USER MOD reduce.3.24.130724 H: found=0, std=0, add=251, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 251 hydrogens (11 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DG O5' : rot 33:sc= 0.00983 USER MOD Single : A 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DT C7 :methyl -30:sc= -1.01 (180deg=-2.71!) USER MOD Single : A 11 DG O3' : rot 180:sc= 0 USER MOD Single : B 12 DC O5' : rot 180:sc= 0 USER MOD Single : B 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 20 DT C7 :methyl 150:sc= -0.0686 (180deg=-0.0686) USER MOD Single : B 22 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 7.904 -16.178 -10.609 1.00 0.83 O ATOM 2 C5' DG A 1 7.548 -17.008 -11.718 1.00 0.87 C ATOM 3 C4' DG A 1 6.270 -16.498 -12.379 1.00 0.82 C ATOM 4 O4' DG A 1 5.198 -16.449 -11.425 1.00 0.74 O ATOM 5 C3' DG A 1 6.418 -15.086 -12.962 1.00 0.80 C ATOM 6 O3' DG A 1 6.144 -15.232 -14.363 1.00 0.88 O ATOM 7 C2' DG A 1 5.382 -14.283 -12.148 1.00 0.72 C ATOM 8 C1' DG A 1 4.391 -15.297 -11.698 1.00 0.70 C ATOM 9 N9 DG A 1 3.709 -14.959 -10.435 1.00 0.57 N ATOM 10 C8 DG A 1 4.254 -14.702 -9.215 1.00 0.51 C ATOM 11 N7 DG A 1 3.421 -14.474 -8.246 1.00 0.48 N ATOM 12 C5 DG A 1 2.188 -14.589 -8.891 1.00 0.48 C ATOM 13 C6 DG A 1 0.872 -14.452 -8.378 1.00 0.47 C ATOM 14 O6 DG A 1 0.493 -14.207 -7.238 1.00 0.48 O ATOM 15 N1 DG A 1 -0.074 -14.644 -9.355 1.00 0.50 N ATOM 16 C2 DG A 1 0.189 -14.931 -10.667 1.00 0.58 C ATOM 17 N2 DG A 1 -0.853 -15.052 -11.467 1.00 0.67 N ATOM 18 N3 DG A 1 1.411 -15.067 -11.164 1.00 0.61 N ATOM 19 C4 DG A 1 2.360 -14.883 -10.223 1.00 0.54 C ATOM 0 H5' DG A 1 7.405 -18.035 -11.380 1.00 0.87 H new ATOM 0 H5'' DG A 1 8.360 -17.022 -12.445 1.00 0.87 H new ATOM 0 H4' DG A 1 6.059 -17.197 -13.188 1.00 0.82 H new ATOM 0 H3' DG A 1 7.382 -14.582 -12.893 1.00 0.80 H new ATOM 0 H2' DG A 1 5.847 -13.780 -11.300 1.00 0.72 H new ATOM 0 H2'' DG A 1 4.911 -13.511 -12.757 1.00 0.72 H new ATOM 0 HO5' DG A 1 7.091 -15.831 -10.186 1.00 0.83 H new ATOM 0 H1' DG A 1 3.613 -15.405 -12.453 1.00 0.70 H new ATOM 0 H8 DG A 1 5.323 -14.688 -9.061 1.00 0.51 H new ATOM 0 H1 DG A 1 -1.053 -14.566 -9.080 1.00 0.50 H new ATOM 0 H21 DG A 1 -0.715 -15.265 -12.455 1.00 0.67 H new ATOM 0 H22 DG A 1 -1.796 -14.932 -11.098 1.00 0.67 H new ATOM 32 P DC A 2 5.393 -14.150 -15.272 1.00 0.77 P ATOM 33 OP1 DC A 2 5.310 -14.674 -16.651 1.00 0.95 O ATOM 34 OP2 DC A 2 5.986 -12.822 -15.018 1.00 1.07 O ATOM 35 O5' DC A 2 3.943 -14.206 -14.593 1.00 0.37 O ATOM 36 C5' DC A 2 2.783 -14.824 -15.158 1.00 0.35 C ATOM 37 C4' DC A 2 1.573 -13.918 -14.949 1.00 0.40 C ATOM 38 O4' DC A 2 1.268 -13.649 -13.553 1.00 0.43 O ATOM 39 C3' DC A 2 1.879 -12.575 -15.605 1.00 0.42 C ATOM 40 O3' DC A 2 0.714 -12.106 -16.288 1.00 0.54 O ATOM 41 C2' DC A 2 2.259 -11.766 -14.333 1.00 0.36 C ATOM 42 C1' DC A 2 1.181 -12.225 -13.349 1.00 0.39 C ATOM 43 N1 DC A 2 1.287 -11.819 -11.902 1.00 0.31 N ATOM 44 C2 DC A 2 0.102 -11.750 -11.166 1.00 0.27 C ATOM 45 O2 DC A 2 -1.003 -11.952 -11.663 1.00 0.31 O ATOM 46 N3 DC A 2 0.173 -11.427 -9.848 1.00 0.25 N ATOM 47 C4 DC A 2 1.341 -11.180 -9.251 1.00 0.25 C ATOM 48 N4 DC A 2 1.365 -10.879 -7.961 1.00 0.28 N ATOM 49 C5 DC A 2 2.559 -11.239 -9.974 1.00 0.29 C ATOM 50 C6 DC A 2 2.486 -11.553 -11.275 1.00 0.34 C ATOM 0 H5' DC A 2 2.610 -15.794 -14.691 1.00 0.35 H new ATOM 0 H5'' DC A 2 2.936 -15.005 -16.222 1.00 0.35 H new ATOM 0 H4' DC A 2 0.715 -14.434 -15.379 1.00 0.40 H new ATOM 0 H3' DC A 2 2.650 -12.543 -16.375 1.00 0.42 H new ATOM 0 H2' DC A 2 3.263 -12.002 -13.981 1.00 0.36 H new ATOM 0 H2'' DC A 2 2.226 -10.690 -14.506 1.00 0.36 H new ATOM 0 H1' DC A 2 0.223 -11.745 -13.551 1.00 0.39 H new ATOM 0 H41 DC A 2 2.254 -10.689 -7.498 1.00 0.28 H new ATOM 0 H42 DC A 2 0.495 -10.837 -7.431 1.00 0.28 H new ATOM 0 H5 DC A 2 3.507 -11.039 -9.496 1.00 0.29 H new ATOM 0 H6 DC A 2 3.398 -11.599 -11.852 1.00 0.34 H new ATOM 62 P DA A 3 0.661 -10.721 -17.104 1.00 0.65 P ATOM 63 OP1 DA A 3 0.252 -11.013 -18.494 1.00 0.92 O ATOM 64 OP2 DA A 3 1.901 -9.955 -16.845 1.00 0.74 O ATOM 65 O5' DA A 3 -0.542 -9.989 -16.353 1.00 0.52 O ATOM 66 C5' DA A 3 -1.872 -10.505 -16.490 1.00 0.45 C ATOM 67 C4' DA A 3 -2.868 -9.677 -15.715 1.00 0.39 C ATOM 68 O4' DA A 3 -2.572 -9.725 -14.300 1.00 0.42 O ATOM 69 C3' DA A 3 -2.810 -8.204 -16.167 1.00 0.36 C ATOM 70 O3' DA A 3 -4.119 -7.727 -16.496 1.00 0.39 O ATOM 71 C2' DA A 3 -2.161 -7.522 -14.940 1.00 0.34 C ATOM 72 C1' DA A 3 -2.551 -8.397 -13.755 1.00 0.35 C ATOM 73 N9 DA A 3 -1.631 -8.354 -12.587 1.00 0.35 N ATOM 74 C8 DA A 3 -0.262 -8.346 -12.527 1.00 0.41 C ATOM 75 N7 DA A 3 0.261 -8.323 -11.335 1.00 0.42 N ATOM 76 C5 DA A 3 -0.867 -8.314 -10.515 1.00 0.34 C ATOM 77 C6 DA A 3 -1.028 -8.291 -9.120 1.00 0.31 C ATOM 78 N6 DA A 3 -0.004 -8.272 -8.273 1.00 0.37 N ATOM 79 N1 DA A 3 -2.277 -8.288 -8.634 1.00 0.26 N ATOM 80 C2 DA A 3 -3.305 -8.308 -9.474 1.00 0.26 C ATOM 81 N3 DA A 3 -3.283 -8.331 -10.798 1.00 0.28 N ATOM 82 C4 DA A 3 -2.016 -8.333 -11.263 1.00 0.30 C ATOM 0 H5' DA A 3 -1.902 -11.536 -16.138 1.00 0.45 H new ATOM 0 H5'' DA A 3 -2.151 -10.520 -17.544 1.00 0.45 H new ATOM 0 H4' DA A 3 -3.860 -10.088 -15.904 1.00 0.39 H new ATOM 0 H3' DA A 3 -2.244 -8.011 -17.078 1.00 0.36 H new ATOM 0 H2' DA A 3 -1.078 -7.462 -15.048 1.00 0.34 H new ATOM 0 H2'' DA A 3 -2.526 -6.502 -14.816 1.00 0.34 H new ATOM 0 H1' DA A 3 -3.497 -8.043 -13.346 1.00 0.35 H new ATOM 0 H8 DA A 3 0.348 -8.358 -13.418 1.00 0.41 H new ATOM 0 H61 DA A 3 -0.174 -8.256 -7.267 1.00 0.37 H new ATOM 0 H62 DA A 3 0.952 -8.274 -8.629 1.00 0.37 H new ATOM 0 H2 DA A 3 -4.285 -8.305 -9.019 1.00 0.26 H new ATOM 94 P DT A 4 -4.507 -6.169 -16.638 1.00 0.41 P ATOM 95 OP1 DT A 4 -5.749 -6.068 -17.434 1.00 0.50 O ATOM 96 OP2 DT A 4 -3.306 -5.404 -17.042 1.00 0.51 O ATOM 97 O5' DT A 4 -4.836 -5.813 -15.108 1.00 0.38 O ATOM 98 C5' DT A 4 -5.841 -6.554 -14.401 1.00 0.35 C ATOM 99 C4' DT A 4 -6.031 -6.069 -12.976 1.00 0.34 C ATOM 100 O4' DT A 4 -4.843 -6.247 -12.172 1.00 0.27 O ATOM 101 C3' DT A 4 -6.415 -4.584 -12.929 1.00 0.40 C ATOM 102 O3' DT A 4 -7.579 -4.412 -12.110 1.00 0.46 O ATOM 103 C2' DT A 4 -5.165 -4.005 -12.265 1.00 0.33 C ATOM 104 C1' DT A 4 -4.758 -5.119 -11.298 1.00 0.27 C ATOM 105 N1 DT A 4 -3.416 -5.010 -10.672 1.00 0.26 N ATOM 106 C2 DT A 4 -3.330 -5.106 -9.289 1.00 0.24 C ATOM 107 O2 DT A 4 -4.302 -5.255 -8.556 1.00 0.29 O ATOM 108 N3 DT A 4 -2.068 -5.021 -8.753 1.00 0.26 N ATOM 109 C4 DT A 4 -0.898 -4.852 -9.452 1.00 0.34 C ATOM 110 O4 DT A 4 0.166 -4.806 -8.845 1.00 0.42 O ATOM 111 C5 DT A 4 -1.077 -4.759 -10.882 1.00 0.39 C ATOM 112 C7 DT A 4 0.112 -4.561 -11.810 1.00 0.54 C ATOM 113 C6 DT A 4 -2.296 -4.838 -11.429 1.00 0.32 C ATOM 0 H5' DT A 4 -5.567 -7.609 -14.388 1.00 0.35 H new ATOM 0 H5'' DT A 4 -6.787 -6.477 -14.936 1.00 0.35 H new ATOM 0 H4' DT A 4 -6.838 -6.677 -12.568 1.00 0.34 H new ATOM 0 H3' DT A 4 -6.666 -4.124 -13.885 1.00 0.40 H new ATOM 0 H2' DT A 4 -4.381 -3.792 -12.992 1.00 0.33 H new ATOM 0 H2'' DT A 4 -5.378 -3.072 -11.743 1.00 0.33 H new ATOM 0 H1' DT A 4 -5.385 -5.132 -10.407 1.00 0.27 H new ATOM 0 H3 DT A 4 -1.993 -5.090 -7.738 1.00 0.26 H new ATOM 0 H71 DT A 4 -0.097 -5.026 -12.773 1.00 0.54 H new ATOM 0 H72 DT A 4 0.289 -3.495 -11.952 1.00 0.54 H new ATOM 0 H73 DT A 4 0.997 -5.020 -11.370 1.00 0.54 H new ATOM 0 H6 DT A 4 -2.395 -4.763 -12.502 1.00 0.32 H new ATOM 126 P DG A 5 -8.342 -3.002 -11.932 1.00 0.45 P ATOM 127 OP1 DG A 5 -9.784 -3.230 -12.176 1.00 0.53 O ATOM 128 OP2 DG A 5 -7.623 -1.967 -12.710 1.00 0.48 O ATOM 129 O5' DG A 5 -8.129 -2.690 -10.367 1.00 0.46 O ATOM 130 C5' DG A 5 -8.901 -3.342 -9.345 1.00 0.46 C ATOM 131 C4' DG A 5 -8.553 -2.839 -7.951 1.00 0.39 C ATOM 132 O4' DG A 5 -7.198 -3.169 -7.587 1.00 0.38 O ATOM 133 C3' DG A 5 -8.724 -1.320 -7.842 1.00 0.39 C ATOM 134 O3' DG A 5 -9.658 -0.983 -6.807 1.00 0.37 O ATOM 135 C2' DG A 5 -7.312 -0.890 -7.543 1.00 0.40 C ATOM 136 C1' DG A 5 -6.625 -2.058 -6.891 1.00 0.32 C ATOM 137 N9 DG A 5 -5.177 -2.058 -7.158 1.00 0.27 N ATOM 138 C8 DG A 5 -4.536 -2.078 -8.355 1.00 0.27 C ATOM 139 N7 DG A 5 -3.239 -2.090 -8.321 1.00 0.28 N ATOM 140 C5 DG A 5 -2.990 -2.074 -6.951 1.00 0.27 C ATOM 141 C6 DG A 5 -1.758 -2.078 -6.252 1.00 0.28 C ATOM 142 O6 DG A 5 -0.608 -2.103 -6.684 1.00 0.32 O ATOM 143 N1 DG A 5 -1.950 -2.058 -4.893 1.00 0.31 N ATOM 144 C2 DG A 5 -3.165 -2.037 -4.258 1.00 0.33 C ATOM 145 N2 DG A 5 -3.147 -2.014 -2.937 1.00 0.39 N ATOM 146 N3 DG A 5 -4.328 -2.035 -4.895 1.00 0.33 N ATOM 147 C4 DG A 5 -4.167 -2.054 -6.237 1.00 0.28 C ATOM 0 H5' DG A 5 -8.731 -4.417 -9.394 1.00 0.46 H new ATOM 0 H5'' DG A 5 -9.962 -3.178 -9.534 1.00 0.46 H new ATOM 0 H4' DG A 5 -9.243 -3.336 -7.270 1.00 0.39 H new ATOM 0 H3' DG A 5 -9.137 -0.831 -8.724 1.00 0.39 H new ATOM 0 H2' DG A 5 -6.795 -0.600 -8.458 1.00 0.40 H new ATOM 0 H2'' DG A 5 -7.305 -0.022 -6.884 1.00 0.40 H new ATOM 0 H1' DG A 5 -6.749 -2.058 -5.808 1.00 0.32 H new ATOM 0 H8 DG A 5 -5.079 -2.084 -9.289 1.00 0.27 H new ATOM 0 H1 DG A 5 -1.117 -2.059 -4.305 1.00 0.31 H new ATOM 0 H21 DG A 5 -4.023 -1.998 -2.415 1.00 0.39 H new ATOM 0 H22 DG A 5 -2.257 -2.013 -2.439 1.00 0.39 H new ATOM 159 P DT A 6 -9.995 0.525 -6.337 1.00 0.38 P ATOM 160 OP1 DT A 6 -11.238 0.488 -5.534 1.00 0.51 O ATOM 161 OP2 DT A 6 -9.908 1.422 -7.511 1.00 0.50 O ATOM 162 O5' DT A 6 -8.764 0.859 -5.357 1.00 0.30 O ATOM 163 C5' DT A 6 -8.596 0.163 -4.113 1.00 0.28 C ATOM 164 C4' DT A 6 -7.336 0.584 -3.368 1.00 0.19 C ATOM 165 O4' DT A 6 -6.144 0.292 -4.136 1.00 0.18 O ATOM 166 C3' DT A 6 -7.327 2.085 -3.064 1.00 0.16 C ATOM 167 O3' DT A 6 -7.083 2.334 -1.675 1.00 0.33 O ATOM 168 C2' DT A 6 -6.144 2.542 -3.900 1.00 0.15 C ATOM 169 C1' DT A 6 -5.202 1.337 -3.875 1.00 0.14 C ATOM 170 N1 DT A 6 -4.107 1.353 -4.880 1.00 0.13 N ATOM 171 C2 DT A 6 -2.801 1.219 -4.436 1.00 0.19 C ATOM 172 O2 DT A 6 -2.489 1.112 -3.254 1.00 0.28 O ATOM 173 N3 DT A 6 -1.833 1.215 -5.410 1.00 0.17 N ATOM 174 C4 DT A 6 -2.035 1.330 -6.765 1.00 0.14 C ATOM 175 O4 DT A 6 -1.064 1.300 -7.513 1.00 0.19 O ATOM 176 C5 DT A 6 -3.422 1.469 -7.145 1.00 0.15 C ATOM 177 C7 DT A 6 -3.830 1.609 -8.615 1.00 0.26 C ATOM 178 C6 DT A 6 -4.384 1.477 -6.209 1.00 0.14 C ATOM 0 H5' DT A 6 -8.559 -0.910 -4.304 1.00 0.28 H new ATOM 0 H5'' DT A 6 -9.465 0.344 -3.480 1.00 0.28 H new ATOM 0 H4' DT A 6 -7.338 0.015 -2.438 1.00 0.19 H new ATOM 0 H3' DT A 6 -8.268 2.589 -3.284 1.00 0.16 H new ATOM 0 H2' DT A 6 -6.445 2.795 -4.917 1.00 0.15 H new ATOM 0 H2'' DT A 6 -5.672 3.429 -3.477 1.00 0.15 H new ATOM 0 H1' DT A 6 -4.633 1.265 -2.948 1.00 0.14 H new ATOM 0 H3 DT A 6 -0.867 1.117 -5.097 1.00 0.17 H new ATOM 0 H71 DT A 6 -4.823 1.182 -8.759 1.00 0.26 H new ATOM 0 H72 DT A 6 -3.845 2.664 -8.890 1.00 0.26 H new ATOM 0 H73 DT A 6 -3.113 1.081 -9.243 1.00 0.26 H new ATOM 0 H6 DT A 6 -5.413 1.585 -6.519 1.00 0.14 H new ATOM 191 P DG A 7 -7.255 3.801 -1.021 1.00 0.47 P ATOM 192 OP1 DG A 7 -7.834 3.630 0.329 1.00 0.65 O ATOM 193 OP2 DG A 7 -7.931 4.684 -1.999 1.00 0.63 O ATOM 194 O5' DG A 7 -5.736 4.306 -0.873 1.00 0.37 O ATOM 195 C5' DG A 7 -4.935 3.985 0.274 1.00 0.32 C ATOM 196 C4' DG A 7 -3.523 4.551 0.170 1.00 0.28 C ATOM 197 O4' DG A 7 -2.775 3.953 -0.912 1.00 0.32 O ATOM 198 C3' DG A 7 -3.508 6.077 -0.041 1.00 0.28 C ATOM 199 O3' DG A 7 -2.745 6.723 0.992 1.00 0.33 O ATOM 200 C2' DG A 7 -2.842 6.156 -1.400 1.00 0.27 C ATOM 201 C1' DG A 7 -1.923 4.966 -1.459 1.00 0.30 C ATOM 202 N9 DG A 7 -1.549 4.668 -2.851 1.00 0.25 N ATOM 203 C8 DG A 7 -2.358 4.439 -3.912 1.00 0.23 C ATOM 204 N7 DG A 7 -1.781 4.171 -5.042 1.00 0.24 N ATOM 205 C5 DG A 7 -0.434 4.231 -4.688 1.00 0.25 C ATOM 206 C6 DG A 7 0.720 4.031 -5.482 1.00 0.31 C ATOM 207 O6 DG A 7 0.806 3.745 -6.672 1.00 0.37 O ATOM 208 N1 DG A 7 1.870 4.183 -4.750 1.00 0.34 N ATOM 209 C2 DG A 7 1.928 4.490 -3.416 1.00 0.34 C ATOM 210 N2 DG A 7 3.130 4.615 -2.886 1.00 0.36 N ATOM 211 N3 DG A 7 0.857 4.680 -2.653 1.00 0.31 N ATOM 212 C4 DG A 7 -0.288 4.534 -3.355 1.00 0.26 C ATOM 0 H5' DG A 7 -4.883 2.902 0.386 1.00 0.32 H new ATOM 0 H5'' DG A 7 -5.416 4.376 1.171 1.00 0.32 H new ATOM 0 H4' DG A 7 -3.057 4.311 1.126 1.00 0.28 H new ATOM 0 H3' DG A 7 -4.479 6.571 0.001 1.00 0.28 H new ATOM 0 H2' DG A 7 -3.579 6.124 -2.202 1.00 0.27 H new ATOM 0 H2'' DG A 7 -2.288 7.088 -1.513 1.00 0.27 H new ATOM 0 H1' DG A 7 -0.974 5.085 -0.936 1.00 0.30 H new ATOM 0 H8 DG A 7 -3.434 4.478 -3.822 1.00 0.23 H new ATOM 0 H1 DG A 7 2.756 4.057 -5.240 1.00 0.34 H new ATOM 0 H21 DG A 7 3.230 4.843 -1.897 1.00 0.36 H new ATOM 0 H22 DG A 7 3.959 4.484 -3.466 1.00 0.36 H new ATOM 224 P DT A 8 -2.154 8.230 0.922 1.00 0.36 P ATOM 225 OP1 DT A 8 -2.123 8.768 2.301 1.00 0.43 O ATOM 226 OP2 DT A 8 -2.864 8.977 -0.142 1.00 0.41 O ATOM 227 O5' DT A 8 -0.634 7.998 0.430 1.00 0.35 O ATOM 228 C5' DT A 8 0.296 7.264 1.246 1.00 0.31 C ATOM 229 C4' DT A 8 1.759 7.478 0.876 1.00 0.33 C ATOM 230 O4' DT A 8 2.077 7.031 -0.451 1.00 0.35 O ATOM 231 C3' DT A 8 2.200 8.923 1.026 1.00 0.38 C ATOM 232 O3' DT A 8 3.567 9.067 1.433 1.00 0.44 O ATOM 233 C2' DT A 8 1.966 9.366 -0.395 1.00 0.38 C ATOM 234 C1' DT A 8 2.473 8.173 -1.219 1.00 0.33 C ATOM 235 N1 DT A 8 1.879 8.022 -2.569 1.00 0.28 N ATOM 236 C2 DT A 8 2.734 7.817 -3.642 1.00 0.29 C ATOM 237 O2 DT A 8 3.955 7.769 -3.548 1.00 0.35 O ATOM 238 N3 DT A 8 2.138 7.670 -4.869 1.00 0.29 N ATOM 239 C4 DT A 8 0.793 7.707 -5.130 1.00 0.26 C ATOM 240 O4 DT A 8 0.408 7.540 -6.282 1.00 0.28 O ATOM 241 C5 DT A 8 -0.036 7.926 -3.966 1.00 0.29 C ATOM 242 C7 DT A 8 -1.557 8.011 -4.127 1.00 0.36 C ATOM 243 C6 DT A 8 0.522 8.071 -2.745 1.00 0.30 C ATOM 0 H5' DT A 8 0.066 6.201 1.172 1.00 0.31 H new ATOM 0 H5'' DT A 8 0.151 7.549 2.288 1.00 0.31 H new ATOM 0 H4' DT A 8 2.308 6.865 1.590 1.00 0.33 H new ATOM 0 H3' DT A 8 1.682 9.491 1.799 1.00 0.38 H new ATOM 0 H2' DT A 8 0.912 9.569 -0.586 1.00 0.38 H new ATOM 0 H2'' DT A 8 2.514 10.279 -0.628 1.00 0.38 H new ATOM 0 H1' DT A 8 3.541 8.303 -1.391 1.00 0.33 H new ATOM 0 H3 DT A 8 2.757 7.518 -5.665 1.00 0.29 H new ATOM 0 H71 DT A 8 -1.797 8.412 -5.112 1.00 0.36 H new ATOM 0 H72 DT A 8 -1.990 7.016 -4.025 1.00 0.36 H new ATOM 0 H73 DT A 8 -1.968 8.666 -3.359 1.00 0.36 H new ATOM 0 H6 DT A 8 -0.116 8.229 -1.888 1.00 0.30 H new ATOM 256 P DA A 9 4.269 10.514 1.559 1.00 0.55 P ATOM 257 OP1 DA A 9 5.413 10.388 2.488 1.00 0.66 O ATOM 258 OP2 DA A 9 3.228 11.536 1.814 1.00 0.70 O ATOM 259 O5' DA A 9 4.833 10.748 0.068 1.00 0.49 O ATOM 260 C5' DA A 9 6.067 10.146 -0.343 1.00 0.50 C ATOM 261 C4' DA A 9 6.582 10.659 -1.684 1.00 0.52 C ATOM 262 O4' DA A 9 5.728 10.301 -2.796 1.00 0.52 O ATOM 263 C3' DA A 9 6.744 12.185 -1.717 1.00 0.52 C ATOM 264 O3' DA A 9 8.070 12.502 -2.162 1.00 0.68 O ATOM 265 C2' DA A 9 5.679 12.585 -2.726 1.00 0.42 C ATOM 266 C1' DA A 9 5.571 11.431 -3.670 1.00 0.45 C ATOM 267 N9 DA A 9 4.268 11.314 -4.353 1.00 0.36 N ATOM 268 C8 DA A 9 3.009 11.553 -3.896 1.00 0.31 C ATOM 269 N7 DA A 9 2.036 11.314 -4.723 1.00 0.33 N ATOM 270 C5 DA A 9 2.725 10.874 -5.853 1.00 0.36 C ATOM 271 C6 DA A 9 2.298 10.450 -7.116 1.00 0.44 C ATOM 272 N6 DA A 9 1.022 10.383 -7.470 1.00 0.53 N ATOM 273 N1 DA A 9 3.237 10.086 -7.999 1.00 0.48 N ATOM 274 C2 DA A 9 4.516 10.137 -7.654 1.00 0.50 C ATOM 275 N3 DA A 9 5.043 10.513 -6.502 1.00 0.47 N ATOM 276 C4 DA A 9 4.077 10.875 -5.634 1.00 0.38 C ATOM 0 H5' DA A 9 5.932 9.066 -0.405 1.00 0.50 H new ATOM 0 H5'' DA A 9 6.823 10.329 0.421 1.00 0.50 H new ATOM 0 H4' DA A 9 7.553 10.174 -1.789 1.00 0.52 H new ATOM 0 H3' DA A 9 6.625 12.697 -0.762 1.00 0.52 H new ATOM 0 H2' DA A 9 4.726 12.781 -2.234 1.00 0.42 H new ATOM 0 H2'' DA A 9 5.959 13.498 -3.252 1.00 0.42 H new ATOM 0 H1' DA A 9 6.299 11.528 -4.476 1.00 0.45 H new ATOM 0 H8 DA A 9 2.828 11.922 -2.897 1.00 0.31 H new ATOM 0 H61 DA A 9 0.768 10.066 -8.406 1.00 0.53 H new ATOM 0 H62 DA A 9 0.294 10.648 -6.807 1.00 0.53 H new ATOM 0 H2 DA A 9 5.220 9.831 -8.414 1.00 0.50 H new ATOM 288 P DC A 10 8.603 13.981 -2.512 1.00 0.77 P ATOM 289 OP1 DC A 10 10.053 14.025 -2.226 1.00 0.92 O ATOM 290 OP2 DC A 10 7.700 14.976 -1.893 1.00 0.78 O ATOM 291 O5' DC A 10 8.389 14.022 -4.100 1.00 0.77 O ATOM 292 C5' DC A 10 9.057 13.088 -4.962 1.00 0.86 C ATOM 293 C4' DC A 10 8.530 13.162 -6.386 1.00 0.78 C ATOM 294 O4' DC A 10 7.115 12.894 -6.404 1.00 0.63 O ATOM 295 C3' DC A 10 8.747 14.553 -6.991 1.00 0.84 C ATOM 296 O3' DC A 10 9.526 14.497 -8.191 1.00 1.00 O ATOM 297 C2' DC A 10 7.327 14.969 -7.312 1.00 0.65 C ATOM 298 C1' DC A 10 6.599 13.641 -7.500 1.00 0.55 C ATOM 299 N1 DC A 10 5.126 13.753 -7.377 1.00 0.41 N ATOM 300 C2 DC A 10 4.348 13.271 -8.418 1.00 0.35 C ATOM 301 O2 DC A 10 4.835 12.797 -9.442 1.00 0.42 O ATOM 302 N3 DC A 10 3.003 13.344 -8.300 1.00 0.29 N ATOM 303 C4 DC A 10 2.430 13.865 -7.215 1.00 0.28 C ATOM 304 N4 DC A 10 1.106 13.898 -7.162 1.00 0.37 N ATOM 305 C5 DC A 10 3.206 14.372 -6.131 1.00 0.32 C ATOM 306 C6 DC A 10 4.549 14.295 -6.257 1.00 0.41 C ATOM 0 H5' DC A 10 8.924 12.077 -4.577 1.00 0.86 H new ATOM 0 H5'' DC A 10 10.128 13.292 -4.959 1.00 0.86 H new ATOM 0 H4' DC A 10 9.075 12.420 -6.970 1.00 0.78 H new ATOM 0 H3' DC A 10 9.287 15.231 -6.330 1.00 0.84 H new ATOM 0 H2' DC A 10 6.889 15.556 -6.505 1.00 0.65 H new ATOM 0 H2'' DC A 10 7.282 15.582 -8.212 1.00 0.65 H new ATOM 0 H1' DC A 10 6.755 13.214 -8.491 1.00 0.55 H new ATOM 0 H41 DC A 10 0.638 14.290 -6.345 1.00 0.37 H new ATOM 0 H42 DC A 10 0.555 13.531 -7.938 1.00 0.37 H new ATOM 0 H5 DC A 10 2.743 14.797 -5.253 1.00 0.32 H new ATOM 0 H6 DC A 10 5.179 14.667 -5.462 1.00 0.41 H new ATOM 318 P DG A 11 9.893 15.816 -9.042 1.00 1.07 P ATOM 319 OP1 DG A 11 11.161 15.556 -9.760 1.00 1.36 O ATOM 320 OP2 DG A 11 9.784 17.002 -8.166 1.00 1.18 O ATOM 321 O5' DG A 11 8.704 15.901 -10.126 1.00 0.80 O ATOM 322 C5' DG A 11 8.805 15.192 -11.368 1.00 0.75 C ATOM 323 C4' DG A 11 7.760 15.609 -12.398 1.00 0.53 C ATOM 324 O4' DG A 11 6.403 15.255 -12.043 1.00 0.49 O ATOM 325 C3' DG A 11 7.780 17.112 -12.679 1.00 0.42 C ATOM 326 O3' DG A 11 7.760 17.258 -14.095 1.00 0.46 O ATOM 327 C2' DG A 11 6.416 17.533 -12.156 1.00 0.39 C ATOM 328 C1' DG A 11 5.538 16.334 -12.432 1.00 0.36 C ATOM 329 N9 DG A 11 4.331 16.314 -11.592 1.00 0.34 N ATOM 330 C8 DG A 11 4.195 16.557 -10.261 1.00 0.40 C ATOM 331 N7 DG A 11 3.007 16.430 -9.764 1.00 0.40 N ATOM 332 C5 DG A 11 2.269 16.066 -10.887 1.00 0.30 C ATOM 333 C6 DG A 11 0.894 15.781 -11.005 1.00 0.29 C ATOM 334 O6 DG A 11 0.027 15.771 -10.138 1.00 0.39 O ATOM 335 N1 DG A 11 0.552 15.464 -12.293 1.00 0.24 N ATOM 336 C2 DG A 11 1.416 15.417 -13.356 1.00 0.25 C ATOM 337 N2 DG A 11 0.898 15.104 -14.527 1.00 0.31 N ATOM 338 N3 DG A 11 2.715 15.678 -13.269 1.00 0.27 N ATOM 339 C4 DG A 11 3.070 15.996 -12.004 1.00 0.28 C ATOM 0 H5' DG A 11 8.707 14.124 -11.176 1.00 0.75 H new ATOM 0 H5'' DG A 11 9.799 15.350 -11.787 1.00 0.75 H new ATOM 0 H4' DG A 11 8.049 15.048 -13.287 1.00 0.53 H new ATOM 0 H3' DG A 11 8.621 17.661 -12.254 1.00 0.42 H new ATOM 0 H2' DG A 11 6.450 17.767 -11.092 1.00 0.39 H new ATOM 0 H2'' DG A 11 6.049 18.423 -12.667 1.00 0.39 H new ATOM 0 HO3' DG A 11 7.770 18.210 -14.326 1.00 0.46 H new ATOM 0 H1' DG A 11 5.175 16.305 -13.459 1.00 0.36 H new ATOM 0 H8 DG A 11 5.038 16.842 -9.648 1.00 0.40 H new ATOM 0 H1 DG A 11 -0.427 15.245 -12.476 1.00 0.24 H new ATOM 0 H21 DG A 11 1.496 15.055 -15.352 1.00 0.31 H new ATOM 0 H22 DG A 11 -0.100 14.911 -14.608 1.00 0.31 H new TER 352 DG A 11 ATOM 353 O5' DC B 12 -8.550 15.688 -15.575 1.00 0.98 O ATOM 354 C5' DC B 12 -7.691 16.385 -16.490 1.00 0.88 C ATOM 355 C4' DC B 12 -6.230 15.919 -16.409 1.00 0.65 C ATOM 356 O4' DC B 12 -5.657 16.170 -15.112 1.00 0.60 O ATOM 357 C3' DC B 12 -6.088 14.406 -16.690 1.00 0.49 C ATOM 358 O3' DC B 12 -5.405 14.230 -17.939 1.00 0.44 O ATOM 359 C2' DC B 12 -5.152 13.991 -15.508 1.00 0.47 C ATOM 360 C1' DC B 12 -4.511 15.314 -15.032 1.00 0.47 C ATOM 361 N1 DC B 12 -4.035 15.206 -13.638 1.00 0.46 N ATOM 362 C2 DC B 12 -2.671 15.273 -13.402 1.00 0.39 C ATOM 363 O2 DC B 12 -1.851 15.400 -14.309 1.00 0.37 O ATOM 364 N3 DC B 12 -2.238 15.189 -12.126 1.00 0.44 N ATOM 365 C4 DC B 12 -3.092 15.043 -11.115 1.00 0.53 C ATOM 366 N4 DC B 12 -2.583 14.974 -9.894 1.00 0.60 N ATOM 367 C5 DC B 12 -4.503 14.968 -11.334 1.00 0.61 C ATOM 368 C6 DC B 12 -4.923 15.055 -12.614 1.00 0.57 C ATOM 0 H5' DC B 12 -7.738 17.454 -16.283 1.00 0.88 H new ATOM 0 H5'' DC B 12 -8.057 16.241 -17.506 1.00 0.88 H new ATOM 0 H4' DC B 12 -5.702 16.492 -17.171 1.00 0.65 H new ATOM 0 H3' DC B 12 -7.021 13.845 -16.754 1.00 0.49 H new ATOM 0 H2' DC B 12 -5.715 13.513 -14.706 1.00 0.47 H new ATOM 0 H2'' DC B 12 -4.394 13.279 -15.834 1.00 0.47 H new ATOM 0 HO5' DC B 12 -9.466 16.024 -15.666 1.00 0.98 H new ATOM 0 H1' DC B 12 -3.638 15.638 -15.599 1.00 0.47 H new ATOM 0 H41 DC B 12 -3.200 14.862 -9.090 1.00 0.60 H new ATOM 0 H42 DC B 12 -1.574 15.033 -9.758 1.00 0.60 H new ATOM 0 H5 DC B 12 -5.198 14.848 -10.516 1.00 0.61 H new ATOM 0 H6 DC B 12 -5.980 15.004 -12.831 1.00 0.57 H new ATOM 381 P DG B 13 -4.850 12.801 -18.448 1.00 0.34 P ATOM 382 OP1 DG B 13 -4.571 12.915 -19.896 1.00 0.49 O ATOM 383 OP2 DG B 13 -5.762 11.744 -17.956 1.00 0.36 O ATOM 384 O5' DG B 13 -3.452 12.679 -17.649 1.00 0.33 O ATOM 385 C5' DG B 13 -2.253 13.338 -18.089 1.00 0.29 C ATOM 386 C4' DG B 13 -1.001 12.830 -17.369 1.00 0.27 C ATOM 387 O4' DG B 13 -0.935 13.198 -15.972 1.00 0.31 O ATOM 388 C3' DG B 13 -0.854 11.298 -17.447 1.00 0.24 C ATOM 389 O3' DG B 13 0.365 10.975 -18.137 1.00 0.34 O ATOM 390 C2' DG B 13 -0.862 10.953 -15.974 1.00 0.26 C ATOM 391 C1' DG B 13 -0.292 12.120 -15.274 1.00 0.26 C ATOM 392 N9 DG B 13 -0.536 12.156 -13.822 1.00 0.27 N ATOM 393 C8 DG B 13 -1.708 12.107 -13.141 1.00 0.36 C ATOM 394 N7 DG B 13 -1.627 12.185 -11.847 1.00 0.39 N ATOM 395 C5 DG B 13 -0.250 12.297 -11.646 1.00 0.30 C ATOM 396 C6 DG B 13 0.492 12.420 -10.441 1.00 0.28 C ATOM 397 O6 DG B 13 0.093 12.469 -9.283 1.00 0.37 O ATOM 398 N1 DG B 13 1.846 12.503 -10.682 1.00 0.25 N ATOM 399 C2 DG B 13 2.432 12.473 -11.921 1.00 0.27 C ATOM 400 N2 DG B 13 3.750 12.548 -11.966 1.00 0.35 N ATOM 401 N3 DG B 13 1.750 12.361 -13.057 1.00 0.26 N ATOM 402 C4 DG B 13 0.419 12.277 -12.846 1.00 0.25 C ATOM 0 H5' DG B 13 -2.352 14.411 -17.924 1.00 0.29 H new ATOM 0 H5'' DG B 13 -2.135 13.190 -19.162 1.00 0.29 H new ATOM 0 H4' DG B 13 -0.188 13.320 -17.904 1.00 0.27 H new ATOM 0 H3' DG B 13 -1.614 10.747 -18.001 1.00 0.24 H new ATOM 0 H2' DG B 13 -1.875 10.748 -15.628 1.00 0.26 H new ATOM 0 H2'' DG B 13 -0.272 10.057 -15.781 1.00 0.26 H new ATOM 0 H1' DG B 13 0.798 12.137 -15.302 1.00 0.26 H new ATOM 0 H8 DG B 13 -2.657 12.008 -13.647 1.00 0.36 H new ATOM 0 H1 DG B 13 2.462 12.594 -9.874 1.00 0.25 H new ATOM 0 H21 DG B 13 4.231 12.530 -12.865 1.00 0.35 H new ATOM 0 H22 DG B 13 4.286 12.624 -11.102 1.00 0.35 H new ATOM 414 P DT B 14 1.112 9.544 -18.119 1.00 0.32 P ATOM 415 OP1 DT B 14 1.772 9.355 -19.430 1.00 0.41 O ATOM 416 OP2 DT B 14 0.166 8.519 -17.623 1.00 0.37 O ATOM 417 O5' DT B 14 2.255 9.747 -17.002 1.00 0.43 O ATOM 418 C5' DT B 14 3.374 10.633 -17.183 1.00 0.43 C ATOM 419 C4' DT B 14 4.462 10.398 -16.140 1.00 0.44 C ATOM 420 O4' DT B 14 3.966 10.609 -14.799 1.00 0.39 O ATOM 421 C3' DT B 14 5.037 8.982 -16.215 1.00 0.54 C ATOM 422 O3' DT B 14 6.448 9.016 -15.957 1.00 0.63 O ATOM 423 C2' DT B 14 4.269 8.315 -15.070 1.00 0.53 C ATOM 424 C1' DT B 14 4.248 9.441 -14.014 1.00 0.46 C ATOM 425 N1 DT B 14 3.238 9.303 -12.931 1.00 0.44 N ATOM 426 C2 DT B 14 3.677 9.466 -11.627 1.00 0.47 C ATOM 427 O2 DT B 14 4.841 9.705 -11.322 1.00 0.56 O ATOM 428 N3 DT B 14 2.721 9.350 -10.652 1.00 0.47 N ATOM 429 C4 DT B 14 1.387 9.090 -10.834 1.00 0.47 C ATOM 430 O4 DT B 14 0.659 9.035 -9.849 1.00 0.52 O ATOM 431 C5 DT B 14 1.002 8.928 -12.216 1.00 0.45 C ATOM 432 C7 DT B 14 -0.449 8.614 -12.596 1.00 0.55 C ATOM 433 C6 DT B 14 1.916 9.038 -13.195 1.00 0.42 C ATOM 0 H5' DT B 14 3.032 11.666 -17.124 1.00 0.43 H new ATOM 0 H5'' DT B 14 3.791 10.492 -18.180 1.00 0.43 H new ATOM 0 H4' DT B 14 5.247 11.120 -16.365 1.00 0.44 H new ATOM 0 H3' DT B 14 4.933 8.477 -17.175 1.00 0.54 H new ATOM 0 H2' DT B 14 3.265 8.015 -15.370 1.00 0.53 H new ATOM 0 H2'' DT B 14 4.773 7.420 -14.705 1.00 0.53 H new ATOM 0 H1' DT B 14 5.190 9.450 -13.465 1.00 0.46 H new ATOM 0 H3 DT B 14 3.035 9.470 -9.689 1.00 0.47 H new ATOM 0 H71 DT B 14 -0.667 9.035 -13.577 1.00 0.55 H new ATOM 0 H72 DT B 14 -0.592 7.534 -12.624 1.00 0.55 H new ATOM 0 H73 DT B 14 -1.121 9.050 -11.857 1.00 0.55 H new ATOM 0 H6 DT B 14 1.602 8.914 -14.221 1.00 0.42 H new ATOM 446 P DA B 15 7.375 7.697 -15.919 1.00 0.72 P ATOM 447 OP1 DA B 15 8.679 8.030 -16.530 1.00 0.89 O ATOM 448 OP2 DA B 15 6.597 6.549 -16.433 1.00 0.89 O ATOM 449 O5' DA B 15 7.595 7.471 -14.344 1.00 0.64 O ATOM 450 C5' DA B 15 8.545 8.251 -13.606 1.00 0.58 C ATOM 451 C4' DA B 15 8.694 7.780 -12.167 1.00 0.44 C ATOM 452 O4' DA B 15 7.461 7.929 -11.420 1.00 0.45 O ATOM 453 C3' DA B 15 9.109 6.300 -12.070 1.00 0.37 C ATOM 454 O3' DA B 15 10.152 6.144 -11.090 1.00 0.42 O ATOM 455 C2' DA B 15 7.785 5.688 -11.671 1.00 0.31 C ATOM 456 C1' DA B 15 7.202 6.699 -10.732 1.00 0.34 C ATOM 457 N9 DA B 15 5.774 6.472 -10.436 1.00 0.34 N ATOM 458 C8 DA B 15 4.764 6.021 -11.231 1.00 0.39 C ATOM 459 N7 DA B 15 3.587 5.945 -10.685 1.00 0.42 N ATOM 460 C5 DA B 15 3.846 6.391 -9.389 1.00 0.38 C ATOM 461 C6 DA B 15 3.030 6.563 -8.265 1.00 0.42 C ATOM 462 N6 DA B 15 1.729 6.304 -8.273 1.00 0.48 N ATOM 463 N1 DA B 15 3.606 7.019 -7.143 1.00 0.42 N ATOM 464 C2 DA B 15 4.907 7.288 -7.135 1.00 0.38 C ATOM 465 N3 DA B 15 5.774 7.169 -8.122 1.00 0.32 N ATOM 466 C4 DA B 15 5.168 6.710 -9.235 1.00 0.33 C ATOM 0 H5' DA B 15 8.235 9.296 -13.612 1.00 0.58 H new ATOM 0 H5'' DA B 15 9.514 8.203 -14.103 1.00 0.58 H new ATOM 0 H4' DA B 15 9.476 8.411 -11.744 1.00 0.44 H new ATOM 0 H3' DA B 15 9.536 5.846 -12.964 1.00 0.37 H new ATOM 0 H2' DA B 15 7.141 5.525 -12.535 1.00 0.31 H new ATOM 0 H2'' DA B 15 7.919 4.721 -11.187 1.00 0.31 H new ATOM 0 H1' DA B 15 7.640 6.666 -9.734 1.00 0.34 H new ATOM 0 H8 DA B 15 4.932 5.741 -12.261 1.00 0.39 H new ATOM 0 H61 DA B 15 1.176 6.445 -7.428 1.00 0.48 H new ATOM 0 H62 DA B 15 1.282 5.964 -9.124 1.00 0.48 H new ATOM 0 H2 DA B 15 5.306 7.651 -6.200 1.00 0.38 H new ATOM 478 P DC B 16 10.541 4.788 -10.295 1.00 0.50 P ATOM 479 OP1 DC B 16 11.985 4.846 -9.982 1.00 0.66 O ATOM 480 OP2 DC B 16 9.998 3.626 -11.034 1.00 0.51 O ATOM 481 O5' DC B 16 9.719 4.920 -8.919 1.00 0.58 O ATOM 482 C5' DC B 16 9.989 5.963 -7.966 1.00 0.61 C ATOM 483 C4' DC B 16 9.377 5.671 -6.604 1.00 0.58 C ATOM 484 O4' DC B 16 7.950 5.537 -6.722 1.00 0.60 O ATOM 485 C3' DC B 16 9.932 4.397 -5.969 1.00 0.51 C ATOM 486 O3' DC B 16 10.059 4.531 -4.545 1.00 0.56 O ATOM 487 C2' DC B 16 8.835 3.412 -6.359 1.00 0.52 C ATOM 488 C1' DC B 16 7.570 4.292 -6.137 1.00 0.54 C ATOM 489 N1 DC B 16 6.285 3.889 -6.778 1.00 0.49 N ATOM 490 C2 DC B 16 5.125 3.934 -6.008 1.00 0.49 C ATOM 491 O2 DC B 16 5.124 4.263 -4.825 1.00 0.52 O ATOM 492 N3 DC B 16 3.948 3.597 -6.593 1.00 0.50 N ATOM 493 C4 DC B 16 3.894 3.230 -7.874 1.00 0.49 C ATOM 494 N4 DC B 16 2.723 2.914 -8.407 1.00 0.51 N ATOM 495 C5 DC B 16 5.062 3.174 -8.682 1.00 0.50 C ATOM 496 C6 DC B 16 6.229 3.509 -8.095 1.00 0.49 C ATOM 0 H5' DC B 16 9.597 6.908 -8.343 1.00 0.61 H new ATOM 0 H5'' DC B 16 11.067 6.085 -7.859 1.00 0.61 H new ATOM 0 H4' DC B 16 9.637 6.512 -5.961 1.00 0.58 H new ATOM 0 H3' DC B 16 10.934 4.114 -6.292 1.00 0.51 H new ATOM 0 H2' DC B 16 8.929 3.074 -7.391 1.00 0.52 H new ATOM 0 H2'' DC B 16 8.836 2.521 -5.731 1.00 0.52 H new ATOM 0 H1' DC B 16 7.335 4.252 -5.073 1.00 0.54 H new ATOM 0 H41 DC B 16 2.668 2.632 -9.386 1.00 0.51 H new ATOM 0 H42 DC B 16 1.877 2.953 -7.839 1.00 0.51 H new ATOM 0 H5 DC B 16 5.017 2.877 -9.719 1.00 0.50 H new ATOM 0 H6 DC B 16 7.140 3.477 -8.675 1.00 0.49 H new HETATM 508 P A38 B 17 10.586 3.337 -3.593 1.00 0.49 P HETATM 509 O1P A38 B 17 11.304 3.943 -2.450 1.00 0.53 O HETATM 510 O2P A38 B 17 11.269 2.322 -4.426 1.00 0.63 O HETATM 511 O5' A38 B 17 9.213 2.694 -3.058 1.00 0.45 O HETATM 512 C5' A38 B 17 8.503 3.240 -1.938 1.00 0.38 C HETATM 513 C4' A38 B 17 7.257 2.435 -1.600 1.00 0.30 C HETATM 514 O4' A38 B 17 6.262 2.414 -2.643 1.00 0.34 O HETATM 515 C3' A38 B 17 7.602 1.000 -1.237 1.00 0.26 C HETATM 516 O3' A38 B 17 6.896 0.706 -0.018 1.00 0.25 O HETATM 517 C2' A38 B 17 7.011 0.261 -2.524 1.00 0.27 C HETATM 518 C1' A38 B 17 5.686 1.108 -2.611 1.00 0.20 C HETATM 519 N9 A38 B 17 4.899 0.908 -3.851 1.00 0.19 N HETATM 520 C8 A38 B 17 5.467 0.629 -5.085 1.00 0.23 C HETATM 521 N7 A38 B 17 4.448 0.543 -5.945 1.00 0.23 N HETATM 522 C5 A38 B 17 3.223 0.746 -5.386 1.00 0.20 C HETATM 523 C6 A38 B 17 1.887 0.772 -5.796 1.00 0.20 C HETATM 524 N6 A38 B 17 1.484 0.578 -7.044 1.00 0.24 N HETATM 525 N1 A38 B 17 0.972 1.022 -4.853 1.00 0.20 N HETATM 526 C2 A38 B 17 1.362 1.230 -3.599 1.00 0.21 C HETATM 527 N3 A38 B 17 2.589 1.230 -3.093 1.00 0.21 N HETATM 528 C4 A38 B 17 3.503 0.978 -4.055 1.00 0.19 C HETATM 529 O A38 B 17 6.650 0.482 -5.376 1.00 0.28 O HETATM 0 H6N2 A38 B 17 0.490 0.612 -7.270 1.00 0.24 H new HETATM 0 H6N1 A38 B 17 2.168 0.395 -7.778 1.00 0.24 H new HETATM 0 H5'2 A38 B 17 9.162 3.267 -1.070 1.00 0.38 H new HETATM 0 H5'1 A38 B 17 8.220 4.270 -2.156 1.00 0.38 H new HETATM 0 H2'2 A38 B 17 7.644 0.355 -3.406 1.00 0.27 H new HETATM 0 H2'1 A38 B 17 6.835 -0.804 -2.370 1.00 0.27 H new HETATM 0 H7 A38 B 17 4.577 0.342 -6.937 1.00 0.23 H new HETATM 0 H4' A38 B 17 6.826 2.955 -0.744 1.00 0.30 H new HETATM 0 H3' A38 B 17 8.642 0.735 -1.048 1.00 0.26 H new HETATM 0 H2 A38 B 17 0.561 1.428 -2.886 1.00 0.21 H new HETATM 0 H1' A38 B 17 4.980 0.869 -1.816 1.00 0.20 H new ATOM 541 P DC B 18 6.302 -0.709 0.470 1.00 0.38 P ATOM 542 OP1 DC B 18 6.527 -0.837 1.926 1.00 0.56 O ATOM 543 OP2 DC B 18 6.753 -1.784 -0.443 1.00 0.53 O ATOM 544 O5' DC B 18 4.743 -0.459 0.214 1.00 0.44 O ATOM 545 C5' DC B 18 3.957 0.462 0.992 1.00 0.44 C ATOM 546 C4' DC B 18 2.543 -0.082 1.159 1.00 0.50 C ATOM 547 O4' DC B 18 1.985 -0.208 -0.146 1.00 0.52 O ATOM 548 C3' DC B 18 2.557 -1.444 1.850 1.00 0.58 C ATOM 549 O3' DC B 18 1.434 -1.586 2.727 1.00 0.73 O ATOM 550 C2' DC B 18 2.465 -2.328 0.639 1.00 0.57 C ATOM 551 C1' DC B 18 1.556 -1.546 -0.281 1.00 0.54 C ATOM 552 N1 DC B 18 1.667 -1.834 -1.727 1.00 0.47 N ATOM 553 C2 DC B 18 0.521 -1.921 -2.503 1.00 0.51 C ATOM 554 O2 DC B 18 -0.608 -1.799 -2.037 1.00 0.62 O ATOM 555 N3 DC B 18 0.664 -2.156 -3.833 1.00 0.44 N ATOM 556 C4 DC B 18 1.871 -2.305 -4.387 1.00 0.38 C ATOM 557 N4 DC B 18 1.952 -2.524 -5.694 1.00 0.39 N ATOM 558 C5 DC B 18 3.047 -2.219 -3.588 1.00 0.40 C ATOM 559 C6 DC B 18 2.895 -1.986 -2.293 1.00 0.41 C ATOM 0 H5' DC B 18 3.927 1.435 0.501 1.00 0.44 H new ATOM 0 H5'' DC B 18 4.417 0.612 1.969 1.00 0.44 H new ATOM 0 H4' DC B 18 1.953 0.593 1.779 1.00 0.50 H new ATOM 0 H3' DC B 18 3.411 -1.648 2.496 1.00 0.58 H new ATOM 0 H2' DC B 18 3.443 -2.501 0.190 1.00 0.57 H new ATOM 0 H2'' DC B 18 2.049 -3.306 0.883 1.00 0.57 H new ATOM 0 H1' DC B 18 0.533 -1.792 0.004 1.00 0.54 H new ATOM 0 H41 DC B 18 2.864 -2.640 -6.136 1.00 0.39 H new ATOM 0 H42 DC B 18 1.102 -2.576 -6.256 1.00 0.39 H new ATOM 0 H5 DC B 18 4.028 -2.340 -4.023 1.00 0.40 H new ATOM 0 H6 DC B 18 3.772 -1.914 -1.667 1.00 0.41 H new ATOM 571 P DA B 19 1.089 -2.960 3.493 1.00 0.90 P ATOM 572 OP1 DA B 19 0.358 -2.618 4.732 1.00 1.14 O ATOM 573 OP2 DA B 19 2.314 -3.784 3.569 1.00 1.03 O ATOM 574 O5' DA B 19 0.076 -3.669 2.465 1.00 0.74 O ATOM 575 C5' DA B 19 -1.276 -3.209 2.358 1.00 0.69 C ATOM 576 C4' DA B 19 -2.083 -3.910 1.283 1.00 0.56 C ATOM 577 O4' DA B 19 -1.545 -3.708 -0.049 1.00 0.51 O ATOM 578 C3' DA B 19 -2.187 -5.445 1.479 1.00 0.52 C ATOM 579 O3' DA B 19 -3.549 -5.817 1.725 1.00 0.57 O ATOM 580 C2' DA B 19 -1.607 -5.982 0.161 1.00 0.45 C ATOM 581 C1' DA B 19 -1.831 -4.881 -0.832 1.00 0.43 C ATOM 582 N9 DA B 19 -0.968 -5.015 -2.018 1.00 0.39 N ATOM 583 C8 DA B 19 0.380 -5.101 -2.079 1.00 0.44 C ATOM 584 N7 DA B 19 0.906 -5.217 -3.260 1.00 0.41 N ATOM 585 C5 DA B 19 -0.226 -5.207 -4.076 1.00 0.32 C ATOM 586 C6 DA B 19 -0.391 -5.295 -5.461 1.00 0.28 C ATOM 587 N6 DA B 19 0.634 -5.421 -6.295 1.00 0.35 N ATOM 588 N1 DA B 19 -1.640 -5.254 -5.947 1.00 0.25 N ATOM 589 C2 DA B 19 -2.665 -5.132 -5.108 1.00 0.24 C ATOM 590 N3 DA B 19 -2.638 -5.040 -3.787 1.00 0.27 N ATOM 591 C4 DA B 19 -1.368 -5.084 -3.329 1.00 0.30 C ATOM 0 H5' DA B 19 -1.269 -2.138 2.153 1.00 0.69 H new ATOM 0 H5'' DA B 19 -1.773 -3.346 3.318 1.00 0.69 H new ATOM 0 H4' DA B 19 -3.068 -3.453 1.380 1.00 0.56 H new ATOM 0 H3' DA B 19 -1.652 -5.848 2.339 1.00 0.52 H new ATOM 0 H2' DA B 19 -0.547 -6.215 0.261 1.00 0.45 H new ATOM 0 H2'' DA B 19 -2.107 -6.900 -0.147 1.00 0.45 H new ATOM 0 H1' DA B 19 -2.833 -4.870 -1.262 1.00 0.43 H new ATOM 0 H8 DA B 19 0.990 -5.074 -1.188 1.00 0.44 H new ATOM 0 H61 DA B 19 0.469 -5.482 -7.300 1.00 0.35 H new ATOM 0 H62 DA B 19 1.586 -5.457 -5.931 1.00 0.35 H new ATOM 0 H2 DA B 19 -3.645 -5.104 -5.562 1.00 0.24 H new ATOM 603 P DT B 20 -4.173 -7.279 1.455 1.00 0.50 P ATOM 604 OP1 DT B 20 -5.335 -7.455 2.354 1.00 0.58 O ATOM 605 OP2 DT B 20 -3.083 -8.281 1.457 1.00 0.56 O ATOM 606 O5' DT B 20 -4.706 -7.106 -0.052 1.00 0.38 O ATOM 607 C5' DT B 20 -5.807 -6.226 -0.351 1.00 0.37 C ATOM 608 C4' DT B 20 -6.535 -6.625 -1.629 1.00 0.28 C ATOM 609 O4' DT B 20 -5.657 -6.595 -2.775 1.00 0.26 O ATOM 610 C3' DT B 20 -7.086 -8.045 -1.491 1.00 0.22 C ATOM 611 O3' DT B 20 -8.369 -8.227 -2.104 1.00 0.28 O ATOM 612 C2' DT B 20 -5.996 -8.816 -2.195 1.00 0.22 C ATOM 613 C1' DT B 20 -5.600 -7.908 -3.345 1.00 0.22 C ATOM 614 N1 DT B 20 -4.253 -8.131 -3.925 1.00 0.21 N ATOM 615 C2 DT B 20 -4.134 -8.161 -5.307 1.00 0.24 C ATOM 616 O2 DT B 20 -5.079 -8.045 -6.080 1.00 0.34 O ATOM 617 N3 DT B 20 -2.863 -8.342 -5.797 1.00 0.25 N ATOM 618 C4 DT B 20 -1.717 -8.494 -5.054 1.00 0.28 C ATOM 619 O4 DT B 20 -0.649 -8.637 -5.641 1.00 0.32 O ATOM 620 C5 DT B 20 -1.928 -8.451 -3.622 1.00 0.34 C ATOM 621 C7 DT B 20 -0.768 -8.604 -2.639 1.00 0.49 C ATOM 622 C6 DT B 20 -3.159 -8.276 -3.120 1.00 0.29 C ATOM 0 H5' DT B 20 -5.437 -5.205 -0.450 1.00 0.37 H new ATOM 0 H5'' DT B 20 -6.510 -6.231 0.482 1.00 0.37 H new ATOM 0 H4' DT B 20 -7.341 -5.907 -1.779 1.00 0.28 H new ATOM 0 H3' DT B 20 -7.282 -8.349 -0.463 1.00 0.22 H new ATOM 0 H2' DT B 20 -5.153 -9.014 -1.532 1.00 0.22 H new ATOM 0 H2'' DT B 20 -6.355 -9.781 -2.552 1.00 0.22 H new ATOM 0 H1' DT B 20 -6.268 -8.093 -4.186 1.00 0.22 H new ATOM 0 H3 DT B 20 -2.760 -8.366 -6.812 1.00 0.25 H new ATOM 0 H71 DT B 20 -0.987 -8.046 -1.728 1.00 0.49 H new ATOM 0 H72 DT B 20 -0.634 -9.658 -2.395 1.00 0.49 H new ATOM 0 H73 DT B 20 0.145 -8.217 -3.091 1.00 0.49 H new ATOM 0 H6 DT B 20 -3.289 -8.249 -2.048 1.00 0.29 H new ATOM 635 P DG B 21 -9.214 -9.600 -1.956 1.00 0.36 P ATOM 636 OP1 DG B 21 -10.652 -9.249 -1.979 1.00 0.51 O ATOM 637 OP2 DG B 21 -8.670 -10.370 -0.815 1.00 0.49 O ATOM 638 O5' DG B 21 -8.849 -10.397 -3.309 1.00 0.38 O ATOM 639 C5' DG B 21 -9.477 -10.079 -4.561 1.00 0.34 C ATOM 640 C4' DG B 21 -8.950 -10.911 -5.725 1.00 0.30 C ATOM 641 O4' DG B 21 -7.557 -10.670 -5.997 1.00 0.33 O ATOM 642 C3' DG B 21 -9.121 -12.420 -5.527 1.00 0.32 C ATOM 643 O3' DG B 21 -10.071 -12.891 -6.487 1.00 0.40 O ATOM 644 C2' DG B 21 -7.697 -12.926 -5.764 1.00 0.27 C ATOM 645 C1' DG B 21 -7.001 -11.863 -6.564 1.00 0.26 C ATOM 646 N9 DG B 21 -5.544 -11.812 -6.340 1.00 0.19 N ATOM 647 C8 DG B 21 -4.861 -11.828 -5.163 1.00 0.20 C ATOM 648 N7 DG B 21 -3.573 -11.734 -5.236 1.00 0.20 N ATOM 649 C5 DG B 21 -3.372 -11.647 -6.611 1.00 0.17 C ATOM 650 C6 DG B 21 -2.168 -11.525 -7.335 1.00 0.20 C ATOM 651 O6 DG B 21 -1.020 -11.457 -6.917 1.00 0.31 O ATOM 652 N1 DG B 21 -2.386 -11.469 -8.687 1.00 0.18 N ATOM 653 C2 DG B 21 -3.611 -11.524 -9.294 1.00 0.17 C ATOM 654 N2 DG B 21 -3.609 -11.465 -10.613 1.00 0.22 N ATOM 655 N3 DG B 21 -4.759 -11.638 -8.632 1.00 0.18 N ATOM 656 C4 DG B 21 -4.565 -11.694 -7.292 1.00 0.15 C ATOM 0 H5' DG B 21 -9.323 -9.022 -4.779 1.00 0.34 H new ATOM 0 H5'' DG B 21 -10.552 -10.233 -4.470 1.00 0.34 H new ATOM 0 H4' DG B 21 -9.561 -10.585 -6.567 1.00 0.30 H new ATOM 0 H3' DG B 21 -9.504 -12.749 -4.561 1.00 0.32 H new ATOM 0 H2' DG B 21 -7.184 -13.100 -4.818 1.00 0.27 H new ATOM 0 H2'' DG B 21 -7.705 -13.874 -6.301 1.00 0.27 H new ATOM 0 H1' DG B 21 -7.136 -12.021 -7.634 1.00 0.26 H new ATOM 0 H8 DG B 21 -5.370 -11.915 -4.214 1.00 0.20 H new ATOM 0 H1 DG B 21 -1.568 -11.379 -9.290 1.00 0.18 H new ATOM 0 H21 DG B 21 -4.490 -11.501 -11.126 1.00 0.22 H new ATOM 0 H22 DG B 21 -2.727 -11.383 -11.118 1.00 0.22 H new ATOM 668 P DC B 22 -10.477 -14.437 -6.677 1.00 0.50 P ATOM 669 OP1 DC B 22 -11.840 -14.493 -7.252 1.00 0.63 O ATOM 670 OP2 DC B 22 -10.173 -15.173 -5.430 1.00 0.62 O ATOM 671 O5' DC B 22 -9.429 -14.901 -7.806 1.00 0.48 O ATOM 672 C5' DC B 22 -9.436 -14.304 -9.113 1.00 0.47 C ATOM 673 C4' DC B 22 -8.187 -14.672 -9.907 1.00 0.47 C ATOM 674 O4' DC B 22 -7.004 -14.310 -9.177 1.00 0.48 O ATOM 675 C3' DC B 22 -8.073 -16.203 -10.120 1.00 0.53 C ATOM 676 O3' DC B 22 -8.420 -16.562 -11.460 1.00 0.59 O ATOM 677 C2' DC B 22 -6.559 -16.500 -9.885 1.00 0.53 C ATOM 678 C1' DC B 22 -5.933 -15.115 -9.691 1.00 0.50 C ATOM 679 N1 DC B 22 -4.850 -15.122 -8.680 1.00 0.47 N ATOM 680 C2 DC B 22 -3.559 -14.828 -9.087 1.00 0.53 C ATOM 681 O2 DC B 22 -3.271 -14.600 -10.260 1.00 0.61 O ATOM 682 N3 DC B 22 -2.581 -14.811 -8.153 1.00 0.53 N ATOM 683 C4 DC B 22 -2.841 -15.073 -6.872 1.00 0.44 C ATOM 684 N4 DC B 22 -1.834 -15.030 -6.010 1.00 0.45 N ATOM 685 C5 DC B 22 -4.161 -15.385 -6.425 1.00 0.38 C ATOM 686 C6 DC B 22 -5.135 -15.397 -7.368 1.00 0.41 C ATOM 0 H5' DC B 22 -9.501 -13.220 -9.018 1.00 0.47 H new ATOM 0 H5'' DC B 22 -10.322 -14.630 -9.657 1.00 0.47 H new ATOM 0 H4' DC B 22 -8.270 -14.145 -10.857 1.00 0.47 H new ATOM 0 H3' DC B 22 -8.738 -16.759 -9.460 1.00 0.53 H new ATOM 0 H2' DC B 22 -6.408 -17.132 -9.010 1.00 0.53 H new ATOM 0 H2'' DC B 22 -6.118 -17.021 -10.735 1.00 0.53 H new ATOM 0 HO3' DC B 22 -8.339 -17.532 -11.570 1.00 0.59 H new ATOM 0 H1' DC B 22 -5.499 -14.759 -10.626 1.00 0.50 H new ATOM 0 H41 DC B 22 -1.999 -15.225 -5.023 1.00 0.45 H new ATOM 0 H42 DC B 22 -0.894 -14.802 -6.334 1.00 0.45 H new ATOM 0 H5 DC B 22 -4.373 -15.601 -5.388 1.00 0.38 H new ATOM 0 H6 DC B 22 -6.151 -15.627 -7.081 1.00 0.41 H new TER 699 DC B 22