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 -100:sc= -0.201 USER MOD Single : A 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= -1.88 (180deg=-1.88) 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= -0.498 (180deg=-0.498) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 7.644 -6.795 -1.962 1.00 0.18 O ATOM 2 C5' DC A 1 8.078 -5.685 -2.754 1.00 0.19 C ATOM 3 C4' DC A 1 7.986 -4.350 -1.922 1.00 0.18 C ATOM 4 O4' DC A 1 6.608 -3.920 -1.810 1.00 0.20 O ATOM 5 C3' DC A 1 8.478 -4.586 -0.486 1.00 0.14 C ATOM 6 O3' DC A 1 9.671 -3.834 -0.215 1.00 0.17 O ATOM 7 C2' DC A 1 7.331 -4.135 0.394 1.00 0.16 C ATOM 8 C1' DC A 1 6.466 -3.310 -0.525 1.00 0.20 C ATOM 9 N1 DC A 1 5.066 -3.283 -0.080 1.00 0.21 N ATOM 10 C2 DC A 1 4.419 -2.059 -0.012 1.00 0.22 C ATOM 11 O2 DC A 1 5.009 -1.025 -0.318 1.00 0.23 O ATOM 12 N3 DC A 1 3.124 -2.045 0.406 1.00 0.24 N ATOM 13 C4 DC A 1 2.503 -3.183 0.741 1.00 0.25 C ATOM 14 N4 DC A 1 1.233 -3.141 1.145 1.00 0.27 N ATOM 15 C5 DC A 1 3.190 -4.435 0.663 1.00 0.24 C ATOM 16 C6 DC A 1 4.446 -4.424 0.253 1.00 0.22 C ATOM 0 H5' DC A 1 7.462 -5.606 -3.650 1.00 0.19 H new ATOM 0 H5'' DC A 1 9.104 -5.845 -3.085 1.00 0.19 H new ATOM 0 H4' DC A 1 8.593 -3.604 -2.435 1.00 0.18 H new ATOM 0 H3' DC A 1 8.742 -5.629 -0.310 1.00 0.14 H new ATOM 0 H2' DC A 1 6.783 -4.985 0.801 1.00 0.16 H new ATOM 0 H2'' DC A 1 7.685 -3.548 1.241 1.00 0.16 H new ATOM 0 HO5' DC A 1 8.425 -7.273 -1.612 1.00 0.18 H new ATOM 0 H1' DC A 1 6.772 -2.264 -0.540 1.00 0.20 H new ATOM 0 H41 DC A 1 0.751 -4.002 1.402 1.00 0.27 H new ATOM 0 H42 DC A 1 0.744 -2.248 1.197 1.00 0.27 H new ATOM 0 H5 DC A 1 2.698 -5.359 0.930 1.00 0.24 H new ATOM 0 H6 DC A 1 4.986 -5.357 0.184 1.00 0.22 H new ATOM 29 P DT A 2 10.234 -3.705 1.291 1.00 0.15 P ATOM 30 OP1 DT A 2 11.713 -3.690 1.230 1.00 0.20 O ATOM 31 OP2 DT A 2 9.545 -4.703 2.140 1.00 0.19 O ATOM 32 O5' DT A 2 9.730 -2.238 1.731 1.00 0.18 O ATOM 33 C5' DT A 2 10.555 -1.089 1.508 1.00 0.19 C ATOM 34 C4' DT A 2 9.877 0.197 2.034 1.00 0.19 C ATOM 35 O4' DT A 2 8.445 0.087 1.856 1.00 0.18 O ATOM 36 C3' DT A 2 10.140 0.318 3.529 1.00 0.19 C ATOM 37 O3' DT A 2 10.731 1.587 3.840 1.00 0.21 O ATOM 38 C2' DT A 2 8.781 0.178 4.119 1.00 0.18 C ATOM 39 C1' DT A 2 7.831 0.629 3.026 1.00 0.17 C ATOM 40 N1 DT A 2 6.530 0.023 3.240 1.00 0.16 N ATOM 41 C2 DT A 2 5.379 0.755 3.027 1.00 0.18 C ATOM 42 O2 DT A 2 5.396 1.928 2.658 1.00 0.19 O ATOM 43 N3 DT A 2 4.196 0.077 3.257 1.00 0.18 N ATOM 44 C4 DT A 2 4.083 -1.243 3.668 1.00 0.18 C ATOM 45 O4 DT A 2 2.978 -1.750 3.844 1.00 0.20 O ATOM 46 C5 DT A 2 5.358 -1.908 3.861 1.00 0.16 C ATOM 47 C7 DT A 2 5.393 -3.363 4.321 1.00 0.18 C ATOM 48 C6 DT A 2 6.513 -1.248 3.641 1.00 0.16 C ATOM 0 H5' DT A 2 10.759 -0.986 0.442 1.00 0.19 H new ATOM 0 H5'' DT A 2 11.516 -1.226 2.005 1.00 0.19 H new ATOM 0 H4' DT A 2 10.270 1.059 1.495 1.00 0.19 H new ATOM 0 H3' DT A 2 10.842 -0.423 3.913 1.00 0.19 H new ATOM 0 H2' DT A 2 8.583 -0.852 4.414 1.00 0.18 H new ATOM 0 H2'' DT A 2 8.674 0.792 5.013 1.00 0.18 H new ATOM 0 H1' DT A 2 7.674 1.707 2.978 1.00 0.17 H new ATOM 0 H3 DT A 2 3.329 0.594 3.111 1.00 0.18 H new ATOM 0 H71 DT A 2 6.284 -3.849 3.924 1.00 0.18 H new ATOM 0 H72 DT A 2 5.415 -3.400 5.410 1.00 0.18 H new ATOM 0 H73 DT A 2 4.505 -3.881 3.958 1.00 0.18 H new ATOM 0 H6 DT A 2 7.450 -1.763 3.794 1.00 0.16 H new ATOM 61 P DC A 3 11.148 1.975 5.349 1.00 0.23 P ATOM 62 OP1 DC A 3 12.474 2.631 5.308 1.00 0.29 O ATOM 63 OP2 DC A 3 10.938 0.791 6.213 1.00 0.25 O ATOM 64 O5' DC A 3 10.048 3.084 5.738 1.00 0.22 O ATOM 65 C5' DC A 3 9.844 4.232 4.905 1.00 0.24 C ATOM 66 C4' DC A 3 8.440 4.804 5.083 1.00 0.22 C ATOM 67 O4' DC A 3 7.443 3.792 4.833 1.00 0.21 O ATOM 68 C3' DC A 3 8.220 5.282 6.524 1.00 0.21 C ATOM 69 O3' DC A 3 8.049 6.704 6.577 1.00 0.25 O ATOM 70 C2' DC A 3 6.972 4.558 6.979 1.00 0.19 C ATOM 71 C1' DC A 3 6.336 4.068 5.698 1.00 0.19 C ATOM 72 N1 DC A 3 5.538 2.846 5.934 1.00 0.17 N ATOM 73 C2 DC A 3 4.153 2.961 5.953 1.00 0.17 C ATOM 74 O2 DC A 3 3.615 4.052 5.777 1.00 0.19 O ATOM 75 N3 DC A 3 3.418 1.836 6.170 1.00 0.19 N ATOM 76 C4 DC A 3 4.011 0.650 6.360 1.00 0.18 C ATOM 77 N4 DC A 3 3.259 -0.430 6.570 1.00 0.21 N ATOM 78 C5 DC A 3 5.437 0.529 6.341 1.00 0.18 C ATOM 79 C6 DC A 3 6.155 1.645 6.127 1.00 0.18 C ATOM 0 H5' DC A 3 9.998 3.958 3.861 1.00 0.24 H new ATOM 0 H5'' DC A 3 10.583 4.995 5.147 1.00 0.24 H new ATOM 0 H4' DC A 3 8.348 5.632 4.380 1.00 0.22 H new ATOM 0 H3' DC A 3 9.074 5.067 7.166 1.00 0.21 H new ATOM 0 H2' DC A 3 7.213 3.730 7.645 1.00 0.19 H new ATOM 0 H2'' DC A 3 6.304 5.223 7.526 1.00 0.19 H new ATOM 0 H1' DC A 3 5.648 4.799 5.274 1.00 0.19 H new ATOM 0 H41 DC A 3 3.700 -1.338 6.716 1.00 0.21 H new ATOM 0 H42 DC A 3 2.242 -0.348 6.585 1.00 0.21 H new ATOM 0 H5 DC A 3 5.919 -0.425 6.493 1.00 0.18 H new ATOM 0 H6 DC A 3 7.233 1.590 6.108 1.00 0.18 H new ATOM 91 P DG A 4 8.049 7.484 7.989 1.00 0.28 P ATOM 92 OP1 DG A 4 8.684 8.806 7.787 1.00 0.39 O ATOM 93 OP2 DG A 4 8.570 6.568 9.029 1.00 0.34 O ATOM 94 O5' DG A 4 6.479 7.714 8.264 1.00 0.24 O ATOM 95 C5' DG A 4 5.757 8.727 7.556 1.00 0.23 C ATOM 96 C4' DG A 4 4.285 8.755 7.958 1.00 0.17 C ATOM 97 O4' DG A 4 3.640 7.482 7.671 1.00 0.16 O ATOM 98 C3' DG A 4 4.127 9.007 9.460 1.00 0.18 C ATOM 99 O3' DG A 4 3.130 10.010 9.709 1.00 0.20 O ATOM 100 C2' DG A 4 3.715 7.664 9.992 1.00 0.18 C ATOM 101 C1' DG A 4 2.955 7.051 8.862 1.00 0.14 C ATOM 102 N9 DG A 4 2.926 5.585 8.966 1.00 0.13 N ATOM 103 C8 DG A 4 3.952 4.713 9.000 1.00 0.16 C ATOM 104 N7 DG A 4 3.673 3.457 9.098 1.00 0.16 N ATOM 105 C5 DG A 4 2.276 3.484 9.136 1.00 0.14 C ATOM 106 C6 DG A 4 1.351 2.415 9.240 1.00 0.14 C ATOM 107 O6 DG A 4 1.584 1.213 9.320 1.00 0.17 O ATOM 108 N1 DG A 4 0.040 2.873 9.245 1.00 0.14 N ATOM 109 C2 DG A 4 -0.340 4.199 9.160 1.00 0.13 C ATOM 110 N2 DG A 4 -1.650 4.443 9.182 1.00 0.17 N ATOM 111 N3 DG A 4 0.527 5.211 9.062 1.00 0.12 N ATOM 112 C4 DG A 4 1.810 4.786 9.056 1.00 0.12 C ATOM 0 H5' DG A 4 5.838 8.550 6.484 1.00 0.23 H new ATOM 0 H5'' DG A 4 6.207 9.700 7.753 1.00 0.23 H new ATOM 0 H4' DG A 4 3.824 9.558 7.384 1.00 0.17 H new ATOM 0 H3' DG A 4 5.033 9.384 9.935 1.00 0.18 H new ATOM 0 H2' DG A 4 4.580 7.060 10.267 1.00 0.18 H new ATOM 0 H2'' DG A 4 3.097 7.760 10.885 1.00 0.18 H new ATOM 0 H1' DG A 4 1.910 7.362 8.862 1.00 0.14 H new ATOM 0 H8 DG A 4 4.975 5.054 8.947 1.00 0.16 H new ATOM 0 H1 DG A 4 -0.701 2.176 9.317 1.00 0.14 H new ATOM 0 H21 DG A 4 -1.991 5.402 9.123 1.00 0.17 H new ATOM 0 H22 DG A 4 -2.311 3.670 9.258 1.00 0.17 H new ATOM 124 P DG A 5 2.550 10.268 11.192 1.00 0.26 P ATOM 125 OP1 DG A 5 2.129 11.685 11.284 1.00 0.38 O ATOM 126 OP2 DG A 5 3.512 9.721 12.174 1.00 0.34 O ATOM 127 O5' DG A 5 1.229 9.346 11.212 1.00 0.23 O ATOM 128 C5' DG A 5 0.075 9.715 10.448 1.00 0.23 C ATOM 129 C4' DG A 5 -1.156 8.899 10.854 1.00 0.20 C ATOM 130 O4' DG A 5 -0.927 7.472 10.657 1.00 0.18 O ATOM 131 C3' DG A 5 -1.481 9.101 12.336 1.00 0.21 C ATOM 132 O3' DG A 5 -2.879 9.349 12.542 1.00 0.24 O ATOM 133 C2' DG A 5 -1.057 7.809 12.964 1.00 0.21 C ATOM 134 C1' DG A 5 -1.281 6.791 11.875 1.00 0.18 C ATOM 135 N9 DG A 5 -0.459 5.589 12.083 1.00 0.16 N ATOM 136 C8 DG A 5 0.879 5.478 12.126 1.00 0.18 C ATOM 137 N7 DG A 5 1.382 4.305 12.331 1.00 0.19 N ATOM 138 C5 DG A 5 0.230 3.520 12.442 1.00 0.17 C ATOM 139 C6 DG A 5 0.093 2.124 12.674 1.00 0.19 C ATOM 140 O6 DG A 5 0.977 1.282 12.830 1.00 0.21 O ATOM 141 N1 DG A 5 -1.242 1.743 12.714 1.00 0.22 N ATOM 142 C2 DG A 5 -2.318 2.594 12.549 1.00 0.24 C ATOM 143 N2 DG A 5 -3.529 2.040 12.622 1.00 0.31 N ATOM 144 N3 DG A 5 -2.198 3.907 12.332 1.00 0.21 N ATOM 145 C4 DG A 5 -0.905 4.302 12.290 1.00 0.17 C ATOM 0 H5' DG A 5 0.277 9.566 9.387 1.00 0.23 H new ATOM 0 H5'' DG A 5 -0.130 10.777 10.587 1.00 0.23 H new ATOM 0 H4' DG A 5 -1.980 9.244 10.229 1.00 0.20 H new ATOM 0 H3' DG A 5 -0.976 9.967 12.763 1.00 0.21 H new ATOM 0 H2' DG A 5 -0.013 7.839 13.275 1.00 0.21 H new ATOM 0 H2'' DG A 5 -1.648 7.582 13.851 1.00 0.21 H new ATOM 0 H1' DG A 5 -2.310 6.433 11.856 1.00 0.18 H new ATOM 0 H8 DG A 5 1.514 6.341 11.994 1.00 0.18 H new ATOM 0 H1 DG A 5 -1.444 0.757 12.878 1.00 0.22 H new ATOM 0 H21 DG A 5 -4.362 2.618 12.508 1.00 0.31 H new ATOM 0 H22 DG A 5 -3.622 1.039 12.792 1.00 0.31 H new ATOM 157 P DC A 6 -3.427 9.830 13.982 1.00 0.28 P ATOM 158 OP1 DC A 6 -4.645 10.643 13.764 1.00 0.37 O ATOM 159 OP2 DC A 6 -2.293 10.396 14.748 1.00 0.35 O ATOM 160 O5' DC A 6 -3.862 8.444 14.680 1.00 0.26 O ATOM 161 C5' DC A 6 -5.054 7.768 14.265 1.00 0.26 C ATOM 162 C4' DC A 6 -5.112 6.334 14.823 1.00 0.21 C ATOM 163 O4' DC A 6 -3.924 5.623 14.458 1.00 0.20 O ATOM 164 C3' DC A 6 -5.150 6.342 16.361 1.00 0.19 C ATOM 165 O3' DC A 6 -6.375 5.768 16.846 1.00 0.17 O ATOM 166 C2' DC A 6 -3.972 5.504 16.780 1.00 0.18 C ATOM 167 C1' DC A 6 -3.615 4.744 15.536 1.00 0.17 C ATOM 168 N1 DC A 6 -2.200 4.401 15.534 1.00 0.16 N ATOM 169 C2 DC A 6 -1.881 3.085 15.716 1.00 0.14 C ATOM 170 O2 DC A 6 -2.770 2.266 15.870 1.00 0.15 O ATOM 171 N3 DC A 6 -0.581 2.723 15.715 1.00 0.15 N ATOM 172 C4 DC A 6 0.384 3.623 15.540 1.00 0.16 C ATOM 173 N4 DC A 6 1.648 3.203 15.550 1.00 0.18 N ATOM 174 C5 DC A 6 0.076 5.016 15.349 1.00 0.18 C ATOM 175 C6 DC A 6 -1.265 5.360 15.355 1.00 0.18 C ATOM 0 H5' DC A 6 -5.096 7.738 13.176 1.00 0.26 H new ATOM 0 H5'' DC A 6 -5.927 8.327 14.603 1.00 0.26 H new ATOM 0 H4' DC A 6 -6.008 5.866 14.416 1.00 0.21 H new ATOM 0 H3' DC A 6 -5.103 7.353 16.765 1.00 0.19 H new ATOM 0 H2' DC A 6 -3.143 6.122 17.123 1.00 0.18 H new ATOM 0 H2'' DC A 6 -4.229 4.833 17.599 1.00 0.18 H new ATOM 0 H1' DC A 6 -4.162 3.804 15.461 1.00 0.17 H new ATOM 0 H41 DC A 6 2.408 3.870 15.418 1.00 0.18 H new ATOM 0 H42 DC A 6 1.856 2.214 15.689 1.00 0.18 H new ATOM 0 H5 DC A 6 0.851 5.755 15.208 1.00 0.18 H new ATOM 0 H6 DC A 6 -1.562 6.389 15.217 1.00 0.18 H new ATOM 187 P DG A 7 -6.660 5.616 18.428 1.00 0.17 P ATOM 188 OP1 DG A 7 -8.070 5.987 18.676 1.00 0.21 O ATOM 189 OP2 DG A 7 -5.582 6.318 19.161 1.00 0.22 O ATOM 190 O5' DG A 7 -6.506 4.026 18.709 1.00 0.14 O ATOM 191 C5' DG A 7 -7.158 3.049 17.880 1.00 0.15 C ATOM 192 C4' DG A 7 -7.533 1.788 18.674 1.00 0.13 C ATOM 193 O4' DG A 7 -6.364 1.007 19.084 1.00 0.12 O ATOM 194 C3' DG A 7 -8.262 2.190 19.944 1.00 0.13 C ATOM 195 O3' DG A 7 -9.355 1.291 20.191 1.00 0.17 O ATOM 196 C2' DG A 7 -7.192 2.085 20.990 1.00 0.10 C ATOM 197 C1' DG A 7 -6.358 0.890 20.533 1.00 0.09 C ATOM 198 N9 DG A 7 -4.950 0.945 21.033 1.00 0.10 N ATOM 199 C8 DG A 7 -4.013 -0.060 21.274 1.00 0.11 C ATOM 200 N7 DG A 7 -2.844 0.357 21.647 1.00 0.14 N ATOM 201 C5 DG A 7 -2.984 1.741 21.671 1.00 0.15 C ATOM 202 C6 DG A 7 -2.030 2.739 22.014 1.00 0.19 C ATOM 203 O6 DG A 7 -0.865 2.587 22.373 1.00 0.23 O ATOM 204 N1 DG A 7 -2.563 4.016 21.907 1.00 0.21 N ATOM 205 C2 DG A 7 -3.853 4.308 21.519 1.00 0.19 C ATOM 206 N2 DG A 7 -4.174 5.615 21.477 1.00 0.22 N ATOM 207 N3 DG A 7 -4.759 3.363 21.195 1.00 0.15 N ATOM 208 C4 DG A 7 -4.257 2.110 21.295 1.00 0.12 C ATOM 0 H5' DG A 7 -6.501 2.777 17.054 1.00 0.15 H new ATOM 0 H5'' DG A 7 -8.057 3.484 17.443 1.00 0.15 H new ATOM 0 H4' DG A 7 -8.152 1.180 18.014 1.00 0.13 H new ATOM 0 H3' DG A 7 -8.709 3.183 19.910 1.00 0.13 H new ATOM 0 H2' DG A 7 -6.593 2.994 21.044 1.00 0.10 H new ATOM 0 H2'' DG A 7 -7.615 1.923 21.981 1.00 0.10 H new ATOM 0 H1' DG A 7 -6.766 -0.047 20.911 1.00 0.09 H new ATOM 0 H8 DG A 7 -4.245 -1.108 21.158 1.00 0.11 H new ATOM 0 H1 DG A 7 -1.952 4.801 22.133 1.00 0.21 H new ATOM 0 H21 DG A 7 -5.112 5.901 21.198 1.00 0.22 H new ATOM 0 H22 DG A 7 -3.479 6.319 21.724 1.00 0.22 H new ATOM 219 P DC A 8 -10.247 1.377 21.530 1.00 0.20 P ATOM 220 OP1 DC A 8 -11.655 1.107 21.166 1.00 0.29 O ATOM 221 OP2 DC A 8 -9.897 2.624 22.249 1.00 0.26 O ATOM 222 O5' DC A 8 -9.701 0.130 22.391 1.00 0.17 O ATOM 223 C5' DC A 8 -9.253 -1.071 21.746 1.00 0.13 C ATOM 224 C4' DC A 8 -8.574 -1.999 22.703 1.00 0.13 C ATOM 225 O4' DC A 8 -7.231 -1.566 22.789 1.00 0.12 O ATOM 226 C3' DC A 8 -9.165 -1.904 24.111 1.00 0.13 C ATOM 227 O3' DC A 8 -9.642 -3.199 24.518 1.00 0.17 O ATOM 228 C2' DC A 8 -7.993 -1.416 24.953 1.00 0.12 C ATOM 229 C1' DC A 8 -6.810 -1.742 24.117 1.00 0.11 C ATOM 230 N1 DC A 8 -5.659 -0.852 24.356 1.00 0.11 N ATOM 231 C2 DC A 8 -4.435 -1.448 24.487 1.00 0.13 C ATOM 232 O2 DC A 8 -4.357 -2.658 24.455 1.00 0.15 O ATOM 233 N3 DC A 8 -3.341 -0.664 24.648 1.00 0.15 N ATOM 234 C4 DC A 8 -3.446 0.665 24.694 1.00 0.16 C ATOM 235 N4 DC A 8 -2.348 1.396 24.879 1.00 0.20 N ATOM 236 C5 DC A 8 -4.721 1.302 24.556 1.00 0.15 C ATOM 237 C6 DC A 8 -5.798 0.507 24.386 1.00 0.12 C ATOM 0 H5' DC A 8 -8.566 -0.815 20.939 1.00 0.13 H new ATOM 0 H5'' DC A 8 -10.104 -1.578 21.291 1.00 0.13 H new ATOM 0 H4' DC A 8 -8.688 -3.024 22.349 1.00 0.13 H new ATOM 0 H3' DC A 8 -10.022 -1.236 24.199 1.00 0.13 H new ATOM 0 H2' DC A 8 -8.060 -0.347 25.154 1.00 0.12 H new ATOM 0 H2'' DC A 8 -7.954 -1.920 25.918 1.00 0.12 H new ATOM 0 H1' DC A 8 -6.474 -2.752 24.352 1.00 0.11 H new ATOM 0 H41 DC A 8 -2.413 2.413 24.916 1.00 0.20 H new ATOM 0 H42 DC A 8 -1.442 0.938 24.983 1.00 0.20 H new ATOM 0 H5 DC A 8 -4.817 2.377 24.587 1.00 0.15 H new ATOM 0 H6 DC A 8 -6.777 0.948 24.273 1.00 0.12 H new ATOM 249 P DC A 9 -10.115 -3.508 26.024 1.00 0.19 P ATOM 250 OP1 DC A 9 -11.230 -4.480 25.970 1.00 0.27 O ATOM 251 OP2 DC A 9 -10.293 -2.221 26.734 1.00 0.24 O ATOM 252 O5' DC A 9 -8.826 -4.248 26.638 1.00 0.17 O ATOM 253 C5' DC A 9 -8.624 -5.664 26.491 1.00 0.19 C ATOM 254 C4' DC A 9 -7.290 -6.065 27.094 1.00 0.18 C ATOM 255 O4' DC A 9 -6.352 -5.020 26.792 1.00 0.16 O ATOM 256 C3' DC A 9 -7.460 -6.089 28.612 1.00 0.16 C ATOM 257 O3' DC A 9 -6.958 -7.333 29.130 1.00 0.20 O ATOM 258 C2' DC A 9 -6.626 -4.932 29.076 1.00 0.13 C ATOM 259 C1' DC A 9 -5.604 -4.770 27.982 1.00 0.13 C ATOM 260 N1 DC A 9 -5.025 -3.421 27.936 1.00 0.12 N ATOM 261 C2 DC A 9 -3.674 -3.296 28.211 1.00 0.13 C ATOM 262 O2 DC A 9 -3.007 -4.287 28.498 1.00 0.16 O ATOM 263 N3 DC A 9 -3.115 -2.062 28.152 1.00 0.16 N ATOM 264 C4 DC A 9 -3.844 -0.986 27.839 1.00 0.17 C ATOM 265 N4 DC A 9 -3.244 0.206 27.800 1.00 0.21 N ATOM 266 C5 DC A 9 -5.248 -1.101 27.549 1.00 0.16 C ATOM 267 C6 DC A 9 -5.797 -2.349 27.611 1.00 0.14 C ATOM 0 H5' DC A 9 -8.651 -5.936 25.436 1.00 0.19 H new ATOM 0 H5'' DC A 9 -9.432 -6.207 26.981 1.00 0.19 H new ATOM 0 H4' DC A 9 -6.957 -7.030 26.712 1.00 0.18 H new ATOM 0 H3' DC A 9 -8.496 -6.010 28.942 1.00 0.16 H new ATOM 0 H2' DC A 9 -7.226 -4.030 29.201 1.00 0.13 H new ATOM 0 H2'' DC A 9 -6.155 -5.137 30.037 1.00 0.13 H new ATOM 0 H1' DC A 9 -4.755 -5.438 28.127 1.00 0.13 H new ATOM 0 H41 DC A 9 -3.781 1.040 27.563 1.00 0.21 H new ATOM 0 H42 DC A 9 -2.248 0.283 28.007 1.00 0.21 H new ATOM 0 H5 DC A 9 -5.843 -0.237 27.293 1.00 0.16 H new ATOM 0 H6 DC A 9 -6.848 -2.486 27.401 1.00 0.14 H new ATOM 279 P DA A 10 -7.129 -7.755 30.677 1.00 0.27 P ATOM 280 OP1 DA A 10 -7.278 -9.226 30.736 1.00 0.38 O ATOM 281 OP2 DA A 10 -8.163 -6.887 31.284 1.00 0.34 O ATOM 282 O5' DA A 10 -5.703 -7.369 31.332 1.00 0.21 O ATOM 283 C5' DA A 10 -4.482 -7.398 30.571 1.00 0.17 C ATOM 284 C4' DA A 10 -3.244 -7.491 31.473 1.00 0.15 C ATOM 285 O4' DA A 10 -2.343 -6.423 31.120 1.00 0.14 O ATOM 286 C3' DA A 10 -3.648 -7.254 32.921 1.00 0.16 C ATOM 287 O3' DA A 10 -2.979 -8.215 33.758 1.00 0.19 O ATOM 288 C2' DA A 10 -3.225 -5.818 33.166 1.00 0.12 C ATOM 289 C1' DA A 10 -2.024 -5.665 32.305 1.00 0.11 C ATOM 290 N9 DA A 10 -1.902 -4.276 31.857 1.00 0.11 N ATOM 291 C8 DA A 10 -2.864 -3.538 31.281 1.00 0.14 C ATOM 292 N7 DA A 10 -2.575 -2.336 30.931 1.00 0.15 N ATOM 293 C5 DA A 10 -1.237 -2.251 31.318 1.00 0.14 C ATOM 294 C6 DA A 10 -0.304 -1.222 31.232 1.00 0.17 C ATOM 295 N6 DA A 10 -0.594 -0.033 30.713 1.00 0.20 N ATOM 296 N1 DA A 10 0.931 -1.462 31.702 1.00 0.19 N ATOM 297 C2 DA A 10 1.230 -2.655 32.226 1.00 0.18 C ATOM 298 N3 DA A 10 0.419 -3.706 32.359 1.00 0.15 N ATOM 299 C4 DA A 10 -0.810 -3.434 31.882 1.00 0.13 C ATOM 0 H5' DA A 10 -4.416 -6.500 29.957 1.00 0.17 H new ATOM 0 H5'' DA A 10 -4.499 -8.249 29.890 1.00 0.17 H new ATOM 0 H4' DA A 10 -2.786 -8.472 31.351 1.00 0.15 H new ATOM 0 H3' DA A 10 -4.708 -7.383 33.140 1.00 0.16 H new ATOM 0 H2' DA A 10 -4.010 -5.114 32.890 1.00 0.12 H new ATOM 0 H2'' DA A 10 -2.993 -5.640 34.216 1.00 0.12 H new ATOM 0 H1' DA A 10 -1.119 -5.971 32.829 1.00 0.11 H new ATOM 0 H8 DA A 10 -3.852 -3.943 31.117 1.00 0.14 H new ATOM 0 H61 DA A 10 0.121 0.693 30.670 1.00 0.20 H new ATOM 0 H62 DA A 10 -1.532 0.153 30.358 1.00 0.20 H new ATOM 0 H2 DA A 10 2.242 -2.782 32.582 1.00 0.18 H new ATOM 311 P DT A 11 -2.408 -7.844 35.208 1.00 0.20 P ATOM 312 OP1 DT A 11 -2.041 -9.103 35.895 1.00 0.26 O ATOM 313 OP2 DT A 11 -3.348 -6.900 35.854 1.00 0.23 O ATOM 314 O5' DT A 11 -1.055 -7.047 34.857 1.00 0.16 O ATOM 315 C5' DT A 11 0.204 -7.725 34.720 1.00 0.18 C ATOM 316 C4' DT A 11 1.310 -6.797 35.150 1.00 0.17 C ATOM 317 O4' DT A 11 1.104 -5.539 34.480 1.00 0.14 O ATOM 318 C3' DT A 11 1.091 -6.558 36.637 1.00 0.16 C ATOM 319 O3' DT A 11 2.311 -6.784 37.366 1.00 0.19 O ATOM 320 C2' DT A 11 0.670 -5.126 36.684 1.00 0.13 C ATOM 321 C1' DT A 11 1.269 -4.515 35.463 1.00 0.13 C ATOM 322 N1 DT A 11 0.499 -3.328 35.106 1.00 0.13 N ATOM 323 C2 DT A 11 1.155 -2.128 34.905 1.00 0.16 C ATOM 324 O2 DT A 11 2.375 -2.015 35.009 1.00 0.19 O ATOM 325 N3 DT A 11 0.347 -1.056 34.575 1.00 0.18 N ATOM 326 C4 DT A 11 -1.032 -1.086 34.434 1.00 0.18 C ATOM 327 O4 DT A 11 -1.648 -0.067 34.134 1.00 0.22 O ATOM 328 C5 DT A 11 -1.621 -2.390 34.668 1.00 0.15 C ATOM 329 C7 DT A 11 -3.134 -2.567 34.547 1.00 0.18 C ATOM 330 C6 DT A 11 -0.846 -3.448 34.989 1.00 0.13 C ATOM 0 H5' DT A 11 0.354 -8.036 33.686 1.00 0.18 H new ATOM 0 H5'' DT A 11 0.213 -8.629 35.329 1.00 0.18 H new ATOM 0 H4' DT A 11 2.299 -7.199 34.931 1.00 0.17 H new ATOM 0 H3' DT A 11 0.357 -7.224 37.091 1.00 0.16 H new ATOM 0 H2' DT A 11 -0.416 -5.032 36.682 1.00 0.13 H new ATOM 0 H2'' DT A 11 1.030 -4.637 37.589 1.00 0.13 H new ATOM 0 H1' DT A 11 2.308 -4.204 35.576 1.00 0.13 H new ATOM 0 H3 DT A 11 0.808 -0.159 34.421 1.00 0.18 H new ATOM 0 H71 DT A 11 -3.357 -3.584 34.225 1.00 0.18 H new ATOM 0 H72 DT A 11 -3.600 -2.382 35.515 1.00 0.18 H new ATOM 0 H73 DT A 11 -3.526 -1.861 33.815 1.00 0.18 H new ATOM 0 H6 DT A 11 -1.307 -4.410 35.156 1.00 0.13 H new ATOM 343 P DC A 12 2.471 -6.366 38.917 1.00 0.17 P ATOM 344 OP1 DC A 12 3.345 -7.361 39.575 1.00 0.22 O ATOM 345 OP2 DC A 12 1.125 -6.088 39.468 1.00 0.23 O ATOM 346 O5' DC A 12 3.275 -4.970 38.826 1.00 0.16 O ATOM 347 C5' DC A 12 4.510 -4.879 38.102 1.00 0.18 C ATOM 348 C4' DC A 12 5.000 -3.431 38.017 1.00 0.22 C ATOM 349 O4' DC A 12 4.035 -2.626 37.314 1.00 0.19 O ATOM 350 C3' DC A 12 5.131 -2.826 39.420 1.00 0.25 C ATOM 351 O3' DC A 12 6.482 -2.432 39.683 1.00 0.35 O ATOM 352 C2' DC A 12 4.209 -1.628 39.402 1.00 0.25 C ATOM 353 C1' DC A 12 4.019 -1.333 37.928 1.00 0.22 C ATOM 354 N1 DC A 12 2.723 -0.668 37.690 1.00 0.19 N ATOM 355 C2 DC A 12 2.716 0.681 37.364 1.00 0.22 C ATOM 356 O2 DC A 12 3.769 1.307 37.275 1.00 0.28 O ATOM 357 N3 DC A 12 1.512 1.282 37.149 1.00 0.21 N ATOM 358 C4 DC A 12 0.368 0.589 37.250 1.00 0.20 C ATOM 359 N4 DC A 12 -0.794 1.204 37.033 1.00 0.23 N ATOM 360 C5 DC A 12 0.378 -0.799 37.587 1.00 0.19 C ATOM 361 C6 DC A 12 1.569 -1.380 37.795 1.00 0.17 C ATOM 0 H5' DC A 12 4.375 -5.279 37.097 1.00 0.18 H new ATOM 0 H5'' DC A 12 5.267 -5.493 38.591 1.00 0.18 H new ATOM 0 H4' DC A 12 5.962 -3.439 37.504 1.00 0.22 H new ATOM 0 H3' DC A 12 4.869 -3.536 40.204 1.00 0.25 H new ATOM 0 H2' DC A 12 3.260 -1.848 39.891 1.00 0.25 H new ATOM 0 H2'' DC A 12 4.648 -0.779 39.926 1.00 0.25 H new ATOM 0 HO3' DC A 12 6.541 -2.047 40.582 1.00 0.35 H new ATOM 0 H1' DC A 12 4.784 -0.665 37.533 1.00 0.22 H new ATOM 0 H41 DC A 12 -1.668 0.684 37.108 1.00 0.23 H new ATOM 0 H42 DC A 12 -0.809 2.195 36.792 1.00 0.23 H new ATOM 0 H5 DC A 12 -0.541 -1.361 37.671 1.00 0.19 H new ATOM 0 H6 DC A 12 1.612 -2.429 38.050 1.00 0.17 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 0.335 11.726 35.656 1.00 0.35 O ATOM 376 C5' DG B 13 1.667 12.101 36.016 1.00 0.30 C ATOM 377 C4' DG B 13 2.696 11.124 35.451 1.00 0.22 C ATOM 378 O4' DG B 13 2.442 9.775 35.934 1.00 0.20 O ATOM 379 C3' DG B 13 2.627 11.079 33.922 1.00 0.15 C ATOM 380 O3' DG B 13 3.949 11.182 33.354 1.00 0.15 O ATOM 381 C2' DG B 13 1.960 9.765 33.650 1.00 0.15 C ATOM 382 C1' DG B 13 2.396 8.892 34.798 1.00 0.15 C ATOM 383 N9 DG B 13 1.418 7.821 35.029 1.00 0.18 N ATOM 384 C8 DG B 13 0.076 7.845 34.861 1.00 0.25 C ATOM 385 N7 DG B 13 -0.581 6.771 35.141 1.00 0.28 N ATOM 386 C5 DG B 13 0.444 5.912 35.550 1.00 0.22 C ATOM 387 C6 DG B 13 0.379 4.565 35.991 1.00 0.24 C ATOM 388 O6 DG B 13 -0.611 3.850 36.110 1.00 0.28 O ATOM 389 N1 DG B 13 1.637 4.070 36.307 1.00 0.24 N ATOM 390 C2 DG B 13 2.818 4.780 36.212 1.00 0.25 C ATOM 391 N2 DG B 13 3.930 4.132 36.560 1.00 0.31 N ATOM 392 N3 DG B 13 2.888 6.048 35.798 1.00 0.21 N ATOM 393 C4 DG B 13 1.673 6.550 35.484 1.00 0.18 C ATOM 0 H5' DG B 13 1.755 12.136 37.102 1.00 0.30 H new ATOM 0 H5'' DG B 13 1.876 13.105 35.646 1.00 0.30 H new ATOM 0 H4' DG B 13 3.676 11.472 35.777 1.00 0.22 H new ATOM 0 H3' DG B 13 2.077 11.905 33.471 1.00 0.15 H new ATOM 0 H2' DG B 13 0.875 9.867 33.616 1.00 0.15 H new ATOM 0 H2'' DG B 13 2.272 9.350 32.692 1.00 0.15 H new ATOM 0 HO5' DG B 13 -0.300 12.370 36.034 1.00 0.35 H new ATOM 0 H1' DG B 13 3.355 8.411 34.606 1.00 0.15 H new ATOM 0 H8 DG B 13 -0.427 8.732 34.505 1.00 0.25 H new ATOM 0 H1 DG B 13 1.694 3.106 36.635 1.00 0.24 H new ATOM 0 H21 DG B 13 4.832 4.605 36.511 1.00 0.31 H new ATOM 0 H22 DG B 13 3.878 3.163 36.876 1.00 0.31 H new ATOM 406 P DA B 14 4.380 10.400 32.010 1.00 0.17 P ATOM 407 OP1 DA B 14 5.664 10.964 31.538 1.00 0.27 O ATOM 408 OP2 DA B 14 3.214 10.357 31.098 1.00 0.20 O ATOM 409 O5' DA B 14 4.653 8.910 32.554 1.00 0.20 O ATOM 410 C5' DA B 14 5.670 8.666 33.534 1.00 0.20 C ATOM 411 C4' DA B 14 6.122 7.216 33.517 1.00 0.19 C ATOM 412 O4' DA B 14 5.062 6.332 33.973 1.00 0.17 O ATOM 413 C3' DA B 14 6.459 6.826 32.090 1.00 0.19 C ATOM 414 O3' DA B 14 7.741 6.191 32.024 1.00 0.22 O ATOM 415 C2' DA B 14 5.335 5.912 31.706 1.00 0.16 C ATOM 416 C1' DA B 14 4.927 5.276 33.008 1.00 0.15 C ATOM 417 N9 DA B 14 3.526 4.852 32.950 1.00 0.14 N ATOM 418 C8 DA B 14 2.462 5.556 32.519 1.00 0.15 C ATOM 419 N7 DA B 14 1.304 4.985 32.573 1.00 0.16 N ATOM 420 C5 DA B 14 1.636 3.734 33.112 1.00 0.16 C ATOM 421 C6 DA B 14 0.872 2.608 33.441 1.00 0.19 C ATOM 422 N6 DA B 14 -0.448 2.546 33.267 1.00 0.21 N ATOM 423 N1 DA B 14 1.522 1.546 33.953 1.00 0.20 N ATOM 424 C2 DA B 14 2.845 1.586 34.132 1.00 0.20 C ATOM 425 N3 DA B 14 3.663 2.597 33.855 1.00 0.18 N ATOM 426 C4 DA B 14 2.990 3.647 33.344 1.00 0.16 C ATOM 0 H5' DA B 14 5.291 8.919 34.524 1.00 0.20 H new ATOM 0 H5'' DA B 14 6.524 9.317 33.344 1.00 0.20 H new ATOM 0 H4' DA B 14 6.984 7.120 34.177 1.00 0.19 H new ATOM 0 H3' DA B 14 6.541 7.674 31.410 1.00 0.19 H new ATOM 0 H2' DA B 14 4.510 6.462 31.254 1.00 0.16 H new ATOM 0 H2'' DA B 14 5.657 5.165 30.980 1.00 0.16 H new ATOM 0 H1' DA B 14 5.526 4.397 33.244 1.00 0.15 H new ATOM 0 H8 DA B 14 2.573 6.562 32.142 1.00 0.15 H new ATOM 0 H61 DA B 14 -0.957 1.700 33.524 1.00 0.21 H new ATOM 0 H62 DA B 14 -0.949 3.344 32.877 1.00 0.21 H new ATOM 0 H2 DA B 14 3.301 0.699 34.548 1.00 0.20 H new ATOM 438 P DT B 15 8.434 5.837 30.616 1.00 0.24 P ATOM 439 OP1 DT B 15 9.864 6.212 30.696 1.00 0.32 O ATOM 440 OP2 DT B 15 7.589 6.375 29.526 1.00 0.26 O ATOM 441 O5' DT B 15 8.334 4.233 30.585 1.00 0.26 O ATOM 442 C5' DT B 15 8.897 3.439 31.638 1.00 0.27 C ATOM 443 C4' DT B 15 8.249 2.059 31.681 1.00 0.24 C ATOM 444 O4' DT B 15 6.841 2.165 31.986 1.00 0.21 O ATOM 445 C3' DT B 15 8.337 1.394 30.305 1.00 0.22 C ATOM 446 O3' DT B 15 9.114 0.189 30.365 1.00 0.24 O ATOM 447 C2' DT B 15 6.897 1.112 29.939 1.00 0.18 C ATOM 448 C1' DT B 15 6.169 1.154 31.223 1.00 0.18 C ATOM 449 N1 DT B 15 4.760 1.486 30.984 1.00 0.15 N ATOM 450 C2 DT B 15 3.791 0.570 31.353 1.00 0.16 C ATOM 451 O2 DT B 15 4.066 -0.504 31.885 1.00 0.18 O ATOM 452 N3 DT B 15 2.487 0.935 31.079 1.00 0.16 N ATOM 453 C4 DT B 15 2.082 2.120 30.479 1.00 0.15 C ATOM 454 O4 DT B 15 0.893 2.354 30.285 1.00 0.19 O ATOM 455 C5 DT B 15 3.171 3.005 30.133 1.00 0.14 C ATOM 456 C7 DT B 15 2.870 4.345 29.465 1.00 0.15 C ATOM 457 C6 DT B 15 4.446 2.663 30.393 1.00 0.15 C ATOM 0 H5' DT B 15 8.755 3.942 32.594 1.00 0.27 H new ATOM 0 H5'' DT B 15 9.972 3.337 31.488 1.00 0.27 H new ATOM 0 H4' DT B 15 8.773 1.481 32.442 1.00 0.24 H new ATOM 0 H3' DT B 15 8.833 2.021 29.564 1.00 0.22 H new ATOM 0 H2' DT B 15 6.513 1.856 29.241 1.00 0.18 H new ATOM 0 H2'' DT B 15 6.794 0.140 29.457 1.00 0.18 H new ATOM 0 H1' DT B 15 6.168 0.201 31.751 1.00 0.18 H new ATOM 0 H3 DT B 15 1.756 0.274 31.341 1.00 0.16 H new ATOM 0 H71 DT B 15 3.635 5.070 29.744 1.00 0.15 H new ATOM 0 H72 DT B 15 2.866 4.219 28.382 1.00 0.15 H new ATOM 0 H73 DT B 15 1.894 4.703 29.792 1.00 0.15 H new ATOM 0 H6 DT B 15 5.239 3.345 30.123 1.00 0.15 H new ATOM 470 P DG B 16 9.165 -0.826 29.114 1.00 0.23 P ATOM 471 OP1 DG B 16 10.343 -1.708 29.281 1.00 0.28 O ATOM 472 OP2 DG B 16 9.002 -0.042 27.869 1.00 0.26 O ATOM 473 O5' DG B 16 7.835 -1.709 29.333 1.00 0.18 O ATOM 474 C5' DG B 16 7.847 -2.835 30.216 1.00 0.17 C ATOM 475 C4' DG B 16 6.834 -3.894 29.790 1.00 0.13 C ATOM 476 O4' DG B 16 5.464 -3.426 29.956 1.00 0.13 O ATOM 477 C3' DG B 16 7.011 -4.249 28.316 1.00 0.13 C ATOM 478 O3' DG B 16 7.041 -5.671 28.132 1.00 0.16 O ATOM 479 C2' DG B 16 5.822 -3.614 27.657 1.00 0.12 C ATOM 480 C1' DG B 16 4.757 -3.663 28.721 1.00 0.10 C ATOM 481 N9 DG B 16 3.724 -2.634 28.493 1.00 0.11 N ATOM 482 C8 DG B 16 3.868 -1.325 28.181 1.00 0.13 C ATOM 483 N7 DG B 16 2.792 -0.624 28.023 1.00 0.15 N ATOM 484 C5 DG B 16 1.794 -1.578 28.257 1.00 0.13 C ATOM 485 C6 DG B 16 0.375 -1.447 28.234 1.00 0.16 C ATOM 486 O6 DG B 16 -0.306 -0.445 28.001 1.00 0.19 O ATOM 487 N1 DG B 16 -0.249 -2.653 28.524 1.00 0.16 N ATOM 488 C2 DG B 16 0.400 -3.841 28.803 1.00 0.16 C ATOM 489 N2 DG B 16 -0.375 -4.895 29.058 1.00 0.19 N ATOM 490 N3 DG B 16 1.727 -3.972 28.826 1.00 0.13 N ATOM 491 C4 DG B 16 2.361 -2.812 28.547 1.00 0.12 C ATOM 0 H5' DG B 16 7.624 -2.505 31.231 1.00 0.17 H new ATOM 0 H5'' DG B 16 8.845 -3.272 30.235 1.00 0.17 H new ATOM 0 H4' DG B 16 7.012 -4.762 30.425 1.00 0.13 H new ATOM 0 H3' DG B 16 7.951 -3.893 27.894 1.00 0.13 H new ATOM 0 H2' DG B 16 6.034 -2.590 27.349 1.00 0.12 H new ATOM 0 H2'' DG B 16 5.521 -4.160 26.763 1.00 0.12 H new ATOM 0 H1' DG B 16 4.227 -4.616 28.726 1.00 0.10 H new ATOM 0 H8 DG B 16 4.846 -0.881 28.068 1.00 0.13 H new ATOM 0 H1 DG B 16 -1.269 -2.663 28.532 1.00 0.16 H new ATOM 0 H21 DG B 16 0.047 -5.799 29.271 1.00 0.19 H new ATOM 0 H22 DG B 16 -1.390 -4.798 29.040 1.00 0.19 H new ATOM 503 P DG B 17 7.132 -6.319 26.661 1.00 0.21 P ATOM 504 OP1 DG B 17 7.834 -7.618 26.770 1.00 0.30 O ATOM 505 OP2 DG B 17 7.631 -5.288 25.724 1.00 0.28 O ATOM 506 O5' DG B 17 5.586 -6.605 26.319 1.00 0.23 O ATOM 507 C5' DG B 17 4.916 -7.748 26.860 1.00 0.20 C ATOM 508 C4' DG B 17 3.546 -7.937 26.228 1.00 0.17 C ATOM 509 O4' DG B 17 2.628 -6.881 26.644 1.00 0.16 O ATOM 510 C3' DG B 17 3.637 -7.886 24.703 1.00 0.15 C ATOM 511 O3' DG B 17 2.968 -8.984 24.058 1.00 0.15 O ATOM 512 C2' DG B 17 3.011 -6.572 24.379 1.00 0.15 C ATOM 513 C1' DG B 17 2.010 -6.356 25.460 1.00 0.14 C ATOM 514 N9 DG B 17 1.706 -4.929 25.507 1.00 0.15 N ATOM 515 C8 DG B 17 2.489 -3.882 25.823 1.00 0.18 C ATOM 516 N7 DG B 17 1.990 -2.699 25.696 1.00 0.19 N ATOM 517 C5 DG B 17 0.707 -2.994 25.235 1.00 0.16 C ATOM 518 C6 DG B 17 -0.363 -2.133 24.897 1.00 0.17 C ATOM 519 O6 DG B 17 -0.405 -0.904 24.944 1.00 0.20 O ATOM 520 N1 DG B 17 -1.469 -2.855 24.474 1.00 0.16 N ATOM 521 C2 DG B 17 -1.541 -4.236 24.390 1.00 0.14 C ATOM 522 N2 DG B 17 -2.682 -4.765 23.957 1.00 0.16 N ATOM 523 N3 DG B 17 -0.541 -5.037 24.710 1.00 0.13 N ATOM 524 C4 DG B 17 0.538 -4.360 25.119 1.00 0.14 C ATOM 0 H5' DG B 17 4.808 -7.632 27.938 1.00 0.20 H new ATOM 0 H5'' DG B 17 5.521 -8.639 26.694 1.00 0.20 H new ATOM 0 H4' DG B 17 3.180 -8.910 26.556 1.00 0.17 H new ATOM 0 H3' DG B 17 4.662 -7.978 24.343 1.00 0.15 H new ATOM 0 H2' DG B 17 3.753 -5.773 24.360 1.00 0.15 H new ATOM 0 H2'' DG B 17 2.537 -6.590 23.398 1.00 0.15 H new ATOM 0 H1' DG B 17 1.052 -6.856 25.319 1.00 0.14 H new ATOM 0 H8 DG B 17 3.501 -4.027 26.171 1.00 0.18 H new ATOM 0 H1 DG B 17 -2.298 -2.326 24.202 1.00 0.16 H new ATOM 0 H21 DG B 17 -2.778 -5.778 23.880 1.00 0.16 H new ATOM 0 H22 DG B 17 -3.461 -4.158 23.702 1.00 0.16 H new ATOM 536 P DC B 18 3.737 -9.836 22.910 1.00 0.18 P ATOM 537 OP1 DC B 18 3.805 -11.247 23.355 1.00 0.26 O ATOM 538 OP2 DC B 18 4.983 -9.119 22.556 1.00 0.24 O ATOM 539 O5' DC B 18 2.737 -9.756 21.643 1.00 0.14 O ATOM 540 C5' DC B 18 1.492 -10.449 21.685 1.00 0.13 C ATOM 541 C4' DC B 18 0.403 -9.816 20.855 1.00 0.12 C ATOM 542 O4' DC B 18 0.404 -10.327 19.503 1.00 0.14 O ATOM 543 C3' DC B 18 -0.948 -10.181 21.482 1.00 0.12 C ATOM 544 O3' DC B 18 -1.526 -9.046 22.156 1.00 0.16 O ATOM 545 C2' DC B 18 -1.794 -10.735 20.358 1.00 0.12 C ATOM 546 C1' DC B 18 -0.945 -10.664 19.105 1.00 0.14 C ATOM 547 N1 DC B 18 -0.971 -11.933 18.363 1.00 0.20 N ATOM 548 C2 DC B 18 -1.253 -11.901 17.003 1.00 0.27 C ATOM 549 O2 DC B 18 -1.475 -10.831 16.439 1.00 0.30 O ATOM 550 N3 DC B 18 -1.272 -13.082 16.325 1.00 0.35 N ATOM 551 C4 DC B 18 -1.026 -14.239 16.957 1.00 0.35 C ATOM 552 N4 DC B 18 -1.053 -15.379 16.267 1.00 0.44 N ATOM 553 C5 DC B 18 -0.737 -14.262 18.358 1.00 0.30 C ATOM 554 C6 DC B 18 -0.723 -13.083 19.007 1.00 0.23 C ATOM 0 H5' DC B 18 1.156 -10.508 22.720 1.00 0.13 H new ATOM 0 H5'' DC B 18 1.647 -11.472 21.342 1.00 0.13 H new ATOM 0 H4' DC B 18 0.572 -8.739 20.830 1.00 0.12 H new ATOM 0 H3' DC B 18 -0.857 -10.934 22.264 1.00 0.12 H new ATOM 0 H2' DC B 18 -2.092 -11.762 20.567 1.00 0.12 H new ATOM 0 H2'' DC B 18 -2.710 -10.155 20.240 1.00 0.12 H new ATOM 0 H1' DC B 18 -1.344 -9.903 18.434 1.00 0.14 H new ATOM 0 H41 DC B 18 -0.867 -16.265 16.738 1.00 0.44 H new ATOM 0 H42 DC B 18 -1.259 -15.366 15.268 1.00 0.44 H new ATOM 0 H5 DC B 18 -0.538 -15.189 18.875 1.00 0.30 H new ATOM 0 H6 DC B 18 -0.508 -13.063 20.065 1.00 0.23 H new ATOM 566 P DG B 19 -3.063 -8.600 22.031 1.00 0.14 P ATOM 567 OP1 DG B 19 -3.343 -7.594 23.079 1.00 0.18 O ATOM 568 OP2 DG B 19 -3.902 -9.816 21.932 1.00 0.17 O ATOM 569 O5' DG B 19 -3.064 -7.867 20.606 1.00 0.11 O ATOM 570 C5' DG B 19 -2.575 -6.526 20.418 1.00 0.10 C ATOM 571 C4' DG B 19 -3.023 -6.044 19.102 1.00 0.11 C ATOM 572 O4' DG B 19 -2.496 -4.735 18.763 1.00 0.13 O ATOM 573 C3' DG B 19 -2.511 -7.020 18.071 1.00 0.11 C ATOM 574 O3' DG B 19 -3.582 -7.417 17.191 1.00 0.13 O ATOM 575 C2' DG B 19 -1.448 -6.255 17.374 1.00 0.11 C ATOM 576 C1' DG B 19 -1.921 -4.850 17.455 1.00 0.12 C ATOM 577 N9 DG B 19 -0.919 -3.787 17.163 1.00 0.13 N ATOM 578 C8 DG B 19 0.451 -3.747 17.159 1.00 0.14 C ATOM 579 N7 DG B 19 1.008 -2.620 16.845 1.00 0.15 N ATOM 580 C5 DG B 19 -0.103 -1.807 16.609 1.00 0.15 C ATOM 581 C6 DG B 19 -0.180 -0.440 16.224 1.00 0.17 C ATOM 582 O6 DG B 19 0.741 0.358 16.006 1.00 0.19 O ATOM 583 N1 DG B 19 -1.503 -0.030 16.097 1.00 0.19 N ATOM 584 C2 DG B 19 -2.614 -0.827 16.310 1.00 0.18 C ATOM 585 N2 DG B 19 -3.809 -0.264 16.141 1.00 0.21 N ATOM 586 N3 DG B 19 -2.542 -2.096 16.669 1.00 0.16 N ATOM 587 C4 DG B 19 -1.273 -2.521 16.801 1.00 0.14 C ATOM 0 H5' DG B 19 -1.487 -6.508 20.477 1.00 0.10 H new ATOM 0 H5'' DG B 19 -2.948 -5.873 21.207 1.00 0.10 H new ATOM 0 H4' DG B 19 -4.110 -5.966 19.126 1.00 0.11 H new ATOM 0 H3' DG B 19 -2.127 -7.951 18.488 1.00 0.11 H new ATOM 0 H2' DG B 19 -0.480 -6.381 17.859 1.00 0.11 H new ATOM 0 H2'' DG B 19 -1.332 -6.580 16.340 1.00 0.11 H new ATOM 0 H1' DG B 19 -2.636 -4.665 16.653 1.00 0.12 H new ATOM 0 H8 DG B 19 1.041 -4.617 17.407 1.00 0.14 H new ATOM 0 H1 DG B 19 -1.668 0.939 15.824 1.00 0.19 H new ATOM 0 H21 DG B 19 -4.656 -0.813 16.287 1.00 0.21 H new ATOM 0 H22 DG B 19 -3.877 0.716 15.866 1.00 0.21 H new ATOM 599 P DC B 20 -3.336 -8.033 15.714 1.00 0.14 P ATOM 600 OP1 DC B 20 -4.068 -9.316 15.623 1.00 0.22 O ATOM 601 OP2 DC B 20 -1.889 -7.987 15.406 1.00 0.15 O ATOM 602 O5' DC B 20 -4.087 -6.959 14.771 1.00 0.16 O ATOM 603 C5' DC B 20 -5.248 -6.272 15.253 1.00 0.17 C ATOM 604 C4' DC B 20 -5.484 -4.962 14.532 1.00 0.15 C ATOM 605 O4' DC B 20 -4.374 -4.101 14.773 1.00 0.14 O ATOM 606 C3' DC B 20 -5.567 -5.180 13.017 1.00 0.12 C ATOM 607 O3' DC B 20 -6.853 -4.766 12.523 1.00 0.13 O ATOM 608 C2' DC B 20 -4.439 -4.307 12.459 1.00 0.11 C ATOM 609 C1' DC B 20 -4.147 -3.348 13.592 1.00 0.12 C ATOM 610 N1 DC B 20 -2.750 -2.915 13.564 1.00 0.12 N ATOM 611 C2 DC B 20 -2.467 -1.593 13.260 1.00 0.13 C ATOM 612 O2 DC B 20 -3.375 -0.799 13.023 1.00 0.16 O ATOM 613 N3 DC B 20 -1.165 -1.208 13.233 1.00 0.15 N ATOM 614 C4 DC B 20 -0.182 -2.081 13.491 1.00 0.16 C ATOM 615 N4 DC B 20 1.084 -1.662 13.455 1.00 0.18 N ATOM 616 C5 DC B 20 -0.474 -3.449 13.810 1.00 0.16 C ATOM 617 C6 DC B 20 -1.771 -3.818 13.836 1.00 0.15 C ATOM 0 H5' DC B 20 -5.137 -6.081 16.320 1.00 0.17 H new ATOM 0 H5'' DC B 20 -6.122 -6.912 15.133 1.00 0.17 H new ATOM 0 H4' DC B 20 -6.418 -4.534 14.896 1.00 0.15 H new ATOM 0 H3' DC B 20 -5.459 -6.224 12.724 1.00 0.12 H new ATOM 0 H2' DC B 20 -3.563 -4.900 12.199 1.00 0.11 H new ATOM 0 H2'' DC B 20 -4.747 -3.780 11.556 1.00 0.11 H new ATOM 0 H1' DC B 20 -4.767 -2.454 13.526 1.00 0.12 H new ATOM 0 H41 DC B 20 1.843 -2.315 13.649 1.00 0.18 H new ATOM 0 H42 DC B 20 1.293 -0.689 13.233 1.00 0.18 H new ATOM 0 H5 DC B 20 0.315 -4.156 14.021 1.00 0.16 H new ATOM 0 H6 DC B 20 -2.034 -4.838 14.075 1.00 0.15 H new ATOM 629 P DC B 21 -7.170 -4.663 10.943 1.00 0.13 P ATOM 630 OP1 DC B 21 -8.591 -5.020 10.734 1.00 0.16 O ATOM 631 OP2 DC B 21 -6.112 -5.389 10.205 1.00 0.17 O ATOM 632 O5' DC B 21 -7.000 -3.086 10.645 1.00 0.14 O ATOM 633 C5' DC B 21 -7.375 -2.109 11.627 1.00 0.14 C ATOM 634 C4' DC B 21 -7.176 -0.693 11.127 1.00 0.14 C ATOM 635 O4' DC B 21 -5.804 -0.383 11.344 1.00 0.13 O ATOM 636 C3' DC B 21 -7.402 -0.676 9.622 1.00 0.13 C ATOM 637 O3' DC B 21 -8.317 0.369 9.256 1.00 0.16 O ATOM 638 C2' DC B 21 -6.025 -0.416 9.070 1.00 0.12 C ATOM 639 C1' DC B 21 -5.310 0.280 10.186 1.00 0.12 C ATOM 640 N1 DC B 21 -3.895 -0.040 10.091 1.00 0.12 N ATOM 641 C2 DC B 21 -2.963 0.947 9.824 1.00 0.15 C ATOM 642 O2 DC B 21 -3.311 2.114 9.663 1.00 0.16 O ATOM 643 N3 DC B 21 -1.654 0.573 9.745 1.00 0.17 N ATOM 644 C4 DC B 21 -1.291 -0.711 9.922 1.00 0.18 C ATOM 645 N4 DC B 21 -0.004 -1.044 9.839 1.00 0.21 N ATOM 646 C5 DC B 21 -2.266 -1.722 10.198 1.00 0.16 C ATOM 647 C6 DC B 21 -3.551 -1.335 10.272 1.00 0.13 C ATOM 0 H5' DC B 21 -6.785 -2.260 12.531 1.00 0.14 H new ATOM 0 H5'' DC B 21 -8.420 -2.253 11.900 1.00 0.14 H new ATOM 0 H4' DC B 21 -7.850 0.003 11.626 1.00 0.14 H new ATOM 0 H3' DC B 21 -7.843 -1.597 9.241 1.00 0.13 H new ATOM 0 H2' DC B 21 -5.525 -1.344 8.793 1.00 0.12 H new ATOM 0 H2'' DC B 21 -6.065 0.204 8.174 1.00 0.12 H new ATOM 0 H1' DC B 21 -5.449 1.361 10.183 1.00 0.12 H new ATOM 0 H41 DC B 21 0.281 -2.014 9.972 1.00 0.21 H new ATOM 0 H42 DC B 21 0.696 -0.329 9.643 1.00 0.21 H new ATOM 0 H5 DC B 21 -1.981 -2.754 10.341 1.00 0.16 H new ATOM 0 H6 DC B 21 -4.318 -2.067 10.478 1.00 0.13 H new ATOM 659 P DG B 22 -8.598 0.729 7.708 1.00 0.17 P ATOM 660 OP1 DG B 22 -9.921 1.389 7.619 1.00 0.23 O ATOM 661 OP2 DG B 22 -8.317 -0.471 6.889 1.00 0.20 O ATOM 662 O5' DG B 22 -7.464 1.830 7.397 1.00 0.17 O ATOM 663 C5' DG B 22 -7.389 3.027 8.177 1.00 0.14 C ATOM 664 C4' DG B 22 -6.467 4.065 7.547 1.00 0.13 C ATOM 665 O4' DG B 22 -5.079 3.728 7.800 1.00 0.13 O ATOM 666 C3' DG B 22 -6.662 4.099 6.035 1.00 0.14 C ATOM 667 O3' DG B 22 -6.721 5.448 5.550 1.00 0.17 O ATOM 668 C2' DG B 22 -5.460 3.365 5.529 1.00 0.14 C ATOM 669 C1' DG B 22 -4.392 3.683 6.541 1.00 0.12 C ATOM 670 N9 DG B 22 -3.391 2.615 6.584 1.00 0.11 N ATOM 671 C8 DG B 22 -3.583 1.304 6.832 1.00 0.13 C ATOM 672 N7 DG B 22 -2.545 0.537 6.840 1.00 0.14 N ATOM 673 C5 DG B 22 -1.519 1.449 6.563 1.00 0.12 C ATOM 674 C6 DG B 22 -0.122 1.237 6.434 1.00 0.14 C ATOM 675 O6 DG B 22 0.504 0.184 6.539 1.00 0.15 O ATOM 676 N1 DG B 22 0.550 2.419 6.154 1.00 0.15 N ATOM 677 C2 DG B 22 -0.043 3.658 6.012 1.00 0.16 C ATOM 678 N2 DG B 22 0.772 4.678 5.744 1.00 0.21 N ATOM 679 N3 DG B 22 -1.358 3.867 6.131 1.00 0.14 N ATOM 680 C4 DG B 22 -2.033 2.728 6.405 1.00 0.11 C ATOM 0 H5' DG B 22 -7.032 2.785 9.178 1.00 0.14 H new ATOM 0 H5'' DG B 22 -8.387 3.450 8.289 1.00 0.14 H new ATOM 0 H4' DG B 22 -6.711 5.033 7.986 1.00 0.13 H new ATOM 0 H3' DG B 22 -7.598 3.649 5.703 1.00 0.14 H new ATOM 0 H2' DG B 22 -5.644 2.293 5.465 1.00 0.14 H new ATOM 0 H2'' DG B 22 -5.178 3.700 4.531 1.00 0.14 H new ATOM 0 H1' DG B 22 -3.876 4.613 6.301 1.00 0.12 H new ATOM 0 H8 DG B 22 -4.571 0.909 7.018 1.00 0.13 H new ATOM 0 H1 DG B 22 1.563 2.368 6.044 1.00 0.15 H new ATOM 0 H21 DG B 22 0.392 5.618 5.628 1.00 0.21 H new ATOM 0 H22 DG B 22 1.776 4.519 5.655 1.00 0.21 H new ATOM 692 P DA B 23 -6.861 5.760 3.977 1.00 0.21 P ATOM 693 OP1 DA B 23 -7.355 7.147 3.821 1.00 0.28 O ATOM 694 OP2 DA B 23 -7.594 4.641 3.342 1.00 0.26 O ATOM 695 O5' DA B 23 -5.331 5.708 3.478 1.00 0.20 O ATOM 696 C5' DA B 23 -4.452 6.818 3.691 1.00 0.19 C ATOM 697 C4' DA B 23 -3.269 6.778 2.741 1.00 0.15 C ATOM 698 O4' DA B 23 -2.324 5.767 3.167 1.00 0.15 O ATOM 699 C3' DA B 23 -3.750 6.349 1.359 1.00 0.13 C ATOM 700 O3' DA B 23 -3.300 7.260 0.348 1.00 0.13 O ATOM 701 C2' DA B 23 -3.183 4.977 1.190 1.00 0.14 C ATOM 702 C1' DA B 23 -1.984 4.977 2.013 1.00 0.14 C ATOM 703 N9 DA B 23 -1.638 3.610 2.392 1.00 0.16 N ATOM 704 C8 DA B 23 -2.472 2.589 2.565 1.00 0.17 C ATOM 705 N7 DA B 23 -1.974 1.448 2.909 1.00 0.20 N ATOM 706 C5 DA B 23 -0.609 1.757 2.974 1.00 0.20 C ATOM 707 C6 DA B 23 0.524 0.998 3.287 1.00 0.23 C ATOM 708 N6 DA B 23 0.467 -0.295 3.609 1.00 0.26 N ATOM 709 N1 DA B 23 1.716 1.622 3.253 1.00 0.24 N ATOM 710 C2 DA B 23 1.790 2.916 2.927 1.00 0.23 C ATOM 711 N3 DA B 23 0.784 3.727 2.614 1.00 0.19 N ATOM 712 C4 DA B 23 -0.397 3.080 2.657 1.00 0.18 C ATOM 0 H5' DA B 23 -4.094 6.808 4.721 1.00 0.19 H new ATOM 0 H5'' DA B 23 -5.000 7.750 3.553 1.00 0.19 H new ATOM 0 H4' DA B 23 -2.810 7.767 2.727 1.00 0.15 H new ATOM 0 H3' DA B 23 -4.836 6.350 1.264 1.00 0.13 H new ATOM 0 H2' DA B 23 -3.889 4.213 1.516 1.00 0.14 H new ATOM 0 H2'' DA B 23 -2.948 4.770 0.146 1.00 0.14 H new ATOM 0 H1' DA B 23 -1.118 5.384 1.492 1.00 0.14 H new ATOM 0 H8 DA B 23 -3.536 2.710 2.422 1.00 0.17 H new ATOM 0 H61 DA B 23 1.323 -0.804 3.829 1.00 0.26 H new ATOM 0 H62 DA B 23 -0.433 -0.775 3.635 1.00 0.26 H new ATOM 0 H2 DA B 23 2.778 3.352 2.917 1.00 0.23 H new ATOM 724 P DG B 24 -3.767 7.122 -1.189 1.00 0.15 P ATOM 725 OP1 DG B 24 -4.451 8.374 -1.582 1.00 0.23 O ATOM 726 OP2 DG B 24 -4.452 5.820 -1.360 1.00 0.21 O ATOM 727 O5' DG B 24 -2.356 7.054 -1.960 1.00 0.14 O ATOM 728 C5' DG B 24 -1.311 7.977 -1.633 1.00 0.12 C ATOM 729 C4' DG B 24 0.053 7.361 -1.855 1.00 0.14 C ATOM 730 O4' DG B 24 0.195 6.244 -0.962 1.00 0.13 O ATOM 731 C3' DG B 24 0.137 6.817 -3.272 1.00 0.18 C ATOM 732 O3' DG B 24 1.128 7.516 -4.033 1.00 0.22 O ATOM 733 C2' DG B 24 0.510 5.371 -3.095 1.00 0.20 C ATOM 734 C1' DG B 24 0.948 5.240 -1.631 1.00 0.16 C ATOM 735 N9 DG B 24 0.574 3.918 -1.112 1.00 0.17 N ATOM 736 C8 DG B 24 -0.663 3.400 -0.932 1.00 0.17 C ATOM 737 N7 DG B 24 -0.749 2.202 -0.463 1.00 0.19 N ATOM 738 C5 DG B 24 0.599 1.864 -0.305 1.00 0.20 C ATOM 739 C6 DG B 24 1.183 0.666 0.176 1.00 0.24 C ATOM 740 O6 DG B 24 0.620 -0.354 0.568 1.00 0.27 O ATOM 741 N1 DG B 24 2.569 0.739 0.174 1.00 0.27 N ATOM 742 C2 DG B 24 3.310 1.829 -0.238 1.00 0.27 C ATOM 743 N2 DG B 24 4.635 1.707 -0.167 1.00 0.32 N ATOM 744 N3 DG B 24 2.768 2.962 -0.694 1.00 0.23 N ATOM 745 C4 DG B 24 1.417 2.913 -0.701 1.00 0.20 C ATOM 0 H5' DG B 24 -1.408 8.286 -0.592 1.00 0.12 H new ATOM 0 H5'' DG B 24 -1.411 8.875 -2.243 1.00 0.12 H new ATOM 0 H4' DG B 24 0.824 8.112 -1.686 1.00 0.14 H new ATOM 0 H3' DG B 24 -0.798 6.939 -3.819 1.00 0.18 H new ATOM 0 H2' DG B 24 -0.335 4.718 -3.312 1.00 0.20 H new ATOM 0 H2'' DG B 24 1.315 5.087 -3.773 1.00 0.20 H new ATOM 0 HO3' DG B 24 1.164 7.147 -4.940 1.00 0.22 H new ATOM 0 H1' DG B 24 2.024 5.349 -1.499 1.00 0.16 H new ATOM 0 H8 DG B 24 -1.548 3.970 -1.173 1.00 0.17 H new ATOM 0 H1 DG B 24 3.082 -0.079 0.504 1.00 0.27 H new ATOM 0 H21 DG B 24 5.235 2.479 -0.458 1.00 0.32 H new ATOM 0 H22 DG B 24 5.050 0.841 0.178 1.00 0.32 H new TER 758 DG B 24 HETATM 759 N3A GIQ A 25 -1.697 -1.878 20.471 1.00 0.11 N HETATM 760 C3A GIQ A 25 -0.735 -2.870 20.527 1.00 0.11 C HETATM 761 C1A GIQ A 25 -1.233 -3.881 21.334 1.00 0.11 C HETATM 762 N1A GIQ A 25 -2.514 -3.532 21.789 1.00 0.11 N HETATM 763 C GIQ A 25 -1.588 -0.642 19.702 1.00 0.13 C HETATM 764 C4A GIQ A 25 0.522 -2.955 19.935 1.00 0.13 C HETATM 765 C5A GIQ A 25 1.262 -4.090 20.177 1.00 0.13 C HETATM 766 C6A GIQ A 25 0.832 -5.107 20.967 1.00 0.12 C HETATM 767 C10 GIQ A 25 -0.422 -5.057 21.583 1.00 0.12 C HETATM 768 N6A GIQ A 25 1.703 -6.127 21.107 1.00 0.14 N HETATM 769 C7A GIQ A 25 1.353 -7.110 21.855 1.00 0.14 C HETATM 770 C8A GIQ A 25 0.132 -7.185 22.510 1.00 0.14 C HETATM 771 C9A GIQ A 25 -0.752 -6.153 22.365 1.00 0.12 C HETATM 772 N10 GIQ A 25 -3.900 -1.483 21.398 1.00 0.12 N HETATM 773 C2A GIQ A 25 -2.760 -2.337 21.247 1.00 0.11 C HETATM 0 H102 GIQ A 25 -4.695 -1.788 21.959 1.00 0.12 H new HETATM 0 H9A GIQ A 25 -1.719 -6.192 22.866 1.00 0.12 H new HETATM 0 H8A GIQ A 25 -0.117 -8.049 23.127 1.00 0.14 H new HETATM 0 H7A GIQ A 25 2.056 -7.933 21.983 1.00 0.14 H new HETATM 0 H5A GIQ A 25 2.243 -4.177 19.711 1.00 0.13 H new HETATM 0 H4A GIQ A 25 0.906 -2.153 19.304 1.00 0.13 H new HETATM 0 H3 GIQ A 25 -0.722 -0.076 20.045 1.00 0.13 H new HETATM 0 H2 GIQ A 25 -1.471 -0.880 18.645 1.00 0.13 H new HETATM 0 H1 GIQ A 25 -2.490 -0.046 19.841 1.00 0.13 H new