USER MOD reduce.3.24.130724 H: found=0, std=0, add=250, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 250 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 -30:sc= -0.939 (180deg=-2.42!) USER MOD Set 1.2: A 18 DT C7 :methyl 150:sc= -6.44! (180deg=-6.44!) USER MOD Single : A 1 DA O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= -2.5! (180deg=-2.5!) USER MOD Single : A 12 DT C7 :methyl -30:sc= 0 (180deg=-1.05) USER MOD Single : A 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 6.826 9.313 5.405 1.00 1.06 O ATOM 2 C5' DA A 1 5.837 9.551 4.396 1.00 0.92 C ATOM 3 C4' DA A 1 4.412 9.379 4.983 1.00 0.77 C ATOM 4 O4' DA A 1 3.378 9.564 3.991 1.00 0.80 O ATOM 5 C3' DA A 1 4.127 8.001 5.612 1.00 0.67 C ATOM 6 O3' DA A 1 3.289 8.161 6.768 1.00 0.76 O ATOM 7 C2' DA A 1 3.422 7.290 4.465 1.00 0.62 C ATOM 8 C1' DA A 1 2.521 8.410 3.975 1.00 0.70 C ATOM 9 N9 DA A 1 1.962 8.160 2.629 1.00 0.64 N ATOM 10 C8 DA A 1 2.587 7.700 1.502 1.00 0.60 C ATOM 11 N7 DA A 1 1.806 7.579 0.463 1.00 0.57 N ATOM 12 C5 DA A 1 0.566 7.993 0.941 1.00 0.59 C ATOM 13 C6 DA A 1 -0.698 8.105 0.340 1.00 0.63 C ATOM 14 N6 DA A 1 -0.953 7.797 -0.930 1.00 0.63 N ATOM 15 N1 DA A 1 -1.704 8.546 1.104 1.00 0.71 N ATOM 16 C2 DA A 1 -1.484 8.859 2.376 1.00 0.76 C ATOM 17 N3 DA A 1 -0.345 8.797 3.048 1.00 0.74 N ATOM 18 C4 DA A 1 0.654 8.348 2.258 1.00 0.65 C ATOM 0 H5' DA A 1 5.981 8.859 3.566 1.00 0.92 H new ATOM 0 H5'' DA A 1 5.953 10.558 3.995 1.00 0.92 H new ATOM 0 H4' DA A 1 4.390 10.148 5.755 1.00 0.77 H new ATOM 0 H3' DA A 1 4.999 7.456 5.973 1.00 0.67 H new ATOM 0 H2' DA A 1 4.116 6.947 3.698 1.00 0.62 H new ATOM 0 H2'' DA A 1 2.859 6.418 4.798 1.00 0.62 H new ATOM 0 HO5' DA A 1 7.720 9.424 5.019 1.00 1.06 H new ATOM 0 H1' DA A 1 1.637 8.523 4.603 1.00 0.70 H new ATOM 0 H8 DA A 1 3.639 7.457 1.474 1.00 0.60 H new ATOM 0 H61 DA A 1 -1.897 7.903 -1.301 1.00 0.63 H new ATOM 0 H62 DA A 1 -0.204 7.455 -1.532 1.00 0.63 H new ATOM 0 H2 DA A 1 -2.342 9.208 2.932 1.00 0.76 H new ATOM 31 P DG A 2 2.777 6.934 7.690 1.00 0.92 P ATOM 32 OP1 DG A 2 2.686 7.419 9.087 1.00 1.12 O ATOM 33 OP2 DG A 2 3.582 5.732 7.378 1.00 1.10 O ATOM 34 O5' DG A 2 1.284 6.701 7.128 1.00 0.86 O ATOM 35 C5' DG A 2 0.280 7.724 7.256 1.00 0.78 C ATOM 36 C4' DG A 2 -1.109 7.227 6.784 1.00 0.70 C ATOM 37 O4' DG A 2 -1.071 6.932 5.385 1.00 0.70 O ATOM 38 C3' DG A 2 -1.685 5.965 7.470 1.00 0.70 C ATOM 39 O3' DG A 2 -3.113 6.112 7.487 1.00 0.72 O ATOM 40 C2' DG A 2 -1.213 4.878 6.492 1.00 0.61 C ATOM 41 C1' DG A 2 -1.528 5.599 5.167 1.00 0.61 C ATOM 42 N9 DG A 2 -0.795 5.124 3.969 1.00 0.51 N ATOM 43 C8 DG A 2 0.487 4.643 3.840 1.00 0.46 C ATOM 44 N7 DG A 2 0.821 4.355 2.616 1.00 0.40 N ATOM 45 C5 DG A 2 -0.309 4.663 1.877 1.00 0.44 C ATOM 46 C6 DG A 2 -0.534 4.555 0.485 1.00 0.43 C ATOM 47 O6 DG A 2 0.242 4.163 -0.382 1.00 0.40 O ATOM 48 N1 DG A 2 -1.801 4.965 0.153 1.00 0.51 N ATOM 49 C2 DG A 2 -2.738 5.421 1.049 1.00 0.57 C ATOM 50 N2 DG A 2 -3.921 5.758 0.590 1.00 0.65 N ATOM 51 N3 DG A 2 -2.541 5.528 2.351 1.00 0.59 N ATOM 52 C4 DG A 2 -1.301 5.130 2.697 1.00 0.51 C ATOM 0 H5' DG A 2 0.572 8.596 6.671 1.00 0.78 H new ATOM 0 H5'' DG A 2 0.218 8.044 8.296 1.00 0.78 H new ATOM 0 H4' DG A 2 -1.761 8.057 7.056 1.00 0.70 H new ATOM 0 H3' DG A 2 -1.382 5.763 8.497 1.00 0.70 H new ATOM 0 H2' DG A 2 -0.155 4.642 6.602 1.00 0.61 H new ATOM 0 H2'' DG A 2 -1.762 3.943 6.604 1.00 0.61 H new ATOM 0 H1' DG A 2 -2.586 5.447 4.955 1.00 0.61 H new ATOM 0 H8 DG A 2 1.156 4.516 4.679 1.00 0.46 H new ATOM 0 H1 DG A 2 -2.067 4.929 -0.831 1.00 0.51 H new ATOM 0 H21 DG A 2 -4.638 6.100 1.230 1.00 0.65 H new ATOM 0 H22 DG A 2 -4.123 5.678 -0.407 1.00 0.65 H new ATOM 64 P DG A 3 -4.105 5.229 8.409 1.00 0.65 P ATOM 65 OP1 DG A 3 -5.318 6.031 8.676 1.00 0.74 O ATOM 66 OP2 DG A 3 -3.328 4.671 9.540 1.00 0.77 O ATOM 67 O5' DG A 3 -4.504 4.016 7.433 1.00 0.73 O ATOM 68 C5' DG A 3 -4.997 4.263 6.111 1.00 0.67 C ATOM 69 C4' DG A 3 -4.467 3.181 5.176 1.00 0.57 C ATOM 70 O4' DG A 3 -5.133 3.854 4.092 1.00 0.59 O ATOM 71 C3' DG A 3 -5.162 1.796 5.447 1.00 0.57 C ATOM 72 O3' DG A 3 -4.844 0.644 4.651 1.00 0.54 O ATOM 73 C2' DG A 3 -6.344 1.985 4.478 1.00 0.64 C ATOM 74 C1' DG A 3 -5.841 2.880 3.367 1.00 0.61 C ATOM 75 N9 DG A 3 -5.097 2.388 2.187 1.00 0.54 N ATOM 76 C8 DG A 3 -5.603 2.229 0.927 1.00 0.55 C ATOM 77 N7 DG A 3 -4.734 1.840 0.044 1.00 0.52 N ATOM 78 C5 DG A 3 -3.557 1.729 0.776 1.00 0.49 C ATOM 79 C6 DG A 3 -2.272 1.344 0.350 1.00 0.48 C ATOM 80 O6 DG A 3 -1.909 1.045 -0.779 1.00 0.48 O ATOM 81 N1 DG A 3 -1.364 1.354 1.372 1.00 0.49 N ATOM 82 C2 DG A 3 -1.642 1.694 2.665 1.00 0.51 C ATOM 83 N2 DG A 3 -0.643 1.645 3.528 1.00 0.55 N ATOM 84 N3 DG A 3 -2.844 2.062 3.091 1.00 0.52 N ATOM 85 C4 DG A 3 -3.761 2.058 2.091 1.00 0.50 C ATOM 0 H5' DG A 3 -4.678 5.247 5.768 1.00 0.67 H new ATOM 0 H5'' DG A 3 -6.087 4.262 6.109 1.00 0.67 H new ATOM 0 H4' DG A 3 -3.407 2.930 5.149 1.00 0.57 H new ATOM 0 H3' DG A 3 -5.079 1.637 6.522 1.00 0.57 H new ATOM 0 H2' DG A 3 -6.681 1.026 4.083 1.00 0.64 H new ATOM 0 H2'' DG A 3 -7.196 2.437 4.986 1.00 0.64 H new ATOM 0 H1' DG A 3 -6.711 3.179 2.783 1.00 0.61 H new ATOM 0 H8 DG A 3 -6.640 2.412 0.686 1.00 0.55 H new ATOM 0 H1 DG A 3 -0.405 1.087 1.152 1.00 0.49 H new ATOM 0 H21 DG A 3 -0.801 1.890 4.505 1.00 0.55 H new ATOM 0 H22 DG A 3 0.286 1.362 3.217 1.00 0.55 H new ATOM 97 P DG A 4 -5.078 -0.843 5.265 1.00 0.53 P ATOM 98 OP1 DG A 4 -5.774 -0.745 6.570 1.00 0.62 O ATOM 99 OP2 DG A 4 -3.790 -1.563 5.168 1.00 0.61 O ATOM 100 O5' DG A 4 -6.074 -1.532 4.208 1.00 0.54 O ATOM 101 C5' DG A 4 -7.480 -1.306 4.004 1.00 0.53 C ATOM 102 C4' DG A 4 -7.929 -1.982 2.724 1.00 0.51 C ATOM 103 O4' DG A 4 -7.109 -1.582 1.611 1.00 0.55 O ATOM 104 C3' DG A 4 -7.850 -3.508 2.766 1.00 0.49 C ATOM 105 O3' DG A 4 -8.736 -4.070 1.791 1.00 0.64 O ATOM 106 C2' DG A 4 -6.394 -3.673 2.397 1.00 0.50 C ATOM 107 C1' DG A 4 -6.296 -2.703 1.238 1.00 0.50 C ATOM 108 N9 DG A 4 -4.883 -2.314 1.075 1.00 0.46 N ATOM 109 C8 DG A 4 -3.979 -1.923 2.027 1.00 0.51 C ATOM 110 N7 DG A 4 -2.788 -1.671 1.558 1.00 0.50 N ATOM 111 C5 DG A 4 -2.917 -1.913 0.197 1.00 0.43 C ATOM 112 C6 DG A 4 -1.957 -1.813 -0.838 1.00 0.41 C ATOM 113 O6 DG A 4 -0.769 -1.518 -0.743 1.00 0.45 O ATOM 114 N1 DG A 4 -2.504 -2.143 -2.060 1.00 0.41 N ATOM 115 C2 DG A 4 -3.811 -2.526 -2.259 1.00 0.42 C ATOM 116 N2 DG A 4 -4.215 -2.830 -3.472 1.00 0.49 N ATOM 117 N3 DG A 4 -4.712 -2.625 -1.297 1.00 0.42 N ATOM 118 C4 DG A 4 -4.194 -2.304 -0.099 1.00 0.41 C ATOM 0 H5' DG A 4 -7.682 -0.236 3.951 1.00 0.53 H new ATOM 0 H5'' DG A 4 -8.047 -1.696 4.850 1.00 0.53 H new ATOM 0 H4' DG A 4 -8.968 -1.671 2.612 1.00 0.51 H new ATOM 0 H3' DG A 4 -8.137 -3.994 3.698 1.00 0.49 H new ATOM 0 H2' DG A 4 -5.725 -3.410 3.217 1.00 0.50 H new ATOM 0 H2'' DG A 4 -6.153 -4.695 2.105 1.00 0.50 H new ATOM 0 H1' DG A 4 -6.634 -3.122 0.291 1.00 0.50 H new ATOM 0 H8 DG A 4 -4.230 -1.831 3.073 1.00 0.51 H new ATOM 0 H1 DG A 4 -1.895 -2.100 -2.877 1.00 0.41 H new ATOM 0 H21 DG A 4 -5.181 -3.115 -3.631 1.00 0.49 H new ATOM 0 H22 DG A 4 -3.562 -2.781 -4.254 1.00 0.49 H new ATOM 130 P DT A 5 -9.402 -5.525 1.960 1.00 0.80 P ATOM 131 OP1 DT A 5 -10.439 -5.673 0.917 1.00 1.15 O ATOM 132 OP2 DT A 5 -9.769 -5.710 3.384 1.00 0.80 O ATOM 133 O5' DT A 5 -8.218 -6.552 1.609 1.00 1.04 O ATOM 134 C5' DT A 5 -7.309 -7.066 2.586 1.00 1.14 C ATOM 135 C4' DT A 5 -6.658 -8.327 2.043 1.00 1.21 C ATOM 136 O4' DT A 5 -5.656 -8.803 2.954 1.00 1.41 O ATOM 137 C3' DT A 5 -7.656 -9.493 1.870 1.00 1.15 C ATOM 138 O3' DT A 5 -7.131 -10.518 1.020 1.00 1.56 O ATOM 139 C2' DT A 5 -7.593 -10.027 3.235 1.00 1.03 C ATOM 140 C1' DT A 5 -6.058 -10.111 3.386 1.00 1.23 C ATOM 141 N1 DT A 5 -5.470 -10.515 4.678 1.00 1.22 N ATOM 142 C2 DT A 5 -4.109 -10.349 4.865 1.00 1.40 C ATOM 143 O2 DT A 5 -3.359 -9.910 4.015 1.00 1.70 O ATOM 144 N3 DT A 5 -3.617 -10.736 6.086 1.00 1.50 N ATOM 145 C4 DT A 5 -4.344 -11.265 7.122 1.00 1.45 C ATOM 146 O4 DT A 5 -3.798 -11.576 8.174 1.00 1.64 O ATOM 147 C5 DT A 5 -5.749 -11.398 6.828 1.00 1.46 C ATOM 148 C7 DT A 5 -6.728 -11.955 7.847 1.00 1.89 C ATOM 149 C6 DT A 5 -6.242 -11.032 5.655 1.00 1.35 C ATOM 0 H5' DT A 5 -7.838 -7.285 3.514 1.00 1.14 H new ATOM 0 H5'' DT A 5 -6.549 -6.321 2.821 1.00 1.14 H new ATOM 0 H4' DT A 5 -6.244 -8.045 1.075 1.00 1.21 H new ATOM 0 H3' DT A 5 -8.621 -9.196 1.460 1.00 1.15 H new ATOM 0 H2' DT A 5 -8.053 -9.365 3.969 1.00 1.03 H new ATOM 0 H2'' DT A 5 -8.080 -10.997 3.331 1.00 1.03 H new ATOM 0 H1' DT A 5 -5.675 -10.952 2.807 1.00 1.23 H new ATOM 0 H3 DT A 5 -2.615 -10.619 6.238 1.00 1.50 H new ATOM 0 H71 DT A 5 -7.710 -11.509 7.689 1.00 1.89 H new ATOM 0 H72 DT A 5 -6.797 -13.037 7.731 1.00 1.89 H new ATOM 0 H73 DT A 5 -6.380 -11.719 8.853 1.00 1.89 H new ATOM 0 H6 DT A 5 -7.300 -11.152 5.474 1.00 1.35 H new ATOM 162 P DT A 6 -7.352 -10.578 -0.556 1.00 1.90 P ATOM 163 OP1 DT A 6 -8.811 -10.622 -0.804 1.00 2.36 O ATOM 164 OP2 DT A 6 -6.477 -11.648 -1.085 1.00 2.54 O ATOM 165 O5' DT A 6 -6.778 -9.164 -1.041 1.00 1.37 O ATOM 166 C5' DT A 6 -7.639 -8.251 -1.725 1.00 1.28 C ATOM 167 C4' DT A 6 -6.841 -7.261 -2.519 1.00 0.93 C ATOM 168 O4' DT A 6 -6.055 -6.392 -1.709 1.00 0.73 O ATOM 169 C3' DT A 6 -5.928 -7.983 -3.504 1.00 0.75 C ATOM 170 O3' DT A 6 -6.043 -7.246 -4.724 1.00 0.82 O ATOM 171 C2' DT A 6 -4.520 -7.712 -2.786 1.00 0.66 C ATOM 172 C1' DT A 6 -4.806 -6.244 -2.372 1.00 0.70 C ATOM 173 N1 DT A 6 -3.802 -5.763 -1.387 1.00 0.70 N ATOM 174 C2 DT A 6 -2.607 -5.280 -1.870 1.00 0.77 C ATOM 175 O2 DT A 6 -2.331 -5.213 -3.062 1.00 0.84 O ATOM 176 N3 DT A 6 -1.714 -4.847 -0.931 1.00 0.81 N ATOM 177 C4 DT A 6 -1.895 -4.854 0.430 1.00 0.78 C ATOM 178 O4 DT A 6 -1.025 -4.397 1.155 1.00 0.86 O ATOM 179 C5 DT A 6 -3.156 -5.380 0.874 1.00 0.72 C ATOM 180 C7 DT A 6 -3.440 -5.478 2.391 1.00 0.78 C ATOM 181 C6 DT A 6 -4.052 -5.804 -0.036 1.00 0.68 C ATOM 0 H5' DT A 6 -8.266 -7.726 -1.004 1.00 1.28 H new ATOM 0 H5'' DT A 6 -8.307 -8.801 -2.387 1.00 1.28 H new ATOM 0 H4' DT A 6 -7.567 -6.646 -3.050 1.00 0.93 H new ATOM 0 H3' DT A 6 -6.109 -9.035 -3.723 1.00 0.75 H new ATOM 0 H2' DT A 6 -4.336 -8.371 -1.937 1.00 0.66 H new ATOM 0 H2'' DT A 6 -3.668 -7.812 -3.458 1.00 0.66 H new ATOM 0 H1' DT A 6 -4.788 -5.542 -3.205 1.00 0.70 H new ATOM 0 H3 DT A 6 -0.825 -4.483 -1.275 1.00 0.81 H new ATOM 0 H71 DT A 6 -2.504 -5.633 2.927 1.00 0.78 H new ATOM 0 H72 DT A 6 -3.907 -4.555 2.734 1.00 0.78 H new ATOM 0 H73 DT A 6 -4.110 -6.316 2.582 1.00 0.78 H new ATOM 0 H6 DT A 6 -5.001 -6.190 0.307 1.00 0.68 H new ATOM 194 P DA A 7 -5.576 -7.875 -6.124 1.00 0.83 P ATOM 195 OP1 DA A 7 -6.255 -7.127 -7.207 1.00 1.11 O ATOM 196 OP2 DA A 7 -5.694 -9.349 -6.060 1.00 1.07 O ATOM 197 O5' DA A 7 -4.016 -7.494 -6.126 1.00 0.80 O ATOM 198 C5' DA A 7 -3.583 -6.235 -6.653 1.00 0.83 C ATOM 199 C4' DA A 7 -2.098 -6.258 -6.972 1.00 0.70 C ATOM 200 O4' DA A 7 -1.252 -6.427 -5.820 1.00 0.57 O ATOM 201 C3' DA A 7 -1.760 -7.423 -7.922 1.00 0.71 C ATOM 202 O3' DA A 7 -0.748 -7.009 -8.855 1.00 0.85 O ATOM 203 C2' DA A 7 -1.177 -8.416 -6.935 1.00 0.60 C ATOM 204 C1' DA A 7 -0.306 -7.430 -6.180 1.00 0.51 C ATOM 205 N9 DA A 7 0.405 -8.044 -5.043 1.00 0.47 N ATOM 206 C8 DA A 7 0.015 -9.071 -4.224 1.00 0.53 C ATOM 207 N7 DA A 7 0.896 -9.389 -3.310 1.00 0.59 N ATOM 208 C5 DA A 7 1.950 -8.500 -3.548 1.00 0.52 C ATOM 209 C6 DA A 7 3.208 -8.295 -2.936 1.00 0.57 C ATOM 210 N6 DA A 7 3.693 -8.979 -1.913 1.00 0.69 N ATOM 211 N1 DA A 7 3.983 -7.334 -3.434 1.00 0.53 N ATOM 212 C2 DA A 7 3.564 -6.617 -4.459 1.00 0.49 C ATOM 213 N3 DA A 7 2.422 -6.702 -5.121 1.00 0.47 N ATOM 214 C4 DA A 7 1.650 -7.683 -4.602 1.00 0.46 C ATOM 0 H5' DA A 7 -3.791 -5.444 -5.932 1.00 0.83 H new ATOM 0 H5'' DA A 7 -4.148 -6.001 -7.555 1.00 0.83 H new ATOM 0 H4' DA A 7 -1.904 -5.283 -7.419 1.00 0.70 H new ATOM 0 H3' DA A 7 -2.594 -7.797 -8.516 1.00 0.71 H new ATOM 0 H2' DA A 7 -1.931 -8.892 -6.308 1.00 0.60 H new ATOM 0 H2'' DA A 7 -0.609 -9.214 -7.413 1.00 0.60 H new ATOM 0 H1' DA A 7 0.527 -7.031 -6.759 1.00 0.51 H new ATOM 0 H8 DA A 7 -0.936 -9.574 -4.324 1.00 0.53 H new ATOM 0 H61 DA A 7 4.616 -8.754 -1.541 1.00 0.69 H new ATOM 0 H62 DA A 7 3.144 -9.731 -1.496 1.00 0.69 H new ATOM 0 H2 DA A 7 4.247 -5.856 -4.805 1.00 0.49 H new ATOM 226 P DG A 8 -0.983 -7.062 -10.445 1.00 0.58 P ATOM 227 OP1 DG A 8 -1.593 -8.368 -10.782 1.00 0.73 O ATOM 228 OP2 DG A 8 0.276 -6.648 -11.108 1.00 0.63 O ATOM 229 O5' DG A 8 -2.091 -5.925 -10.672 1.00 0.75 O ATOM 230 C5' DG A 8 -1.806 -4.597 -11.128 1.00 0.74 C ATOM 231 C4' DG A 8 -3.049 -3.754 -10.934 1.00 0.65 C ATOM 232 O4' DG A 8 -3.300 -3.593 -9.536 1.00 0.73 O ATOM 233 C3' DG A 8 -2.977 -2.342 -11.533 1.00 0.70 C ATOM 234 O3' DG A 8 -4.133 -2.010 -12.326 1.00 0.87 O ATOM 235 C2' DG A 8 -2.812 -1.441 -10.322 1.00 0.63 C ATOM 236 C1' DG A 8 -3.619 -2.232 -9.258 1.00 0.65 C ATOM 237 N9 DG A 8 -3.101 -2.012 -7.899 1.00 0.52 N ATOM 238 C8 DG A 8 -3.833 -1.663 -6.814 1.00 0.47 C ATOM 239 N7 DG A 8 -3.151 -1.569 -5.716 1.00 0.45 N ATOM 240 C5 DG A 8 -1.858 -1.880 -6.101 1.00 0.43 C ATOM 241 C6 DG A 8 -0.686 -1.941 -5.320 1.00 0.44 C ATOM 242 O6 DG A 8 -0.582 -1.747 -4.116 1.00 0.49 O ATOM 243 N1 DG A 8 0.409 -2.284 -6.071 1.00 0.45 N ATOM 244 C2 DG A 8 0.381 -2.542 -7.416 1.00 0.53 C ATOM 245 N2 DG A 8 1.534 -2.846 -7.977 1.00 0.61 N ATOM 246 N3 DG A 8 -0.715 -2.494 -8.170 1.00 0.58 N ATOM 247 C4 DG A 8 -1.805 -2.153 -7.440 1.00 0.50 C ATOM 0 H5' DG A 8 -1.515 -4.610 -12.178 1.00 0.74 H new ATOM 0 H5'' DG A 8 -0.970 -4.175 -10.571 1.00 0.74 H new ATOM 0 H4' DG A 8 -3.837 -4.295 -11.457 1.00 0.65 H new ATOM 0 H3' DG A 8 -2.155 -2.236 -12.240 1.00 0.70 H new ATOM 0 H2' DG A 8 -1.767 -1.316 -10.039 1.00 0.63 H new ATOM 0 H2'' DG A 8 -3.218 -0.444 -10.491 1.00 0.63 H new ATOM 0 H1' DG A 8 -4.671 -1.948 -9.300 1.00 0.65 H new ATOM 0 H8 DG A 8 -4.896 -1.478 -6.860 1.00 0.47 H new ATOM 0 H1 DG A 8 1.308 -2.352 -5.594 1.00 0.45 H new ATOM 0 H21 DG A 8 1.578 -3.048 -8.976 1.00 0.61 H new ATOM 0 H22 DG A 8 2.383 -2.879 -7.412 1.00 0.61 H new ATOM 259 P DG A 9 -5.698 -2.127 -11.915 1.00 0.98 P ATOM 260 OP1 DG A 9 -5.942 -3.461 -11.328 1.00 1.06 O ATOM 261 OP2 DG A 9 -6.501 -1.685 -13.077 1.00 1.24 O ATOM 262 O5' DG A 9 -5.858 -1.033 -10.747 1.00 0.87 O ATOM 263 C5' DG A 9 -5.609 0.352 -10.991 1.00 0.78 C ATOM 264 C4' DG A 9 -5.966 1.188 -9.774 1.00 0.67 C ATOM 265 O4' DG A 9 -5.200 0.896 -8.590 1.00 0.56 O ATOM 266 C3' DG A 9 -5.748 2.667 -10.051 1.00 0.67 C ATOM 267 O3' DG A 9 -6.781 3.352 -9.348 1.00 0.77 O ATOM 268 C2' DG A 9 -4.362 2.861 -9.407 1.00 0.60 C ATOM 269 C1' DG A 9 -4.674 2.125 -8.070 1.00 0.51 C ATOM 270 N9 DG A 9 -3.445 1.811 -7.292 1.00 0.43 N ATOM 271 C8 DG A 9 -2.161 1.543 -7.730 1.00 0.46 C ATOM 272 N7 DG A 9 -1.316 1.312 -6.773 1.00 0.44 N ATOM 273 C5 DG A 9 -2.068 1.428 -5.622 1.00 0.39 C ATOM 274 C6 DG A 9 -1.666 1.278 -4.278 1.00 0.39 C ATOM 275 O6 DG A 9 -0.545 1.022 -3.854 1.00 0.44 O ATOM 276 N1 DG A 9 -2.715 1.468 -3.419 1.00 0.39 N ATOM 277 C2 DG A 9 -3.996 1.772 -3.796 1.00 0.40 C ATOM 278 N2 DG A 9 -4.902 1.923 -2.852 1.00 0.44 N ATOM 279 N3 DG A 9 -4.389 1.919 -5.056 1.00 0.41 N ATOM 280 C4 DG A 9 -3.369 1.732 -5.922 1.00 0.39 C ATOM 0 H5' DG A 9 -6.192 0.685 -11.850 1.00 0.78 H new ATOM 0 H5'' DG A 9 -4.559 0.498 -11.243 1.00 0.78 H new ATOM 0 H4' DG A 9 -7.010 0.936 -9.589 1.00 0.67 H new ATOM 0 H3' DG A 9 -5.778 3.013 -11.084 1.00 0.67 H new ATOM 0 H2' DG A 9 -3.555 2.398 -9.975 1.00 0.60 H new ATOM 0 H2'' DG A 9 -4.094 3.909 -9.269 1.00 0.60 H new ATOM 0 H1' DG A 9 -5.310 2.699 -7.397 1.00 0.51 H new ATOM 0 H8 DG A 9 -1.886 1.527 -8.774 1.00 0.46 H new ATOM 0 H1 DG A 9 -2.528 1.376 -2.421 1.00 0.39 H new ATOM 0 H21 DG A 9 -5.865 2.150 -3.101 1.00 0.44 H new ATOM 0 H22 DG A 9 -4.641 1.813 -1.872 1.00 0.44 H new ATOM 292 P DG A 10 -6.982 4.931 -9.475 1.00 0.96 P ATOM 293 OP1 DG A 10 -7.610 5.221 -10.783 1.00 1.24 O ATOM 294 OP2 DG A 10 -5.708 5.576 -9.083 1.00 0.97 O ATOM 295 O5' DG A 10 -8.063 5.163 -8.314 1.00 1.06 O ATOM 296 C5' DG A 10 -7.696 5.013 -6.936 1.00 0.99 C ATOM 297 C4' DG A 10 -8.404 6.076 -6.109 1.00 0.90 C ATOM 298 O4' DG A 10 -7.979 6.005 -4.745 1.00 0.90 O ATOM 299 C3' DG A 10 -8.100 7.500 -6.608 1.00 0.89 C ATOM 300 O3' DG A 10 -9.088 8.461 -6.240 1.00 0.82 O ATOM 301 C2' DG A 10 -6.838 7.824 -5.785 1.00 0.89 C ATOM 302 C1' DG A 10 -7.181 7.158 -4.466 1.00 0.85 C ATOM 303 N9 DG A 10 -5.959 6.762 -3.775 1.00 0.70 N ATOM 304 C8 DG A 10 -5.759 6.852 -2.450 1.00 0.71 C ATOM 305 N7 DG A 10 -4.588 6.442 -2.055 1.00 0.61 N ATOM 306 C5 DG A 10 -3.966 6.048 -3.235 1.00 0.51 C ATOM 307 C6 DG A 10 -2.675 5.511 -3.456 1.00 0.46 C ATOM 308 O6 DG A 10 -1.800 5.260 -2.634 1.00 0.57 O ATOM 309 N1 DG A 10 -2.461 5.261 -4.791 1.00 0.46 N ATOM 310 C2 DG A 10 -3.367 5.490 -5.793 1.00 0.52 C ATOM 311 N2 DG A 10 -3.021 5.209 -7.033 1.00 0.61 N ATOM 312 N3 DG A 10 -4.576 5.987 -5.600 1.00 0.60 N ATOM 313 C4 DG A 10 -4.806 6.242 -4.295 1.00 0.57 C ATOM 0 H5' DG A 10 -6.616 5.107 -6.823 1.00 0.99 H new ATOM 0 H5'' DG A 10 -7.968 4.019 -6.581 1.00 0.99 H new ATOM 0 H4' DG A 10 -9.472 5.879 -6.204 1.00 0.90 H new ATOM 0 H3' DG A 10 -8.031 7.540 -7.695 1.00 0.89 H new ATOM 0 H2' DG A 10 -5.935 7.411 -6.234 1.00 0.89 H new ATOM 0 H2'' DG A 10 -6.679 8.897 -5.677 1.00 0.89 H new ATOM 0 H1' DG A 10 -7.729 7.850 -3.826 1.00 0.85 H new ATOM 0 H8 DG A 10 -6.506 7.232 -1.770 1.00 0.71 H new ATOM 0 H1 DG A 10 -1.555 4.874 -5.057 1.00 0.46 H new ATOM 0 H21 DG A 10 -3.679 5.371 -7.795 1.00 0.61 H new ATOM 0 H22 DG A 10 -2.095 4.829 -7.231 1.00 0.61 H new ATOM 325 P DT A 11 -9.084 9.932 -6.904 1.00 0.89 P ATOM 326 OP1 DT A 11 -10.136 10.708 -6.215 1.00 1.00 O ATOM 327 OP2 DT A 11 -9.130 9.780 -8.376 1.00 1.05 O ATOM 328 O5' DT A 11 -7.649 10.581 -6.493 1.00 0.87 O ATOM 329 C5' DT A 11 -6.516 10.750 -7.380 1.00 0.94 C ATOM 330 C4' DT A 11 -5.380 11.598 -6.743 1.00 1.04 C ATOM 331 O4' DT A 11 -5.859 12.910 -6.477 1.00 0.98 O ATOM 332 C3' DT A 11 -4.877 11.048 -5.392 1.00 1.12 C ATOM 333 O3' DT A 11 -3.593 11.562 -5.020 1.00 1.26 O ATOM 334 C2' DT A 11 -5.979 11.601 -4.468 1.00 1.00 C ATOM 335 C1' DT A 11 -6.067 13.050 -5.070 1.00 0.95 C ATOM 336 N1 DT A 11 -7.431 13.571 -4.867 1.00 0.88 N ATOM 337 C2 DT A 11 -7.674 14.364 -3.757 1.00 0.97 C ATOM 338 O2 DT A 11 -6.819 14.661 -2.928 1.00 1.08 O ATOM 339 N3 DT A 11 -8.958 14.823 -3.617 1.00 0.99 N ATOM 340 C4 DT A 11 -10.009 14.571 -4.467 1.00 0.93 C ATOM 341 O4 DT A 11 -11.111 15.049 -4.218 1.00 1.02 O ATOM 342 C5 DT A 11 -9.671 13.735 -5.602 1.00 0.82 C ATOM 343 C7 DT A 11 -10.743 13.376 -6.630 1.00 0.83 C ATOM 344 C6 DT A 11 -8.418 13.269 -5.765 1.00 0.81 C ATOM 0 H5' DT A 11 -6.849 11.228 -8.301 1.00 0.94 H new ATOM 0 H5'' DT A 11 -6.124 9.770 -7.653 1.00 0.94 H new ATOM 0 H4' DT A 11 -4.562 11.575 -7.463 1.00 1.04 H new ATOM 0 H3' DT A 11 -4.732 9.968 -5.376 1.00 1.12 H new ATOM 0 H2' DT A 11 -6.916 11.050 -4.548 1.00 1.00 H new ATOM 0 H2'' DT A 11 -5.694 11.595 -3.416 1.00 1.00 H new ATOM 0 H1' DT A 11 -5.342 13.718 -4.605 1.00 0.95 H new ATOM 0 H3 DT A 11 -9.152 15.408 -2.804 1.00 0.99 H new ATOM 0 H71 DT A 11 -10.279 13.237 -7.606 1.00 0.83 H new ATOM 0 H72 DT A 11 -11.240 12.453 -6.330 1.00 0.83 H new ATOM 0 H73 DT A 11 -11.476 14.181 -6.688 1.00 0.83 H new ATOM 0 H6 DT A 11 -8.189 12.647 -6.618 1.00 0.81 H new ATOM 357 P DT A 12 -2.327 10.576 -5.153 1.00 1.80 P ATOM 358 OP1 DT A 12 -1.885 10.597 -6.567 1.00 2.59 O ATOM 359 OP2 DT A 12 -2.687 9.288 -4.513 1.00 2.12 O ATOM 360 O5' DT A 12 -1.208 11.272 -4.252 1.00 1.40 O ATOM 361 C5' DT A 12 -0.445 12.382 -4.729 1.00 1.32 C ATOM 362 C4' DT A 12 0.436 12.917 -3.619 1.00 0.91 C ATOM 363 O4' DT A 12 -0.360 13.249 -2.460 1.00 0.80 O ATOM 364 C3' DT A 12 1.451 11.864 -3.156 1.00 0.84 C ATOM 365 O3' DT A 12 2.695 12.476 -2.817 1.00 0.73 O ATOM 366 C2' DT A 12 0.787 11.231 -1.939 1.00 0.87 C ATOM 367 C1' DT A 12 0.079 12.479 -1.327 1.00 0.67 C ATOM 368 N1 DT A 12 -1.032 12.079 -0.434 1.00 0.67 N ATOM 369 C2 DT A 12 -0.870 12.204 0.935 1.00 0.86 C ATOM 370 O2 DT A 12 0.155 12.616 1.461 1.00 1.15 O ATOM 371 N3 DT A 12 -1.943 11.825 1.701 1.00 0.87 N ATOM 372 C4 DT A 12 -3.143 11.338 1.244 1.00 0.72 C ATOM 373 O4 DT A 12 -4.022 11.036 2.045 1.00 0.75 O ATOM 374 C5 DT A 12 -3.229 11.236 -0.193 1.00 0.80 C ATOM 375 C7 DT A 12 -4.516 10.677 -0.814 1.00 1.18 C ATOM 376 C6 DT A 12 -2.183 11.608 -0.961 1.00 0.78 C ATOM 0 H5' DT A 12 -1.112 13.167 -5.086 1.00 1.32 H new ATOM 0 H5'' DT A 12 0.168 12.076 -5.576 1.00 1.32 H new ATOM 0 H4' DT A 12 0.945 13.793 -4.021 1.00 0.91 H new ATOM 0 H3' DT A 12 1.688 11.130 -3.926 1.00 0.84 H new ATOM 0 H2' DT A 12 0.082 10.446 -2.212 1.00 0.87 H new ATOM 0 H2'' DT A 12 1.510 10.787 -1.255 1.00 0.87 H new ATOM 0 H1' DT A 12 0.741 13.068 -0.692 1.00 0.67 H new ATOM 0 H3 DT A 12 -1.839 11.914 2.712 1.00 0.87 H new ATOM 0 H71 DT A 12 -4.972 9.965 -0.126 1.00 1.18 H new ATOM 0 H72 DT A 12 -5.212 11.494 -1.005 1.00 1.18 H new ATOM 0 H73 DT A 12 -4.279 10.175 -1.752 1.00 1.18 H new ATOM 0 H6 DT A 12 -2.270 11.526 -2.034 1.00 0.78 H new ATOM 389 P DA A 13 4.019 11.821 -3.446 1.00 0.66 P ATOM 390 OP1 DA A 13 5.184 12.635 -3.036 1.00 0.93 O ATOM 391 OP2 DA A 13 3.769 11.552 -4.882 1.00 0.95 O ATOM 392 O5' DA A 13 4.048 10.410 -2.663 1.00 0.48 O ATOM 393 C5' DA A 13 4.753 10.191 -1.431 1.00 0.41 C ATOM 394 C4' DA A 13 5.592 8.895 -1.522 1.00 0.43 C ATOM 395 O4' DA A 13 4.796 7.713 -1.706 1.00 0.46 O ATOM 396 C3' DA A 13 6.582 8.876 -2.699 1.00 0.47 C ATOM 397 O3' DA A 13 7.666 7.977 -2.438 1.00 0.56 O ATOM 398 C2' DA A 13 5.659 8.367 -3.810 1.00 0.45 C ATOM 399 C1' DA A 13 4.860 7.269 -3.074 1.00 0.45 C ATOM 400 N9 DA A 13 3.451 7.227 -3.533 1.00 0.44 N ATOM 401 C8 DA A 13 2.336 6.902 -2.803 1.00 0.46 C ATOM 402 N7 DA A 13 1.215 6.996 -3.466 1.00 0.55 N ATOM 403 C5 DA A 13 1.622 7.413 -4.734 1.00 0.56 C ATOM 404 C6 DA A 13 0.923 7.702 -5.921 1.00 0.68 C ATOM 405 N6 DA A 13 -0.398 7.630 -6.046 1.00 0.81 N ATOM 406 N1 DA A 13 1.643 8.085 -6.981 1.00 0.71 N ATOM 407 C2 DA A 13 2.962 8.178 -6.880 1.00 0.64 C ATOM 408 N3 DA A 13 3.727 7.937 -5.834 1.00 0.55 N ATOM 409 C4 DA A 13 2.979 7.553 -4.778 1.00 0.49 C ATOM 0 H5' DA A 13 4.045 10.118 -0.606 1.00 0.41 H new ATOM 0 H5'' DA A 13 5.403 11.040 -1.219 1.00 0.41 H new ATOM 0 H4' DA A 13 6.112 8.892 -0.564 1.00 0.43 H new ATOM 0 H3' DA A 13 7.072 9.824 -2.921 1.00 0.47 H new ATOM 0 H2' DA A 13 5.012 9.154 -4.197 1.00 0.45 H new ATOM 0 H2'' DA A 13 6.218 7.969 -4.657 1.00 0.45 H new ATOM 0 H1' DA A 13 5.328 6.298 -3.235 1.00 0.45 H new ATOM 0 H8 DA A 13 2.381 6.595 -1.769 1.00 0.46 H new ATOM 0 H61 DA A 13 -0.839 7.854 -6.938 1.00 0.81 H new ATOM 0 H62 DA A 13 -0.971 7.351 -5.250 1.00 0.81 H new ATOM 0 H2 DA A 13 3.479 8.493 -7.774 1.00 0.64 H new ATOM 421 P DG A 14 8.959 7.868 -3.399 1.00 0.47 P ATOM 422 OP1 DG A 14 9.093 9.150 -4.126 1.00 0.67 O ATOM 423 OP2 DG A 14 8.850 6.605 -4.167 1.00 0.58 O ATOM 424 O5' DG A 14 10.239 7.763 -2.400 1.00 0.42 O ATOM 425 C5' DG A 14 10.741 6.532 -1.852 1.00 0.39 C ATOM 426 C4' DG A 14 9.866 6.031 -0.703 1.00 0.42 C ATOM 427 O4' DG A 14 8.517 5.858 -1.137 1.00 0.44 O ATOM 428 C3' DG A 14 10.294 4.668 -0.131 1.00 0.53 C ATOM 429 O3' DG A 14 10.054 4.666 1.288 1.00 0.60 O ATOM 430 C2' DG A 14 9.335 3.737 -0.876 1.00 0.50 C ATOM 431 C1' DG A 14 8.061 4.580 -0.735 1.00 0.40 C ATOM 432 N9 DG A 14 6.904 4.246 -1.603 1.00 0.33 N ATOM 433 C8 DG A 14 6.823 4.024 -2.968 1.00 0.33 C ATOM 434 N7 DG A 14 5.603 3.814 -3.388 1.00 0.32 N ATOM 435 C5 DG A 14 4.827 3.898 -2.238 1.00 0.29 C ATOM 436 C6 DG A 14 3.425 3.757 -2.073 1.00 0.32 C ATOM 437 O6 DG A 14 2.579 3.538 -2.931 1.00 0.35 O ATOM 438 N1 DG A 14 3.048 3.912 -0.759 1.00 0.36 N ATOM 439 C2 DG A 14 3.917 4.171 0.273 1.00 0.40 C ATOM 440 N2 DG A 14 3.431 4.274 1.493 1.00 0.50 N ATOM 441 N3 DG A 14 5.228 4.307 0.136 1.00 0.38 N ATOM 442 C4 DG A 14 5.615 4.159 -1.148 1.00 0.31 C ATOM 0 H5' DG A 14 11.761 6.680 -1.496 1.00 0.39 H new ATOM 0 H5'' DG A 14 10.784 5.775 -2.635 1.00 0.39 H new ATOM 0 H4' DG A 14 9.972 6.795 0.067 1.00 0.42 H new ATOM 0 H3' DG A 14 11.343 4.398 -0.256 1.00 0.53 H new ATOM 0 H2' DG A 14 9.623 3.573 -1.914 1.00 0.50 H new ATOM 0 H2'' DG A 14 9.248 2.755 -0.410 1.00 0.50 H new ATOM 0 H1' DG A 14 7.669 4.445 0.273 1.00 0.40 H new ATOM 0 H8 DG A 14 7.683 4.024 -3.621 1.00 0.33 H new ATOM 0 H1 DG A 14 2.056 3.829 -0.536 1.00 0.36 H new ATOM 0 H21 DG A 14 4.056 4.466 2.276 1.00 0.50 H new ATOM 0 H22 DG A 14 2.430 4.162 1.654 1.00 0.50 H new ATOM 454 P DG A 15 10.492 3.469 2.284 1.00 0.84 P ATOM 455 OP1 DG A 15 10.354 3.963 3.672 1.00 1.04 O ATOM 456 OP2 DG A 15 11.791 2.933 1.819 1.00 0.98 O ATOM 457 O5' DG A 15 9.360 2.346 2.021 1.00 0.83 O ATOM 458 C5' DG A 15 7.979 2.503 2.401 1.00 0.80 C ATOM 459 C4' DG A 15 7.673 1.932 3.787 1.00 0.69 C ATOM 460 O4' DG A 15 6.273 2.037 4.079 1.00 0.68 O ATOM 461 C3' DG A 15 8.041 0.468 4.038 1.00 0.58 C ATOM 462 O3' DG A 15 8.290 0.347 5.449 1.00 0.58 O ATOM 463 C2' DG A 15 6.739 -0.252 3.604 1.00 0.52 C ATOM 464 C1' DG A 15 5.716 0.725 4.237 1.00 0.56 C ATOM 465 N9 DG A 15 4.421 0.724 3.541 1.00 0.56 N ATOM 466 C8 DG A 15 3.192 0.849 4.107 1.00 0.64 C ATOM 467 N7 DG A 15 2.203 0.835 3.250 1.00 0.64 N ATOM 468 C5 DG A 15 2.845 0.688 2.023 1.00 0.55 C ATOM 469 C6 DG A 15 2.311 0.605 0.715 1.00 0.53 C ATOM 470 O6 DG A 15 1.140 0.649 0.361 1.00 0.58 O ATOM 471 N1 DG A 15 3.295 0.460 -0.229 1.00 0.51 N ATOM 472 C2 DG A 15 4.638 0.399 0.040 1.00 0.53 C ATOM 473 N2 DG A 15 5.473 0.249 -0.966 1.00 0.61 N ATOM 474 N3 DG A 15 5.154 0.475 1.254 1.00 0.51 N ATOM 475 C4 DG A 15 4.200 0.619 2.197 1.00 0.51 C ATOM 0 H5' DG A 15 7.346 2.010 1.663 1.00 0.80 H new ATOM 0 H5'' DG A 15 7.721 3.562 2.385 1.00 0.80 H new ATOM 0 H4' DG A 15 8.311 2.540 4.428 1.00 0.69 H new ATOM 0 H3' DG A 15 8.916 0.075 3.520 1.00 0.58 H new ATOM 0 H2' DG A 15 6.638 -0.328 2.521 1.00 0.52 H new ATOM 0 H2'' DG A 15 6.661 -1.263 4.003 1.00 0.52 H new ATOM 0 H1' DG A 15 5.541 0.429 5.271 1.00 0.56 H new ATOM 0 H8 DG A 15 3.044 0.951 5.172 1.00 0.64 H new ATOM 0 H1 DG A 15 3.006 0.392 -1.205 1.00 0.51 H new ATOM 0 H21 DG A 15 6.477 0.201 -0.793 1.00 0.61 H new ATOM 0 H22 DG A 15 5.116 0.181 -1.919 1.00 0.61 H new ATOM 487 P DG A 16 8.930 -0.962 6.147 1.00 0.48 P ATOM 488 OP1 DG A 16 9.551 -0.554 7.428 1.00 0.66 O ATOM 489 OP2 DG A 16 9.739 -1.684 5.139 1.00 0.61 O ATOM 490 O5' DG A 16 7.625 -1.847 6.467 1.00 0.44 O ATOM 491 C5' DG A 16 6.616 -1.365 7.367 1.00 0.38 C ATOM 492 C4' DG A 16 5.255 -1.954 7.028 1.00 0.37 C ATOM 493 O4' DG A 16 4.815 -1.675 5.685 1.00 0.43 O ATOM 494 C3' DG A 16 5.207 -3.472 7.189 1.00 0.44 C ATOM 495 O3' DG A 16 3.925 -3.761 7.760 1.00 0.69 O ATOM 496 C2' DG A 16 5.265 -3.918 5.726 1.00 0.42 C ATOM 497 C1' DG A 16 4.290 -2.901 5.173 1.00 0.40 C ATOM 498 N9 DG A 16 4.138 -2.921 3.708 1.00 0.32 N ATOM 499 C8 DG A 16 5.073 -3.138 2.737 1.00 0.30 C ATOM 500 N7 DG A 16 4.602 -3.074 1.518 1.00 0.28 N ATOM 501 C5 DG A 16 3.251 -2.797 1.709 1.00 0.28 C ATOM 502 C6 DG A 16 2.207 -2.612 0.767 1.00 0.32 C ATOM 503 O6 DG A 16 2.251 -2.652 -0.452 1.00 0.35 O ATOM 504 N1 DG A 16 1.008 -2.355 1.366 1.00 0.39 N ATOM 505 C2 DG A 16 0.814 -2.280 2.720 1.00 0.43 C ATOM 506 N2 DG A 16 -0.410 -2.031 3.138 1.00 0.55 N ATOM 507 N3 DG A 16 1.772 -2.449 3.625 1.00 0.40 N ATOM 508 C4 DG A 16 2.966 -2.704 3.045 1.00 0.31 C ATOM 0 H5' DG A 16 6.568 -0.277 7.316 1.00 0.38 H new ATOM 0 H5'' DG A 16 6.883 -1.625 8.391 1.00 0.38 H new ATOM 0 H4' DG A 16 4.594 -1.465 7.744 1.00 0.37 H new ATOM 0 H3' DG A 16 5.975 -3.938 7.806 1.00 0.44 H new ATOM 0 H2' DG A 16 6.262 -3.835 5.293 1.00 0.42 H new ATOM 0 H2'' DG A 16 4.938 -4.948 5.579 1.00 0.42 H new ATOM 0 H1' DG A 16 3.262 -3.096 5.479 1.00 0.40 H new ATOM 0 H8 DG A 16 6.110 -3.344 2.956 1.00 0.30 H new ATOM 0 H1 DG A 16 0.199 -2.208 0.763 1.00 0.39 H new ATOM 0 H21 DG A 16 -0.604 -1.966 4.137 1.00 0.55 H new ATOM 0 H22 DG A 16 -1.164 -1.903 2.462 1.00 0.55 H new ATOM 520 P DT A 17 3.728 -4.788 8.972 1.00 0.88 P ATOM 521 OP1 DT A 17 2.423 -4.492 9.607 1.00 1.18 O ATOM 522 OP2 DT A 17 4.964 -4.803 9.790 1.00 1.20 O ATOM 523 O5' DT A 17 3.624 -6.198 8.204 1.00 0.77 O ATOM 524 C5' DT A 17 3.492 -7.424 8.933 1.00 0.76 C ATOM 525 C4' DT A 17 2.200 -8.153 8.586 1.00 0.68 C ATOM 526 O4' DT A 17 1.013 -7.392 8.861 1.00 0.74 O ATOM 527 C3' DT A 17 2.065 -8.600 7.146 1.00 0.60 C ATOM 528 O3' DT A 17 1.312 -9.824 7.216 1.00 0.61 O ATOM 529 C2' DT A 17 1.285 -7.434 6.551 1.00 0.61 C ATOM 530 C1' DT A 17 0.239 -7.355 7.652 1.00 0.63 C ATOM 531 N1 DT A 17 -0.615 -6.153 7.583 1.00 0.68 N ATOM 532 C2 DT A 17 -1.879 -6.258 7.024 1.00 0.77 C ATOM 533 O2 DT A 17 -2.333 -7.299 6.561 1.00 0.88 O ATOM 534 N3 DT A 17 -2.624 -5.103 7.009 1.00 0.92 N ATOM 535 C4 DT A 17 -2.234 -3.875 7.490 1.00 1.00 C ATOM 536 O4 DT A 17 -3.002 -2.923 7.424 1.00 1.22 O ATOM 537 C5 DT A 17 -0.899 -3.854 8.053 1.00 1.03 C ATOM 538 C7 DT A 17 -0.328 -2.553 8.619 1.00 1.41 C ATOM 539 C6 DT A 17 -0.153 -4.973 8.079 1.00 0.90 C ATOM 0 H5' DT A 17 3.515 -7.215 10.003 1.00 0.76 H new ATOM 0 H5'' DT A 17 4.343 -8.069 8.716 1.00 0.76 H new ATOM 0 H4' DT A 17 2.282 -9.024 9.236 1.00 0.68 H new ATOM 0 H3' DT A 17 2.966 -8.800 6.566 1.00 0.60 H new ATOM 0 H2' DT A 17 1.877 -6.524 6.450 1.00 0.61 H new ATOM 0 H2'' DT A 17 0.864 -7.651 5.569 1.00 0.61 H new ATOM 0 H1' DT A 17 -0.479 -8.171 7.573 1.00 0.63 H new ATOM 0 H3 DT A 17 -3.557 -5.162 6.601 1.00 0.92 H new ATOM 0 H71 DT A 17 0.370 -2.782 9.424 1.00 1.41 H new ATOM 0 H72 DT A 17 0.194 -2.011 7.830 1.00 1.41 H new ATOM 0 H73 DT A 17 -1.140 -1.937 9.006 1.00 1.41 H new ATOM 0 H6 DT A 17 0.839 -4.934 8.505 1.00 0.90 H new ATOM 552 P DT A 18 0.562 -10.479 5.962 1.00 0.63 P ATOM 553 OP1 DT A 18 -0.357 -9.479 5.381 1.00 0.74 O ATOM 554 OP2 DT A 18 0.034 -11.795 6.382 1.00 0.91 O ATOM 555 O5' DT A 18 1.782 -10.706 4.943 1.00 0.49 O ATOM 556 C5' DT A 18 2.655 -11.821 5.134 1.00 0.54 C ATOM 557 C4' DT A 18 3.608 -12.031 3.983 1.00 0.47 C ATOM 558 O4' DT A 18 2.883 -12.146 2.760 1.00 0.45 O ATOM 559 C3' DT A 18 4.689 -10.940 3.762 1.00 0.41 C ATOM 560 O3' DT A 18 5.837 -11.544 3.157 1.00 0.50 O ATOM 561 C2' DT A 18 3.989 -9.983 2.776 1.00 0.37 C ATOM 562 C1' DT A 18 3.211 -11.037 1.923 1.00 0.37 C ATOM 563 N1 DT A 18 1.935 -10.470 1.415 1.00 0.35 N ATOM 564 C2 DT A 18 1.777 -10.385 0.048 1.00 0.36 C ATOM 565 O2 DT A 18 2.609 -10.807 -0.748 1.00 0.42 O ATOM 566 N3 DT A 18 0.617 -9.819 -0.411 1.00 0.40 N ATOM 567 C4 DT A 18 -0.409 -9.331 0.360 1.00 0.48 C ATOM 568 O4 DT A 18 -1.401 -8.842 -0.173 1.00 0.61 O ATOM 569 C5 DT A 18 -0.178 -9.460 1.784 1.00 0.50 C ATOM 570 C7 DT A 18 -1.238 -8.950 2.747 1.00 0.69 C ATOM 571 C6 DT A 18 0.959 -10.014 2.266 1.00 0.41 C ATOM 0 H5' DT A 18 2.058 -12.722 5.273 1.00 0.54 H new ATOM 0 H5'' DT A 18 3.228 -11.674 6.050 1.00 0.54 H new ATOM 0 H4' DT A 18 4.137 -12.941 4.266 1.00 0.47 H new ATOM 0 H3' DT A 18 5.033 -10.442 4.669 1.00 0.41 H new ATOM 0 H2' DT A 18 3.328 -9.274 3.275 1.00 0.37 H new ATOM 0 H2'' DT A 18 4.694 -9.399 2.184 1.00 0.37 H new ATOM 0 H1' DT A 18 3.839 -11.334 1.083 1.00 0.37 H new ATOM 0 H3 DT A 18 0.505 -9.754 -1.423 1.00 0.40 H new ATOM 0 H71 DT A 18 -1.215 -9.544 3.661 1.00 0.69 H new ATOM 0 H72 DT A 18 -1.039 -7.906 2.987 1.00 0.69 H new ATOM 0 H73 DT A 18 -2.221 -9.035 2.284 1.00 0.69 H new ATOM 0 H6 DT A 18 1.100 -10.098 3.333 1.00 0.41 H new ATOM 584 P DA A 19 7.265 -10.802 3.109 1.00 0.56 P ATOM 585 OP1 DA A 19 8.276 -11.801 2.698 1.00 0.71 O ATOM 586 OP2 DA A 19 7.445 -10.056 4.376 1.00 0.71 O ATOM 587 O5' DA A 19 7.081 -9.733 1.915 1.00 0.51 O ATOM 588 C5' DA A 19 7.189 -10.094 0.528 1.00 0.45 C ATOM 589 C4' DA A 19 7.215 -8.816 -0.367 1.00 0.41 C ATOM 590 O4' DA A 19 5.958 -8.125 -0.336 1.00 0.44 O ATOM 591 C3' DA A 19 8.259 -7.724 -0.012 1.00 0.37 C ATOM 592 O3' DA A 19 8.545 -6.985 -1.218 1.00 0.42 O ATOM 593 C2' DA A 19 7.464 -6.916 1.025 1.00 0.38 C ATOM 594 C1' DA A 19 6.139 -6.821 0.242 1.00 0.39 C ATOM 595 N9 DA A 19 4.965 -6.604 1.107 1.00 0.38 N ATOM 596 C8 DA A 19 4.807 -6.663 2.481 1.00 0.39 C ATOM 597 N7 DA A 19 3.591 -6.424 2.875 1.00 0.44 N ATOM 598 C5 DA A 19 2.901 -6.191 1.690 1.00 0.44 C ATOM 599 C6 DA A 19 1.574 -5.883 1.422 1.00 0.51 C ATOM 600 N6 DA A 19 0.673 -5.749 2.382 1.00 0.61 N ATOM 601 N1 DA A 19 1.219 -5.717 0.135 1.00 0.50 N ATOM 602 C2 DA A 19 2.128 -5.848 -0.827 1.00 0.44 C ATOM 603 N3 DA A 19 3.409 -6.138 -0.689 1.00 0.42 N ATOM 604 C4 DA A 19 3.729 -6.298 0.615 1.00 0.39 C ATOM 0 H5' DA A 19 6.349 -10.727 0.244 1.00 0.45 H new ATOM 0 H5'' DA A 19 8.096 -10.677 0.367 1.00 0.45 H new ATOM 0 H4' DA A 19 7.473 -9.246 -1.335 1.00 0.41 H new ATOM 0 H3' DA A 19 9.227 -8.050 0.368 1.00 0.37 H new ATOM 0 H2' DA A 19 7.359 -7.432 1.979 1.00 0.38 H new ATOM 0 H2'' DA A 19 7.905 -5.942 1.236 1.00 0.38 H new ATOM 0 H1' DA A 19 6.203 -5.989 -0.459 1.00 0.39 H new ATOM 0 H8 DA A 19 5.616 -6.886 3.161 1.00 0.39 H new ATOM 0 H61 DA A 19 -0.293 -5.522 2.147 1.00 0.61 H new ATOM 0 H62 DA A 19 0.945 -5.873 3.357 1.00 0.61 H new ATOM 0 H2 DA A 19 1.778 -5.700 -1.838 1.00 0.44 H new ATOM 616 P DG A 20 9.201 -5.508 -1.290 1.00 0.50 P ATOM 617 OP1 DG A 20 10.482 -5.526 -0.551 1.00 0.69 O ATOM 618 OP2 DG A 20 8.152 -4.519 -0.940 1.00 0.55 O ATOM 619 O5' DG A 20 9.510 -5.364 -2.862 1.00 0.53 O ATOM 620 C5' DG A 20 8.399 -5.237 -3.754 1.00 0.46 C ATOM 621 C4' DG A 20 8.808 -4.912 -5.186 1.00 0.44 C ATOM 622 O4' DG A 20 7.606 -4.698 -5.925 1.00 0.44 O ATOM 623 C3' DG A 20 9.586 -3.611 -5.398 1.00 0.43 C ATOM 624 O3' DG A 20 10.122 -3.784 -6.722 1.00 0.49 O ATOM 625 C2' DG A 20 8.449 -2.606 -5.244 1.00 0.39 C ATOM 626 C1' DG A 20 7.483 -3.298 -6.199 1.00 0.39 C ATOM 627 N9 DG A 20 6.081 -2.990 -5.933 1.00 0.35 N ATOM 628 C8 DG A 20 5.110 -2.707 -6.840 1.00 0.37 C ATOM 629 N7 DG A 20 3.931 -2.508 -6.302 1.00 0.39 N ATOM 630 C5 DG A 20 4.165 -2.675 -4.936 1.00 0.35 C ATOM 631 C6 DG A 20 3.283 -2.587 -3.835 1.00 0.38 C ATOM 632 O6 DG A 20 2.081 -2.351 -3.842 1.00 0.43 O ATOM 633 N1 DG A 20 3.928 -2.822 -2.642 1.00 0.35 N ATOM 634 C2 DG A 20 5.257 -3.114 -2.493 1.00 0.34 C ATOM 635 N2 DG A 20 5.712 -3.335 -1.267 1.00 0.39 N ATOM 636 N3 DG A 20 6.094 -3.200 -3.519 1.00 0.35 N ATOM 637 C4 DG A 20 5.479 -2.970 -4.705 1.00 0.33 C ATOM 0 H5' DG A 20 7.735 -4.454 -3.387 1.00 0.46 H new ATOM 0 H5'' DG A 20 7.830 -6.166 -3.748 1.00 0.46 H new ATOM 0 H4' DG A 20 9.445 -5.744 -5.485 1.00 0.44 H new ATOM 0 H3' DG A 20 10.417 -3.318 -4.756 1.00 0.43 H new ATOM 0 H2' DG A 20 8.071 -2.533 -4.224 1.00 0.39 H new ATOM 0 H2'' DG A 20 8.718 -1.597 -5.557 1.00 0.39 H new ATOM 0 H1' DG A 20 7.727 -2.981 -7.213 1.00 0.39 H new ATOM 0 H8 DG A 20 5.292 -2.651 -7.903 1.00 0.37 H new ATOM 0 H1 DG A 20 3.365 -2.774 -1.793 1.00 0.35 H new ATOM 0 H21 DG A 20 6.697 -3.555 -1.121 1.00 0.39 H new ATOM 0 H22 DG A 20 5.077 -3.285 -0.471 1.00 0.39 H new ATOM 649 P DG A 21 10.944 -2.739 -7.621 1.00 0.54 P ATOM 650 OP1 DG A 21 11.590 -3.494 -8.717 1.00 0.79 O ATOM 651 OP2 DG A 21 11.766 -1.895 -6.723 1.00 0.70 O ATOM 652 O5' DG A 21 9.763 -1.844 -8.259 1.00 0.56 O ATOM 653 C5' DG A 21 9.696 -0.427 -8.076 1.00 0.52 C ATOM 654 C4' DG A 21 8.347 0.146 -8.512 1.00 0.40 C ATOM 655 O4' DG A 21 7.267 -0.264 -7.657 1.00 0.40 O ATOM 656 C3' DG A 21 8.384 1.694 -8.418 1.00 0.43 C ATOM 657 O3' DG A 21 7.506 2.390 -9.315 1.00 0.44 O ATOM 658 C2' DG A 21 7.821 1.865 -7.024 1.00 0.46 C ATOM 659 C1' DG A 21 6.622 0.930 -7.211 1.00 0.36 C ATOM 660 N9 DG A 21 5.897 0.708 -5.947 1.00 0.36 N ATOM 661 C8 DG A 21 6.379 0.373 -4.702 1.00 0.45 C ATOM 662 N7 DG A 21 5.446 0.264 -3.796 1.00 0.45 N ATOM 663 C5 DG A 21 4.272 0.543 -4.485 1.00 0.38 C ATOM 664 C6 DG A 21 2.931 0.579 -4.029 1.00 0.43 C ATOM 665 O6 DG A 21 2.502 0.370 -2.903 1.00 0.49 O ATOM 666 N1 DG A 21 2.056 0.899 -5.036 1.00 0.47 N ATOM 667 C2 DG A 21 2.423 1.156 -6.334 1.00 0.45 C ATOM 668 N2 DG A 21 1.475 1.452 -7.195 1.00 0.57 N ATOM 669 N3 DG A 21 3.670 1.129 -6.779 1.00 0.38 N ATOM 670 C4 DG A 21 4.543 0.815 -5.799 1.00 0.34 C ATOM 0 H5' DG A 21 10.493 0.050 -8.646 1.00 0.52 H new ATOM 0 H5'' DG A 21 9.868 -0.189 -7.026 1.00 0.52 H new ATOM 0 H4' DG A 21 8.180 -0.218 -9.526 1.00 0.40 H new ATOM 0 H3' DG A 21 9.374 2.087 -8.650 1.00 0.43 H new ATOM 0 H2' DG A 21 8.504 1.541 -6.239 1.00 0.46 H new ATOM 0 H2'' DG A 21 7.537 2.892 -6.795 1.00 0.46 H new ATOM 0 H1' DG A 21 5.863 1.314 -7.893 1.00 0.36 H new ATOM 0 H8 DG A 21 7.427 0.216 -4.495 1.00 0.45 H new ATOM 0 H1 DG A 21 1.064 0.950 -4.804 1.00 0.47 H new ATOM 0 H21 DG A 21 1.712 1.649 -8.167 1.00 0.57 H new ATOM 0 H22 DG A 21 0.502 1.485 -6.891 1.00 0.57 H new ATOM 682 P DG A 22 7.508 2.248 -10.917 1.00 0.58 P ATOM 683 OP1 DG A 22 7.039 0.889 -11.273 1.00 0.76 O ATOM 684 OP2 DG A 22 8.792 2.759 -11.446 1.00 0.89 O ATOM 685 O5' DG A 22 6.343 3.303 -11.285 1.00 0.68 O ATOM 686 C5' DG A 22 5.040 3.227 -10.680 1.00 0.59 C ATOM 687 C4' DG A 22 4.005 3.960 -11.533 1.00 0.46 C ATOM 688 O4' DG A 22 2.716 3.853 -10.919 1.00 0.46 O ATOM 689 C3' DG A 22 4.251 5.466 -11.727 1.00 0.44 C ATOM 690 O3' DG A 22 3.604 5.984 -12.893 1.00 0.60 O ATOM 691 C2' DG A 22 3.508 6.021 -10.514 1.00 0.42 C ATOM 692 C1' DG A 22 2.222 5.170 -10.654 1.00 0.42 C ATOM 693 N9 DG A 22 1.427 5.058 -9.416 1.00 0.38 N ATOM 694 C8 DG A 22 0.069 5.153 -9.269 1.00 0.46 C ATOM 695 N7 DG A 22 -0.346 4.962 -8.048 1.00 0.45 N ATOM 696 C5 DG A 22 0.822 4.726 -7.332 1.00 0.34 C ATOM 697 C6 DG A 22 1.005 4.453 -5.955 1.00 0.31 C ATOM 698 O6 DG A 22 0.155 4.357 -5.078 1.00 0.38 O ATOM 699 N1 DG A 22 2.328 4.278 -5.636 1.00 0.27 N ATOM 700 C2 DG A 22 3.367 4.353 -6.529 1.00 0.29 C ATOM 701 N2 DG A 22 4.590 4.157 -6.075 1.00 0.37 N ATOM 702 N3 DG A 22 3.214 4.609 -7.824 1.00 0.30 N ATOM 703 C4 DG A 22 1.913 4.783 -8.158 1.00 0.31 C ATOM 0 H5' DG A 22 5.071 3.664 -9.682 1.00 0.59 H new ATOM 0 H5'' DG A 22 4.748 2.183 -10.562 1.00 0.59 H new ATOM 0 H4' DG A 22 4.077 3.479 -12.508 1.00 0.46 H new ATOM 0 H3' DG A 22 5.308 5.710 -11.829 1.00 0.44 H new ATOM 0 H2' DG A 22 4.034 5.848 -9.575 1.00 0.42 H new ATOM 0 H2'' DG A 22 3.320 7.093 -10.582 1.00 0.42 H new ATOM 0 HO3' DG A 22 3.789 6.943 -12.971 1.00 0.60 H new ATOM 0 H1' DG A 22 1.577 5.622 -11.408 1.00 0.42 H new ATOM 0 H8 DG A 22 -0.598 5.367 -10.091 1.00 0.46 H new ATOM 0 H1 DG A 22 2.556 4.077 -4.662 1.00 0.27 H new ATOM 0 H21 DG A 22 5.385 4.206 -6.713 1.00 0.37 H new ATOM 0 H22 DG A 22 4.741 3.957 -5.086 1.00 0.37 H new TER 716 DG A 22