 C2 DG A 15 0.487 -0.399 -4.914 1.00 0.00 C ATOM 467 N2 DG A 15 1.279 -1.341 -5.326 1.00 0.00 N ATOM 468 N3 DG A 15 -0.245 0.197 -5.847 1.00 0.00 N ATOM 469 C4 DG A 15 -1.123 1.102 -5.329 1.00 0.00 C ATOM 0 H5' DG A 15 -3.765 4.992 -9.225 1.00 0.00 H new ATOM 0 H5'' DG A 15 -5.001 4.088 -10.076 1.00 0.00 H new ATOM 0 H4' DG A 15 -3.095 2.704 -9.989 1.00 0.00 H new ATOM 0 H3' DG A 15 -5.373 1.773 -8.282 1.00 0.00 H new ATOM 0 H2' DG A 15 -3.971 0.500 -6.900 1.00 0.00 H new ATOM 0 H2'' DG A 15 -3.090 -0.091 -8.294 1.00 0.00 H new ATOM 0 H1' DG A 15 -1.387 1.395 -7.948 1.00 0.00 H new ATOM 0 H8 DG A 15 -3.504 3.270 -5.350 1.00 0.00 H new ATOM 0 H1 DG A 15 1.036 -0.655 -2.947 1.00 0.00 H new ATOM 0 H21 DG A 15 1.347 -1.551 -6.322 1.00 0.00 H new ATOM 0 H22 DG A 15 1.834 -1.871 -4.654 1.00 0.00 H new ATOM 481 P DG A 16 -5.585 -0.489 -9.926 1.00 0.00 P ATOM 482 OP1 DG A 16 -6.252 -0.591 -11.242 1.00 0.00 O ATOM 483 OP2 DG A 16 -6.429 -0.559 -8.713 1.00 0.00 O ATOM 484 O5' DG A 16 -4.527 -1.662 -9.813 1.00 0.00 O ATOM 485 C5' DG A 16 -3.574 -1.927 -10.831 1.00 0.00 C ATOM 486 C4' DG A 16 -2.695 -3.146 -10.497 1.00 0.00 C ATOM 487 O4' DG A 16 -2.081 -2.950 -9.230 1.00 0.00 O ATOM 488 C3' DG A 16 -3.492 -4.466 -10.394 1.00 0.00 C ATOM 489 O3' DG A 16 -2.748 -5.666 -10.626 1.00 0.00 O ATOM 490 C2' DG A 16 -3.875 -4.486 -8.917 1.00 0.00 C ATOM 491 C1' DG A 16 -2.619 -3.879 -8.299 1.00 0.00 C ATOM 492 N9 DG A 16 -2.839 -3.225 -6.992 1.00 0.00 N ATOM 493 C8 DG A 16 -3.706 -2.218 -6.644 1.00 0.00 C ATOM 494 N7 DG A 16 -3.569 -1.785 -5.415 1.00 0.00 N ATOM 495 C5 DG A 16 -2.586 -2.633 -4.885 1.00 0.00 C ATOM 496 C6 DG A 16 -1.998 -2.715 -3.575 1.00 0.00 C ATOM 497 O6 DG A 16 -2.177 -1.970 -2.607 1.00 0.00 O ATOM 498 N1 DG A 16 -1.115 -3.774 -3.427 1.00 0.00 N ATOM 499 C2 DG A 16 -0.814 -4.636 -4.438 1.00 0.00 C ATOM 500 N2 DG A 16 -0.078 -5.681 -4.191 1.00 0.00 N ATOM 501 N3 DG A 16 -1.251 -4.536 -5.687 1.00 0.00 N ATOM 502 C4 DG A 16 -2.159 -3.528 -5.840 1.00 0.00 C ATOM 0 H5' DG A 16 -2.941 -1.051 -10.971 1.00 0.00 H new ATOM 0 H5'' DG A 16 -4.091 -2.101 -11.775 1.00 0.00 H new ATOM 0 H4' DG A 16 -1.975 -3.229 -11.311 1.00 0.00 H new ATOM 0 H3' DG A 16 -4.285 -4.468 -11.141 1.00 0.00 H new ATOM 0 H2' DG A 16 -4.767 -3.894 -8.711 1.00 0.00 H new ATOM 0 H2'' DG A 16 -4.071 -5.494 -8.553 1.00 0.00 H new ATOM 0 H1' DG A 16 -1.926 -4.695 -8.094 1.00 0.00 H new ATOM 0 H8 DG A 16 -4.440 -1.816 -7.327 1.00 0.00 H new ATOM 0 H1 DG A 16 -0.671 -3.914 -2.520 1.00 0.00 H new ATOM 0 H21 DG A 16 0.152 -6.332 -4.942 1.00 0.00 H new ATOM 0 H22 DG A 16 0.268 -5.849 -3.246 1.00 0.00 H new ATOM 514 P DA A 17 -1.851 -5.916 -11.925 1.00 0.00 P ATOM 515 OP1 DA A 17 -2.534 -5.319 -13.090 1.00 0.00 O ATOM 516 OP2 DA A 17 -1.481 -7.344 -11.980 1.00 0.00 O ATOM 517 O5' DA A 17 -0.509 -5.096 -11.673 1.00 0.00 O ATOM 518 C5' DA A 17 0.295 -5.279 -10.510 1.00 0.00 C ATOM 519 C4' DA A 17 1.627 -4.511 -10.601 1.00 0.00 C ATOM 520 O4' DA A 17 2.307 -4.993 -11.752 1.00 0.00 O ATOM 521 C3' DA A 17 1.440 -2.993 -10.781 1.00 0.00 C ATOM 522 O3' DA A 17 2.494 -2.192 -10.256 1.00 0.00 O ATOM 523 C2' DA A 17 1.449 -2.840 -12.293 1.00 0.00 C ATOM 524 C1' DA A 17 2.388 -3.971 -12.732 1.00 0.00 C ATOM 525 N9 DA A 17 2.094 -4.534 -14.074 1.00 0.00 N ATOM 526 C8 DA A 17 0.995 -4.350 -14.885 1.00 0.00 C ATOM 527 N7 DA A 17 1.079 -4.935 -16.052 1.00 0.00 N ATOM 528 C5 DA A 17 2.342 -5.545 -16.006 1.00 0.00 C ATOM 529 C6 DA A 17 3.104 -6.318 -16.912 1.00 0.00 C ATOM 530 N6 DA A 17 2.720 -6.617 -18.136 1.00 0.00 N ATOM 531 N1 DA A 17 4.291 -6.817 -16.570 1.00 0.00 N ATOM 532 C2 DA A 17 4.741 -6.557 -15.349 1.00 0.00 C ATOM 533 N3 DA A 17 4.159 -5.828 -14.402 1.00 0.00 N ATOM 534 C4 DA A 17 2.950 -5.339 -14.798 1.00 0.00 C ATOM 0 H5' DA A 17 0.498 -6.341 -10.373 1.00 0.00 H new ATOM 0 H5'' DA A 17 -0.257 -4.944 -9.632 1.00 0.00 H new ATOM 0 H4' DA A 17 2.172 -4.670 -9.670 1.00 0.00 H new ATOM 0 H3' DA A 17 0.545 -2.660 -10.255 1.00 0.00 H new ATOM 0 H2' DA A 17 0.452 -2.951 -12.719 1.00 0.00 H new ATOM 0 H2'' DA A 17 1.819 -1.862 -12.600 1.00 0.00 H new ATOM 0 H1' DA A 17 3.391 -3.552 -12.817 1.00 0.00 H new ATOM 0 H8 DA A 17 0.135 -3.771 -14.582 1.00 0.00 H new ATOM 0 H61 DA A 17 3.322 -7.180 -18.736 1.00 0.00 H new ATOM 0 H62 DA A 17 1.820 -6.285 -18.484 1.00 0.00 H new ATOM 0 H2 DA A 17 5.697 -6.991 -15.094 1.00 0.00 H new ATOM 546 P DG A 18 2.693 -1.934 -8.692 1.00 0.00 P ATOM 547 OP1 DG A 18 1.430 -2.266 -7.997 1.00 0.00 O ATOM 548 OP2 DG A 18 3.227 -0.565 -8.562 1.00 0.00 O ATOM 549 O5' DG A 18 3.801 -2.984 -8.233 1.00 0.00 O ATOM 550 C5' DG A 18 5.098 -3.028 -8.821 1.00 0.00 C ATOM 551 C4' DG A 18 6.227 -2.999 -7.776 1.00 0.00 C ATOM 552 O4' DG A 18 6.251 -1.734 -7.115 1.00 0.00 O ATOM 553 C3' DG A 18 6.041 -4.087 -6.709 1.00 0.00 C ATOM 554 O3' DG A 18 7.268 -4.709 -6.336 1.00 0.00 O ATOM 555 C2' DG A 18 5.497 -3.293 -5.538 1.00 0.00 C ATOM 556 C1' DG A 18 6.175 -1.941 -5.713 1.00 0.00 C ATOM 557 N9 DG A 18 5.396 -0.895 -5.017 1.00 0.00 N ATOM 558 C8 DG A 18 4.527 0.031 -5.541 1.00 0.00 C ATOM 559 N7 DG A 18 3.903 0.763 -4.653 1.00 0.00 N ATOM 560 C5 DG A 18 4.414 0.278 -3.442 1.00 0.00 C ATOM 561 C6 DG A 18 4.129 0.653 -2.087 1.00 0.00 C ATOM 562 O6 DG A 18 3.390 1.556 -1.687 1.00 0.00 O ATOM 563 N1 DG A 18 4.790 -0.108 -1.141 1.00 0.00 N ATOM 564 C2 DG A 18 5.700 -1.067 -1.468 1.00 0.00 C ATOM 565 N2 DG A 18 6.262 -1.731 -0.499 1.00 0.00 N ATOM 566 N3 DG A 18 6.020 -1.433 -2.705 1.00 0.00 N ATOM 567 C4 DG A 18 5.330 -0.727 -3.655 1.00 0.00 C ATOM 0 H5' DG A 18 5.214 -2.182 -9.498 1.00 0.00 H new ATOM 0 H5'' DG A 18 5.189 -3.932 -9.423 1.00 0.00 H new ATOM 0 H4' DG A 18 7.161 -3.176 -8.310 1.00 0.00 H new ATOM 0 H3' DG A 18 5.404 -4.901 -7.056 1.00 0.00 H new ATOM 0 H2' DG A 18 4.411 -3.210 -5.574 1.00 0.00 H new ATOM 0 H2'' DG A 18 5.750 -3.753 -4.583 1.00 0.00 H new ATOM 0 H1' DG A 18 7.173 -1.903 -5.276 1.00 0.00 H new ATOM 0 H8 DG A 18 4.371 0.146 -6.603 1.00 0.00 H new ATOM 0 H1 DG A 18 4.587 0.056 -0.155 1.00 0.00 H new ATOM 0 H21 DG A 18 6.948 -2.456 -0.708 1.00 0.00 H new ATOM 0 H22 DG A 18 6.016 -1.526 0.469 1.00 0.00 H new ATOM 579 P DG A 19 7.404 -6.296 -6.402 1.00 0.00 P ATOM 580 OP1 DG A 19 8.727 -6.661 -5.847 1.00 0.00 O ATOM 581 OP2 DG A 19 7.045 -6.738 -7.766 1.00 0.00 O ATOM 582 O5' DG A 19 6.271 -6.782 -5.388 1.00 0.00 O ATOM 583 C5' DG A 19 6.455 -7.892 -4.520 1.00 0.00 C ATOM 584 C4' DG A 19 5.302 -8.038 -3.521 1.00 0.00 C ATOM 585 O4' DG A 19 5.044 -6.768 -2.925 1.00 0.00 O ATOM 586 C3' DG A 19 3.996 -8.506 -4.180 1.00 0.00 C ATOM 587 O3' DG A 19 3.336 -9.410 -3.310 1.00 0.00 O ATOM 588 C2' DG A 19 3.184 -7.229 -4.242 1.00 0.00 C ATOM 589 C1' DG A 19 3.645 -6.562 -2.949 1.00 0.00 C ATOM 590 N9 DG A 19 3.273 -5.133 -2.859 1.00 0.00 N ATOM 591 C8 DG A 19 2.814 -4.295 -3.845 1.00 0.00 C ATOM 592 N7 DG A 19 2.395 -3.134 -3.415 1.00 0.00 N ATOM 593 C5 DG A 19 2.554 -3.219 -2.031 1.00 0.00 C ATOM 594 C6 DG A 19 2.179 -2.311 -0.981 1.00 0.00 C ATOM 595 O6 DG A 19 1.622 -1.213 -1.083 1.00 0.00 O ATOM 596 N1 DG A 19 2.451 -2.791 0.288 1.00 0.00 N ATOM 597 C2 DG A 19 3.010 -4.015 0.514 1.00 0.00 C ATOM 598 N2 DG A 19 3.104 -4.445 1.737 1.00 0.00 N ATOM 599 N3 DG A 19 3.363 -4.883 -0.426 1.00 0.00 N ATOM 600 C4 DG A 19 3.106 -4.432 -1.687 1.00 0.00 C ATOM 0 H5' DG A 19 7.393 -7.776 -3.977 1.00 0.00 H new ATOM 0 H5'' DG A 19 6.540 -8.804 -5.111 1.00 0.00 H new ATOM 0 H4' DG A 19 5.609 -8.787 -2.791 1.00 0.00 H new ATOM 0 H3' DG A 19 4.141 -8.996 -5.143 1.00 0.00 H new ATOM 0 H2' DG A 19 3.413 -6.631 -5.124 1.00 0.00 H new ATOM 0 H2'' DG A 19 2.110 -7.417 -4.255 1.00 0.00 H new ATOM 0 H1' DG A 19 3.152 -6.996 -2.079 1.00 0.00 H new ATOM 0 H8 DG A 19 2.800 -4.572 -4.889 1.00 0.00 H new ATOM 0 H1 DG A 19 2.223 -2.204 1.090 1.00 0.00 H new ATOM 0 H21 DG A 19 3.519 -5.357 1.926 1.00 0.00 H new ATOM 0 H22 DG A 19 2.763 -3.870 2.507 1.00 0.00 H new ATOM 612 P DG A 20 2.620 -10.721 -3.838 1.00 0.00 P ATOM 613 OP1 DG A 20 3.678 -11.654 -4.285 1.00 0.00 O ATOM 614 OP2 DG A 20 1.538 -10.330 -4.773 1.00 0.00 O ATOM 615 O5' DG A 20 1.961 -11.284 -2.499 1.00 0.00 O ATOM 616 C5' DG A 20 2.754 -11.886 -1.479 1.00 0.00 C ATOM 617 C4' DG A 20 2.163 -11.735 -0.067 1.00 0.00 C ATOM 618 O4' DG A 20 2.194 -10.348 0.257 1.00 0.00 O ATOM 619 C3' DG A 20 0.705 -12.218 0.047 1.00 0.00 C ATOM 620 O3' DG A 20 0.360 -12.936 1.248 1.00 0.00 O ATOM 621 C2' DG A 20 -0.071 -10.919 -0.134 1.00 0.00 C ATOM 622 C1' DG A 20 0.874 -9.874 0.467 1.00 0.00 C ATOM 623 N9 DG A 20 0.704 -8.531 -0.121 1.00 0.00 N ATOM 624 C8 DG A 20 0.758 -8.164 -1.441 1.00 0.00 C ATOM 625 N7 DG A 20 0.482 -6.906 -1.659 1.00 0.00 N ATOM 626 C5 DG A 20 0.225 -6.399 -0.381 1.00 0.00 C ATOM 627 C6 DG A 20 -0.173 -5.088 0.056 1.00 0.00 C ATOM 628 O6 DG A 20 -0.377 -4.074 -0.617 1.00 0.00 O ATOM 629 N1 DG A 20 -0.351 -4.995 1.421 1.00 0.00 N ATOM 630 C2 DG A 20 -0.138 -6.023 2.279 1.00 0.00 C ATOM 631 N2 DG A 20 -0.309 -5.803 3.553 1.00 0.00 N ATOM 632 N3 DG A 20 0.202 -7.256 1.922 1.00 0.00 N ATOM 633 C4 DG A 20 0.375 -7.385 0.570 1.00 0.00 C ATOM 0 H5' DG A 20 3.750 -11.443 -1.496 1.00 0.00 H new ATOM 0 H5'' DG A 20 2.873 -12.946 -1.702 1.00 0.00 H new ATOM 0 H4' DG A 20 2.756 -12.351 0.609 1.00 0.00 H new ATOM 0 H3' DG A 20 0.477 -12.987 -0.691 1.00 0.00 H new ATOM 0 H2' DG A 20 -0.283 -10.717 -1.184 1.00 0.00 H new ATOM 0 H2'' DG A 20 -1.029 -10.944 0.385 1.00 0.00 H new ATOM 0 H1' DG A 20 0.650 -9.754 1.527 1.00 0.00 H new ATOM 0 H8 DG A 20 1.007 -8.855 -2.232 1.00 0.00 H new ATOM 0 H1 DG A 20 -0.660 -4.103 1.806 1.00 0.00 H new ATOM 0 H21 DG A 20 -0.157 -6.555 4.225 1.00 0.00 H new ATOM 0 H22 DG A 20 -0.595 -4.879 3.877 1.00 0.00 H new ATOM 645 P DT A 21 0.519 -12.390 2.763 1.00 0.00 P ATOM 646 OP1 DT A 21 1.861 -11.812 2.937 1.00 0.00 O ATOM 647 OP2 DT A 21 0.122 -13.497 3.655 1.00 0.00 O ATOM 648 O5' DT A 21 -0.554 -11.243 2.972 1.00 0.00 O ATOM 649 C5' DT A 21 -1.944 -11.528 2.971 1.00 0.00 C ATOM 650 C4' DT A 21 -2.735 -10.223 3.001 1.00 0.00 C ATOM 651 O4' DT A 21 -2.319 -9.341 1.978 1.00 0.00 O ATOM 652 C3' DT A 21 -4.235 -10.422 2.763 1.00 0.00 C ATOM 653 O3' DT A 21 -4.929 -10.658 3.982 1.00 0.00 O ATOM 654 C2' DT A 21 -4.646 -9.098 2.112 1.00 0.00 C ATOM 655 C1' DT A 21 -3.323 -8.358 1.860 1.00 0.00 C ATOM 656 N1 DT A 21 -3.271 -7.692 0.529 1.00 0.00 N ATOM 657 C2 DT A 21 -3.690 -6.358 0.456 1.00 0.00 C ATOM 658 O2 DT A 21 -4.072 -5.718 1.437 1.00 0.00 O ATOM 659 N3 DT A 21 -3.692 -5.772 -0.788 1.00 0.00 N ATOM 660 C4 DT A 21 -3.360 -6.397 -1.971 1.00 0.00 C ATOM 661 O4 DT A 21 -3.476 -5.774 -3.025 1.00 0.00 O ATOM 662 C5 DT A 21 -2.909 -7.782 -1.827 1.00 0.00 C ATOM 663 C7 DT A 21 -2.478 -8.574 -3.051 1.00 0.00 C ATOM 664 C6 DT A 21 -2.881 -8.379 -0.604 1.00 0.00 C ATOM 0 H5' DT A 21 -2.200 -12.140 3.836 1.00 0.00 H new ATOM 0 H5'' DT A 21 -2.207 -12.104 2.084 1.00 0.00 H new ATOM 0 H4' DT A 21 -2.550 -9.823 3.998 1.00 0.00 H new ATOM 0 H3' DT A 21 -4.469 -11.291 2.147 1.00 0.00 H new ATOM 0 H2' DT A 21 -5.189 -9.266 1.182 1.00 0.00 H new ATOM 0 H2'' DT A 21 -5.303 -8.523 2.765 1.00 0.00 H new ATOM 0 HO3' DT A 21 -5.884 -10.779 3.797 1.00 0.00 H new ATOM 0 H1' DT A 21 -3.197 -7.547 2.577 1.00 0.00 H new ATOM 0 H3 DT A 21 -3.963 -4.790 -0.840 1.00 0.00 H new ATOM 0 H71 DT A 21 -1.721 -9.304 -2.764 1.00 0.00 H new ATOM 0 H72 DT A 21 -3.340 -9.091 -3.472 1.00 0.00 H new ATOM 0 H73 DT A 21 -2.063 -7.895 -3.796 1.00 0.00 H new ATOM 0 H6 DT A 21 -2.549 -9.403 -0.518 1.00 0.00 H new TER 678 DT A 21 HETATM 679 K K A 22 1.465 1.430 0.158 1.00 0.00 K HETATM 680 K K A 23 -1.080 -1.430 -0.235 1.00 0.00 K