USER MOD reduce.3.24.130724 H: found=0, std=0, add=280, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 279 hydrogens (9 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 NoAdj-H: A 25 GIQH101 : A 25 GIQ N10 : A 7 DG C8 :(H bumps) USER MOD Single : A 1 DC O5' : rot 180:sc= -0.199 USER MOD Single : A 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= -1.78 (180deg=-1.78) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= 0 USER MOD Single : B 15 DT C7 :methyl 150:sc= -0.407 (180deg=-0.407) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 8.023 -7.186 -0.985 1.00 0.22 O ATOM 2 C5' DC A 1 8.512 -6.114 -1.795 1.00 0.20 C ATOM 3 C4' DC A 1 8.407 -4.747 -1.018 1.00 0.16 C ATOM 4 O4' DC A 1 7.035 -4.285 -0.994 1.00 0.14 O ATOM 5 C3' DC A 1 8.818 -4.940 0.449 1.00 0.16 C ATOM 6 O3' DC A 1 10.013 -4.205 0.756 1.00 0.19 O ATOM 7 C2' DC A 1 7.639 -4.432 1.251 1.00 0.12 C ATOM 8 C1' DC A 1 6.840 -3.625 0.259 1.00 0.12 C ATOM 9 N1 DC A 1 5.421 -3.552 0.627 1.00 0.11 N ATOM 10 C2 DC A 1 4.797 -2.315 0.604 1.00 0.14 C ATOM 11 O2 DC A 1 5.423 -1.307 0.283 1.00 0.18 O ATOM 12 N3 DC A 1 3.483 -2.257 0.953 1.00 0.14 N ATOM 13 C4 DC A 1 2.822 -3.366 1.307 1.00 0.12 C ATOM 14 N4 DC A 1 1.535 -3.282 1.642 1.00 0.15 N ATOM 15 C5 DC A 1 3.486 -4.633 1.323 1.00 0.11 C ATOM 16 C6 DC A 1 4.761 -4.665 0.980 1.00 0.10 C ATOM 0 H5' DC A 1 7.939 -6.058 -2.721 1.00 0.20 H new ATOM 0 H5'' DC A 1 9.549 -6.303 -2.073 1.00 0.20 H new ATOM 0 H4' DC A 1 9.056 -4.033 -1.525 1.00 0.16 H new ATOM 0 H3' DC A 1 9.047 -5.981 0.676 1.00 0.16 H new ATOM 0 H2' DC A 1 7.052 -5.254 1.661 1.00 0.12 H new ATOM 0 H2'' DC A 1 7.963 -3.821 2.093 1.00 0.12 H new ATOM 0 HO5' DC A 1 8.093 -8.029 -1.481 1.00 0.22 H new ATOM 0 H1' DC A 1 7.169 -2.587 0.224 1.00 0.12 H new ATOM 0 H41 DC A 1 1.023 -4.121 1.913 1.00 0.15 H new ATOM 0 H42 DC A 1 1.062 -2.378 1.627 1.00 0.15 H new ATOM 0 H5 DC A 1 2.962 -5.534 1.606 1.00 0.11 H new ATOM 0 H6 DC A 1 5.285 -5.610 0.984 1.00 0.10 H new ATOM 29 P DT A 2 10.496 -4.028 2.284 1.00 0.17 P ATOM 30 OP1 DT A 2 11.976 -4.037 2.304 1.00 0.23 O ATOM 31 OP2 DT A 2 9.744 -4.983 3.130 1.00 0.20 O ATOM 32 O5' DT A 2 9.993 -2.538 2.640 1.00 0.13 O ATOM 33 C5' DT A 2 10.848 -1.412 2.420 1.00 0.15 C ATOM 34 C4' DT A 2 10.158 -0.092 2.837 1.00 0.15 C ATOM 35 O4' DT A 2 8.738 -0.189 2.569 1.00 0.15 O ATOM 36 C3' DT A 2 10.324 0.097 4.338 1.00 0.13 C ATOM 37 O3' DT A 2 10.916 1.372 4.625 1.00 0.15 O ATOM 38 C2' DT A 2 8.927 0.008 4.843 1.00 0.13 C ATOM 39 C1' DT A 2 8.059 0.419 3.668 1.00 0.15 C ATOM 40 N1 DT A 2 6.736 -0.154 3.827 1.00 0.13 N ATOM 41 C2 DT A 2 5.614 0.586 3.508 1.00 0.15 C ATOM 42 O2 DT A 2 5.677 1.740 3.087 1.00 0.17 O ATOM 43 N3 DT A 2 4.407 -0.061 3.693 1.00 0.15 N ATOM 44 C4 DT A 2 4.242 -1.359 4.155 1.00 0.14 C ATOM 45 O4 DT A 2 3.119 -1.838 4.285 1.00 0.16 O ATOM 46 C5 DT A 2 5.491 -2.034 4.459 1.00 0.12 C ATOM 47 C7 DT A 2 5.471 -3.466 4.987 1.00 0.12 C ATOM 48 C6 DT A 2 6.669 -1.404 4.283 1.00 0.11 C ATOM 0 H5' DT A 2 11.125 -1.363 1.367 1.00 0.15 H new ATOM 0 H5'' DT A 2 11.771 -1.537 2.987 1.00 0.15 H new ATOM 0 H4' DT A 2 10.600 0.736 2.284 1.00 0.15 H new ATOM 0 H3' DT A 2 10.984 -0.635 4.802 1.00 0.13 H new ATOM 0 H2' DT A 2 8.690 -1.003 5.174 1.00 0.13 H new ATOM 0 H2'' DT A 2 8.773 0.667 5.697 1.00 0.13 H new ATOM 0 H1' DT A 2 7.926 1.495 3.555 1.00 0.15 H new ATOM 0 H3 DT A 2 3.561 0.463 3.470 1.00 0.15 H new ATOM 0 H71 DT A 2 6.376 -3.983 4.670 1.00 0.12 H new ATOM 0 H72 DT A 2 5.424 -3.452 6.076 1.00 0.12 H new ATOM 0 H73 DT A 2 4.598 -3.987 4.593 1.00 0.12 H new ATOM 0 H6 DT A 2 7.584 -1.927 4.518 1.00 0.11 H new ATOM 61 P DC A 3 11.242 1.829 6.137 1.00 0.15 P ATOM 62 OP1 DC A 3 12.574 2.474 6.148 1.00 0.20 O ATOM 63 OP2 DC A 3 10.966 0.690 7.042 1.00 0.19 O ATOM 64 O5' DC A 3 10.130 2.963 6.401 1.00 0.14 O ATOM 65 C5' DC A 3 10.001 4.079 5.512 1.00 0.14 C ATOM 66 C4' DC A 3 8.600 4.680 5.574 1.00 0.16 C ATOM 67 O4' DC A 3 7.602 3.672 5.307 1.00 0.16 O ATOM 68 C3' DC A 3 8.299 5.228 6.974 1.00 0.20 C ATOM 69 O3' DC A 3 8.152 6.653 6.952 1.00 0.29 O ATOM 70 C2' DC A 3 7.010 4.547 7.380 1.00 0.20 C ATOM 71 C1' DC A 3 6.447 4.006 6.085 1.00 0.17 C ATOM 72 N1 DC A 3 5.613 2.810 6.326 1.00 0.16 N ATOM 73 C2 DC A 3 4.232 2.950 6.268 1.00 0.18 C ATOM 74 O2 DC A 3 3.726 4.043 6.022 1.00 0.20 O ATOM 75 N3 DC A 3 3.464 1.848 6.490 1.00 0.19 N ATOM 76 C4 DC A 3 4.022 0.660 6.755 1.00 0.19 C ATOM 77 N4 DC A 3 3.238 -0.397 6.967 1.00 0.23 N ATOM 78 C5 DC A 3 5.444 0.512 6.816 1.00 0.17 C ATOM 79 C6 DC A 3 6.195 1.605 6.597 1.00 0.16 C ATOM 0 H5' DC A 3 10.217 3.761 4.492 1.00 0.14 H new ATOM 0 H5'' DC A 3 10.737 4.840 5.771 1.00 0.14 H new ATOM 0 H4' DC A 3 8.567 5.476 4.830 1.00 0.16 H new ATOM 0 H3' DC A 3 9.107 5.028 7.678 1.00 0.20 H new ATOM 0 H2' DC A 3 7.192 3.748 8.099 1.00 0.20 H new ATOM 0 H2'' DC A 3 6.321 5.248 7.851 1.00 0.20 H new ATOM 0 H1' DC A 3 5.800 4.726 5.584 1.00 0.17 H new ATOM 0 H41 DC A 3 3.652 -1.307 7.170 1.00 0.23 H new ATOM 0 H42 DC A 3 2.224 -0.296 6.927 1.00 0.23 H new ATOM 0 H5 DC A 3 5.898 -0.444 7.030 1.00 0.17 H new ATOM 0 H6 DC A 3 7.272 1.529 6.636 1.00 0.16 H new ATOM 91 P DG A 4 8.130 7.502 8.322 1.00 0.34 P ATOM 92 OP1 DG A 4 8.778 8.809 8.067 1.00 0.48 O ATOM 93 OP2 DG A 4 8.626 6.637 9.417 1.00 0.38 O ATOM 94 O5' DG A 4 6.556 7.755 8.555 1.00 0.32 O ATOM 95 C5' DG A 4 5.863 8.761 7.809 1.00 0.36 C ATOM 96 C4' DG A 4 4.374 8.793 8.148 1.00 0.28 C ATOM 97 O4' DG A 4 3.743 7.514 7.855 1.00 0.27 O ATOM 98 C3' DG A 4 4.151 9.070 9.637 1.00 0.23 C ATOM 99 O3' DG A 4 3.144 10.077 9.824 1.00 0.22 O ATOM 100 C2' DG A 4 3.716 7.737 10.175 1.00 0.21 C ATOM 101 C1' DG A 4 3.006 7.105 9.023 1.00 0.21 C ATOM 102 N9 DG A 4 2.967 5.641 9.150 1.00 0.21 N ATOM 103 C8 DG A 4 3.986 4.766 9.255 1.00 0.25 C ATOM 104 N7 DG A 4 3.697 3.513 9.356 1.00 0.25 N ATOM 105 C5 DG A 4 2.300 3.544 9.315 1.00 0.22 C ATOM 106 C6 DG A 4 1.365 2.480 9.382 1.00 0.24 C ATOM 107 O6 DG A 4 1.587 1.278 9.493 1.00 0.26 O ATOM 108 N1 DG A 4 0.059 2.944 9.306 1.00 0.27 N ATOM 109 C2 DG A 4 -0.310 4.269 9.180 1.00 0.27 C ATOM 110 N2 DG A 4 -1.618 4.519 9.124 1.00 0.34 N ATOM 111 N3 DG A 4 0.565 5.276 9.116 1.00 0.23 N ATOM 112 C4 DG A 4 1.845 4.846 9.189 1.00 0.20 C ATOM 0 H5' DG A 4 5.989 8.574 6.743 1.00 0.36 H new ATOM 0 H5'' DG A 4 6.304 9.736 8.016 1.00 0.36 H new ATOM 0 H4' DG A 4 3.937 9.586 7.541 1.00 0.28 H new ATOM 0 H3' DG A 4 5.036 9.455 10.144 1.00 0.23 H new ATOM 0 H2' DG A 4 4.568 7.138 10.498 1.00 0.21 H new ATOM 0 H2'' DG A 4 3.059 7.848 11.038 1.00 0.21 H new ATOM 0 H1' DG A 4 1.963 7.419 8.972 1.00 0.21 H new ATOM 0 H8 DG A 4 5.012 5.103 9.255 1.00 0.25 H new ATOM 0 H1 DG A 4 -0.688 2.251 9.346 1.00 0.27 H new ATOM 0 H21 DG A 4 -1.950 5.479 9.031 1.00 0.34 H new ATOM 0 H22 DG A 4 -2.287 3.750 9.174 1.00 0.34 H new ATOM 124 P DG A 5 2.531 10.391 11.283 1.00 0.24 P ATOM 125 OP1 DG A 5 2.129 11.815 11.318 1.00 0.34 O ATOM 126 OP2 DG A 5 3.462 9.862 12.306 1.00 0.34 O ATOM 127 O5' DG A 5 1.196 9.487 11.300 1.00 0.20 O ATOM 128 C5' DG A 5 0.052 9.870 10.529 1.00 0.22 C ATOM 129 C4' DG A 5 -1.193 9.068 10.927 1.00 0.19 C ATOM 130 O4' DG A 5 -0.985 7.639 10.722 1.00 0.19 O ATOM 131 C3' DG A 5 -1.520 9.264 12.410 1.00 0.18 C ATOM 132 O3' DG A 5 -2.915 9.532 12.614 1.00 0.21 O ATOM 133 C2' DG A 5 -1.119 7.961 13.030 1.00 0.18 C ATOM 134 C1' DG A 5 -1.356 6.954 11.933 1.00 0.18 C ATOM 135 N9 DG A 5 -0.555 5.735 12.138 1.00 0.20 N ATOM 136 C8 DG A 5 0.779 5.604 12.205 1.00 0.21 C ATOM 137 N7 DG A 5 1.263 4.421 12.401 1.00 0.23 N ATOM 138 C5 DG A 5 0.099 3.650 12.476 1.00 0.22 C ATOM 139 C6 DG A 5 -0.060 2.251 12.682 1.00 0.24 C ATOM 140 O6 DG A 5 0.811 1.395 12.842 1.00 0.26 O ATOM 141 N1 DG A 5 -1.399 1.887 12.690 1.00 0.25 N ATOM 142 C2 DG A 5 -2.462 2.754 12.519 1.00 0.25 C ATOM 143 N2 DG A 5 -3.679 2.212 12.560 1.00 0.28 N ATOM 144 N3 DG A 5 -2.322 4.070 12.325 1.00 0.23 N ATOM 145 C4 DG A 5 -1.024 4.450 12.315 1.00 0.22 C ATOM 0 H5' DG A 5 0.259 9.719 9.470 1.00 0.22 H new ATOM 0 H5'' DG A 5 -0.141 10.934 10.667 1.00 0.22 H new ATOM 0 H4' DG A 5 -2.009 9.430 10.301 1.00 0.19 H new ATOM 0 H3' DG A 5 -1.003 10.119 12.845 1.00 0.18 H new ATOM 0 H2' DG A 5 -0.075 7.972 13.345 1.00 0.18 H new ATOM 0 H2'' DG A 5 -1.716 7.738 13.914 1.00 0.18 H new ATOM 0 H1' DG A 5 -2.391 6.613 11.905 1.00 0.18 H new ATOM 0 H8 DG A 5 1.428 6.460 12.098 1.00 0.21 H new ATOM 0 H1 DG A 5 -1.616 0.901 12.834 1.00 0.25 H new ATOM 0 H21 DG A 5 -4.504 2.800 12.440 1.00 0.28 H new ATOM 0 H22 DG A 5 -3.786 1.209 12.711 1.00 0.28 H new ATOM 157 P DC A 6 -3.464 10.001 14.058 1.00 0.21 P ATOM 158 OP1 DC A 6 -4.672 10.831 13.845 1.00 0.30 O ATOM 159 OP2 DC A 6 -2.327 10.544 14.836 1.00 0.26 O ATOM 160 O5' DC A 6 -3.920 8.611 14.739 1.00 0.21 O ATOM 161 C5' DC A 6 -5.117 7.952 14.310 1.00 0.22 C ATOM 162 C4' DC A 6 -5.193 6.511 14.850 1.00 0.19 C ATOM 163 O4' DC A 6 -4.010 5.793 14.481 1.00 0.17 O ATOM 164 C3' DC A 6 -5.239 6.498 16.388 1.00 0.18 C ATOM 165 O3' DC A 6 -6.472 5.927 16.857 1.00 0.20 O ATOM 166 C2' DC A 6 -4.071 5.643 16.801 1.00 0.17 C ATOM 167 C1' DC A 6 -3.715 4.896 15.549 1.00 0.16 C ATOM 168 N1 DC A 6 -2.303 4.540 15.548 1.00 0.15 N ATOM 169 C2 DC A 6 -1.996 3.218 15.708 1.00 0.15 C ATOM 170 O2 DC A 6 -2.894 2.403 15.844 1.00 0.17 O ATOM 171 N3 DC A 6 -0.699 2.845 15.707 1.00 0.16 N ATOM 172 C4 DC A 6 0.274 3.739 15.551 1.00 0.16 C ATOM 173 N4 DC A 6 1.535 3.308 15.559 1.00 0.19 N ATOM 174 C5 DC A 6 -0.020 5.137 15.383 1.00 0.15 C ATOM 175 C6 DC A 6 -1.359 5.493 15.390 1.00 0.15 C ATOM 0 H5' DC A 6 -5.154 7.936 13.221 1.00 0.22 H new ATOM 0 H5'' DC A 6 -5.986 8.515 14.650 1.00 0.22 H new ATOM 0 H4' DC A 6 -6.093 6.058 14.433 1.00 0.19 H new ATOM 0 H3' DC A 6 -5.184 7.503 16.807 1.00 0.18 H new ATOM 0 H2' DC A 6 -3.237 6.249 17.156 1.00 0.17 H new ATOM 0 H2'' DC A 6 -4.339 4.963 17.610 1.00 0.17 H new ATOM 0 H1' DC A 6 -4.271 3.963 15.460 1.00 0.16 H new ATOM 0 H41 DC A 6 2.301 3.971 15.442 1.00 0.19 H new ATOM 0 H42 DC A 6 1.734 2.315 15.683 1.00 0.19 H new ATOM 0 H5 DC A 6 0.762 5.871 15.258 1.00 0.15 H new ATOM 0 H6 DC A 6 -1.646 6.527 15.270 1.00 0.15 H new ATOM 187 P DG A 7 -6.769 5.755 18.435 1.00 0.22 P ATOM 188 OP1 DG A 7 -8.180 6.131 18.676 1.00 0.30 O ATOM 189 OP2 DG A 7 -5.694 6.442 19.184 1.00 0.27 O ATOM 190 O5' DG A 7 -6.626 4.161 18.695 1.00 0.19 O ATOM 191 C5' DG A 7 -7.288 3.198 17.855 1.00 0.18 C ATOM 192 C4' DG A 7 -7.669 1.930 18.634 1.00 0.15 C ATOM 193 O4' DG A 7 -6.505 1.134 19.029 1.00 0.13 O ATOM 194 C3' DG A 7 -8.389 2.321 19.913 1.00 0.15 C ATOM 195 O3' DG A 7 -9.488 1.429 20.155 1.00 0.18 O ATOM 196 C2' DG A 7 -7.314 2.195 20.952 1.00 0.14 C ATOM 197 C1' DG A 7 -6.492 1.000 20.477 1.00 0.13 C ATOM 198 N9 DG A 7 -5.081 1.038 20.969 1.00 0.11 N ATOM 199 C8 DG A 7 -4.150 0.021 21.193 1.00 0.12 C ATOM 200 N7 DG A 7 -2.977 0.425 21.564 1.00 0.13 N ATOM 201 C5 DG A 7 -3.105 1.809 21.606 1.00 0.13 C ATOM 202 C6 DG A 7 -2.142 2.796 21.956 1.00 0.16 C ATOM 203 O6 DG A 7 -0.975 2.631 22.306 1.00 0.17 O ATOM 204 N1 DG A 7 -2.664 4.078 21.868 1.00 0.18 N ATOM 205 C2 DG A 7 -3.954 4.385 21.490 1.00 0.18 C ATOM 206 N2 DG A 7 -4.265 5.696 21.465 1.00 0.23 N ATOM 207 N3 DG A 7 -4.869 3.452 21.160 1.00 0.16 N ATOM 208 C4 DG A 7 -4.377 2.194 21.241 1.00 0.12 C ATOM 0 H5' DG A 7 -6.636 2.932 17.023 1.00 0.18 H new ATOM 0 H5'' DG A 7 -8.185 3.645 17.426 1.00 0.18 H new ATOM 0 H4' DG A 7 -8.295 1.336 17.968 1.00 0.15 H new ATOM 0 H3' DG A 7 -8.829 3.318 19.893 1.00 0.15 H new ATOM 0 H2' DG A 7 -6.708 3.099 21.013 1.00 0.14 H new ATOM 0 H2'' DG A 7 -7.733 2.024 21.944 1.00 0.14 H new ATOM 0 H1' DG A 7 -6.905 0.062 20.847 1.00 0.13 H new ATOM 0 H8 DG A 7 -4.391 -1.024 21.066 1.00 0.12 H new ATOM 0 H1 DG A 7 -2.045 4.855 22.101 1.00 0.18 H new ATOM 0 H21 DG A 7 -5.203 5.993 21.194 1.00 0.23 H new ATOM 0 H22 DG A 7 -3.563 6.392 21.717 1.00 0.23 H new ATOM 219 P DC A 8 -10.371 1.507 21.501 1.00 0.21 P ATOM 220 OP1 DC A 8 -11.782 1.241 21.145 1.00 0.30 O ATOM 221 OP2 DC A 8 -10.014 2.747 22.226 1.00 0.27 O ATOM 222 O5' DC A 8 -9.821 0.252 22.348 1.00 0.19 O ATOM 223 C5' DC A 8 -9.395 -0.949 21.691 1.00 0.16 C ATOM 224 C4' DC A 8 -8.722 -1.893 22.635 1.00 0.14 C ATOM 225 O4' DC A 8 -7.374 -1.476 22.717 1.00 0.13 O ATOM 226 C3' DC A 8 -9.304 -1.803 24.048 1.00 0.14 C ATOM 227 O3' DC A 8 -9.792 -3.097 24.448 1.00 0.16 O ATOM 228 C2' DC A 8 -8.122 -1.334 24.887 1.00 0.12 C ATOM 229 C1' DC A 8 -6.947 -1.666 24.041 1.00 0.12 C ATOM 230 N1 DC A 8 -5.785 -0.790 24.279 1.00 0.12 N ATOM 231 C2 DC A 8 -4.568 -1.402 24.397 1.00 0.12 C ATOM 232 O2 DC A 8 -4.505 -2.612 24.354 1.00 0.13 O ATOM 233 N3 DC A 8 -3.463 -0.633 24.557 1.00 0.12 N ATOM 234 C4 DC A 8 -3.552 0.697 24.616 1.00 0.12 C ATOM 235 N4 DC A 8 -2.443 1.411 24.802 1.00 0.13 N ATOM 236 C5 DC A 8 -4.820 1.350 24.492 1.00 0.13 C ATOM 237 C6 DC A 8 -5.909 0.570 24.322 1.00 0.12 C ATOM 0 H5' DC A 8 -8.711 -0.696 20.881 1.00 0.16 H new ATOM 0 H5'' DC A 8 -10.256 -1.440 21.239 1.00 0.16 H new ATOM 0 H4' DC A 8 -8.850 -2.913 22.273 1.00 0.14 H new ATOM 0 H3' DC A 8 -10.154 -1.127 24.146 1.00 0.14 H new ATOM 0 H2' DC A 8 -8.177 -0.266 25.097 1.00 0.12 H new ATOM 0 H2'' DC A 8 -8.083 -1.846 25.848 1.00 0.12 H new ATOM 0 H1' DC A 8 -6.620 -2.681 24.267 1.00 0.12 H new ATOM 0 H41 DC A 8 -2.494 2.429 24.849 1.00 0.13 H new ATOM 0 H42 DC A 8 -1.543 0.940 24.897 1.00 0.13 H new ATOM 0 H5 DC A 8 -4.902 2.426 24.533 1.00 0.13 H new ATOM 0 H6 DC A 8 -6.884 1.024 24.219 1.00 0.12 H new ATOM 249 P DC A 9 -10.262 -3.412 25.954 1.00 0.16 P ATOM 250 OP1 DC A 9 -11.382 -4.378 25.898 1.00 0.22 O ATOM 251 OP2 DC A 9 -10.431 -2.128 26.672 1.00 0.20 O ATOM 252 O5' DC A 9 -8.974 -4.163 26.559 1.00 0.17 O ATOM 253 C5' DC A 9 -8.789 -5.581 26.416 1.00 0.19 C ATOM 254 C4' DC A 9 -7.459 -5.997 27.014 1.00 0.17 C ATOM 255 O4' DC A 9 -6.508 -4.965 26.709 1.00 0.16 O ATOM 256 C3' DC A 9 -7.624 -6.019 28.532 1.00 0.16 C ATOM 257 O3' DC A 9 -7.138 -7.272 29.046 1.00 0.18 O ATOM 258 C2' DC A 9 -6.773 -4.873 28.994 1.00 0.13 C ATOM 259 C1' DC A 9 -5.754 -4.724 27.896 1.00 0.13 C ATOM 260 N1 DC A 9 -5.157 -3.384 27.844 1.00 0.11 N ATOM 261 C2 DC A 9 -3.803 -3.278 28.106 1.00 0.12 C ATOM 262 O2 DC A 9 -3.150 -4.278 28.388 1.00 0.14 O ATOM 263 N3 DC A 9 -3.226 -2.054 28.039 1.00 0.11 N ATOM 264 C4 DC A 9 -3.940 -0.968 27.729 1.00 0.11 C ATOM 265 N4 DC A 9 -3.322 0.213 27.682 1.00 0.13 N ATOM 266 C5 DC A 9 -5.349 -1.062 27.452 1.00 0.11 C ATOM 267 C6 DC A 9 -5.915 -2.302 27.522 1.00 0.11 C ATOM 0 H5' DC A 9 -8.824 -5.855 25.362 1.00 0.19 H new ATOM 0 H5'' DC A 9 -9.601 -6.113 26.911 1.00 0.19 H new ATOM 0 H4' DC A 9 -7.139 -6.966 26.630 1.00 0.17 H new ATOM 0 H3' DC A 9 -8.657 -5.925 28.867 1.00 0.16 H new ATOM 0 H2' DC A 9 -7.360 -3.964 29.122 1.00 0.13 H new ATOM 0 H2'' DC A 9 -6.301 -5.085 29.953 1.00 0.13 H new ATOM 0 H1' DC A 9 -4.914 -5.403 28.041 1.00 0.13 H new ATOM 0 H41 DC A 9 -3.848 1.055 27.447 1.00 0.13 H new ATOM 0 H42 DC A 9 -2.323 0.274 27.881 1.00 0.13 H new ATOM 0 H5 DC A 9 -5.933 -0.189 27.200 1.00 0.11 H new ATOM 0 H6 DC A 9 -6.969 -2.424 27.321 1.00 0.11 H new ATOM 279 P DA A 10 -7.307 -7.699 30.591 1.00 0.19 P ATOM 280 OP1 DA A 10 -7.443 -9.172 30.648 1.00 0.27 O ATOM 281 OP2 DA A 10 -8.351 -6.842 31.197 1.00 0.23 O ATOM 282 O5' DA A 10 -5.886 -7.300 31.248 1.00 0.17 O ATOM 283 C5' DA A 10 -4.664 -7.313 30.489 1.00 0.16 C ATOM 284 C4' DA A 10 -3.427 -7.415 31.390 1.00 0.15 C ATOM 285 O4' DA A 10 -2.504 -6.371 31.020 1.00 0.15 O ATOM 286 C3' DA A 10 -3.823 -7.149 32.834 1.00 0.14 C ATOM 287 O3' DA A 10 -3.175 -8.112 33.683 1.00 0.16 O ATOM 288 C2' DA A 10 -3.367 -5.720 33.060 1.00 0.12 C ATOM 289 C1' DA A 10 -2.166 -5.604 32.194 1.00 0.13 C ATOM 290 N9 DA A 10 -2.013 -4.223 31.733 1.00 0.12 N ATOM 291 C8 DA A 10 -2.956 -3.467 31.148 1.00 0.13 C ATOM 292 N7 DA A 10 -2.639 -2.274 30.792 1.00 0.13 N ATOM 293 C5 DA A 10 -1.301 -2.217 31.183 1.00 0.13 C ATOM 294 C6 DA A 10 -0.344 -1.210 31.096 1.00 0.14 C ATOM 295 N6 DA A 10 -0.605 -0.018 30.567 1.00 0.16 N ATOM 296 N1 DA A 10 0.884 -1.475 31.572 1.00 0.17 N ATOM 297 C2 DA A 10 1.153 -2.672 32.104 1.00 0.18 C ATOM 298 N3 DA A 10 0.317 -3.703 32.239 1.00 0.15 N ATOM 299 C4 DA A 10 -0.903 -3.406 31.756 1.00 0.13 C ATOM 0 H5' DA A 10 -4.601 -6.405 29.889 1.00 0.16 H new ATOM 0 H5'' DA A 10 -4.677 -8.154 29.795 1.00 0.16 H new ATOM 0 H4' DA A 10 -2.989 -8.407 31.282 1.00 0.15 H new ATOM 0 H3' DA A 10 -4.885 -7.251 33.055 1.00 0.14 H new ATOM 0 H2' DA A 10 -4.137 -5.002 32.778 1.00 0.12 H new ATOM 0 H2'' DA A 10 -3.127 -5.535 34.107 1.00 0.12 H new ATOM 0 H1' DA A 10 -1.265 -5.924 32.718 1.00 0.13 H new ATOM 0 H8 DA A 10 -3.952 -3.851 30.982 1.00 0.13 H new ATOM 0 H61 DA A 10 0.126 0.692 30.523 1.00 0.16 H new ATOM 0 H62 DA A 10 -1.537 0.186 30.205 1.00 0.16 H new ATOM 0 H2 DA A 10 2.160 -2.821 32.465 1.00 0.18 H new ATOM 311 P DT A 11 -2.589 -7.735 35.126 1.00 0.15 P ATOM 312 OP1 DT A 11 -2.252 -8.992 35.831 1.00 0.19 O ATOM 313 OP2 DT A 11 -3.504 -6.758 35.761 1.00 0.17 O ATOM 314 O5' DT A 11 -1.218 -6.975 34.761 1.00 0.13 O ATOM 315 C5' DT A 11 0.024 -7.683 34.629 1.00 0.13 C ATOM 316 C4' DT A 11 1.152 -6.777 35.048 1.00 0.10 C ATOM 317 O4' DT A 11 0.974 -5.520 34.368 1.00 0.11 O ATOM 318 C3' DT A 11 0.939 -6.522 36.533 1.00 0.09 C ATOM 319 O3' DT A 11 2.153 -6.769 37.264 1.00 0.11 O ATOM 320 C2' DT A 11 0.548 -5.081 36.568 1.00 0.08 C ATOM 321 C1' DT A 11 1.161 -4.492 35.343 1.00 0.09 C ATOM 322 N1 DT A 11 0.418 -3.290 34.978 1.00 0.11 N ATOM 323 C2 DT A 11 1.101 -2.105 34.772 1.00 0.14 C ATOM 324 O2 DT A 11 2.323 -2.019 34.876 1.00 0.15 O ATOM 325 N3 DT A 11 0.318 -1.016 34.435 1.00 0.16 N ATOM 326 C4 DT A 11 -1.061 -1.016 34.293 1.00 0.15 C ATOM 327 O4 DT A 11 -1.655 0.015 33.987 1.00 0.18 O ATOM 328 C5 DT A 11 -1.680 -2.307 34.533 1.00 0.12 C ATOM 329 C7 DT A 11 -3.196 -2.450 34.413 1.00 0.15 C ATOM 330 C6 DT A 11 -0.929 -3.380 34.861 1.00 0.11 C ATOM 0 H5' DT A 11 0.165 -8.007 33.598 1.00 0.13 H new ATOM 0 H5'' DT A 11 0.013 -8.581 35.247 1.00 0.13 H new ATOM 0 H4' DT A 11 2.132 -7.202 34.830 1.00 0.10 H new ATOM 0 H3' DT A 11 0.192 -7.169 36.993 1.00 0.09 H new ATOM 0 H2' DT A 11 -0.536 -4.965 36.563 1.00 0.08 H new ATOM 0 H2'' DT A 11 0.917 -4.592 37.470 1.00 0.08 H new ATOM 0 H1' DT A 11 2.206 -4.203 35.453 1.00 0.09 H new ATOM 0 H3 DT A 11 0.800 -0.131 34.276 1.00 0.16 H new ATOM 0 H71 DT A 11 -3.442 -3.463 34.095 1.00 0.15 H new ATOM 0 H72 DT A 11 -3.658 -2.251 35.380 1.00 0.15 H new ATOM 0 H73 DT A 11 -3.572 -1.738 33.678 1.00 0.15 H new ATOM 0 H6 DT A 11 -1.412 -4.330 35.034 1.00 0.11 H new ATOM 343 P DC A 12 2.319 -6.356 38.816 1.00 0.14 P ATOM 344 OP1 DC A 12 3.165 -7.374 39.477 1.00 0.21 O ATOM 345 OP2 DC A 12 0.980 -6.042 39.363 1.00 0.17 O ATOM 346 O5' DC A 12 3.161 -4.984 38.727 1.00 0.17 O ATOM 347 C5' DC A 12 4.394 -4.924 37.997 1.00 0.18 C ATOM 348 C4' DC A 12 4.919 -3.490 37.906 1.00 0.20 C ATOM 349 O4' DC A 12 3.978 -2.665 37.194 1.00 0.18 O ATOM 350 C3' DC A 12 5.057 -2.881 39.306 1.00 0.21 C ATOM 351 O3' DC A 12 6.417 -2.526 39.578 1.00 0.29 O ATOM 352 C2' DC A 12 4.170 -1.657 39.275 1.00 0.21 C ATOM 353 C1' DC A 12 3.993 -1.368 37.798 1.00 0.19 C ATOM 354 N1 DC A 12 2.715 -0.671 37.550 1.00 0.18 N ATOM 355 C2 DC A 12 2.745 0.675 37.212 1.00 0.20 C ATOM 356 O2 DC A 12 3.815 1.273 37.121 1.00 0.24 O ATOM 357 N3 DC A 12 1.558 1.305 36.987 1.00 0.22 N ATOM 358 C4 DC A 12 0.395 0.644 37.090 1.00 0.21 C ATOM 359 N4 DC A 12 -0.749 1.288 36.863 1.00 0.25 N ATOM 360 C5 DC A 12 0.368 -0.740 37.439 1.00 0.19 C ATOM 361 C6 DC A 12 1.542 -1.351 37.657 1.00 0.17 C ATOM 0 H5' DC A 12 4.244 -5.323 36.994 1.00 0.18 H new ATOM 0 H5'' DC A 12 5.138 -5.555 38.483 1.00 0.18 H new ATOM 0 H4' DC A 12 5.883 -3.525 37.398 1.00 0.20 H new ATOM 0 H3' DC A 12 4.768 -3.579 40.092 1.00 0.21 H new ATOM 0 H2' DC A 12 3.213 -1.845 39.762 1.00 0.21 H new ATOM 0 H2'' DC A 12 4.632 -0.817 39.793 1.00 0.21 H new ATOM 0 HO3' DC A 12 6.481 -2.138 40.476 1.00 0.29 H new ATOM 0 H1' DC A 12 4.777 -0.723 37.401 1.00 0.19 H new ATOM 0 H41 DC A 12 -1.637 0.792 36.939 1.00 0.25 H new ATOM 0 H42 DC A 12 -0.737 2.277 36.613 1.00 0.25 H new ATOM 0 H5 DC A 12 -0.565 -1.276 37.525 1.00 0.19 H new ATOM 0 H6 DC A 12 1.556 -2.398 37.921 1.00 0.17 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 0.764 11.789 35.584 1.00 0.31 O ATOM 376 C5' DG B 13 2.115 12.107 35.930 1.00 0.24 C ATOM 377 C4' DG B 13 3.096 11.095 35.344 1.00 0.18 C ATOM 378 O4' DG B 13 2.796 9.752 35.820 1.00 0.16 O ATOM 379 C3' DG B 13 3.005 11.064 33.815 1.00 0.18 C ATOM 380 O3' DG B 13 4.321 11.121 33.229 1.00 0.22 O ATOM 381 C2' DG B 13 2.284 9.779 33.543 1.00 0.17 C ATOM 382 C1' DG B 13 2.702 8.882 34.678 1.00 0.14 C ATOM 383 N9 DG B 13 1.688 7.845 34.912 1.00 0.14 N ATOM 384 C8 DG B 13 0.347 7.918 34.758 1.00 0.20 C ATOM 385 N7 DG B 13 -0.345 6.865 35.035 1.00 0.21 N ATOM 386 C5 DG B 13 0.653 5.967 35.427 1.00 0.16 C ATOM 387 C6 DG B 13 0.544 4.620 35.858 1.00 0.18 C ATOM 388 O6 DG B 13 -0.469 3.939 35.981 1.00 0.22 O ATOM 389 N1 DG B 13 1.787 4.078 36.157 1.00 0.18 N ATOM 390 C2 DG B 13 2.992 4.745 36.056 1.00 0.18 C ATOM 391 N2 DG B 13 4.083 4.055 36.388 1.00 0.25 N ATOM 392 N3 DG B 13 3.102 6.014 35.651 1.00 0.15 N ATOM 393 C4 DG B 13 1.903 6.561 35.354 1.00 0.13 C ATOM 0 H5' DG B 13 2.218 12.129 37.015 1.00 0.24 H new ATOM 0 H5'' DG B 13 2.360 13.105 35.566 1.00 0.24 H new ATOM 0 H4' DG B 13 4.093 11.402 35.659 1.00 0.18 H new ATOM 0 H3' DG B 13 2.482 11.914 33.378 1.00 0.18 H new ATOM 0 H2' DG B 13 1.204 9.923 33.525 1.00 0.17 H new ATOM 0 H2'' DG B 13 2.566 9.359 32.577 1.00 0.17 H new ATOM 0 HO5' DG B 13 0.161 12.455 35.976 1.00 0.31 H new ATOM 0 H1' DG B 13 3.640 8.368 34.471 1.00 0.14 H new ATOM 0 H8 DG B 13 -0.128 8.825 34.415 1.00 0.20 H new ATOM 0 H1 DG B 13 1.812 3.110 36.477 1.00 0.18 H new ATOM 0 H21 DG B 13 5.001 4.496 36.333 1.00 0.25 H new ATOM 0 H22 DG B 13 3.999 3.086 36.697 1.00 0.25 H new ATOM 406 P DA B 14 4.710 10.320 31.884 1.00 0.23 P ATOM 407 OP1 DA B 14 6.012 10.832 31.401 1.00 0.31 O ATOM 408 OP2 DA B 14 3.537 10.320 30.981 1.00 0.27 O ATOM 409 O5' DA B 14 4.929 8.821 32.429 1.00 0.20 O ATOM 410 C5' DA B 14 5.939 8.541 33.407 1.00 0.18 C ATOM 411 C4' DA B 14 6.349 7.079 33.380 1.00 0.14 C ATOM 412 O4' DA B 14 5.266 6.223 33.834 1.00 0.12 O ATOM 413 C3' DA B 14 6.671 6.688 31.951 1.00 0.14 C ATOM 414 O3' DA B 14 7.935 6.019 31.876 1.00 0.16 O ATOM 415 C2' DA B 14 5.522 5.807 31.564 1.00 0.13 C ATOM 416 C1' DA B 14 5.099 5.176 32.865 1.00 0.11 C ATOM 417 N9 DA B 14 3.685 4.792 32.808 1.00 0.11 N ATOM 418 C8 DA B 14 2.641 5.528 32.383 1.00 0.14 C ATOM 419 N7 DA B 14 1.467 4.989 32.437 1.00 0.13 N ATOM 420 C5 DA B 14 1.764 3.726 32.968 1.00 0.11 C ATOM 421 C6 DA B 14 0.968 2.620 33.293 1.00 0.14 C ATOM 422 N6 DA B 14 -0.354 2.596 33.122 1.00 0.16 N ATOM 423 N1 DA B 14 1.589 1.538 33.799 1.00 0.18 N ATOM 424 C2 DA B 14 2.912 1.540 33.975 1.00 0.19 C ATOM 425 N3 DA B 14 3.759 2.528 33.702 1.00 0.14 N ATOM 426 C4 DA B 14 3.116 3.600 33.198 1.00 0.10 C ATOM 0 H5' DA B 14 5.568 8.798 34.399 1.00 0.18 H new ATOM 0 H5'' DA B 14 6.811 9.168 33.221 1.00 0.18 H new ATOM 0 H4' DA B 14 7.210 6.955 34.037 1.00 0.14 H new ATOM 0 H3' DA B 14 6.774 7.538 31.277 1.00 0.14 H new ATOM 0 H2' DA B 14 4.711 6.381 31.116 1.00 0.13 H new ATOM 0 H2'' DA B 14 5.822 5.055 30.834 1.00 0.13 H new ATOM 0 H1' DA B 14 5.673 4.279 33.096 1.00 0.11 H new ATOM 0 H8 DA B 14 2.779 6.532 32.010 1.00 0.14 H new ATOM 0 H61 DA B 14 -0.886 1.764 33.376 1.00 0.16 H new ATOM 0 H62 DA B 14 -0.833 3.410 32.737 1.00 0.16 H new ATOM 0 H2 DA B 14 3.343 0.638 34.385 1.00 0.19 H new ATOM 438 P DT B 15 8.601 5.636 30.462 1.00 0.14 P ATOM 439 OP1 DT B 15 10.045 5.952 30.529 1.00 0.19 O ATOM 440 OP2 DT B 15 7.769 6.208 29.379 1.00 0.20 O ATOM 441 O5' DT B 15 8.434 4.038 30.434 1.00 0.21 O ATOM 442 C5' DT B 15 8.973 3.222 31.482 1.00 0.17 C ATOM 443 C4' DT B 15 8.287 1.861 31.520 1.00 0.14 C ATOM 444 O4' DT B 15 6.883 2.002 31.831 1.00 0.14 O ATOM 445 C3' DT B 15 8.352 1.199 30.141 1.00 0.13 C ATOM 446 O3' DT B 15 9.093 -0.029 30.193 1.00 0.16 O ATOM 447 C2' DT B 15 6.904 0.958 29.779 1.00 0.13 C ATOM 448 C1' DT B 15 6.182 1.012 31.065 1.00 0.12 C ATOM 449 N1 DT B 15 4.781 1.378 30.832 1.00 0.12 N ATOM 450 C2 DT B 15 3.792 0.481 31.196 1.00 0.14 C ATOM 451 O2 DT B 15 4.042 -0.602 31.721 1.00 0.17 O ATOM 452 N3 DT B 15 2.496 0.877 30.925 1.00 0.15 N ATOM 453 C4 DT B 15 2.117 2.075 30.333 1.00 0.14 C ATOM 454 O4 DT B 15 0.933 2.337 30.143 1.00 0.18 O ATOM 455 C5 DT B 15 3.225 2.938 29.993 1.00 0.13 C ATOM 456 C7 DT B 15 2.955 4.289 29.334 1.00 0.16 C ATOM 457 C6 DT B 15 4.493 2.565 30.249 1.00 0.12 C ATOM 0 H5' DT B 15 8.846 3.724 32.441 1.00 0.17 H new ATOM 0 H5'' DT B 15 10.044 3.090 31.331 1.00 0.17 H new ATOM 0 H4' DT B 15 8.798 1.266 32.277 1.00 0.14 H new ATOM 0 H3' DT B 15 8.864 1.816 29.403 1.00 0.13 H new ATOM 0 H2' DT B 15 6.537 1.716 29.087 1.00 0.13 H new ATOM 0 H2'' DT B 15 6.773 -0.008 29.292 1.00 0.13 H new ATOM 0 H1' DT B 15 6.158 0.057 31.590 1.00 0.12 H new ATOM 0 H3 DT B 15 1.750 0.231 31.183 1.00 0.15 H new ATOM 0 H71 DT B 15 3.736 4.995 29.618 1.00 0.16 H new ATOM 0 H72 DT B 15 2.949 4.171 28.250 1.00 0.16 H new ATOM 0 H73 DT B 15 1.987 4.667 29.663 1.00 0.16 H new ATOM 0 H6 DT B 15 5.301 3.230 29.982 1.00 0.12 H new ATOM 470 P DG B 16 9.091 -1.052 28.948 1.00 0.20 P ATOM 471 OP1 DG B 16 10.240 -1.972 29.104 1.00 0.27 O ATOM 472 OP2 DG B 16 8.937 -0.270 27.701 1.00 0.25 O ATOM 473 O5' DG B 16 7.735 -1.889 29.188 1.00 0.17 O ATOM 474 C5' DG B 16 7.727 -3.026 30.058 1.00 0.16 C ATOM 475 C4' DG B 16 6.691 -4.059 29.624 1.00 0.13 C ATOM 476 O4' DG B 16 5.332 -3.565 29.793 1.00 0.14 O ATOM 477 C3' DG B 16 6.859 -4.408 28.147 1.00 0.13 C ATOM 478 O3' DG B 16 6.861 -5.830 27.955 1.00 0.13 O ATOM 479 C2' DG B 16 5.682 -3.748 27.493 1.00 0.12 C ATOM 480 C1' DG B 16 4.619 -3.782 28.558 1.00 0.12 C ATOM 481 N9 DG B 16 3.605 -2.735 28.336 1.00 0.12 N ATOM 482 C8 DG B 16 3.769 -1.429 28.022 1.00 0.13 C ATOM 483 N7 DG B 16 2.704 -0.710 27.868 1.00 0.14 N ATOM 484 C5 DG B 16 1.691 -1.647 28.108 1.00 0.12 C ATOM 485 C6 DG B 16 0.275 -1.494 28.092 1.00 0.13 C ATOM 486 O6 DG B 16 -0.391 -0.482 27.861 1.00 0.15 O ATOM 487 N1 DG B 16 -0.366 -2.690 28.387 1.00 0.13 N ATOM 488 C2 DG B 16 0.265 -3.888 28.663 1.00 0.13 C ATOM 489 N2 DG B 16 -0.524 -4.929 28.923 1.00 0.14 N ATOM 490 N3 DG B 16 1.590 -4.039 28.680 1.00 0.13 N ATOM 491 C4 DG B 16 2.240 -2.890 28.396 1.00 0.12 C ATOM 0 H5' DG B 16 7.515 -2.703 31.077 1.00 0.16 H new ATOM 0 H5'' DG B 16 8.716 -3.484 30.068 1.00 0.16 H new ATOM 0 H4' DG B 16 6.852 -4.934 30.254 1.00 0.13 H new ATOM 0 H3' DG B 16 7.805 -4.067 27.726 1.00 0.13 H new ATOM 0 H2' DG B 16 5.913 -2.727 27.190 1.00 0.12 H new ATOM 0 H2'' DG B 16 5.369 -4.284 26.597 1.00 0.12 H new ATOM 0 H1' DG B 16 4.072 -4.725 28.560 1.00 0.12 H new ATOM 0 H8 DG B 16 4.754 -1.002 27.904 1.00 0.13 H new ATOM 0 H1 DG B 16 -1.386 -2.684 28.401 1.00 0.13 H new ATOM 0 H21 DG B 16 -0.115 -5.839 29.134 1.00 0.14 H new ATOM 0 H22 DG B 16 -1.538 -4.816 28.911 1.00 0.14 H new ATOM 503 P DG B 17 6.936 -6.474 26.481 1.00 0.15 P ATOM 504 OP1 DG B 17 7.609 -7.789 26.584 1.00 0.20 O ATOM 505 OP2 DG B 17 7.457 -5.451 25.547 1.00 0.19 O ATOM 506 O5' DG B 17 5.384 -6.726 26.139 1.00 0.19 O ATOM 507 C5' DG B 17 4.694 -7.865 26.666 1.00 0.15 C ATOM 508 C4' DG B 17 3.320 -8.023 26.035 1.00 0.12 C ATOM 509 O4' DG B 17 2.420 -6.957 26.463 1.00 0.12 O ATOM 510 C3' DG B 17 3.410 -7.956 24.511 1.00 0.11 C ATOM 511 O3' DG B 17 2.727 -9.037 23.853 1.00 0.10 O ATOM 512 C2' DG B 17 2.803 -6.631 24.202 1.00 0.10 C ATOM 513 C1' DG B 17 1.808 -6.411 25.286 1.00 0.10 C ATOM 514 N9 DG B 17 1.524 -4.980 25.347 1.00 0.11 N ATOM 515 C8 DG B 17 2.324 -3.947 25.668 1.00 0.12 C ATOM 516 N7 DG B 17 1.840 -2.755 25.553 1.00 0.13 N ATOM 517 C5 DG B 17 0.551 -3.028 25.096 1.00 0.11 C ATOM 518 C6 DG B 17 -0.509 -2.149 24.771 1.00 0.12 C ATOM 519 O6 DG B 17 -0.534 -0.919 24.829 1.00 0.14 O ATOM 520 N1 DG B 17 -1.627 -2.852 24.347 1.00 0.12 N ATOM 521 C2 DG B 17 -1.718 -4.231 24.251 1.00 0.12 C ATOM 522 N2 DG B 17 -2.869 -4.740 23.817 1.00 0.14 N ATOM 523 N3 DG B 17 -0.729 -5.048 24.559 1.00 0.11 N ATOM 524 C4 DG B 17 0.363 -4.391 24.969 1.00 0.10 C ATOM 0 H5' DG B 17 4.590 -7.762 27.746 1.00 0.15 H new ATOM 0 H5'' DG B 17 5.284 -8.764 26.487 1.00 0.15 H new ATOM 0 H4' DG B 17 2.938 -8.993 26.354 1.00 0.12 H new ATOM 0 H3' DG B 17 4.433 -8.058 24.150 1.00 0.11 H new ATOM 0 H2' DG B 17 3.556 -5.843 24.190 1.00 0.10 H new ATOM 0 H2'' DG B 17 2.327 -6.632 23.221 1.00 0.10 H new ATOM 0 H1' DG B 17 0.842 -6.895 25.143 1.00 0.10 H new ATOM 0 H8 DG B 17 3.336 -4.109 26.010 1.00 0.12 H new ATOM 0 H1 DG B 17 -2.450 -2.309 24.084 1.00 0.12 H new ATOM 0 H21 DG B 17 -2.980 -5.750 23.731 1.00 0.14 H new ATOM 0 H22 DG B 17 -3.640 -4.120 23.571 1.00 0.14 H new ATOM 536 P DC B 18 3.486 -9.883 22.695 1.00 0.11 P ATOM 537 OP1 DC B 18 3.536 -11.300 23.121 1.00 0.17 O ATOM 538 OP2 DC B 18 4.741 -9.176 22.350 1.00 0.16 O ATOM 539 O5' DC B 18 2.488 -9.773 21.428 1.00 0.11 O ATOM 540 C5' DC B 18 1.235 -10.449 21.460 1.00 0.11 C ATOM 541 C4' DC B 18 0.159 -9.792 20.632 1.00 0.10 C ATOM 542 O4' DC B 18 0.155 -10.296 19.278 1.00 0.12 O ATOM 543 C3' DC B 18 -1.200 -10.134 21.254 1.00 0.11 C ATOM 544 O3' DC B 18 -1.760 -8.987 21.920 1.00 0.13 O ATOM 545 C2' DC B 18 -2.049 -10.678 20.128 1.00 0.12 C ATOM 546 C1' DC B 18 -1.196 -10.618 18.878 1.00 0.12 C ATOM 547 N1 DC B 18 -1.234 -11.887 18.134 1.00 0.14 N ATOM 548 C2 DC B 18 -1.497 -11.851 16.771 1.00 0.21 C ATOM 549 O2 DC B 18 -1.696 -10.778 16.204 1.00 0.26 O ATOM 550 N3 DC B 18 -1.526 -13.032 16.093 1.00 0.24 N ATOM 551 C4 DC B 18 -1.306 -14.192 16.727 1.00 0.20 C ATOM 552 N4 DC B 18 -1.341 -15.331 16.035 1.00 0.23 N ATOM 553 C5 DC B 18 -1.035 -14.220 18.132 1.00 0.16 C ATOM 554 C6 DC B 18 -1.012 -13.041 18.781 1.00 0.15 C ATOM 0 H5' DC B 18 0.895 -10.513 22.494 1.00 0.11 H new ATOM 0 H5'' DC B 18 1.377 -11.471 21.108 1.00 0.11 H new ATOM 0 H4' DC B 18 0.346 -8.718 20.613 1.00 0.10 H new ATOM 0 H3' DC B 18 -1.127 -10.887 22.039 1.00 0.11 H new ATOM 0 H2' DC B 18 -2.360 -11.702 20.336 1.00 0.12 H new ATOM 0 H2'' DC B 18 -2.957 -10.087 20.007 1.00 0.12 H new ATOM 0 H1' DC B 18 -1.585 -9.853 18.206 1.00 0.12 H new ATOM 0 H41 DC B 18 -1.175 -16.220 16.507 1.00 0.23 H new ATOM 0 H42 DC B 18 -1.534 -15.314 15.034 1.00 0.23 H new ATOM 0 H5 DC B 18 -0.856 -15.150 18.651 1.00 0.16 H new ATOM 0 H6 DC B 18 -0.811 -13.024 19.842 1.00 0.15 H new ATOM 566 P DG B 19 -3.297 -8.537 21.821 1.00 0.11 P ATOM 567 OP1 DG B 19 -3.564 -7.550 22.891 1.00 0.13 O ATOM 568 OP2 DG B 19 -4.139 -9.749 21.708 1.00 0.16 O ATOM 569 O5' DG B 19 -3.311 -7.776 20.410 1.00 0.12 O ATOM 570 C5' DG B 19 -2.794 -6.444 20.233 1.00 0.10 C ATOM 571 C4' DG B 19 -3.230 -5.949 18.919 1.00 0.11 C ATOM 572 O4' DG B 19 -2.691 -4.642 18.592 1.00 0.11 O ATOM 573 C3' DG B 19 -2.721 -6.921 17.883 1.00 0.12 C ATOM 574 O3' DG B 19 -3.793 -7.303 16.996 1.00 0.14 O ATOM 575 C2' DG B 19 -1.649 -6.161 17.197 1.00 0.11 C ATOM 576 C1' DG B 19 -2.109 -4.751 17.286 1.00 0.11 C ATOM 577 N9 DG B 19 -1.097 -3.692 17.017 1.00 0.11 N ATOM 578 C8 DG B 19 0.273 -3.663 17.015 1.00 0.12 C ATOM 579 N7 DG B 19 0.840 -2.535 16.727 1.00 0.14 N ATOM 580 C5 DG B 19 -0.264 -1.708 16.508 1.00 0.15 C ATOM 581 C6 DG B 19 -0.329 -0.331 16.153 1.00 0.18 C ATOM 582 O6 DG B 19 0.599 0.463 15.953 1.00 0.20 O ATOM 583 N1 DG B 19 -1.648 0.092 16.035 1.00 0.20 N ATOM 584 C2 DG B 19 -2.766 -0.700 16.229 1.00 0.19 C ATOM 585 N2 DG B 19 -3.955 -0.121 16.072 1.00 0.22 N ATOM 586 N3 DG B 19 -2.705 -1.977 16.560 1.00 0.16 N ATOM 587 C4 DG B 19 -1.439 -2.415 16.683 1.00 0.14 C ATOM 0 H5' DG B 19 -1.706 -6.448 20.295 1.00 0.10 H new ATOM 0 H5'' DG B 19 -3.156 -5.788 21.025 1.00 0.10 H new ATOM 0 H4' DG B 19 -4.316 -5.862 18.939 1.00 0.11 H new ATOM 0 H3' DG B 19 -2.346 -7.858 18.294 1.00 0.12 H new ATOM 0 H2' DG B 19 -0.684 -6.300 17.685 1.00 0.11 H new ATOM 0 H2'' DG B 19 -1.531 -6.480 16.161 1.00 0.11 H new ATOM 0 H1' DG B 19 -2.813 -4.556 16.477 1.00 0.11 H new ATOM 0 H8 DG B 19 0.855 -4.543 17.244 1.00 0.12 H new ATOM 0 H1 DG B 19 -1.805 1.068 15.784 1.00 0.20 H new ATOM 0 H21 DG B 19 -4.808 -0.664 16.204 1.00 0.22 H new ATOM 0 H22 DG B 19 -4.012 0.866 15.819 1.00 0.22 H new ATOM 599 P DC B 20 -3.550 -7.913 15.516 1.00 0.14 P ATOM 600 OP1 DC B 20 -4.287 -9.192 15.418 1.00 0.19 O ATOM 601 OP2 DC B 20 -2.103 -7.873 15.208 1.00 0.17 O ATOM 602 O5' DC B 20 -4.296 -6.831 14.579 1.00 0.15 O ATOM 603 C5' DC B 20 -5.459 -6.149 15.064 1.00 0.15 C ATOM 604 C4' DC B 20 -5.679 -4.822 14.368 1.00 0.15 C ATOM 605 O4' DC B 20 -4.562 -3.977 14.635 1.00 0.14 O ATOM 606 C3' DC B 20 -5.752 -5.009 12.848 1.00 0.15 C ATOM 607 O3' DC B 20 -7.024 -4.559 12.350 1.00 0.18 O ATOM 608 C2' DC B 20 -4.602 -4.149 12.318 1.00 0.13 C ATOM 609 C1' DC B 20 -4.313 -3.209 13.468 1.00 0.13 C ATOM 610 N1 DC B 20 -2.911 -2.789 13.460 1.00 0.13 N ATOM 611 C2 DC B 20 -2.615 -1.466 13.172 1.00 0.13 C ATOM 612 O2 DC B 20 -3.514 -0.663 12.935 1.00 0.15 O ATOM 613 N3 DC B 20 -1.310 -1.091 13.162 1.00 0.14 N ATOM 614 C4 DC B 20 -0.336 -1.974 13.422 1.00 0.14 C ATOM 615 N4 DC B 20 0.932 -1.563 13.403 1.00 0.16 N ATOM 616 C5 DC B 20 -0.642 -3.344 13.724 1.00 0.14 C ATOM 617 C6 DC B 20 -1.942 -3.703 13.733 1.00 0.13 C ATOM 0 H5' DC B 20 -5.359 -5.982 16.136 1.00 0.15 H new ATOM 0 H5'' DC B 20 -6.335 -6.782 14.920 1.00 0.15 H new ATOM 0 H4' DC B 20 -6.612 -4.393 14.733 1.00 0.15 H new ATOM 0 H3' DC B 20 -5.663 -6.050 12.536 1.00 0.15 H new ATOM 0 H2' DC B 20 -3.731 -4.754 12.064 1.00 0.13 H new ATOM 0 H2'' DC B 20 -4.887 -3.606 11.417 1.00 0.13 H new ATOM 0 H1' DC B 20 -4.922 -2.307 13.409 1.00 0.13 H new ATOM 0 H41 DC B 20 1.685 -2.223 13.599 1.00 0.16 H new ATOM 0 H42 DC B 20 1.149 -0.589 13.193 1.00 0.16 H new ATOM 0 H5 DC B 20 0.139 -4.059 13.936 1.00 0.14 H new ATOM 0 H6 DC B 20 -2.215 -4.723 13.959 1.00 0.13 H new ATOM 629 P DC B 21 -7.330 -4.439 10.768 1.00 0.18 P ATOM 630 OP1 DC B 21 -8.756 -4.769 10.548 1.00 0.27 O ATOM 631 OP2 DC B 21 -6.281 -5.180 10.031 1.00 0.20 O ATOM 632 O5' DC B 21 -7.129 -2.863 10.480 1.00 0.18 O ATOM 633 C5' DC B 21 -7.528 -1.882 11.449 1.00 0.19 C ATOM 634 C4' DC B 21 -7.294 -0.469 10.957 1.00 0.19 C ATOM 635 O4' DC B 21 -5.923 -0.183 11.211 1.00 0.18 O ATOM 636 C3' DC B 21 -7.482 -0.446 9.447 1.00 0.18 C ATOM 637 O3' DC B 21 -8.366 0.616 9.057 1.00 0.21 O ATOM 638 C2' DC B 21 -6.086 -0.211 8.933 1.00 0.18 C ATOM 639 C1' DC B 21 -5.388 0.472 10.068 1.00 0.18 C ATOM 640 N1 DC B 21 -3.977 0.128 10.010 1.00 0.18 N ATOM 641 C2 DC B 21 -3.021 1.102 9.778 1.00 0.19 C ATOM 642 O2 DC B 21 -3.346 2.276 9.618 1.00 0.22 O ATOM 643 N3 DC B 21 -1.717 0.706 9.734 1.00 0.19 N ATOM 644 C4 DC B 21 -1.381 -0.584 9.909 1.00 0.18 C ATOM 645 N4 DC B 21 -0.097 -0.938 9.861 1.00 0.21 N ATOM 646 C5 DC B 21 -2.380 -1.581 10.148 1.00 0.18 C ATOM 647 C6 DC B 21 -3.659 -1.174 10.189 1.00 0.16 C ATOM 0 H5' DC B 21 -6.974 -2.040 12.374 1.00 0.19 H new ATOM 0 H5'' DC B 21 -8.584 -2.014 11.684 1.00 0.19 H new ATOM 0 H4' DC B 21 -7.969 0.238 11.439 1.00 0.19 H new ATOM 0 H3' DC B 21 -7.932 -1.358 9.054 1.00 0.18 H new ATOM 0 H2' DC B 21 -5.595 -1.148 8.670 1.00 0.18 H new ATOM 0 H2'' DC B 21 -6.091 0.409 8.037 1.00 0.18 H new ATOM 0 H1' DC B 21 -5.509 1.555 10.062 1.00 0.18 H new ATOM 0 H41 DC B 21 0.168 -1.914 9.993 1.00 0.21 H new ATOM 0 H42 DC B 21 0.620 -0.233 9.693 1.00 0.21 H new ATOM 0 H5 DC B 21 -2.116 -2.619 10.290 1.00 0.18 H new ATOM 0 H6 DC B 21 -4.443 -1.895 10.367 1.00 0.16 H new ATOM 659 P DG B 22 -8.632 0.950 7.501 1.00 0.24 P ATOM 660 OP1 DG B 22 -9.944 1.627 7.391 1.00 0.31 O ATOM 661 OP2 DG B 22 -8.365 -0.272 6.708 1.00 0.29 O ATOM 662 O5' DG B 22 -7.479 2.027 7.171 1.00 0.25 O ATOM 663 C5' DG B 22 -7.404 3.252 7.908 1.00 0.23 C ATOM 664 C4' DG B 22 -6.442 4.249 7.269 1.00 0.22 C ATOM 665 O4' DG B 22 -5.070 3.908 7.595 1.00 0.23 O ATOM 666 C3' DG B 22 -6.573 4.220 5.750 1.00 0.19 C ATOM 667 O3' DG B 22 -6.594 5.546 5.203 1.00 0.21 O ATOM 668 C2' DG B 22 -5.361 3.449 5.328 1.00 0.16 C ATOM 669 C1' DG B 22 -4.332 3.799 6.369 1.00 0.18 C ATOM 670 N9 DG B 22 -3.347 2.724 6.501 1.00 0.18 N ATOM 671 C8 DG B 22 -3.566 1.425 6.789 1.00 0.20 C ATOM 672 N7 DG B 22 -2.538 0.649 6.877 1.00 0.21 N ATOM 673 C5 DG B 22 -1.490 1.539 6.614 1.00 0.21 C ATOM 674 C6 DG B 22 -0.091 1.306 6.561 1.00 0.23 C ATOM 675 O6 DG B 22 0.514 0.252 6.736 1.00 0.25 O ATOM 676 N1 DG B 22 0.608 2.468 6.267 1.00 0.23 N ATOM 677 C2 DG B 22 0.039 3.708 6.048 1.00 0.22 C ATOM 678 N2 DG B 22 0.881 4.707 5.779 1.00 0.24 N ATOM 679 N3 DG B 22 -1.277 3.936 6.096 1.00 0.20 N ATOM 680 C4 DG B 22 -1.980 2.816 6.382 1.00 0.19 C ATOM 0 H5' DG B 22 -7.082 3.042 8.928 1.00 0.23 H new ATOM 0 H5'' DG B 22 -8.397 3.697 7.972 1.00 0.23 H new ATOM 0 H4' DG B 22 -6.692 5.238 7.653 1.00 0.22 H new ATOM 0 H3' DG B 22 -7.501 3.769 5.399 1.00 0.19 H new ATOM 0 H2' DG B 22 -5.557 2.377 5.304 1.00 0.16 H new ATOM 0 H2'' DG B 22 -5.033 3.735 4.329 1.00 0.16 H new ATOM 0 H1' DG B 22 -3.794 4.711 6.110 1.00 0.18 H new ATOM 0 H8 DG B 22 -4.566 1.047 6.941 1.00 0.20 H new ATOM 0 H1 DG B 22 1.624 2.401 6.208 1.00 0.23 H new ATOM 0 H21 DG B 22 0.521 5.646 5.608 1.00 0.24 H new ATOM 0 H22 DG B 22 1.885 4.532 5.744 1.00 0.24 H new ATOM 692 P DA B 23 -6.616 5.790 3.611 1.00 0.23 P ATOM 693 OP1 DA B 23 -7.057 7.181 3.362 1.00 0.31 O ATOM 694 OP2 DA B 23 -7.337 4.664 2.977 1.00 0.28 O ATOM 695 O5' DA B 23 -5.058 5.674 3.221 1.00 0.19 O ATOM 696 C5' DA B 23 -4.166 6.776 3.429 1.00 0.17 C ATOM 697 C4' DA B 23 -2.945 6.679 2.534 1.00 0.14 C ATOM 698 O4' DA B 23 -2.034 5.673 3.039 1.00 0.13 O ATOM 699 C3' DA B 23 -3.372 6.202 1.151 1.00 0.12 C ATOM 700 O3' DA B 23 -2.866 7.071 0.128 1.00 0.15 O ATOM 701 C2' DA B 23 -2.819 4.818 1.059 1.00 0.11 C ATOM 702 C1' DA B 23 -1.656 4.833 1.933 1.00 0.11 C ATOM 703 N9 DA B 23 -1.347 3.479 2.381 1.00 0.10 N ATOM 704 C8 DA B 23 -2.204 2.477 2.559 1.00 0.10 C ATOM 705 N7 DA B 23 -1.738 1.346 2.974 1.00 0.10 N ATOM 706 C5 DA B 23 -0.373 1.639 3.086 1.00 0.11 C ATOM 707 C6 DA B 23 0.733 0.878 3.483 1.00 0.13 C ATOM 708 N6 DA B 23 0.643 -0.399 3.855 1.00 0.14 N ATOM 709 N1 DA B 23 1.936 1.484 3.476 1.00 0.16 N ATOM 710 C2 DA B 23 2.044 2.761 3.099 1.00 0.17 C ATOM 711 N3 DA B 23 1.065 3.572 2.706 1.00 0.15 N ATOM 712 C4 DA B 23 -0.126 2.943 2.724 1.00 0.11 C ATOM 0 H5' DA B 23 -3.853 6.800 4.473 1.00 0.17 H new ATOM 0 H5'' DA B 23 -4.690 7.712 3.232 1.00 0.17 H new ATOM 0 H4' DA B 23 -2.471 7.660 2.502 1.00 0.14 H new ATOM 0 H3' DA B 23 -4.453 6.211 1.008 1.00 0.12 H new ATOM 0 H2' DA B 23 -3.549 4.076 1.382 1.00 0.11 H new ATOM 0 H2'' DA B 23 -2.543 4.568 0.035 1.00 0.11 H new ATOM 0 H1' DA B 23 -0.762 5.206 1.434 1.00 0.11 H new ATOM 0 H8 DA B 23 -3.258 2.605 2.362 1.00 0.10 H new ATOM 0 H61 DA B 23 1.481 -0.909 4.136 1.00 0.14 H new ATOM 0 H62 DA B 23 -0.264 -0.866 3.859 1.00 0.14 H new ATOM 0 H2 DA B 23 3.038 3.183 3.115 1.00 0.17 H new ATOM 724 P DG B 24 -3.250 6.873 -1.426 1.00 0.18 P ATOM 725 OP1 DG B 24 -3.907 8.111 -1.903 1.00 0.25 O ATOM 726 OP2 DG B 24 -3.930 5.568 -1.582 1.00 0.20 O ATOM 727 O5' DG B 24 -1.800 6.773 -2.116 1.00 0.19 O ATOM 728 C5' DG B 24 -0.768 7.704 -1.766 1.00 0.22 C ATOM 729 C4' DG B 24 0.601 7.073 -1.891 1.00 0.24 C ATOM 730 O4' DG B 24 0.687 5.989 -0.952 1.00 0.21 O ATOM 731 C3' DG B 24 0.758 6.478 -3.281 1.00 0.26 C ATOM 732 O3' DG B 24 1.793 7.145 -4.012 1.00 0.33 O ATOM 733 C2' DG B 24 1.110 5.038 -3.033 1.00 0.25 C ATOM 734 C1' DG B 24 1.467 4.957 -1.544 1.00 0.22 C ATOM 735 N9 DG B 24 1.056 3.656 -0.999 1.00 0.18 N ATOM 736 C8 DG B 24 -0.193 3.156 -0.854 1.00 0.16 C ATOM 737 N7 DG B 24 -0.311 1.975 -0.351 1.00 0.13 N ATOM 738 C5 DG B 24 1.025 1.631 -0.126 1.00 0.14 C ATOM 739 C6 DG B 24 1.576 0.443 0.418 1.00 0.14 C ATOM 740 O6 DG B 24 0.986 -0.558 0.818 1.00 0.14 O ATOM 741 N1 DG B 24 2.961 0.503 0.472 1.00 0.17 N ATOM 742 C2 DG B 24 3.730 1.572 0.056 1.00 0.20 C ATOM 743 N2 DG B 24 5.049 1.440 0.187 1.00 0.24 N ATOM 744 N3 DG B 24 3.220 2.695 -0.458 1.00 0.20 N ATOM 745 C4 DG B 24 1.870 2.658 -0.520 1.00 0.16 C ATOM 0 H5' DG B 24 -0.919 8.052 -0.744 1.00 0.22 H new ATOM 0 H5'' DG B 24 -0.829 8.579 -2.413 1.00 0.22 H new ATOM 0 H4' DG B 24 1.367 7.826 -1.707 1.00 0.24 H new ATOM 0 H3' DG B 24 -0.145 6.585 -3.883 1.00 0.26 H new ATOM 0 H2' DG B 24 0.273 4.382 -3.273 1.00 0.25 H new ATOM 0 H2'' DG B 24 1.948 4.726 -3.656 1.00 0.25 H new ATOM 0 HO3' DG B 24 1.876 6.743 -4.902 1.00 0.33 H new ATOM 0 H1' DG B 24 2.536 5.065 -1.359 1.00 0.22 H new ATOM 0 H8 DG B 24 -1.061 3.727 -1.149 1.00 0.16 H new ATOM 0 H1 DG B 24 3.451 -0.308 0.850 1.00 0.17 H new ATOM 0 H21 DG B 24 5.669 2.197 -0.103 1.00 0.24 H new ATOM 0 H22 DG B 24 5.439 0.582 0.577 1.00 0.24 H new TER 758 DG B 24 HETATM 759 N3A GIQ A 25 -1.854 -1.813 20.356 1.00 0.10 N HETATM 760 C3A GIQ A 25 -0.903 -2.818 20.396 1.00 0.09 C HETATM 761 C1A GIQ A 25 -1.412 -3.833 21.191 1.00 0.09 C HETATM 762 N1A GIQ A 25 -2.688 -3.474 21.654 1.00 0.10 N HETATM 763 C GIQ A 25 -1.731 -0.568 19.602 1.00 0.12 C HETATM 764 C4A GIQ A 25 0.352 -2.911 19.800 1.00 0.10 C HETATM 765 C5A GIQ A 25 1.077 -4.059 20.026 1.00 0.10 C HETATM 766 C6A GIQ A 25 0.638 -5.079 20.804 1.00 0.09 C HETATM 767 C10 GIQ A 25 -0.615 -5.023 21.423 1.00 0.09 C HETATM 768 N6A GIQ A 25 1.498 -6.111 20.927 1.00 0.09 N HETATM 769 C7A GIQ A 25 1.140 -7.098 21.663 1.00 0.09 C HETATM 770 C8A GIQ A 25 -0.081 -7.169 22.320 1.00 0.09 C HETATM 771 C9A GIQ A 25 -0.955 -6.126 22.190 1.00 0.09 C HETATM 772 N10 GIQ A 25 -4.050 -1.404 21.296 1.00 0.12 N HETATM 773 C2A GIQ A 25 -2.920 -2.269 21.128 1.00 0.11 C HETATM 0 H102 GIQ A 25 -4.847 -1.709 21.855 1.00 0.12 H new HETATM 0 H9A GIQ A 25 -1.922 -6.162 22.691 1.00 0.09 H new HETATM 0 H8A GIQ A 25 -0.337 -8.038 22.926 1.00 0.09 H new HETATM 0 H7A GIQ A 25 1.835 -7.930 21.780 1.00 0.09 H new HETATM 0 H5A GIQ A 25 2.055 -4.153 19.555 1.00 0.10 H new HETATM 0 H4A GIQ A 25 0.745 -2.106 19.179 1.00 0.10 H new HETATM 0 H3 GIQ A 25 -0.857 -0.017 19.949 1.00 0.12 H new HETATM 0 H2 GIQ A 25 -1.619 -0.794 18.542 1.00 0.12 H new HETATM 0 H1 GIQ A 25 -2.625 0.038 19.751 1.00 0.12 H new