USER MOD reduce.3.24.130724 H: found=0, std=0, add=225, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 225 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Set 1.2: A 16 DT C7 :methyl 150:sc=-0.00519 (180deg=-0.00519) USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 180:sc= 0 USER MOD Single : A 11 DT C7 :methyl -30:sc= -1.1 (180deg=-3.07!) USER MOD Single : A 20 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 15.559 5.388 -0.911 1.00 1.36 O ATOM 2 C5' DT A 1 14.600 4.976 -1.889 1.00 0.91 C ATOM 3 C4' DT A 1 13.234 5.605 -1.627 1.00 0.80 C ATOM 4 O4' DT A 1 12.314 5.185 -2.623 1.00 0.74 O ATOM 5 C3' DT A 1 12.623 5.222 -0.295 1.00 0.75 C ATOM 6 O3' DT A 1 11.724 6.254 0.139 1.00 0.94 O ATOM 7 C2' DT A 1 11.834 3.948 -0.618 1.00 0.65 C ATOM 8 C1' DT A 1 11.544 4.081 -2.129 1.00 0.61 C ATOM 9 N1 DT A 1 11.874 2.863 -2.944 1.00 0.69 N ATOM 10 C2 DT A 1 12.426 3.043 -4.215 1.00 1.04 C ATOM 11 O2 DT A 1 12.638 4.148 -4.704 1.00 1.20 O ATOM 12 N3 DT A 1 12.708 1.894 -4.925 1.00 1.32 N ATOM 13 C4 DT A 1 12.496 0.598 -4.504 1.00 1.25 C ATOM 14 O4 DT A 1 12.789 -0.349 -5.228 1.00 1.57 O ATOM 15 C5 DT A 1 11.920 0.495 -3.184 1.00 0.93 C ATOM 16 C7 DT A 1 11.628 -0.885 -2.596 1.00 1.06 C ATOM 17 C6 DT A 1 11.631 1.593 -2.460 1.00 0.74 C ATOM 0 H5' DT A 1 14.510 3.890 -1.878 1.00 0.91 H new ATOM 0 H5'' DT A 1 14.948 5.257 -2.883 1.00 0.91 H new ATOM 0 H4' DT A 1 13.409 6.681 -1.634 1.00 0.80 H new ATOM 0 H3' DT A 1 13.362 5.081 0.494 1.00 0.75 H new ATOM 0 H2' DT A 1 12.412 3.051 -0.397 1.00 0.65 H new ATOM 0 H2'' DT A 1 10.914 3.886 -0.036 1.00 0.65 H new ATOM 0 HO5' DT A 1 16.423 4.968 -1.103 1.00 1.36 H new ATOM 0 H1' DT A 1 10.469 4.226 -2.233 1.00 0.61 H new ATOM 0 H3 DT A 1 13.113 2.015 -5.853 1.00 1.32 H new ATOM 0 H71 DT A 1 11.718 -0.844 -1.510 1.00 1.06 H new ATOM 0 H72 DT A 1 10.616 -1.189 -2.865 1.00 1.06 H new ATOM 0 H73 DT A 1 12.341 -1.608 -2.992 1.00 1.06 H new ATOM 0 H6 DT A 1 11.199 1.477 -1.477 1.00 0.74 H new ATOM 31 P DA A 2 12.193 7.367 1.207 1.00 1.41 P ATOM 32 OP1 DA A 2 12.869 8.461 0.475 1.00 1.96 O ATOM 33 OP2 DA A 2 12.895 6.678 2.313 1.00 1.86 O ATOM 34 O5' DA A 2 10.782 7.923 1.769 1.00 1.27 O ATOM 35 C5' DA A 2 10.049 8.930 1.055 1.00 1.14 C ATOM 36 C4' DA A 2 8.691 8.422 0.561 1.00 0.83 C ATOM 37 O4' DA A 2 8.864 7.247 -0.246 1.00 0.74 O ATOM 38 C3' DA A 2 7.695 8.046 1.678 1.00 0.73 C ATOM 39 O3' DA A 2 6.454 8.744 1.459 1.00 0.75 O ATOM 40 C2' DA A 2 7.493 6.548 1.492 1.00 0.65 C ATOM 41 C1' DA A 2 7.735 6.427 0.004 1.00 0.59 C ATOM 42 N9 DA A 2 8.007 5.059 -0.474 1.00 0.54 N ATOM 43 C8 DA A 2 8.142 3.905 0.252 1.00 0.52 C ATOM 44 N7 DA A 2 8.251 2.834 -0.479 1.00 0.55 N ATOM 45 C5 DA A 2 8.192 3.306 -1.782 1.00 0.58 C ATOM 46 C6 DA A 2 8.253 2.663 -3.029 1.00 0.67 C ATOM 47 N6 DA A 2 8.384 1.340 -3.166 1.00 0.74 N ATOM 48 N1 DA A 2 8.170 3.437 -4.124 1.00 0.74 N ATOM 49 C2 DA A 2 8.035 4.753 -3.977 1.00 0.74 C ATOM 50 N3 DA A 2 7.961 5.465 -2.867 1.00 0.68 N ATOM 51 C4 DA A 2 8.049 4.664 -1.789 1.00 0.58 C ATOM 0 H5' DA A 2 10.639 9.270 0.204 1.00 1.14 H new ATOM 0 H5'' DA A 2 9.897 9.793 1.703 1.00 1.14 H new ATOM 0 H4' DA A 2 8.275 9.262 0.004 1.00 0.83 H new ATOM 0 H3' DA A 2 8.044 8.302 2.678 1.00 0.73 H new ATOM 0 H2' DA A 2 8.198 5.958 2.077 1.00 0.65 H new ATOM 0 H2'' DA A 2 6.492 6.225 1.778 1.00 0.65 H new ATOM 0 H1' DA A 2 6.831 6.724 -0.528 1.00 0.59 H new ATOM 0 H8 DA A 2 8.157 3.886 1.332 1.00 0.52 H new ATOM 0 H61 DA A 2 8.423 0.925 -4.097 1.00 0.74 H new ATOM 0 H62 DA A 2 8.445 0.745 -2.340 1.00 0.74 H new ATOM 0 H2 DA A 2 7.978 5.319 -4.895 1.00 0.74 H new ATOM 63 P DG A 3 5.023 8.130 1.912 1.00 0.66 P ATOM 64 OP1 DG A 3 5.175 7.499 3.247 1.00 0.75 O ATOM 65 OP2 DG A 3 4.480 7.342 0.778 1.00 0.82 O ATOM 66 O5' DG A 3 4.127 9.456 2.084 1.00 0.69 O ATOM 67 C5' DG A 3 2.700 9.376 2.159 1.00 0.60 C ATOM 68 C4' DG A 3 2.044 9.669 0.812 1.00 0.51 C ATOM 69 O4' DG A 3 2.370 8.633 -0.130 1.00 0.52 O ATOM 70 C3' DG A 3 0.518 9.740 0.877 1.00 0.47 C ATOM 71 O3' DG A 3 0.050 10.768 -0.009 1.00 0.50 O ATOM 72 C2' DG A 3 0.086 8.379 0.363 1.00 0.51 C ATOM 73 C1' DG A 3 1.150 8.143 -0.688 1.00 0.51 C ATOM 74 N9 DG A 3 1.332 6.728 -1.057 1.00 0.53 N ATOM 75 C8 DG A 3 1.195 6.147 -2.290 1.00 0.58 C ATOM 76 N7 DG A 3 1.357 4.855 -2.286 1.00 0.59 N ATOM 77 C5 DG A 3 1.625 4.555 -0.955 1.00 0.53 C ATOM 78 C6 DG A 3 1.889 3.304 -0.342 1.00 0.53 C ATOM 79 O6 DG A 3 1.944 2.199 -0.867 1.00 0.57 O ATOM 80 N1 DG A 3 2.109 3.438 1.019 1.00 0.52 N ATOM 81 C2 DG A 3 2.083 4.625 1.709 1.00 0.52 C ATOM 82 N2 DG A 3 2.328 4.545 3.015 1.00 0.57 N ATOM 83 N3 DG A 3 1.835 5.806 1.138 1.00 0.50 N ATOM 84 C4 DG A 3 1.615 5.695 -0.195 1.00 0.50 C ATOM 0 H5' DG A 3 2.335 10.084 2.903 1.00 0.60 H new ATOM 0 H5'' DG A 3 2.409 8.381 2.496 1.00 0.60 H new ATOM 0 H4' DG A 3 2.428 10.643 0.509 1.00 0.51 H new ATOM 0 H3' DG A 3 0.132 9.966 1.871 1.00 0.47 H new ATOM 0 H2' DG A 3 0.095 7.617 1.143 1.00 0.51 H new ATOM 0 H2'' DG A 3 -0.919 8.393 -0.058 1.00 0.51 H new ATOM 0 H1' DG A 3 0.848 8.650 -1.605 1.00 0.51 H new ATOM 0 H8 DG A 3 0.973 6.710 -3.185 1.00 0.58 H new ATOM 0 H1 DG A 3 2.306 2.589 1.550 1.00 0.52 H new ATOM 0 H21 DG A 3 2.324 5.389 3.587 1.00 0.57 H new ATOM 0 H22 DG A 3 2.520 3.639 3.443 1.00 0.57 H new ATOM 96 P DG A 4 -1.518 11.112 -0.111 1.00 0.58 P ATOM 97 OP1 DG A 4 -1.664 12.412 -0.803 1.00 0.88 O ATOM 98 OP2 DG A 4 -2.122 10.915 1.227 1.00 0.69 O ATOM 99 O5' DG A 4 -2.069 9.957 -1.088 1.00 0.75 O ATOM 100 C5' DG A 4 -1.743 9.952 -2.484 1.00 0.85 C ATOM 101 C4' DG A 4 -2.482 8.835 -3.213 1.00 0.87 C ATOM 102 O4' DG A 4 -1.925 7.575 -2.860 1.00 0.80 O ATOM 103 C3' DG A 4 -3.963 8.769 -2.864 1.00 0.87 C ATOM 104 O3' DG A 4 -4.724 9.347 -3.926 1.00 1.05 O ATOM 105 C2' DG A 4 -4.279 7.273 -2.737 1.00 0.79 C ATOM 106 C1' DG A 4 -2.942 6.589 -3.011 1.00 0.78 C ATOM 107 N9 DG A 4 -2.629 5.488 -2.074 1.00 0.70 N ATOM 108 C8 DG A 4 -2.485 5.535 -0.710 1.00 0.65 C ATOM 109 N7 DG A 4 -2.176 4.387 -0.170 1.00 0.62 N ATOM 110 C5 DG A 4 -2.116 3.515 -1.255 1.00 0.63 C ATOM 111 C6 DG A 4 -1.828 2.121 -1.295 1.00 0.64 C ATOM 112 O6 DG A 4 -1.553 1.371 -0.361 1.00 0.66 O ATOM 113 N1 DG A 4 -1.882 1.630 -2.590 1.00 0.68 N ATOM 114 C2 DG A 4 -2.172 2.379 -3.707 1.00 0.72 C ATOM 115 N2 DG A 4 -2.182 1.735 -4.867 1.00 0.78 N ATOM 116 N3 DG A 4 -2.438 3.682 -3.674 1.00 0.73 N ATOM 117 C4 DG A 4 -2.394 4.183 -2.421 1.00 0.68 C ATOM 0 H5' DG A 4 -0.668 9.824 -2.610 1.00 0.85 H new ATOM 0 H5'' DG A 4 -2.003 10.914 -2.926 1.00 0.85 H new ATOM 0 H4' DG A 4 -2.375 9.054 -4.275 1.00 0.87 H new ATOM 0 H3' DG A 4 -4.203 9.311 -1.949 1.00 0.87 H new ATOM 0 H2' DG A 4 -4.657 7.028 -1.744 1.00 0.79 H new ATOM 0 H2'' DG A 4 -5.040 6.963 -3.453 1.00 0.79 H new ATOM 0 H1' DG A 4 -2.996 6.158 -4.011 1.00 0.78 H new ATOM 0 H8 DG A 4 -2.615 6.440 -0.135 1.00 0.65 H new ATOM 0 H1 DG A 4 -1.692 0.637 -2.725 1.00 0.68 H new ATOM 0 H21 DG A 4 -2.391 2.239 -5.729 1.00 0.78 H new ATOM 0 H22 DG A 4 -1.981 0.735 -4.897 1.00 0.78 H new ATOM 129 P DG A 5 -5.781 10.519 -3.607 1.00 1.18 P ATOM 130 OP1 DG A 5 -6.103 11.213 -4.873 1.00 1.44 O ATOM 131 OP2 DG A 5 -5.283 11.291 -2.448 1.00 1.22 O ATOM 132 O5' DG A 5 -7.080 9.693 -3.140 1.00 1.08 O ATOM 133 C5' DG A 5 -7.839 8.948 -4.093 1.00 1.14 C ATOM 134 C4' DG A 5 -8.928 8.114 -3.427 1.00 1.02 C ATOM 135 O4' DG A 5 -9.593 7.330 -4.416 1.00 1.05 O ATOM 136 C3' DG A 5 -8.419 7.130 -2.382 1.00 0.88 C ATOM 137 O3' DG A 5 -9.479 6.806 -1.471 1.00 0.87 O ATOM 138 C2' DG A 5 -8.075 5.908 -3.220 1.00 0.84 C ATOM 139 C1' DG A 5 -9.156 5.965 -4.305 1.00 0.91 C ATOM 140 N9 DG A 5 -8.706 5.536 -5.646 1.00 1.02 N ATOM 141 C8 DG A 5 -7.630 5.970 -6.376 1.00 1.19 C ATOM 142 N7 DG A 5 -7.525 5.414 -7.550 1.00 1.30 N ATOM 143 C5 DG A 5 -8.611 4.546 -7.606 1.00 1.21 C ATOM 144 C6 DG A 5 -9.023 3.666 -8.644 1.00 1.32 C ATOM 145 O6 DG A 5 -8.496 3.474 -9.736 1.00 1.51 O ATOM 146 N1 DG A 5 -10.170 2.972 -8.295 1.00 1.24 N ATOM 147 C2 DG A 5 -10.840 3.103 -7.100 1.00 1.09 C ATOM 148 N2 DG A 5 -11.924 2.353 -6.950 1.00 1.12 N ATOM 149 N3 DG A 5 -10.457 3.924 -6.122 1.00 0.99 N ATOM 150 C4 DG A 5 -9.338 4.614 -6.444 1.00 1.04 C ATOM 0 H5' DG A 5 -7.173 8.293 -4.655 1.00 1.14 H new ATOM 0 H5'' DG A 5 -8.293 9.632 -4.810 1.00 1.14 H new ATOM 0 H4' DG A 5 -9.577 8.837 -2.932 1.00 1.02 H new ATOM 0 H3' DG A 5 -7.585 7.507 -1.789 1.00 0.88 H new ATOM 0 H2' DG A 5 -7.070 5.968 -3.639 1.00 0.84 H new ATOM 0 H2'' DG A 5 -8.124 4.986 -2.640 1.00 0.84 H new ATOM 0 H1' DG A 5 -9.940 5.273 -3.998 1.00 0.91 H new ATOM 0 H8 DG A 5 -6.931 6.708 -6.010 1.00 1.19 H new ATOM 0 H1 DG A 5 -10.547 2.313 -8.976 1.00 1.24 H new ATOM 0 H21 DG A 5 -12.464 2.405 -6.086 1.00 1.12 H new ATOM 0 H22 DG A 5 -12.217 1.725 -7.698 1.00 1.12 H new ATOM 162 P DT A 6 -10.033 7.891 -0.410 1.00 0.99 P ATOM 163 OP1 DT A 6 -10.169 9.194 -1.099 1.00 1.19 O ATOM 164 OP2 DT A 6 -9.219 7.790 0.824 1.00 1.10 O ATOM 165 O5' DT A 6 -11.516 7.339 -0.087 1.00 0.91 O ATOM 166 C5' DT A 6 -11.886 6.908 1.231 1.00 0.91 C ATOM 167 C4' DT A 6 -11.624 5.414 1.446 1.00 0.86 C ATOM 168 O4' DT A 6 -12.214 4.663 0.387 1.00 0.91 O ATOM 169 C3' DT A 6 -10.136 5.029 1.485 1.00 0.78 C ATOM 170 O3' DT A 6 -9.820 4.423 2.751 1.00 0.84 O ATOM 171 C2' DT A 6 -9.980 3.998 0.365 1.00 0.74 C ATOM 172 C1' DT A 6 -11.411 3.506 0.196 1.00 0.77 C ATOM 173 N1 DT A 6 -11.716 2.915 -1.141 1.00 0.78 N ATOM 174 C2 DT A 6 -12.995 3.090 -1.664 1.00 0.89 C ATOM 175 O2 DT A 6 -13.880 3.699 -1.073 1.00 0.99 O ATOM 176 N3 DT A 6 -13.234 2.511 -2.892 1.00 0.98 N ATOM 177 C4 DT A 6 -12.336 1.779 -3.641 1.00 1.00 C ATOM 178 O4 DT A 6 -12.674 1.299 -4.721 1.00 1.16 O ATOM 179 C5 DT A 6 -11.034 1.641 -3.030 1.00 0.91 C ATOM 180 C7 DT A 6 -9.944 0.847 -3.748 1.00 1.05 C ATOM 181 C6 DT A 6 -10.764 2.196 -1.832 1.00 0.81 C ATOM 0 H5' DT A 6 -12.943 7.117 1.397 1.00 0.91 H new ATOM 0 H5'' DT A 6 -11.328 7.483 1.970 1.00 0.91 H new ATOM 0 H4' DT A 6 -12.059 5.189 2.420 1.00 0.86 H new ATOM 0 H3' DT A 6 -9.478 5.889 1.360 1.00 0.78 H new ATOM 0 H2' DT A 6 -9.590 4.444 -0.550 1.00 0.74 H new ATOM 0 H2'' DT A 6 -9.300 3.192 0.642 1.00 0.74 H new ATOM 0 H1' DT A 6 -11.597 2.698 0.904 1.00 0.77 H new ATOM 0 H3 DT A 6 -14.167 2.636 -3.286 1.00 0.98 H new ATOM 0 H71 DT A 6 -8.966 1.251 -3.485 1.00 1.05 H new ATOM 0 H72 DT A 6 -9.997 -0.199 -3.446 1.00 1.05 H new ATOM 0 H73 DT A 6 -10.090 0.922 -4.826 1.00 1.05 H new ATOM 0 H6 DT A 6 -9.780 2.075 -1.404 1.00 0.81 H new ATOM 194 P DA A 7 -10.006 5.228 4.139 1.00 0.83 P ATOM 195 OP1 DA A 7 -11.264 4.767 4.771 1.00 1.22 O ATOM 196 OP2 DA A 7 -9.804 6.671 3.871 1.00 0.98 O ATOM 197 O5' DA A 7 -8.768 4.700 5.033 1.00 0.93 O ATOM 198 C5' DA A 7 -7.622 5.534 5.256 1.00 1.22 C ATOM 199 C4' DA A 7 -6.313 4.824 4.904 1.00 0.88 C ATOM 200 O4' DA A 7 -6.427 4.229 3.602 1.00 0.80 O ATOM 201 C3' DA A 7 -5.098 5.763 4.867 1.00 0.76 C ATOM 202 O3' DA A 7 -3.976 5.154 5.515 1.00 0.73 O ATOM 203 C2' DA A 7 -4.804 5.918 3.390 1.00 0.75 C ATOM 204 C1' DA A 7 -5.264 4.572 2.855 1.00 0.57 C ATOM 205 N9 DA A 7 -5.619 4.604 1.426 1.00 0.56 N ATOM 206 C8 DA A 7 -6.205 5.622 0.731 1.00 0.65 C ATOM 207 N7 DA A 7 -6.310 5.404 -0.546 1.00 0.69 N ATOM 208 C5 DA A 7 -5.754 4.142 -0.713 1.00 0.59 C ATOM 209 C6 DA A 7 -5.563 3.338 -1.844 1.00 0.60 C ATOM 210 N6 DA A 7 -5.919 3.715 -3.071 1.00 0.73 N ATOM 211 N1 DA A 7 -4.986 2.139 -1.658 1.00 0.55 N ATOM 212 C2 DA A 7 -4.629 1.780 -0.429 1.00 0.54 C ATOM 213 N3 DA A 7 -4.752 2.447 0.709 1.00 0.54 N ATOM 214 C4 DA A 7 -5.334 3.642 0.487 1.00 0.53 C ATOM 0 H5' DA A 7 -7.597 5.842 6.301 1.00 1.22 H new ATOM 0 H5'' DA A 7 -7.713 6.441 4.659 1.00 1.22 H new ATOM 0 H4' DA A 7 -6.152 4.084 5.688 1.00 0.88 H new ATOM 0 H3' DA A 7 -5.287 6.710 5.373 1.00 0.76 H new ATOM 0 H2' DA A 7 -5.354 6.747 2.946 1.00 0.75 H new ATOM 0 H2'' DA A 7 -3.746 6.098 3.198 1.00 0.75 H new ATOM 0 H1' DA A 7 -4.450 3.854 2.956 1.00 0.57 H new ATOM 0 H8 DA A 7 -6.552 6.530 1.202 1.00 0.65 H new ATOM 0 H61 DA A 7 -5.758 3.092 -3.863 1.00 0.73 H new ATOM 0 H62 DA A 7 -6.352 4.626 -3.219 1.00 0.73 H new ATOM 0 H2 DA A 7 -4.173 0.804 -0.346 1.00 0.54 H new ATOM 226 P DG A 8 -2.552 5.914 5.560 1.00 0.94 P ATOM 227 OP1 DG A 8 -2.690 7.130 6.391 1.00 1.08 O ATOM 228 OP2 DG A 8 -2.028 6.021 4.177 1.00 1.09 O ATOM 229 O5' DG A 8 -1.621 4.871 6.355 1.00 1.11 O ATOM 230 C5' DG A 8 -1.700 4.744 7.779 1.00 0.93 C ATOM 231 C4' DG A 8 -0.674 3.743 8.300 1.00 0.76 C ATOM 232 O4' DG A 8 -0.965 2.447 7.766 1.00 0.81 O ATOM 233 C3' DG A 8 0.772 4.084 7.915 1.00 0.61 C ATOM 234 O3' DG A 8 1.623 3.961 9.065 1.00 0.67 O ATOM 235 C2' DG A 8 1.137 3.042 6.874 1.00 0.52 C ATOM 236 C1' DG A 8 0.237 1.882 7.254 1.00 0.58 C ATOM 237 N9 DG A 8 -0.125 0.984 6.135 1.00 0.60 N ATOM 238 C8 DG A 8 -0.048 -0.381 6.085 1.00 0.68 C ATOM 239 N7 DG A 8 -0.437 -0.894 4.950 1.00 0.69 N ATOM 240 C5 DG A 8 -0.799 0.210 4.188 1.00 0.61 C ATOM 241 C6 DG A 8 -1.302 0.273 2.858 1.00 0.60 C ATOM 242 O6 DG A 8 -1.518 -0.654 2.078 1.00 0.67 O ATOM 243 N1 DG A 8 -1.542 1.586 2.470 1.00 0.57 N ATOM 244 C2 DG A 8 -1.323 2.693 3.256 1.00 0.55 C ATOM 245 N2 DG A 8 -1.606 3.867 2.704 1.00 0.59 N ATOM 246 N3 DG A 8 -0.851 2.638 4.502 1.00 0.54 N ATOM 247 C4 DG A 8 -0.613 1.367 4.903 1.00 0.56 C ATOM 0 H5' DG A 8 -2.702 4.423 8.063 1.00 0.93 H new ATOM 0 H5'' DG A 8 -1.533 5.716 8.243 1.00 0.93 H new ATOM 0 H4' DG A 8 -0.749 3.773 9.387 1.00 0.76 H new ATOM 0 H3' DG A 8 0.884 5.102 7.541 1.00 0.61 H new ATOM 0 H2' DG A 8 0.943 3.393 5.861 1.00 0.52 H new ATOM 0 H2'' DG A 8 2.192 2.771 6.921 1.00 0.52 H new ATOM 0 H1' DG A 8 0.785 1.269 7.969 1.00 0.58 H new ATOM 0 H8 DG A 8 0.304 -0.981 6.912 1.00 0.68 H new ATOM 0 H1 DG A 8 -1.908 1.740 1.531 1.00 0.57 H new ATOM 0 H21 DG A 8 -1.466 4.727 3.234 1.00 0.59 H new ATOM 0 H22 DG A 8 -1.964 3.909 1.750 1.00 0.59 H new ATOM 259 P DG A 9 3.182 4.385 9.001 1.00 0.61 P ATOM 260 OP1 DG A 9 3.560 4.970 10.307 1.00 0.88 O ATOM 261 OP2 DG A 9 3.402 5.159 7.756 1.00 0.70 O ATOM 262 O5' DG A 9 3.928 2.964 8.846 1.00 0.70 O ATOM 263 C5' DG A 9 3.766 1.928 9.827 1.00 0.79 C ATOM 264 C4' DG A 9 4.179 0.566 9.265 1.00 0.70 C ATOM 265 O4' DG A 9 3.457 0.326 8.054 1.00 0.63 O ATOM 266 C3' DG A 9 5.670 0.451 8.932 1.00 0.65 C ATOM 267 O3' DG A 9 6.140 -0.866 9.275 1.00 0.77 O ATOM 268 C2' DG A 9 5.703 0.648 7.432 1.00 0.52 C ATOM 269 C1' DG A 9 4.393 -0.001 7.033 1.00 0.48 C ATOM 270 N9 DG A 9 3.853 0.487 5.755 1.00 0.41 N ATOM 271 C8 DG A 9 3.787 1.775 5.299 1.00 0.42 C ATOM 272 N7 DG A 9 3.250 1.894 4.115 1.00 0.48 N ATOM 273 C5 DG A 9 2.939 0.582 3.764 1.00 0.47 C ATOM 274 C6 DG A 9 2.337 0.070 2.585 1.00 0.56 C ATOM 275 O6 DG A 9 1.951 0.684 1.593 1.00 0.65 O ATOM 276 N1 DG A 9 2.210 -1.308 2.638 1.00 0.56 N ATOM 277 C2 DG A 9 2.609 -2.100 3.689 1.00 0.52 C ATOM 278 N2 DG A 9 2.408 -3.406 3.556 1.00 0.59 N ATOM 279 N3 DG A 9 3.171 -1.627 4.797 1.00 0.47 N ATOM 280 C4 DG A 9 3.306 -0.283 4.766 1.00 0.42 C ATOM 0 H5' DG A 9 2.726 1.890 10.152 1.00 0.79 H new ATOM 0 H5'' DG A 9 4.367 2.159 10.707 1.00 0.79 H new ATOM 0 H4' DG A 9 3.956 -0.160 10.047 1.00 0.70 H new ATOM 0 H3' DG A 9 6.297 1.163 9.469 1.00 0.65 H new ATOM 0 H2' DG A 9 5.744 1.701 7.154 1.00 0.52 H new ATOM 0 H2'' DG A 9 6.563 0.163 6.970 1.00 0.52 H new ATOM 0 H1' DG A 9 4.566 -1.070 6.912 1.00 0.48 H new ATOM 0 H8 DG A 9 4.147 2.619 5.868 1.00 0.42 H new ATOM 0 H1 DG A 9 1.787 -1.772 1.834 1.00 0.56 H new ATOM 0 H21 DG A 9 2.684 -4.043 4.303 1.00 0.59 H new ATOM 0 H22 DG A 9 1.978 -3.772 2.707 1.00 0.59 H new ATOM 292 P DG A 10 7.708 -1.250 9.172 1.00 0.88 P ATOM 293 OP1 DG A 10 7.982 -2.354 10.119 1.00 1.10 O ATOM 294 OP2 DG A 10 8.497 0.003 9.252 1.00 0.96 O ATOM 295 O5' DG A 10 7.841 -1.835 7.672 1.00 0.84 O ATOM 296 C5' DG A 10 7.239 -3.089 7.317 1.00 0.88 C ATOM 297 C4' DG A 10 7.410 -3.403 5.827 1.00 0.74 C ATOM 298 O4' DG A 10 6.994 -2.273 5.057 1.00 0.64 O ATOM 299 C3' DG A 10 8.848 -3.701 5.399 1.00 0.76 C ATOM 300 O3' DG A 10 8.856 -4.508 4.203 1.00 0.77 O ATOM 301 C2' DG A 10 9.367 -2.318 5.064 1.00 0.72 C ATOM 302 C1' DG A 10 8.139 -1.734 4.380 1.00 0.63 C ATOM 303 N9 DG A 10 8.023 -0.260 4.419 1.00 0.58 N ATOM 304 C8 DG A 10 8.474 0.629 5.360 1.00 0.62 C ATOM 305 N7 DG A 10 8.169 1.873 5.101 1.00 0.61 N ATOM 306 C5 DG A 10 7.466 1.800 3.902 1.00 0.53 C ATOM 307 C6 DG A 10 6.876 2.834 3.120 1.00 0.54 C ATOM 308 O6 DG A 10 6.865 4.045 3.331 1.00 0.67 O ATOM 309 N1 DG A 10 6.263 2.324 1.983 1.00 0.50 N ATOM 310 C2 DG A 10 6.224 0.991 1.640 1.00 0.49 C ATOM 311 N2 DG A 10 5.596 0.685 0.511 1.00 0.54 N ATOM 312 N3 DG A 10 6.775 0.025 2.368 1.00 0.51 N ATOM 313 C4 DG A 10 7.375 0.500 3.480 1.00 0.51 C ATOM 0 H5' DG A 10 6.178 -3.065 7.563 1.00 0.88 H new ATOM 0 H5'' DG A 10 7.686 -3.887 7.910 1.00 0.88 H new ATOM 0 H4' DG A 10 6.810 -4.297 5.655 1.00 0.74 H new ATOM 0 H3' DG A 10 9.426 -4.237 6.152 1.00 0.76 H new ATOM 0 H2' DG A 10 9.657 -1.755 5.951 1.00 0.72 H new ATOM 0 H2'' DG A 10 10.236 -2.347 4.407 1.00 0.72 H new ATOM 0 H1' DG A 10 8.216 -1.998 3.325 1.00 0.63 H new ATOM 0 H8 DG A 10 9.031 0.329 6.235 1.00 0.62 H new ATOM 0 H1 DG A 10 5.808 2.986 1.355 1.00 0.50 H new ATOM 0 H21 DG A 10 5.536 -0.287 0.208 1.00 0.54 H new ATOM 0 H22 DG A 10 5.173 1.422 -0.053 1.00 0.54 H new ATOM 325 P DT A 11 8.436 -6.069 4.210 1.00 0.87 P ATOM 326 OP1 DT A 11 7.138 -6.201 4.912 1.00 1.07 O ATOM 327 OP2 DT A 11 9.601 -6.860 4.665 1.00 1.06 O ATOM 328 O5' DT A 11 8.201 -6.369 2.641 1.00 0.89 O ATOM 329 C5' DT A 11 9.280 -6.260 1.699 1.00 0.84 C ATOM 330 C4' DT A 11 8.831 -5.591 0.398 1.00 0.81 C ATOM 331 O4' DT A 11 8.542 -4.204 0.639 1.00 0.82 O ATOM 332 C3' DT A 11 9.876 -5.626 -0.729 1.00 0.78 C ATOM 333 O3' DT A 11 9.206 -5.876 -1.973 1.00 0.86 O ATOM 334 C2' DT A 11 10.437 -4.213 -0.730 1.00 0.67 C ATOM 335 C1' DT A 11 9.178 -3.446 -0.389 1.00 0.71 C ATOM 336 N1 DT A 11 9.399 -2.073 0.108 1.00 0.65 N ATOM 337 C2 DT A 11 8.789 -1.037 -0.583 1.00 0.66 C ATOM 338 O2 DT A 11 8.146 -1.209 -1.616 1.00 0.68 O ATOM 339 N3 DT A 11 8.987 0.219 -0.075 1.00 0.69 N ATOM 340 C4 DT A 11 9.736 0.547 1.036 1.00 0.69 C ATOM 341 O4 DT A 11 9.837 1.714 1.399 1.00 0.76 O ATOM 342 C5 DT A 11 10.346 -0.583 1.690 1.00 0.66 C ATOM 343 C7 DT A 11 11.238 -0.348 2.905 1.00 0.70 C ATOM 344 C6 DT A 11 10.162 -1.835 1.224 1.00 0.65 C ATOM 0 H5' DT A 11 9.674 -7.253 1.481 1.00 0.84 H new ATOM 0 H5'' DT A 11 10.093 -5.685 2.142 1.00 0.84 H new ATOM 0 H4' DT A 11 7.959 -6.161 0.077 1.00 0.81 H new ATOM 0 H3' DT A 11 10.641 -6.391 -0.597 1.00 0.78 H new ATOM 0 H2' DT A 11 11.225 -4.075 0.010 1.00 0.67 H new ATOM 0 H2'' DT A 11 10.853 -3.928 -1.696 1.00 0.67 H new ATOM 0 H1' DT A 11 8.591 -3.327 -1.300 1.00 0.71 H new ATOM 0 H3 DT A 11 8.535 0.990 -0.568 1.00 0.69 H new ATOM 0 H71 DT A 11 11.719 0.626 2.820 1.00 0.70 H new ATOM 0 H72 DT A 11 10.633 -0.377 3.811 1.00 0.70 H new ATOM 0 H73 DT A 11 12.000 -1.126 2.953 1.00 0.70 H new ATOM 0 H6 DT A 11 10.623 -2.665 1.738 1.00 0.65 H new ATOM 357 P DA A 12 10.028 -6.086 -3.344 1.00 0.97 P ATOM 358 OP1 DA A 12 10.450 -7.503 -3.415 1.00 1.14 O ATOM 359 OP2 DA A 12 11.041 -5.011 -3.457 1.00 1.15 O ATOM 360 O5' DA A 12 8.901 -5.836 -4.473 1.00 0.94 O ATOM 361 C5' DA A 12 8.187 -4.591 -4.561 1.00 0.90 C ATOM 362 C4' DA A 12 6.675 -4.816 -4.520 1.00 0.82 C ATOM 363 O4' DA A 12 6.298 -5.267 -3.217 1.00 0.75 O ATOM 364 C3' DA A 12 5.828 -3.577 -4.808 1.00 0.86 C ATOM 365 O3' DA A 12 5.578 -3.485 -6.222 1.00 1.00 O ATOM 366 C2' DA A 12 4.540 -3.886 -4.062 1.00 0.77 C ATOM 367 C1' DA A 12 5.049 -4.665 -2.850 1.00 0.67 C ATOM 368 N9 DA A 12 5.288 -3.856 -1.633 1.00 0.65 N ATOM 369 C8 DA A 12 5.379 -2.488 -1.485 1.00 0.66 C ATOM 370 N7 DA A 12 5.579 -2.105 -0.255 1.00 0.68 N ATOM 371 C5 DA A 12 5.626 -3.296 0.464 1.00 0.65 C ATOM 372 C6 DA A 12 5.814 -3.577 1.828 1.00 0.67 C ATOM 373 N6 DA A 12 5.990 -2.635 2.747 1.00 0.72 N ATOM 374 N1 DA A 12 5.809 -4.864 2.201 1.00 0.66 N ATOM 375 C2 DA A 12 5.626 -5.802 1.282 1.00 0.65 C ATOM 376 N3 DA A 12 5.439 -5.670 -0.021 1.00 0.64 N ATOM 377 C4 DA A 12 5.452 -4.364 -0.366 1.00 0.64 C ATOM 0 H5' DA A 12 8.456 -4.079 -5.485 1.00 0.90 H new ATOM 0 H5'' DA A 12 8.483 -3.940 -3.738 1.00 0.90 H new ATOM 0 H4' DA A 12 6.482 -5.543 -5.308 1.00 0.82 H new ATOM 0 H3' DA A 12 6.290 -2.637 -4.508 1.00 0.86 H new ATOM 0 H2' DA A 12 4.011 -2.979 -3.770 1.00 0.77 H new ATOM 0 H2'' DA A 12 3.851 -4.477 -4.666 1.00 0.77 H new ATOM 0 H1' DA A 12 4.265 -5.378 -2.595 1.00 0.67 H new ATOM 0 H8 DA A 12 5.293 -1.798 -2.311 1.00 0.66 H new ATOM 0 H61 DA A 12 6.122 -2.895 3.725 1.00 0.72 H new ATOM 0 H62 DA A 12 5.993 -1.652 2.475 1.00 0.72 H new ATOM 0 H2 DA A 12 5.630 -6.818 1.649 1.00 0.65 H new ATOM 389 P DG A 13 4.480 -2.463 -6.837 1.00 1.08 P ATOM 390 OP1 DG A 13 3.154 -2.809 -6.283 1.00 1.47 O ATOM 391 OP2 DG A 13 4.670 -2.423 -8.305 1.00 1.15 O ATOM 392 O5' DG A 13 4.926 -1.037 -6.227 1.00 0.99 O ATOM 393 C5' DG A 13 5.433 0.013 -7.067 1.00 0.86 C ATOM 394 C4' DG A 13 4.517 1.246 -7.063 1.00 0.79 C ATOM 395 O4' DG A 13 4.064 1.498 -5.727 1.00 0.79 O ATOM 396 C3' DG A 13 5.201 2.527 -7.562 1.00 0.78 C ATOM 397 O3' DG A 13 4.365 3.235 -8.511 1.00 0.94 O ATOM 398 C2' DG A 13 5.411 3.367 -6.304 1.00 0.72 C ATOM 399 C1' DG A 13 4.303 2.868 -5.393 1.00 0.73 C ATOM 400 N9 DG A 13 4.618 2.927 -3.954 1.00 0.68 N ATOM 401 C8 DG A 13 5.016 1.913 -3.125 1.00 0.68 C ATOM 402 N7 DG A 13 5.164 2.274 -1.881 1.00 0.64 N ATOM 403 C5 DG A 13 4.841 3.627 -1.885 1.00 0.60 C ATOM 404 C6 DG A 13 4.817 4.559 -0.814 1.00 0.58 C ATOM 405 O6 DG A 13 5.070 4.360 0.373 1.00 0.59 O ATOM 406 N1 DG A 13 4.438 5.823 -1.244 1.00 0.62 N ATOM 407 C2 DG A 13 4.120 6.152 -2.546 1.00 0.68 C ATOM 408 N2 DG A 13 3.778 7.418 -2.770 1.00 0.76 N ATOM 409 N3 DG A 13 4.140 5.276 -3.555 1.00 0.68 N ATOM 410 C4 DG A 13 4.508 4.037 -3.151 1.00 0.64 C ATOM 0 H5' DG A 13 5.538 -0.357 -8.087 1.00 0.86 H new ATOM 0 H5'' DG A 13 6.428 0.300 -6.728 1.00 0.86 H new ATOM 0 H4' DG A 13 3.699 1.012 -7.745 1.00 0.79 H new ATOM 0 H3' DG A 13 6.134 2.312 -8.083 1.00 0.78 H new ATOM 0 H2' DG A 13 6.398 3.208 -5.869 1.00 0.72 H new ATOM 0 H2'' DG A 13 5.320 4.434 -6.508 1.00 0.72 H new ATOM 0 H1' DG A 13 3.444 3.520 -5.551 1.00 0.73 H new ATOM 0 H8 DG A 13 5.192 0.905 -3.470 1.00 0.68 H new ATOM 0 H1 DG A 13 4.391 6.565 -0.545 1.00 0.62 H new ATOM 0 H21 DG A 13 3.532 7.721 -3.713 1.00 0.76 H new ATOM 0 H22 DG A 13 3.761 8.086 -1.999 1.00 0.76 H new ATOM 422 P DG A 14 2.808 3.616 -8.244 1.00 0.66 P ATOM 423 OP1 DG A 14 2.349 4.484 -9.353 1.00 0.82 O ATOM 424 OP2 DG A 14 2.652 4.080 -6.847 1.00 0.81 O ATOM 425 O5' DG A 14 2.056 2.195 -8.398 1.00 0.69 O ATOM 426 C5' DG A 14 2.041 1.509 -9.660 1.00 0.77 C ATOM 427 C4' DG A 14 1.109 0.295 -9.643 1.00 0.74 C ATOM 428 O4' DG A 14 1.403 -0.523 -8.503 1.00 0.71 O ATOM 429 C3' DG A 14 -0.390 0.641 -9.570 1.00 0.70 C ATOM 430 O3' DG A 14 -1.117 -0.159 -10.521 1.00 0.76 O ATOM 431 C2' DG A 14 -0.783 0.241 -8.159 1.00 0.61 C ATOM 432 C1' DG A 14 0.164 -0.920 -7.930 1.00 0.59 C ATOM 433 N9 DG A 14 0.387 -1.264 -6.515 1.00 0.54 N ATOM 434 C8 DG A 14 0.292 -2.492 -5.923 1.00 0.62 C ATOM 435 N7 DG A 14 0.528 -2.482 -4.643 1.00 0.63 N ATOM 436 C5 DG A 14 0.801 -1.148 -4.361 1.00 0.54 C ATOM 437 C6 DG A 14 1.127 -0.531 -3.125 1.00 0.56 C ATOM 438 O6 DG A 14 1.233 -1.052 -2.018 1.00 0.66 O ATOM 439 N1 DG A 14 1.324 0.835 -3.276 1.00 0.54 N ATOM 440 C2 DG A 14 1.218 1.522 -4.465 1.00 0.54 C ATOM 441 N2 DG A 14 1.433 2.833 -4.409 1.00 0.63 N ATOM 442 N3 DG A 14 0.912 0.943 -5.627 1.00 0.52 N ATOM 443 C4 DG A 14 0.717 -0.391 -5.501 1.00 0.50 C ATOM 0 H5' DG A 14 3.052 1.186 -9.909 1.00 0.77 H new ATOM 0 H5'' DG A 14 1.724 2.198 -10.443 1.00 0.77 H new ATOM 0 H4' DG A 14 1.290 -0.214 -10.590 1.00 0.74 H new ATOM 0 H3' DG A 14 -0.600 1.687 -9.792 1.00 0.70 H new ATOM 0 H2' DG A 14 -0.632 1.048 -7.442 1.00 0.61 H new ATOM 0 H2'' DG A 14 -1.829 -0.057 -8.088 1.00 0.61 H new ATOM 0 H1' DG A 14 -0.274 -1.813 -8.377 1.00 0.59 H new ATOM 0 H8 DG A 14 0.043 -3.390 -6.468 1.00 0.62 H new ATOM 0 H1 DG A 14 1.566 1.371 -2.442 1.00 0.54 H new ATOM 0 H21 DG A 14 1.369 3.397 -5.257 1.00 0.63 H new ATOM 0 H22 DG A 14 1.662 3.275 -3.519 1.00 0.63 H new ATOM 455 P DG A 15 -2.734 -0.126 -10.584 1.00 0.80 P ATOM 456 OP1 DG A 15 -3.144 -0.295 -11.996 1.00 0.91 O ATOM 457 OP2 DG A 15 -3.201 1.051 -9.817 1.00 1.00 O ATOM 458 O5' DG A 15 -3.159 -1.460 -9.773 1.00 0.69 O ATOM 459 C5' DG A 15 -3.009 -2.761 -10.369 1.00 0.53 C ATOM 460 C4' DG A 15 -3.528 -3.882 -9.457 1.00 0.48 C ATOM 461 O4' DG A 15 -2.888 -3.786 -8.175 1.00 0.58 O ATOM 462 C3' DG A 15 -5.042 -3.851 -9.199 1.00 0.50 C ATOM 463 O3' DG A 15 -5.552 -5.199 -9.107 1.00 0.70 O ATOM 464 C2' DG A 15 -5.143 -3.154 -7.867 1.00 0.48 C ATOM 465 C1' DG A 15 -3.901 -3.679 -7.173 1.00 0.49 C ATOM 466 N9 DG A 15 -3.398 -2.797 -6.110 1.00 0.52 N ATOM 467 C8 DG A 15 -3.364 -1.431 -6.085 1.00 0.55 C ATOM 468 N7 DG A 15 -2.885 -0.935 -4.984 1.00 0.61 N ATOM 469 C5 DG A 15 -2.579 -2.052 -4.219 1.00 0.62 C ATOM 470 C6 DG A 15 -2.028 -2.132 -2.918 1.00 0.69 C ATOM 471 O6 DG A 15 -1.692 -1.212 -2.175 1.00 0.76 O ATOM 472 N1 DG A 15 -1.877 -3.448 -2.511 1.00 0.71 N ATOM 473 C2 DG A 15 -2.212 -4.551 -3.261 1.00 0.68 C ATOM 474 N2 DG A 15 -1.991 -5.734 -2.698 1.00 0.75 N ATOM 475 N3 DG A 15 -2.733 -4.480 -4.487 1.00 0.61 N ATOM 476 C4 DG A 15 -2.888 -3.199 -4.900 1.00 0.57 C ATOM 0 H5' DG A 15 -1.957 -2.936 -10.594 1.00 0.53 H new ATOM 0 H5'' DG A 15 -3.547 -2.788 -11.317 1.00 0.53 H new ATOM 0 H4' DG A 15 -3.299 -4.807 -9.986 1.00 0.48 H new ATOM 0 H3' DG A 15 -5.612 -3.356 -9.985 1.00 0.50 H new ATOM 0 H2' DG A 15 -5.132 -2.069 -7.967 1.00 0.48 H new ATOM 0 H2'' DG A 15 -6.056 -3.416 -7.332 1.00 0.48 H new ATOM 0 H1' DG A 15 -4.154 -4.627 -6.699 1.00 0.49 H new ATOM 0 H8 DG A 15 -3.705 -0.819 -6.907 1.00 0.55 H new ATOM 0 H1 DG A 15 -1.487 -3.611 -1.583 1.00 0.71 H new ATOM 0 H21 DG A 15 -2.219 -6.590 -3.204 1.00 0.75 H new ATOM 0 H22 DG A 15 -1.594 -5.786 -1.760 1.00 0.75 H new ATOM 488 P DT A 16 -6.995 -5.519 -8.441 1.00 0.75 P ATOM 489 OP1 DT A 16 -7.420 -6.868 -8.878 1.00 1.09 O ATOM 490 OP2 DT A 16 -7.879 -4.354 -8.675 1.00 0.97 O ATOM 491 O5' DT A 16 -6.636 -5.582 -6.864 1.00 0.58 O ATOM 492 C5' DT A 16 -7.623 -5.302 -5.857 1.00 0.55 C ATOM 493 C4' DT A 16 -6.995 -4.703 -4.594 1.00 0.53 C ATOM 494 O4' DT A 16 -6.344 -3.481 -4.922 1.00 0.48 O ATOM 495 C3' DT A 16 -8.010 -4.389 -3.491 1.00 0.56 C ATOM 496 O3' DT A 16 -7.803 -5.289 -2.392 1.00 0.67 O ATOM 497 C2' DT A 16 -7.678 -2.934 -3.037 1.00 0.48 C ATOM 498 C1' DT A 16 -6.372 -2.631 -3.779 1.00 0.44 C ATOM 499 N1 DT A 16 -6.270 -1.241 -4.276 1.00 0.38 N ATOM 500 C2 DT A 16 -5.408 -0.375 -3.622 1.00 0.40 C ATOM 501 O2 DT A 16 -4.766 -0.706 -2.632 1.00 0.47 O ATOM 502 N3 DT A 16 -5.320 0.898 -4.143 1.00 0.44 N ATOM 503 C4 DT A 16 -6.006 1.377 -5.243 1.00 0.48 C ATOM 504 O4 DT A 16 -5.840 2.529 -5.630 1.00 0.62 O ATOM 505 C5 DT A 16 -6.886 0.410 -5.857 1.00 0.45 C ATOM 506 C7 DT A 16 -7.717 0.814 -7.074 1.00 0.57 C ATOM 507 C6 DT A 16 -6.990 -0.841 -5.368 1.00 0.39 C ATOM 0 H5' DT A 16 -8.150 -6.221 -5.600 1.00 0.55 H new ATOM 0 H5'' DT A 16 -8.364 -4.610 -6.257 1.00 0.55 H new ATOM 0 H4' DT A 16 -6.305 -5.458 -4.219 1.00 0.53 H new ATOM 0 H3' DT A 16 -9.041 -4.491 -3.831 1.00 0.56 H new ATOM 0 H2' DT A 16 -8.469 -2.236 -3.310 1.00 0.48 H new ATOM 0 H2'' DT A 16 -7.553 -2.867 -1.956 1.00 0.48 H new ATOM 0 H1' DT A 16 -5.553 -2.787 -3.077 1.00 0.44 H new ATOM 0 H3 DT A 16 -4.690 1.547 -3.673 1.00 0.44 H new ATOM 0 H71 DT A 16 -7.883 -0.058 -7.707 1.00 0.57 H new ATOM 0 H72 DT A 16 -8.677 1.210 -6.744 1.00 0.57 H new ATOM 0 H73 DT A 16 -7.185 1.578 -7.641 1.00 0.57 H new ATOM 0 H6 DT A 16 -7.656 -1.543 -5.848 1.00 0.39 H new ATOM 520 P DA A 17 -8.903 -5.416 -1.222 1.00 0.76 P ATOM 521 OP1 DA A 17 -8.457 -6.462 -0.273 1.00 1.01 O ATOM 522 OP2 DA A 17 -10.240 -5.511 -1.852 1.00 1.03 O ATOM 523 O5' DA A 17 -8.792 -3.984 -0.492 1.00 0.63 O ATOM 524 C5' DA A 17 -7.618 -3.636 0.247 1.00 0.67 C ATOM 525 C4' DA A 17 -7.876 -3.649 1.750 1.00 0.61 C ATOM 526 O4' DA A 17 -8.701 -2.544 2.111 1.00 0.67 O ATOM 527 C3' DA A 17 -8.592 -4.896 2.233 1.00 0.70 C ATOM 528 O3' DA A 17 -8.249 -5.154 3.597 1.00 0.86 O ATOM 529 C2' DA A 17 -10.064 -4.521 2.128 1.00 0.99 C ATOM 530 C1' DA A 17 -10.038 -3.008 2.348 1.00 0.84 C ATOM 531 N9 DA A 17 -10.931 -2.255 1.448 1.00 0.77 N ATOM 532 C8 DA A 17 -10.968 -2.246 0.077 1.00 0.86 C ATOM 533 N7 DA A 17 -11.882 -1.459 -0.422 1.00 0.96 N ATOM 534 C5 DA A 17 -12.491 -0.906 0.703 1.00 1.01 C ATOM 535 C6 DA A 17 -13.542 0.013 0.860 1.00 1.33 C ATOM 536 N6 DA A 17 -14.192 0.560 -0.163 1.00 1.48 N ATOM 537 N1 DA A 17 -13.891 0.340 2.116 1.00 1.61 N ATOM 538 C2 DA A 17 -13.239 -0.210 3.133 1.00 1.60 C ATOM 539 N3 DA A 17 -12.242 -1.080 3.113 1.00 1.29 N ATOM 540 C4 DA A 17 -11.916 -1.389 1.843 1.00 0.97 C ATOM 0 H5' DA A 17 -7.277 -2.646 -0.056 1.00 0.67 H new ATOM 0 H5'' DA A 17 -6.817 -4.336 0.009 1.00 0.67 H new ATOM 0 H4' DA A 17 -6.890 -3.606 2.213 1.00 0.61 H new ATOM 0 H3' DA A 17 -8.336 -5.789 1.663 1.00 0.70 H new ATOM 0 H2' DA A 17 -10.481 -4.782 1.155 1.00 0.99 H new ATOM 0 H2'' DA A 17 -10.667 -5.030 2.880 1.00 0.99 H new ATOM 0 H1' DA A 17 -10.381 -2.836 3.368 1.00 0.84 H new ATOM 0 H8 DA A 17 -10.301 -2.836 -0.534 1.00 0.86 H new ATOM 0 H61 DA A 17 -14.948 1.222 0.009 1.00 1.48 H new ATOM 0 H62 DA A 17 -13.934 0.317 -1.120 1.00 1.48 H new ATOM 0 H2 DA A 17 -13.569 0.096 4.115 1.00 1.60 H new ATOM 552 P DI A 18 -8.663 -6.549 4.281 1.00 1.02 P ATOM 553 OP1 DI A 18 -8.152 -7.649 3.433 1.00 1.33 O ATOM 554 OP2 DI A 18 -10.101 -6.488 4.625 1.00 1.54 O ATOM 555 O5' DI A 18 -7.813 -6.534 5.652 1.00 0.99 O ATOM 556 C5' DI A 18 -6.779 -7.502 5.883 1.00 0.98 C ATOM 557 C4' DI A 18 -5.380 -6.911 5.695 1.00 0.84 C ATOM 558 O4' DI A 18 -5.241 -6.371 4.381 1.00 0.76 O ATOM 559 C3' DI A 18 -5.029 -5.774 6.671 1.00 0.85 C ATOM 560 O3' DI A 18 -3.962 -6.194 7.561 1.00 0.91 O ATOM 561 C2' DI A 18 -4.575 -4.623 5.768 1.00 0.81 C ATOM 562 C1' DI A 18 -4.257 -5.354 4.478 1.00 0.72 C ATOM 563 N9 DI A 18 -4.320 -4.502 3.273 1.00 0.64 N ATOM 564 C8 DI A 18 -4.266 -3.134 3.196 1.00 0.62 C ATOM 565 N7 DI A 18 -4.289 -2.670 1.980 1.00 0.58 N ATOM 566 C5 DI A 18 -4.367 -3.809 1.188 1.00 0.55 C ATOM 567 C6 DI A 18 -4.422 -3.931 -0.227 1.00 0.54 C ATOM 568 O6 DI A 18 -4.408 -3.042 -1.073 1.00 0.58 O ATOM 569 N1 DI A 18 -4.498 -5.255 -0.613 1.00 0.56 N ATOM 570 C2 DI A 18 -4.517 -6.324 0.253 1.00 0.59 C ATOM 571 N3 DI A 18 -4.462 -6.233 1.571 1.00 0.61 N ATOM 572 C4 DI A 18 -4.388 -4.940 1.972 1.00 0.58 C ATOM 0 H5'' DI A 18 -6.872 -7.896 6.895 1.00 0.98 H new ATOM 0 H2'' DI A 18 -5.357 -3.875 5.633 1.00 0.81 H new ATOM 0 H8 DI A 18 -4.209 -2.492 4.075 1.00 0.62 H new ATOM 0 H5' DI A 18 -6.911 -8.342 5.201 1.00 0.98 H new ATOM 0 H4' DI A 18 -4.706 -7.747 5.882 1.00 0.84 H new ATOM 0 H3' DI A 18 -5.866 -5.486 7.307 1.00 0.85 H new ATOM 0 H2' DI A 18 -3.705 -4.105 6.171 1.00 0.81 H new ATOM 0 H2 DI A 18 -4.582 -7.322 -0.180 1.00 0.59 H new ATOM 0 H1' DI A 18 -3.232 -5.724 4.514 1.00 0.72 H new ATOM 0 H1 DI A 18 -4.543 -5.455 -1.612 1.00 0.56 H new ATOM 583 P DG A 19 -2.407 -6.345 7.105 1.00 0.91 P ATOM 584 OP1 DG A 19 -1.684 -7.077 8.172 1.00 1.04 O ATOM 585 OP2 DG A 19 -1.907 -5.021 6.669 1.00 1.03 O ATOM 586 O5' DG A 19 -2.481 -7.311 5.812 1.00 0.85 O ATOM 587 C5' DG A 19 -2.438 -8.742 5.950 1.00 0.86 C ATOM 588 C4' DG A 19 -1.813 -9.422 4.725 1.00 0.79 C ATOM 589 O4' DG A 19 -2.119 -8.677 3.532 1.00 0.75 O ATOM 590 C3' DG A 19 -0.281 -9.553 4.785 1.00 0.78 C ATOM 591 O3' DG A 19 0.093 -10.875 4.343 1.00 0.77 O ATOM 592 C2' DG A 19 0.202 -8.510 3.786 1.00 0.72 C ATOM 593 C1' DG A 19 -0.917 -8.588 2.767 1.00 0.65 C ATOM 594 N9 DG A 19 -1.007 -7.425 1.862 1.00 0.61 N ATOM 595 C8 DG A 19 -1.044 -7.421 0.495 1.00 0.62 C ATOM 596 N7 DG A 19 -1.087 -6.230 -0.031 1.00 0.59 N ATOM 597 C5 DG A 19 -1.078 -5.377 1.067 1.00 0.56 C ATOM 598 C6 DG A 19 -1.110 -3.957 1.116 1.00 0.56 C ATOM 599 O6 DG A 19 -1.146 -3.162 0.183 1.00 0.56 O ATOM 600 N1 DG A 19 -1.087 -3.493 2.419 1.00 0.59 N ATOM 601 C2 DG A 19 -1.037 -4.292 3.541 1.00 0.62 C ATOM 602 N2 DG A 19 -1.022 -3.663 4.710 1.00 0.70 N ATOM 603 N3 DG A 19 -1.006 -5.624 3.499 1.00 0.62 N ATOM 604 C4 DG A 19 -1.030 -6.098 2.233 1.00 0.59 C ATOM 0 H5' DG A 19 -3.449 -9.122 6.098 1.00 0.86 H new ATOM 0 H5'' DG A 19 -1.866 -9.003 6.840 1.00 0.86 H new ATOM 0 H4' DG A 19 -2.243 -10.424 4.715 1.00 0.79 H new ATOM 0 H3' DG A 19 0.136 -9.408 5.781 1.00 0.78 H new ATOM 0 H2' DG A 19 0.294 -7.519 4.230 1.00 0.72 H new ATOM 0 H2'' DG A 19 1.173 -8.760 3.359 1.00 0.72 H new ATOM 0 H1' DG A 19 -0.736 -9.441 2.113 1.00 0.65 H new ATOM 0 H8 DG A 19 -1.038 -8.325 -0.096 1.00 0.62 H new ATOM 0 H1 DG A 19 -1.109 -2.483 2.560 1.00 0.59 H new ATOM 0 H21 DG A 19 -0.985 -4.199 5.577 1.00 0.70 H new ATOM 0 H22 DG A 19 -1.047 -2.644 4.741 1.00 0.70 H new ATOM 616 P DG A 20 1.641 -11.305 4.162 1.00 0.78 P ATOM 617 OP1 DG A 20 1.719 -12.782 4.153 1.00 0.88 O ATOM 618 OP2 DG A 20 2.451 -10.528 5.125 1.00 1.01 O ATOM 619 O5' DG A 20 1.982 -10.772 2.679 1.00 0.68 O ATOM 620 C5' DG A 20 1.434 -11.414 1.523 1.00 0.53 C ATOM 621 C4' DG A 20 2.014 -10.841 0.232 1.00 0.46 C ATOM 622 O4' DG A 20 1.593 -9.479 0.072 1.00 0.54 O ATOM 623 C3' DG A 20 3.549 -10.847 0.181 1.00 0.49 C ATOM 624 O3' DG A 20 4.021 -11.246 -1.109 1.00 0.53 O ATOM 625 C2' DG A 20 3.906 -9.393 0.462 1.00 0.51 C ATOM 626 C1' DG A 20 2.746 -8.689 -0.212 1.00 0.51 C ATOM 627 N9 DG A 20 2.493 -7.314 0.263 1.00 0.55 N ATOM 628 C8 DG A 20 2.536 -6.817 1.541 1.00 0.60 C ATOM 629 N7 DG A 20 2.284 -5.540 1.621 1.00 0.62 N ATOM 630 C5 DG A 20 2.058 -5.160 0.300 1.00 0.59 C ATOM 631 C6 DG A 20 1.740 -3.886 -0.240 1.00 0.61 C ATOM 632 O6 DG A 20 1.595 -2.823 0.354 1.00 0.66 O ATOM 633 N1 DG A 20 1.594 -3.940 -1.617 1.00 0.58 N ATOM 634 C2 DG A 20 1.734 -5.076 -2.383 1.00 0.54 C ATOM 635 N2 DG A 20 1.550 -4.937 -3.688 1.00 0.54 N ATOM 636 N3 DG A 20 2.033 -6.271 -1.881 1.00 0.52 N ATOM 637 C4 DG A 20 2.182 -6.240 -0.536 1.00 0.55 C ATOM 0 H5' DG A 20 0.351 -11.295 1.520 1.00 0.53 H new ATOM 0 H5'' DG A 20 1.637 -12.484 1.570 1.00 0.53 H new ATOM 0 H4' DG A 20 1.644 -11.488 -0.563 1.00 0.46 H new ATOM 0 H3' DG A 20 3.997 -11.547 0.886 1.00 0.49 H new ATOM 0 H2' DG A 20 3.958 -9.178 1.529 1.00 0.51 H new ATOM 0 H2'' DG A 20 4.868 -9.112 0.033 1.00 0.51 H new ATOM 0 HO3' DG A 20 5.001 -11.240 -1.115 1.00 0.53 H new ATOM 0 H1' DG A 20 2.981 -8.593 -1.272 1.00 0.51 H new ATOM 0 H8 DG A 20 2.759 -7.428 2.403 1.00 0.60 H new ATOM 0 H1 DG A 20 1.365 -3.072 -2.101 1.00 0.58 H new ATOM 0 H21 DG A 20 1.641 -5.744 -4.305 1.00 0.54 H new ATOM 0 H22 DG A 20 1.317 -4.023 -4.076 1.00 0.54 H new TER 650 DG A 20