USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 242 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 5 DT C7 :methyl -30:sc= -5.97! (180deg=-6.23!) USER MOD Set 1.2: A 6 DT C7 :methyl 150:sc= -2.18 (180deg=-2.09) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl -30:sc= -31.6! (180deg=-33.2!) USER MOD Single : A 7 DT C7 :methyl -30:sc= -4.34! (180deg=-4.62!) USER MOD Single : A 11 DT C7 :methyl -30:sc= 0 (180deg=-0.378) USER MOD Single : A 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 16 DT C7 :methyl -30:sc= 0 (180deg=-0.468) USER MOD Single : A 17 DT C7 :methyl -30:sc= 0 (180deg=-1.88!) USER MOD Single : A 18 DT C7 :methyl 150:sc= -7.45! (180deg=-7.45!) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -4.229 -5.984 -7.635 1.00 0.43 O ATOM 2 C5' DG A 1 -4.152 -6.049 -6.208 1.00 0.30 C ATOM 3 C4' DG A 1 -5.516 -5.791 -5.557 1.00 0.20 C ATOM 4 O4' DG A 1 -5.354 -5.662 -4.136 1.00 0.19 O ATOM 5 C3' DG A 1 -6.228 -4.521 -6.040 1.00 0.17 C ATOM 6 O3' DG A 1 -7.644 -4.781 -6.112 1.00 0.20 O ATOM 7 C2' DG A 1 -5.932 -3.521 -4.933 1.00 0.16 C ATOM 8 C1' DG A 1 -5.936 -4.424 -3.717 1.00 0.16 C ATOM 9 N9 DG A 1 -5.160 -3.936 -2.561 1.00 0.15 N ATOM 10 C8 DG A 1 -5.600 -3.749 -1.281 1.00 0.15 C ATOM 11 N7 DG A 1 -4.668 -3.384 -0.448 1.00 0.16 N ATOM 12 C5 DG A 1 -3.522 -3.322 -1.231 1.00 0.15 C ATOM 13 C6 DG A 1 -2.194 -2.986 -0.864 1.00 0.16 C ATOM 14 O6 DG A 1 -1.771 -2.659 0.231 1.00 0.17 O ATOM 15 N1 DG A 1 -1.331 -3.055 -1.935 1.00 0.16 N ATOM 16 C2 DG A 1 -1.697 -3.389 -3.223 1.00 0.17 C ATOM 17 N2 DG A 1 -0.738 -3.367 -4.143 1.00 0.19 N ATOM 18 N3 DG A 1 -2.950 -3.705 -3.577 1.00 0.17 N ATOM 19 C4 DG A 1 -3.808 -3.654 -2.530 1.00 0.15 C ATOM 0 H5' DG A 1 -3.432 -5.314 -5.848 1.00 0.30 H new ATOM 0 H5'' DG A 1 -3.784 -7.030 -5.907 1.00 0.30 H new ATOM 0 H4' DG A 1 -6.130 -6.645 -5.842 1.00 0.20 H new ATOM 0 H3' DG A 1 -5.908 -4.174 -7.022 1.00 0.17 H new ATOM 0 H2' DG A 1 -4.973 -3.023 -5.073 1.00 0.16 H new ATOM 0 H2'' DG A 1 -6.690 -2.740 -4.869 1.00 0.16 H new ATOM 0 HO5' DG A 1 -3.343 -6.151 -8.018 1.00 0.43 H new ATOM 0 H1' DG A 1 -6.968 -4.492 -3.373 1.00 0.16 H new ATOM 0 H8 DG A 1 -6.629 -3.891 -0.986 1.00 0.15 H new ATOM 0 H1 DG A 1 -0.348 -2.843 -1.763 1.00 0.16 H new ATOM 0 H21 DG A 1 -0.954 -3.605 -5.111 1.00 0.19 H new ATOM 0 H22 DG A 1 0.214 -3.112 -3.881 1.00 0.19 H new ATOM 32 P DG A 2 -8.690 -3.666 -6.634 1.00 0.23 P ATOM 33 OP1 DG A 2 -9.956 -4.344 -6.997 1.00 0.32 O ATOM 34 OP2 DG A 2 -8.000 -2.808 -7.620 1.00 0.27 O ATOM 35 O5' DG A 2 -8.945 -2.790 -5.314 1.00 0.20 O ATOM 36 C5' DG A 2 -9.740 -3.300 -4.241 1.00 0.19 C ATOM 37 C4' DG A 2 -9.899 -2.264 -3.140 1.00 0.17 C ATOM 38 O4' DG A 2 -8.669 -2.137 -2.422 1.00 0.18 O ATOM 39 C3' DG A 2 -10.281 -0.877 -3.668 1.00 0.16 C ATOM 40 O3' DG A 2 -11.404 -0.348 -2.932 1.00 0.20 O ATOM 41 C2' DG A 2 -9.034 -0.022 -3.459 1.00 0.15 C ATOM 42 C1' DG A 2 -8.290 -0.764 -2.360 1.00 0.14 C ATOM 43 N9 DG A 2 -6.840 -0.723 -2.448 1.00 0.13 N ATOM 44 C8 DG A 2 -6.032 -0.688 -3.543 1.00 0.14 C ATOM 45 N7 DG A 2 -4.780 -0.547 -3.251 1.00 0.15 N ATOM 46 C5 DG A 2 -4.753 -0.495 -1.875 1.00 0.13 C ATOM 47 C6 DG A 2 -3.660 -0.348 -1.001 1.00 0.15 C ATOM 48 O6 DG A 2 -2.470 -0.219 -1.279 1.00 0.17 O ATOM 49 N1 DG A 2 -4.072 -0.349 0.313 1.00 0.16 N ATOM 50 C2 DG A 2 -5.362 -0.472 0.743 1.00 0.16 C ATOM 51 N2 DG A 2 -5.550 -0.433 2.063 1.00 0.19 N ATOM 52 N3 DG A 2 -6.397 -0.610 -0.078 1.00 0.14 N ATOM 53 C4 DG A 2 -6.012 -0.610 -1.373 1.00 0.12 C ATOM 0 H5' DG A 2 -9.276 -4.199 -3.835 1.00 0.19 H new ATOM 0 H5'' DG A 2 -10.721 -3.590 -4.617 1.00 0.19 H new ATOM 0 H4' DG A 2 -10.707 -2.617 -2.500 1.00 0.17 H new ATOM 0 H3' DG A 2 -10.585 -0.900 -4.714 1.00 0.16 H new ATOM 0 H2' DG A 2 -8.439 0.053 -4.369 1.00 0.15 H new ATOM 0 H2'' DG A 2 -9.288 0.995 -3.159 1.00 0.15 H new ATOM 0 H1' DG A 2 -8.562 -0.262 -1.432 1.00 0.14 H new ATOM 0 H8 DG A 2 -6.400 -0.770 -4.555 1.00 0.14 H new ATOM 0 H1 DG A 2 -3.351 -0.249 1.027 1.00 0.16 H new ATOM 0 H21 DG A 2 -6.491 -0.520 2.447 1.00 0.19 H new ATOM 0 H22 DG A 2 -4.753 -0.317 2.688 1.00 0.19 H new ATOM 65 P DG A 3 -11.507 -0.392 -1.317 1.00 0.22 P ATOM 66 OP1 DG A 3 -10.931 -1.658 -0.822 1.00 0.25 O ATOM 67 OP2 DG A 3 -12.891 -0.029 -0.944 1.00 0.26 O ATOM 68 O5' DG A 3 -10.536 0.802 -0.860 1.00 0.24 O ATOM 69 C5' DG A 3 -10.948 2.169 -0.961 1.00 0.23 C ATOM 70 C4' DG A 3 -10.101 3.065 -0.061 1.00 0.21 C ATOM 71 O4' DG A 3 -8.718 2.727 -0.230 1.00 0.20 O ATOM 72 C3' DG A 3 -10.234 4.567 -0.357 1.00 0.24 C ATOM 73 O3' DG A 3 -10.228 5.306 0.874 1.00 0.30 O ATOM 74 C2' DG A 3 -8.972 4.873 -1.144 1.00 0.22 C ATOM 75 C1' DG A 3 -7.996 3.932 -0.449 1.00 0.18 C ATOM 76 N9 DG A 3 -6.765 3.588 -1.190 1.00 0.16 N ATOM 77 C8 DG A 3 -6.597 3.266 -2.507 1.00 0.17 C ATOM 78 N7 DG A 3 -5.361 2.998 -2.833 1.00 0.16 N ATOM 79 C5 DG A 3 -4.665 3.148 -1.639 1.00 0.14 C ATOM 80 C6 DG A 3 -3.285 2.983 -1.355 1.00 0.14 C ATOM 81 O6 DG A 3 -2.386 2.666 -2.133 1.00 0.17 O ATOM 82 N1 DG A 3 -3.010 3.227 -0.014 1.00 0.13 N ATOM 83 C2 DG A 3 -3.936 3.577 0.926 1.00 0.13 C ATOM 84 N2 DG A 3 -3.493 3.690 2.169 1.00 0.16 N ATOM 85 N3 DG A 3 -5.227 3.738 0.663 1.00 0.14 N ATOM 86 C4 DG A 3 -5.518 3.508 -0.633 1.00 0.14 C ATOM 0 H5' DG A 3 -11.998 2.257 -0.683 1.00 0.23 H new ATOM 0 H5'' DG A 3 -10.863 2.502 -1.995 1.00 0.23 H new ATOM 0 H4' DG A 3 -10.465 2.891 0.952 1.00 0.21 H new ATOM 0 H3' DG A 3 -11.151 4.827 -0.886 1.00 0.24 H new ATOM 0 H2' DG A 3 -9.079 4.653 -2.206 1.00 0.22 H new ATOM 0 H2'' DG A 3 -8.673 5.918 -1.063 1.00 0.22 H new ATOM 0 H1' DG A 3 -7.645 4.447 0.445 1.00 0.18 H new ATOM 0 H8 DG A 3 -7.412 3.236 -3.215 1.00 0.17 H new ATOM 0 H1 DG A 3 -2.041 3.137 0.291 1.00 0.13 H new ATOM 0 H21 DG A 3 -4.135 3.949 2.918 1.00 0.16 H new ATOM 0 H22 DG A 3 -2.509 3.518 2.377 1.00 0.16 H new ATOM 98 P DT A 4 -11.589 5.582 1.694 1.00 0.46 P ATOM 99 OP1 DT A 4 -12.066 4.297 2.252 1.00 0.65 O ATOM 100 OP2 DT A 4 -12.489 6.398 0.845 1.00 0.66 O ATOM 101 O5' DT A 4 -11.079 6.508 2.918 1.00 0.40 O ATOM 102 C5' DT A 4 -10.180 5.992 3.913 1.00 0.36 C ATOM 103 C4' DT A 4 -8.955 6.893 4.085 1.00 0.25 C ATOM 104 O4' DT A 4 -8.096 6.377 5.114 1.00 0.24 O ATOM 105 C3' DT A 4 -8.107 7.012 2.817 1.00 0.22 C ATOM 106 O3' DT A 4 -8.048 8.381 2.408 1.00 0.26 O ATOM 107 C2' DT A 4 -6.714 6.533 3.228 1.00 0.22 C ATOM 108 C1' DT A 4 -6.987 5.723 4.492 1.00 0.23 C ATOM 109 N1 DT A 4 -7.354 4.304 4.242 1.00 0.24 N ATOM 110 C2 DT A 4 -8.412 3.759 4.976 1.00 0.35 C ATOM 111 O2 DT A 4 -8.903 4.313 5.956 1.00 0.42 O ATOM 112 N3 DT A 4 -8.851 2.518 4.576 1.00 0.38 N ATOM 113 C4 DT A 4 -8.349 1.775 3.534 1.00 0.32 C ATOM 114 O4 DT A 4 -8.815 0.668 3.273 1.00 0.39 O ATOM 115 C5 DT A 4 -7.253 2.409 2.837 1.00 0.21 C ATOM 116 C7 DT A 4 -6.716 1.791 1.572 1.00 0.20 C ATOM 117 C6 DT A 4 -6.779 3.603 3.207 1.00 0.19 C ATOM 0 H5' DT A 4 -9.859 4.990 3.629 1.00 0.36 H new ATOM 0 H5'' DT A 4 -10.703 5.902 4.865 1.00 0.36 H new ATOM 0 H4' DT A 4 -9.352 7.876 4.339 1.00 0.25 H new ATOM 0 H3' DT A 4 -8.514 6.433 1.988 1.00 0.22 H new ATOM 0 H2' DT A 4 -6.251 5.924 2.451 1.00 0.22 H new ATOM 0 H2'' DT A 4 -6.041 7.368 3.422 1.00 0.22 H new ATOM 0 H1' DT A 4 -6.080 5.687 5.096 1.00 0.23 H new ATOM 0 H3 DT A 4 -9.623 2.110 5.103 1.00 0.38 H new ATOM 0 H71 DT A 4 -6.848 0.710 1.611 1.00 0.20 H new ATOM 0 H72 DT A 4 -7.256 2.192 0.714 1.00 0.20 H new ATOM 0 H73 DT A 4 -5.656 2.024 1.475 1.00 0.20 H new ATOM 0 H6 DT A 4 -5.932 4.024 2.686 1.00 0.19 H new ATOM 130 P DT A 5 -8.255 8.769 0.861 1.00 0.26 P ATOM 131 OP1 DT A 5 -7.788 10.160 0.672 1.00 0.37 O ATOM 132 OP2 DT A 5 -9.633 8.397 0.471 1.00 0.37 O ATOM 133 O5' DT A 5 -7.233 7.771 0.112 1.00 0.26 O ATOM 134 C5' DT A 5 -6.816 8.024 -1.233 1.00 0.30 C ATOM 135 C4' DT A 5 -5.418 8.629 -1.275 1.00 0.24 C ATOM 136 O4' DT A 5 -5.338 9.695 -0.321 1.00 0.24 O ATOM 137 C3' DT A 5 -4.296 7.630 -0.949 1.00 0.23 C ATOM 138 O3' DT A 5 -3.347 7.628 -2.017 1.00 0.26 O ATOM 139 C2' DT A 5 -3.620 8.192 0.294 1.00 0.27 C ATOM 140 C1' DT A 5 -4.059 9.649 0.307 1.00 0.23 C ATOM 141 N1 DT A 5 -4.198 10.194 1.670 1.00 0.25 N ATOM 142 C2 DT A 5 -3.636 11.426 1.952 1.00 0.36 C ATOM 143 O2 DT A 5 -3.072 12.108 1.100 1.00 0.44 O ATOM 144 N3 DT A 5 -3.749 11.853 3.262 1.00 0.43 N ATOM 145 C4 DT A 5 -4.361 11.167 4.296 1.00 0.40 C ATOM 146 O4 DT A 5 -4.396 11.644 5.427 1.00 0.52 O ATOM 147 C5 DT A 5 -4.921 9.892 3.903 1.00 0.32 C ATOM 148 C7 DT A 5 -5.604 9.000 4.942 1.00 0.37 C ATOM 149 C6 DT A 5 -4.825 9.462 2.633 1.00 0.26 C ATOM 0 H5' DT A 5 -7.522 8.701 -1.714 1.00 0.30 H new ATOM 0 H5'' DT A 5 -6.829 7.094 -1.801 1.00 0.30 H new ATOM 0 H4' DT A 5 -5.269 8.972 -2.299 1.00 0.24 H new ATOM 0 H3' DT A 5 -4.673 6.617 -0.807 1.00 0.23 H new ATOM 0 H2' DT A 5 -3.938 7.669 1.196 1.00 0.27 H new ATOM 0 H2'' DT A 5 -2.535 8.100 0.238 1.00 0.27 H new ATOM 0 H1' DT A 5 -3.304 10.246 -0.204 1.00 0.23 H new ATOM 0 H3 DT A 5 -3.342 12.761 3.488 1.00 0.43 H new ATOM 0 H71 DT A 5 -5.149 9.165 5.919 1.00 0.37 H new ATOM 0 H72 DT A 5 -6.665 9.244 4.990 1.00 0.37 H new ATOM 0 H73 DT A 5 -5.485 7.954 4.659 1.00 0.37 H new ATOM 0 H6 DT A 5 -5.258 8.508 2.368 1.00 0.26 H new ATOM 162 P DT A 6 -3.303 6.442 -3.099 1.00 0.22 P ATOM 163 OP1 DT A 6 -2.490 6.910 -4.242 1.00 0.30 O ATOM 164 OP2 DT A 6 -4.683 5.960 -3.327 1.00 0.35 O ATOM 165 O5' DT A 6 -2.493 5.281 -2.333 1.00 0.21 O ATOM 166 C5' DT A 6 -1.065 5.194 -2.376 1.00 0.20 C ATOM 167 C4' DT A 6 -0.401 6.388 -1.693 1.00 0.17 C ATOM 168 O4' DT A 6 -0.969 6.577 -0.400 1.00 0.19 O ATOM 169 C3' DT A 6 1.105 6.211 -1.471 1.00 0.17 C ATOM 170 O3' DT A 6 1.871 6.987 -2.410 1.00 0.16 O ATOM 171 C2' DT A 6 1.350 6.718 -0.045 1.00 0.18 C ATOM 172 C1' DT A 6 -0.004 7.270 0.377 1.00 0.17 C ATOM 173 N1 DT A 6 -0.325 7.081 1.812 1.00 0.17 N ATOM 174 C2 DT A 6 0.693 7.280 2.729 1.00 0.21 C ATOM 175 O2 DT A 6 1.831 7.591 2.395 1.00 0.26 O ATOM 176 N3 DT A 6 0.349 7.139 4.054 1.00 0.22 N ATOM 177 C4 DT A 6 -0.900 6.835 4.543 1.00 0.21 C ATOM 178 O4 DT A 6 -1.091 6.753 5.753 1.00 0.24 O ATOM 179 C5 DT A 6 -1.901 6.644 3.526 1.00 0.19 C ATOM 180 C7 DT A 6 -3.335 6.327 3.941 1.00 0.25 C ATOM 181 C6 DT A 6 -1.594 6.763 2.219 1.00 0.18 C ATOM 0 H5' DT A 6 -0.736 5.140 -3.414 1.00 0.20 H new ATOM 0 H5'' DT A 6 -0.743 4.273 -1.891 1.00 0.20 H new ATOM 0 H4' DT A 6 -0.566 7.233 -2.362 1.00 0.17 H new ATOM 0 H3' DT A 6 1.411 5.174 -1.611 1.00 0.17 H new ATOM 0 H2' DT A 6 1.679 5.915 0.615 1.00 0.18 H new ATOM 0 H2'' DT A 6 2.122 7.487 -0.020 1.00 0.18 H new ATOM 0 H1' DT A 6 0.003 8.348 0.219 1.00 0.17 H new ATOM 0 H3 DT A 6 1.092 7.273 4.740 1.00 0.22 H new ATOM 0 H71 DT A 6 -4.025 6.722 3.196 1.00 0.25 H new ATOM 0 H72 DT A 6 -3.462 5.247 4.017 1.00 0.25 H new ATOM 0 H73 DT A 6 -3.544 6.785 4.908 1.00 0.25 H new ATOM 0 H6 DT A 6 -2.363 6.605 1.478 1.00 0.18 H new ATOM 194 P DT A 7 3.454 7.228 -2.153 1.00 0.16 P ATOM 195 OP1 DT A 7 4.005 6.033 -1.485 1.00 0.21 O ATOM 196 OP2 DT A 7 3.611 8.553 -1.511 1.00 0.21 O ATOM 197 O5' DT A 7 4.079 7.317 -3.634 1.00 0.16 O ATOM 198 C5' DT A 7 4.415 6.139 -4.374 1.00 0.18 C ATOM 199 C4' DT A 7 4.474 6.439 -5.882 1.00 0.21 C ATOM 200 O4' DT A 7 3.166 6.827 -6.320 1.00 0.24 O ATOM 201 C3' DT A 7 5.438 7.560 -6.301 1.00 0.23 C ATOM 202 O3' DT A 7 6.030 7.241 -7.567 1.00 0.30 O ATOM 203 C2' DT A 7 4.553 8.785 -6.473 1.00 0.26 C ATOM 204 C1' DT A 7 3.182 8.186 -6.789 1.00 0.26 C ATOM 205 N1 DT A 7 2.037 8.892 -6.158 1.00 0.25 N ATOM 206 C2 DT A 7 1.067 9.412 -6.996 1.00 0.36 C ATOM 207 O2 DT A 7 1.145 9.338 -8.221 1.00 0.45 O ATOM 208 N3 DT A 7 -0.004 10.028 -6.377 1.00 0.41 N ATOM 209 C4 DT A 7 -0.191 10.167 -5.015 1.00 0.34 C ATOM 210 O4 DT A 7 -1.187 10.737 -4.576 1.00 0.43 O ATOM 211 C5 DT A 7 0.872 9.596 -4.216 1.00 0.22 C ATOM 212 C7 DT A 7 0.798 9.653 -2.689 1.00 0.19 C ATOM 213 C6 DT A 7 1.926 8.996 -4.794 1.00 0.20 C ATOM 0 H5' DT A 7 3.676 5.361 -4.182 1.00 0.18 H new ATOM 0 H5'' DT A 7 5.378 5.755 -4.037 1.00 0.18 H new ATOM 0 H4' DT A 7 4.843 5.521 -6.340 1.00 0.21 H new ATOM 0 H3' DT A 7 6.237 7.707 -5.575 1.00 0.23 H new ATOM 0 H2' DT A 7 4.528 9.393 -5.569 1.00 0.26 H new ATOM 0 H2'' DT A 7 4.907 9.427 -7.279 1.00 0.26 H new ATOM 0 H1' DT A 7 3.053 8.274 -7.868 1.00 0.26 H new ATOM 0 H3 DT A 7 -0.726 10.417 -6.984 1.00 0.41 H new ATOM 0 H71 DT A 7 0.246 10.542 -2.384 1.00 0.19 H new ATOM 0 H72 DT A 7 0.289 8.764 -2.316 1.00 0.19 H new ATOM 0 H73 DT A 7 1.806 9.693 -2.277 1.00 0.19 H new ATOM 0 H6 DT A 7 2.706 8.585 -4.170 1.00 0.20 H new ATOM 226 P DG A 8 7.201 6.144 -7.697 1.00 0.30 P ATOM 227 OP1 DG A 8 8.309 6.532 -6.794 1.00 0.39 O ATOM 228 OP2 DG A 8 7.461 5.930 -9.138 1.00 0.47 O ATOM 229 O5' DG A 8 6.498 4.819 -7.114 1.00 0.27 O ATOM 230 C5' DG A 8 7.233 3.605 -6.914 1.00 0.28 C ATOM 231 C4' DG A 8 7.932 3.577 -5.554 1.00 0.18 C ATOM 232 O4' DG A 8 7.047 4.093 -4.549 1.00 0.16 O ATOM 233 C3' DG A 8 8.350 2.165 -5.110 1.00 0.17 C ATOM 234 O3' DG A 8 9.746 2.137 -4.722 1.00 0.19 O ATOM 235 C2' DG A 8 7.447 1.875 -3.910 1.00 0.17 C ATOM 236 C1' DG A 8 7.177 3.278 -3.396 1.00 0.14 C ATOM 237 N9 DG A 8 5.963 3.409 -2.579 1.00 0.12 N ATOM 238 C8 DG A 8 5.877 3.565 -1.227 1.00 0.13 C ATOM 239 N7 DG A 8 4.652 3.566 -0.761 1.00 0.12 N ATOM 240 C5 DG A 8 3.876 3.404 -1.914 1.00 0.11 C ATOM 241 C6 DG A 8 2.468 3.328 -2.065 1.00 0.11 C ATOM 242 O6 DG A 8 1.609 3.361 -1.196 1.00 0.15 O ATOM 243 N1 DG A 8 2.104 3.178 -3.389 1.00 0.12 N ATOM 244 C2 DG A 8 2.979 3.104 -4.447 1.00 0.13 C ATOM 245 N2 DG A 8 2.445 2.999 -5.656 1.00 0.17 N ATOM 246 N3 DG A 8 4.300 3.163 -4.313 1.00 0.12 N ATOM 247 C4 DG A 8 4.677 3.315 -3.025 1.00 0.11 C ATOM 0 H5' DG A 8 7.975 3.495 -7.705 1.00 0.28 H new ATOM 0 H5'' DG A 8 6.556 2.754 -6.992 1.00 0.28 H new ATOM 0 H4' DG A 8 8.831 4.183 -5.666 1.00 0.18 H new ATOM 0 H3' DG A 8 8.245 1.427 -5.905 1.00 0.17 H new ATOM 0 H2' DG A 8 6.531 1.360 -4.200 1.00 0.17 H new ATOM 0 H2'' DG A 8 7.941 1.252 -3.165 1.00 0.17 H new ATOM 0 H1' DG A 8 7.996 3.566 -2.737 1.00 0.14 H new ATOM 0 H8 DG A 8 6.745 3.678 -0.594 1.00 0.13 H new ATOM 0 H1 DG A 8 1.108 3.117 -3.598 1.00 0.12 H new ATOM 0 H21 DG A 8 3.048 2.941 -6.477 1.00 0.17 H new ATOM 0 H22 DG A 8 1.431 2.977 -5.765 1.00 0.17 H new ATOM 259 P DG A 9 10.346 3.041 -3.516 1.00 0.20 P ATOM 260 OP1 DG A 9 9.936 4.445 -3.739 1.00 0.23 O ATOM 261 OP2 DG A 9 11.784 2.713 -3.364 1.00 0.33 O ATOM 262 O5' DG A 9 9.558 2.482 -2.212 1.00 0.23 O ATOM 263 C5' DG A 9 9.624 3.193 -0.965 1.00 0.19 C ATOM 264 C4' DG A 9 9.197 2.341 0.240 1.00 0.15 C ATOM 265 O4' DG A 9 7.797 2.468 0.500 1.00 0.14 O ATOM 266 C3' DG A 9 9.445 0.825 0.107 1.00 0.16 C ATOM 267 O3' DG A 9 10.651 0.422 0.804 1.00 0.22 O ATOM 268 C2' DG A 9 8.210 0.191 0.777 1.00 0.16 C ATOM 269 C1' DG A 9 7.510 1.391 1.379 1.00 0.13 C ATOM 270 N9 DG A 9 6.045 1.244 1.562 1.00 0.12 N ATOM 271 C8 DG A 9 5.355 1.293 2.740 1.00 0.13 C ATOM 272 N7 DG A 9 4.065 1.138 2.615 1.00 0.12 N ATOM 273 C5 DG A 9 3.883 0.970 1.246 1.00 0.11 C ATOM 274 C6 DG A 9 2.687 0.760 0.514 1.00 0.11 C ATOM 275 O6 DG A 9 1.541 0.691 0.941 1.00 0.13 O ATOM 276 N1 DG A 9 2.929 0.638 -0.843 1.00 0.11 N ATOM 277 C2 DG A 9 4.174 0.708 -1.425 1.00 0.11 C ATOM 278 N2 DG A 9 4.207 0.585 -2.741 1.00 0.13 N ATOM 279 N3 DG A 9 5.309 0.904 -0.742 1.00 0.11 N ATOM 280 C4 DG A 9 5.089 1.028 0.587 1.00 0.11 C ATOM 0 H5' DG A 9 8.986 4.075 -1.023 1.00 0.19 H new ATOM 0 H5'' DG A 9 10.643 3.547 -0.809 1.00 0.19 H new ATOM 0 H4' DG A 9 9.824 2.735 1.039 1.00 0.15 H new ATOM 0 H3' DG A 9 9.580 0.520 -0.931 1.00 0.16 H new ATOM 0 H2' DG A 9 7.578 -0.327 0.055 1.00 0.16 H new ATOM 0 H2'' DG A 9 8.490 -0.538 1.537 1.00 0.16 H new ATOM 0 H1' DG A 9 7.877 1.542 2.394 1.00 0.13 H new ATOM 0 H8 DG A 9 5.836 1.447 3.694 1.00 0.13 H new ATOM 0 H1 DG A 9 2.128 0.485 -1.455 1.00 0.11 H new ATOM 0 H21 DG A 9 5.098 0.628 -3.235 1.00 0.13 H new ATOM 0 H22 DG A 9 3.341 0.447 -3.262 1.00 0.13 H new ATOM 292 P DG A 10 11.090 1.020 2.245 1.00 0.25 P ATOM 293 OP1 DG A 10 11.273 2.484 2.108 1.00 0.30 O ATOM 294 OP2 DG A 10 12.207 0.195 2.764 1.00 0.35 O ATOM 295 O5' DG A 10 9.786 0.756 3.169 1.00 0.22 O ATOM 296 C5' DG A 10 9.632 -0.474 3.889 1.00 0.20 C ATOM 297 C4' DG A 10 8.572 -0.374 4.989 1.00 0.16 C ATOM 298 O4' DG A 10 7.274 -0.228 4.398 1.00 0.15 O ATOM 299 C3' DG A 10 8.530 -1.599 5.899 1.00 0.19 C ATOM 300 O3' DG A 10 8.535 -1.189 7.284 1.00 0.21 O ATOM 301 C2' DG A 10 7.232 -2.319 5.533 1.00 0.20 C ATOM 302 C1' DG A 10 6.379 -1.218 4.925 1.00 0.16 C ATOM 303 N9 DG A 10 5.525 -1.657 3.808 1.00 0.15 N ATOM 304 C8 DG A 10 5.897 -1.857 2.516 1.00 0.16 C ATOM 305 N7 DG A 10 4.915 -2.147 1.719 1.00 0.15 N ATOM 306 C5 DG A 10 3.803 -2.145 2.537 1.00 0.14 C ATOM 307 C6 DG A 10 2.452 -2.394 2.207 1.00 0.14 C ATOM 308 O6 DG A 10 1.980 -2.640 1.099 1.00 0.15 O ATOM 309 N1 DG A 10 1.633 -2.305 3.326 1.00 0.14 N ATOM 310 C2 DG A 10 2.070 -2.013 4.604 1.00 0.14 C ATOM 311 N2 DG A 10 1.153 -2.027 5.563 1.00 0.17 N ATOM 312 N3 DG A 10 3.349 -1.769 4.911 1.00 0.14 N ATOM 313 C4 DG A 10 4.157 -1.853 3.830 1.00 0.14 C ATOM 0 H5' DG A 10 10.587 -0.755 4.332 1.00 0.20 H new ATOM 0 H5'' DG A 10 9.358 -1.267 3.194 1.00 0.20 H new ATOM 0 H4' DG A 10 8.844 0.492 5.593 1.00 0.16 H new ATOM 0 H3' DG A 10 9.395 -2.250 5.769 1.00 0.19 H new ATOM 0 H2' DG A 10 7.407 -3.129 4.825 1.00 0.20 H new ATOM 0 H2'' DG A 10 6.756 -2.759 6.409 1.00 0.20 H new ATOM 0 H1' DG A 10 5.720 -0.856 5.714 1.00 0.16 H new ATOM 0 H8 DG A 10 6.921 -1.781 2.182 1.00 0.16 H new ATOM 0 H1 DG A 10 0.635 -2.467 3.194 1.00 0.14 H new ATOM 0 H21 DG A 10 1.419 -1.819 6.526 1.00 0.17 H new ATOM 0 H22 DG A 10 0.183 -2.246 5.337 1.00 0.17 H new ATOM 325 P DT A 11 7.426 -0.205 7.943 1.00 0.22 P ATOM 326 OP1 DT A 11 7.626 -0.231 9.412 1.00 0.25 O ATOM 327 OP2 DT A 11 6.097 -0.531 7.388 1.00 0.34 O ATOM 328 O5' DT A 11 7.853 1.257 7.416 1.00 0.27 O ATOM 329 C5' DT A 11 7.414 2.428 8.120 1.00 0.34 C ATOM 330 C4' DT A 11 7.833 3.712 7.409 1.00 0.28 C ATOM 331 O4' DT A 11 9.261 3.752 7.296 1.00 0.32 O ATOM 332 C3' DT A 11 7.254 3.850 6.001 1.00 0.23 C ATOM 333 O3' DT A 11 6.853 5.208 5.778 1.00 0.23 O ATOM 334 C2' DT A 11 8.416 3.492 5.089 1.00 0.29 C ATOM 335 C1' DT A 11 9.622 3.935 5.925 1.00 0.33 C ATOM 336 N1 DT A 11 10.840 3.137 5.684 1.00 0.39 N ATOM 337 C2 DT A 11 11.810 3.677 4.861 1.00 0.57 C ATOM 338 O2 DT A 11 11.691 4.783 4.342 1.00 0.66 O ATOM 339 N3 DT A 11 12.933 2.901 4.658 1.00 0.67 N ATOM 340 C4 DT A 11 13.169 1.651 5.198 1.00 0.60 C ATOM 341 O4 DT A 11 14.212 1.052 4.952 1.00 0.75 O ATOM 342 C5 DT A 11 12.102 1.164 6.045 1.00 0.43 C ATOM 343 C7 DT A 11 12.232 -0.204 6.711 1.00 0.42 C ATOM 344 C6 DT A 11 10.996 1.903 6.258 1.00 0.34 C ATOM 0 H5' DT A 11 7.827 2.421 9.129 1.00 0.34 H new ATOM 0 H5'' DT A 11 6.329 2.406 8.219 1.00 0.34 H new ATOM 0 H4' DT A 11 7.444 4.531 8.014 1.00 0.28 H new ATOM 0 H3' DT A 11 6.380 3.221 5.833 1.00 0.23 H new ATOM 0 H2' DT A 11 8.445 2.426 4.863 1.00 0.29 H new ATOM 0 H2'' DT A 11 8.364 4.018 4.136 1.00 0.29 H new ATOM 0 H1' DT A 11 9.852 4.966 5.656 1.00 0.33 H new ATOM 0 H3 DT A 11 13.657 3.287 4.052 1.00 0.67 H new ATOM 0 H71 DT A 11 12.838 -0.858 6.084 1.00 0.42 H new ATOM 0 H72 DT A 11 12.709 -0.091 7.684 1.00 0.42 H new ATOM 0 H73 DT A 11 11.242 -0.641 6.841 1.00 0.42 H new ATOM 0 H6 DT A 11 10.215 1.514 6.895 1.00 0.34 H new ATOM 357 P DG A 12 5.350 5.546 5.308 1.00 0.21 P ATOM 358 OP1 DG A 12 4.789 4.331 4.676 1.00 0.29 O ATOM 359 OP2 DG A 12 5.374 6.821 4.560 1.00 0.34 O ATOM 360 O5' DG A 12 4.594 5.811 6.706 1.00 0.19 O ATOM 361 C5' DG A 12 3.232 6.257 6.727 1.00 0.19 C ATOM 362 C4' DG A 12 2.377 5.378 7.625 1.00 0.15 C ATOM 363 O4' DG A 12 1.117 5.189 7.005 1.00 0.15 O ATOM 364 C3' DG A 12 2.971 3.997 7.875 1.00 0.14 C ATOM 365 O3' DG A 12 2.558 3.537 9.171 1.00 0.17 O ATOM 366 C2' DG A 12 2.349 3.171 6.765 1.00 0.13 C ATOM 367 C1' DG A 12 0.984 3.826 6.639 1.00 0.12 C ATOM 368 N9 DG A 12 0.389 3.819 5.308 1.00 0.12 N ATOM 369 C8 DG A 12 -0.927 3.844 5.030 1.00 0.13 C ATOM 370 N7 DG A 12 -1.207 3.808 3.759 1.00 0.13 N ATOM 371 C5 DG A 12 0.043 3.765 3.149 1.00 0.12 C ATOM 372 C6 DG A 12 0.385 3.716 1.775 1.00 0.12 C ATOM 373 O6 DG A 12 -0.359 3.680 0.805 1.00 0.16 O ATOM 374 N1 DG A 12 1.752 3.691 1.593 1.00 0.12 N ATOM 375 C2 DG A 12 2.682 3.707 2.598 1.00 0.13 C ATOM 376 N2 DG A 12 3.952 3.701 2.219 1.00 0.14 N ATOM 377 N3 DG A 12 2.369 3.747 3.891 1.00 0.13 N ATOM 378 C4 DG A 12 1.033 3.774 4.093 1.00 0.12 C ATOM 0 H5' DG A 12 2.828 6.248 5.715 1.00 0.19 H new ATOM 0 H5'' DG A 12 3.190 7.288 7.077 1.00 0.19 H new ATOM 0 H4' DG A 12 2.307 5.890 8.585 1.00 0.15 H new ATOM 0 H3' DG A 12 4.060 3.956 7.868 1.00 0.14 H new ATOM 0 H2' DG A 12 2.921 3.230 5.839 1.00 0.13 H new ATOM 0 H2'' DG A 12 2.276 2.116 7.029 1.00 0.13 H new ATOM 0 H1' DG A 12 0.329 3.237 7.280 1.00 0.12 H new ATOM 0 H8 DG A 12 -1.687 3.890 5.796 1.00 0.13 H new ATOM 0 H1 DG A 12 2.098 3.658 0.634 1.00 0.12 H new ATOM 0 H21 DG A 12 4.693 3.712 2.920 1.00 0.14 H new ATOM 0 H22 DG A 12 4.188 3.685 1.227 1.00 0.14 H new ATOM 390 P DG A 13 2.538 1.971 9.555 1.00 0.19 P ATOM 391 OP1 DG A 13 2.663 1.854 11.025 1.00 0.27 O ATOM 392 OP2 DG A 13 3.488 1.253 8.674 1.00 0.21 O ATOM 393 O5' DG A 13 1.033 1.557 9.145 1.00 0.20 O ATOM 394 C5' DG A 13 -0.079 2.273 9.699 1.00 0.22 C ATOM 395 C4' DG A 13 -1.410 1.594 9.392 1.00 0.20 C ATOM 396 O4' DG A 13 -1.776 1.795 8.023 1.00 0.21 O ATOM 397 C3' DG A 13 -1.399 0.079 9.626 1.00 0.19 C ATOM 398 O3' DG A 13 -2.266 -0.249 10.716 1.00 0.26 O ATOM 399 C2' DG A 13 -1.965 -0.505 8.333 1.00 0.18 C ATOM 400 C1' DG A 13 -2.608 0.701 7.679 1.00 0.18 C ATOM 401 N9 DG A 13 -2.733 0.621 6.205 1.00 0.16 N ATOM 402 C8 DG A 13 -3.880 0.484 5.462 1.00 0.18 C ATOM 403 N7 DG A 13 -3.687 0.458 4.185 1.00 0.18 N ATOM 404 C5 DG A 13 -2.319 0.591 4.052 1.00 0.16 C ATOM 405 C6 DG A 13 -1.539 0.641 2.885 1.00 0.16 C ATOM 406 O6 DG A 13 -1.894 0.595 1.731 1.00 0.20 O ATOM 407 N1 DG A 13 -0.224 0.789 3.156 1.00 0.13 N ATOM 408 C2 DG A 13 0.335 0.873 4.409 1.00 0.12 C ATOM 409 N2 DG A 13 1.665 1.000 4.457 1.00 0.13 N ATOM 410 N3 DG A 13 -0.387 0.829 5.537 1.00 0.14 N ATOM 411 C4 DG A 13 -1.714 0.689 5.279 1.00 0.15 C ATOM 0 H5' DG A 13 -0.090 3.288 9.302 1.00 0.22 H new ATOM 0 H5'' DG A 13 0.045 2.355 10.779 1.00 0.22 H new ATOM 0 H4' DG A 13 -2.121 2.053 10.079 1.00 0.20 H new ATOM 0 H3' DG A 13 -0.406 -0.301 9.866 1.00 0.19 H new ATOM 0 H2' DG A 13 -1.184 -0.937 7.707 1.00 0.18 H new ATOM 0 H2'' DG A 13 -2.690 -1.295 8.528 1.00 0.18 H new ATOM 0 H1' DG A 13 -3.635 0.787 8.034 1.00 0.18 H new ATOM 0 H8 DG A 13 -4.861 0.405 5.908 1.00 0.18 H new ATOM 0 H1 DG A 13 0.411 0.843 2.360 1.00 0.13 H new ATOM 0 H21 DG A 13 2.139 1.067 5.358 1.00 0.13 H new ATOM 0 H22 DG A 13 2.206 1.030 3.593 1.00 0.13 H new ATOM 423 P DG A 14 -2.089 -1.633 11.522 1.00 0.24 P ATOM 424 OP1 DG A 14 -2.746 -1.482 12.840 1.00 0.32 O ATOM 425 OP2 DG A 14 -0.664 -2.029 11.453 1.00 0.28 O ATOM 426 O5' DG A 14 -2.943 -2.673 10.645 1.00 0.25 O ATOM 427 C5' DG A 14 -4.352 -2.810 10.848 1.00 0.26 C ATOM 428 C4' DG A 14 -5.015 -3.444 9.636 1.00 0.23 C ATOM 429 O4' DG A 14 -4.754 -2.637 8.493 1.00 0.23 O ATOM 430 C3' DG A 14 -4.482 -4.836 9.307 1.00 0.22 C ATOM 431 O3' DG A 14 -5.317 -5.842 9.879 1.00 0.26 O ATOM 432 C2' DG A 14 -4.562 -4.928 7.789 1.00 0.25 C ATOM 433 C1' DG A 14 -4.756 -3.471 7.337 1.00 0.22 C ATOM 434 N9 DG A 14 -3.671 -3.045 6.460 1.00 0.19 N ATOM 435 C8 DG A 14 -2.367 -2.805 6.770 1.00 0.19 C ATOM 436 N7 DG A 14 -1.609 -2.594 5.740 1.00 0.17 N ATOM 437 C5 DG A 14 -2.479 -2.706 4.668 1.00 0.15 C ATOM 438 C6 DG A 14 -2.229 -2.590 3.285 1.00 0.14 C ATOM 439 O6 DG A 14 -1.156 -2.373 2.727 1.00 0.16 O ATOM 440 N1 DG A 14 -3.390 -2.788 2.545 1.00 0.14 N ATOM 441 C2 DG A 14 -4.632 -3.056 3.084 1.00 0.16 C ATOM 442 N2 DG A 14 -5.631 -3.244 2.229 1.00 0.17 N ATOM 443 N3 DG A 14 -4.860 -3.159 4.385 1.00 0.17 N ATOM 444 C4 DG A 14 -3.744 -2.976 5.108 1.00 0.16 C ATOM 0 H5' DG A 14 -4.793 -1.832 11.039 1.00 0.26 H new ATOM 0 H5'' DG A 14 -4.539 -3.421 11.731 1.00 0.26 H new ATOM 0 H4' DG A 14 -6.075 -3.523 9.878 1.00 0.23 H new ATOM 0 H3' DG A 14 -3.475 -4.986 9.695 1.00 0.22 H new ATOM 0 H2' DG A 14 -3.654 -5.359 7.367 1.00 0.25 H new ATOM 0 H2'' DG A 14 -5.392 -5.558 7.471 1.00 0.25 H new ATOM 0 H1' DG A 14 -5.697 -3.395 6.793 1.00 0.22 H new ATOM 0 H8 DG A 14 -1.997 -2.792 7.785 1.00 0.19 H new ATOM 0 H1 DG A 14 -3.318 -2.731 1.529 1.00 0.14 H new ATOM 0 H21 DG A 14 -6.569 -3.445 2.576 1.00 0.17 H new ATOM 0 H22 DG A 14 -5.460 -3.187 1.225 1.00 0.17 H new ATOM 456 P DT A 15 -4.873 -7.391 9.801 1.00 0.28 P ATOM 457 OP1 DT A 15 -5.864 -8.187 10.557 1.00 0.36 O ATOM 458 OP2 DT A 15 -3.438 -7.483 10.149 1.00 0.30 O ATOM 459 O5' DT A 15 -5.029 -7.731 8.229 1.00 0.26 O ATOM 460 C5' DT A 15 -6.325 -7.958 7.672 1.00 0.28 C ATOM 461 C4' DT A 15 -6.319 -7.993 6.141 1.00 0.26 C ATOM 462 O4' DT A 15 -5.716 -6.826 5.586 1.00 0.25 O ATOM 463 C3' DT A 15 -5.517 -9.127 5.517 1.00 0.26 C ATOM 464 O3' DT A 15 -6.260 -10.359 5.513 1.00 0.32 O ATOM 465 C2' DT A 15 -5.309 -8.625 4.081 1.00 0.23 C ATOM 466 C1' DT A 15 -5.521 -7.125 4.197 1.00 0.24 C ATOM 467 N1 DT A 15 -4.382 -6.375 3.640 1.00 0.22 N ATOM 468 C2 DT A 15 -4.558 -5.852 2.375 1.00 0.23 C ATOM 469 O2 DT A 15 -5.647 -5.861 1.808 1.00 0.27 O ATOM 470 N3 DT A 15 -3.446 -5.316 1.778 1.00 0.23 N ATOM 471 C4 DT A 15 -2.184 -5.246 2.314 1.00 0.21 C ATOM 472 O4 DT A 15 -1.255 -4.776 1.662 1.00 0.23 O ATOM 473 C5 DT A 15 -2.080 -5.794 3.645 1.00 0.20 C ATOM 474 C7 DT A 15 -0.732 -5.736 4.350 1.00 0.22 C ATOM 475 C6 DT A 15 -3.158 -6.335 4.265 1.00 0.21 C ATOM 0 H5' DT A 15 -7.002 -7.174 8.010 1.00 0.28 H new ATOM 0 H5'' DT A 15 -6.717 -8.902 8.050 1.00 0.28 H new ATOM 0 H4' DT A 15 -7.380 -8.101 5.916 1.00 0.26 H new ATOM 0 H3' DT A 15 -4.594 -9.346 6.054 1.00 0.26 H new ATOM 0 H2' DT A 15 -4.311 -8.862 3.713 1.00 0.23 H new ATOM 0 H2'' DT A 15 -6.019 -9.079 3.390 1.00 0.23 H new ATOM 0 H1' DT A 15 -6.394 -6.822 3.619 1.00 0.24 H new ATOM 0 H3 DT A 15 -3.569 -4.931 0.842 1.00 0.23 H new ATOM 0 H71 DT A 15 -0.887 -5.667 5.427 1.00 0.22 H new ATOM 0 H72 DT A 15 -0.163 -6.638 4.122 1.00 0.22 H new ATOM 0 H73 DT A 15 -0.179 -4.862 4.006 1.00 0.22 H new ATOM 0 H6 DT A 15 -3.054 -6.739 5.261 1.00 0.21 H new ATOM 488 P DT A 16 -6.244 -11.393 4.252 1.00 0.28 P ATOM 489 OP1 DT A 16 -7.314 -10.976 3.323 1.00 0.44 O ATOM 490 OP2 DT A 16 -6.247 -12.770 4.796 1.00 0.43 O ATOM 491 O5' DT A 16 -4.823 -11.153 3.502 1.00 0.23 O ATOM 492 C5' DT A 16 -4.777 -10.765 2.105 1.00 0.21 C ATOM 493 C4' DT A 16 -3.341 -10.563 1.607 1.00 0.20 C ATOM 494 O4' DT A 16 -2.555 -9.864 2.580 1.00 0.22 O ATOM 495 C3' DT A 16 -2.600 -11.854 1.261 1.00 0.20 C ATOM 496 O3' DT A 16 -2.014 -11.668 -0.036 1.00 0.21 O ATOM 497 C2' DT A 16 -1.500 -11.959 2.337 1.00 0.24 C ATOM 498 C1' DT A 16 -1.281 -10.506 2.703 1.00 0.21 C ATOM 499 N1 DT A 16 -0.842 -10.295 4.085 1.00 0.23 N ATOM 500 C2 DT A 16 0.385 -9.700 4.290 1.00 0.29 C ATOM 501 O2 DT A 16 1.140 -9.417 3.364 1.00 0.35 O ATOM 502 N3 DT A 16 0.722 -9.450 5.603 1.00 0.34 N ATOM 503 C4 DT A 16 -0.055 -9.738 6.710 1.00 0.32 C ATOM 504 O4 DT A 16 0.339 -9.468 7.839 1.00 0.39 O ATOM 505 C5 DT A 16 -1.321 -10.363 6.393 1.00 0.27 C ATOM 506 C7 DT A 16 -2.306 -10.681 7.513 1.00 0.30 C ATOM 507 C6 DT A 16 -1.662 -10.624 5.118 1.00 0.24 C ATOM 0 H5' DT A 16 -5.341 -9.842 1.967 1.00 0.21 H new ATOM 0 H5'' DT A 16 -5.265 -11.530 1.501 1.00 0.21 H new ATOM 0 H4' DT A 16 -3.455 -9.986 0.689 1.00 0.20 H new ATOM 0 H3' DT A 16 -3.226 -12.746 1.241 1.00 0.20 H new ATOM 0 H2' DT A 16 -1.822 -12.552 3.193 1.00 0.24 H new ATOM 0 H2'' DT A 16 -0.593 -12.424 1.950 1.00 0.24 H new ATOM 0 H1' DT A 16 -0.501 -10.116 2.049 1.00 0.21 H new ATOM 0 H3 DT A 16 1.627 -9.012 5.774 1.00 0.34 H new ATOM 0 H71 DT A 16 -1.758 -10.884 8.433 1.00 0.30 H new ATOM 0 H72 DT A 16 -2.970 -9.830 7.666 1.00 0.30 H new ATOM 0 H73 DT A 16 -2.895 -11.557 7.242 1.00 0.30 H new ATOM 0 H6 DT A 16 -2.607 -11.105 4.911 1.00 0.24 H new ATOM 520 P DT A 17 -1.217 -12.835 -0.810 1.00 0.24 P ATOM 521 OP1 DT A 17 -2.171 -13.567 -1.675 1.00 0.32 O ATOM 522 OP2 DT A 17 -0.379 -13.574 0.159 1.00 0.27 O ATOM 523 O5' DT A 17 -0.229 -11.970 -1.760 1.00 0.24 O ATOM 524 C5' DT A 17 0.700 -11.030 -1.184 1.00 0.23 C ATOM 525 C4' DT A 17 1.555 -10.320 -2.248 1.00 0.22 C ATOM 526 O4' DT A 17 0.708 -9.476 -3.031 1.00 0.20 O ATOM 527 C3' DT A 17 2.668 -9.434 -1.673 1.00 0.23 C ATOM 528 O3' DT A 17 3.848 -9.408 -2.499 1.00 0.27 O ATOM 529 C2' DT A 17 2.068 -8.043 -1.643 1.00 0.23 C ATOM 530 C1' DT A 17 0.909 -8.103 -2.658 1.00 0.19 C ATOM 531 N1 DT A 17 -0.353 -7.569 -2.097 1.00 0.16 N ATOM 532 C2 DT A 17 -0.279 -6.330 -1.480 1.00 0.16 C ATOM 533 O2 DT A 17 0.761 -5.679 -1.431 1.00 0.19 O ATOM 534 N3 DT A 17 -1.445 -5.852 -0.941 1.00 0.16 N ATOM 535 C4 DT A 17 -2.671 -6.476 -0.966 1.00 0.16 C ATOM 536 O4 DT A 17 -3.655 -5.938 -0.479 1.00 0.20 O ATOM 537 C5 DT A 17 -2.673 -7.754 -1.623 1.00 0.17 C ATOM 538 C7 DT A 17 -3.992 -8.518 -1.706 1.00 0.19 C ATOM 539 C6 DT A 17 -1.537 -8.264 -2.161 1.00 0.17 C ATOM 0 H5' DT A 17 1.354 -11.552 -0.486 1.00 0.23 H new ATOM 0 H5'' DT A 17 0.149 -10.286 -0.609 1.00 0.23 H new ATOM 0 H4' DT A 17 2.029 -11.111 -2.829 1.00 0.22 H new ATOM 0 H3' DT A 17 2.985 -9.810 -0.700 1.00 0.23 H new ATOM 0 H2' DT A 17 1.710 -7.786 -0.646 1.00 0.23 H new ATOM 0 H2'' DT A 17 2.802 -7.287 -1.923 1.00 0.23 H new ATOM 0 H1' DT A 17 1.175 -7.488 -3.518 1.00 0.19 H new ATOM 0 H3 DT A 17 -1.399 -4.945 -0.476 1.00 0.16 H new ATOM 0 H71 DT A 17 -4.611 -8.271 -0.843 1.00 0.19 H new ATOM 0 H72 DT A 17 -4.517 -8.240 -2.620 1.00 0.19 H new ATOM 0 H73 DT A 17 -3.792 -9.589 -1.714 1.00 0.19 H new ATOM 0 H6 DT A 17 -1.563 -9.229 -2.646 1.00 0.17 H new ATOM 552 P DT A 18 5.220 -8.752 -1.906 1.00 0.31 P ATOM 553 OP1 DT A 18 6.347 -9.129 -2.781 1.00 0.39 O ATOM 554 OP2 DT A 18 5.291 -9.093 -0.469 1.00 0.38 O ATOM 555 O5' DT A 18 4.962 -7.144 -2.005 1.00 0.26 O ATOM 556 C5' DT A 18 4.998 -6.396 -3.242 1.00 0.21 C ATOM 557 C4' DT A 18 6.248 -6.709 -4.071 1.00 0.25 C ATOM 558 O4' DT A 18 6.053 -7.927 -4.796 1.00 0.31 O ATOM 559 C3' DT A 18 6.607 -5.649 -5.098 1.00 0.31 C ATOM 560 O3' DT A 18 8.030 -5.621 -5.283 1.00 0.34 O ATOM 561 C2' DT A 18 5.918 -6.133 -6.363 1.00 0.42 C ATOM 562 C1' DT A 18 5.910 -7.648 -6.193 1.00 0.42 C ATOM 563 N1 DT A 18 4.660 -8.297 -6.646 1.00 0.58 N ATOM 564 C2 DT A 18 4.191 -7.986 -7.911 1.00 0.88 C ATOM 565 O2 DT A 18 4.775 -7.210 -8.661 1.00 0.98 O ATOM 566 N3 DT A 18 3.016 -8.603 -8.288 1.00 1.08 N ATOM 567 C4 DT A 18 2.279 -9.487 -7.526 1.00 0.99 C ATOM 568 O4 DT A 18 1.247 -9.984 -7.970 1.00 1.22 O ATOM 569 C5 DT A 18 2.843 -9.748 -6.221 1.00 0.67 C ATOM 570 C7 DT A 18 2.108 -10.654 -5.243 1.00 0.55 C ATOM 571 C6 DT A 18 3.989 -9.165 -5.831 1.00 0.49 C ATOM 0 H5' DT A 18 4.969 -5.329 -3.021 1.00 0.21 H new ATOM 0 H5'' DT A 18 4.108 -6.624 -3.829 1.00 0.21 H new ATOM 0 H4' DT A 18 7.058 -6.767 -3.344 1.00 0.25 H new ATOM 0 H3' DT A 18 6.302 -4.643 -4.810 1.00 0.31 H new ATOM 0 H2' DT A 18 4.908 -5.732 -6.451 1.00 0.42 H new ATOM 0 H2'' DT A 18 6.461 -5.831 -7.259 1.00 0.42 H new ATOM 0 H1' DT A 18 6.721 -8.043 -6.805 1.00 0.42 H new ATOM 0 H3 DT A 18 2.658 -8.385 -9.218 1.00 1.08 H new ATOM 0 H71 DT A 18 2.830 -11.158 -4.601 1.00 0.55 H new ATOM 0 H72 DT A 18 1.433 -10.056 -4.631 1.00 0.55 H new ATOM 0 H73 DT A 18 1.534 -11.397 -5.796 1.00 0.55 H new ATOM 0 H6 DT A 18 4.388 -9.387 -4.852 1.00 0.49 H new ATOM 584 P DG A 19 8.998 -4.979 -4.158 1.00 0.38 P ATOM 585 OP1 DG A 19 10.191 -5.846 -4.038 1.00 0.53 O ATOM 586 OP2 DG A 19 8.191 -4.675 -2.958 1.00 0.46 O ATOM 587 O5' DG A 19 9.462 -3.587 -4.825 1.00 0.28 O ATOM 588 C5' DG A 19 8.592 -2.452 -4.871 1.00 0.22 C ATOM 589 C4' DG A 19 7.603 -2.540 -6.026 1.00 0.16 C ATOM 590 O4' DG A 19 6.407 -3.177 -5.569 1.00 0.15 O ATOM 591 C3' DG A 19 7.210 -1.175 -6.589 1.00 0.16 C ATOM 592 O3' DG A 19 7.437 -1.130 -8.016 1.00 0.17 O ATOM 593 C2' DG A 19 5.729 -1.047 -6.276 1.00 0.14 C ATOM 594 C1' DG A 19 5.288 -2.494 -6.117 1.00 0.12 C ATOM 595 N9 DG A 19 4.137 -2.692 -5.206 1.00 0.12 N ATOM 596 C8 DG A 19 2.835 -2.964 -5.525 1.00 0.13 C ATOM 597 N7 DG A 19 2.034 -3.012 -4.500 1.00 0.14 N ATOM 598 C5 DG A 19 2.863 -2.766 -3.415 1.00 0.12 C ATOM 599 C6 DG A 19 2.554 -2.699 -2.030 1.00 0.13 C ATOM 600 O6 DG A 19 1.461 -2.814 -1.490 1.00 0.17 O ATOM 601 N1 DG A 19 3.678 -2.439 -1.270 1.00 0.13 N ATOM 602 C2 DG A 19 4.949 -2.263 -1.783 1.00 0.13 C ATOM 603 N2 DG A 19 5.923 -2.046 -0.915 1.00 0.16 N ATOM 604 N3 DG A 19 5.238 -2.316 -3.079 1.00 0.13 N ATOM 605 C4 DG A 19 4.155 -2.572 -3.836 1.00 0.12 C ATOM 0 H5' DG A 19 9.186 -1.543 -4.970 1.00 0.22 H new ATOM 0 H5'' DG A 19 8.046 -2.375 -3.931 1.00 0.22 H new ATOM 0 H4' DG A 19 8.098 -3.104 -6.817 1.00 0.16 H new ATOM 0 H3' DG A 19 7.795 -0.363 -6.158 1.00 0.16 H new ATOM 0 H2' DG A 19 5.557 -0.470 -5.367 1.00 0.14 H new ATOM 0 H2'' DG A 19 5.188 -0.546 -7.079 1.00 0.14 H new ATOM 0 H1' DG A 19 4.962 -2.860 -7.090 1.00 0.12 H new ATOM 0 H8 DG A 19 2.501 -3.125 -6.539 1.00 0.13 H new ATOM 0 H1 DG A 19 3.561 -2.372 -0.259 1.00 0.13 H new ATOM 0 H21 DG A 19 6.879 -1.910 -1.244 1.00 0.16 H new ATOM 0 H22 DG A 19 5.718 -2.015 0.084 1.00 0.16 H new ATOM 617 P DG A 20 6.675 -2.106 -9.058 1.00 0.18 P ATOM 618 OP1 DG A 20 6.789 -3.497 -8.570 1.00 0.21 O ATOM 619 OP2 DG A 20 7.138 -1.771 -10.424 1.00 0.28 O ATOM 620 O5' DG A 20 5.132 -1.652 -8.923 1.00 0.19 O ATOM 621 C5' DG A 20 4.128 -2.321 -9.685 1.00 0.17 C ATOM 622 C4' DG A 20 2.764 -1.646 -9.597 1.00 0.15 C ATOM 623 O4' DG A 20 2.319 -1.602 -8.252 1.00 0.14 O ATOM 624 C3' DG A 20 2.745 -0.208 -10.103 1.00 0.15 C ATOM 625 O3' DG A 20 2.278 -0.173 -11.453 1.00 0.20 O ATOM 626 C2' DG A 20 1.725 0.498 -9.200 1.00 0.15 C ATOM 627 C1' DG A 20 1.338 -0.574 -8.159 1.00 0.14 C ATOM 628 N9 DG A 20 1.342 -0.130 -6.754 1.00 0.12 N ATOM 629 C8 DG A 20 2.392 0.235 -5.987 1.00 0.12 C ATOM 630 N7 DG A 20 2.135 0.345 -4.723 1.00 0.12 N ATOM 631 C5 DG A 20 0.796 0.053 -4.646 1.00 0.12 C ATOM 632 C6 DG A 20 -0.050 0.021 -3.520 1.00 0.12 C ATOM 633 O6 DG A 20 0.257 0.231 -2.336 1.00 0.15 O ATOM 634 N1 DG A 20 -1.351 -0.312 -3.895 1.00 0.13 N ATOM 635 C2 DG A 20 -1.751 -0.570 -5.202 1.00 0.14 C ATOM 636 N2 DG A 20 -3.030 -0.792 -5.419 1.00 0.16 N ATOM 637 N3 DG A 20 -0.945 -0.544 -6.236 1.00 0.14 N ATOM 638 C4 DG A 20 0.301 -0.229 -5.891 1.00 0.12 C ATOM 0 H5' DG A 20 4.041 -3.350 -9.337 1.00 0.17 H new ATOM 0 H5'' DG A 20 4.440 -2.363 -10.729 1.00 0.17 H new ATOM 0 H4' DG A 20 2.118 -2.251 -10.233 1.00 0.15 H new ATOM 0 H3' DG A 20 3.732 0.254 -10.078 1.00 0.15 H new ATOM 0 H2' DG A 20 2.156 1.379 -8.724 1.00 0.15 H new ATOM 0 H2'' DG A 20 0.857 0.835 -9.767 1.00 0.15 H new ATOM 0 H1' DG A 20 0.315 -0.871 -8.391 1.00 0.14 H new ATOM 0 H8 DG A 20 3.373 0.421 -6.398 1.00 0.12 H new ATOM 0 H1 DG A 20 -2.057 -0.370 -3.161 1.00 0.13 H new ATOM 0 H21 DG A 20 -3.361 -0.985 -6.364 1.00 0.16 H new ATOM 0 H22 DG A 20 -3.690 -0.771 -4.642 1.00 0.16 H new ATOM 650 P DG A 21 2.396 1.187 -12.312 1.00 0.21 P ATOM 651 OP1 DG A 21 2.376 0.828 -13.747 1.00 0.29 O ATOM 652 OP2 DG A 21 3.517 1.988 -11.770 1.00 0.27 O ATOM 653 O5' DG A 21 1.022 1.946 -11.964 1.00 0.23 O ATOM 654 C5' DG A 21 -0.128 1.797 -12.804 1.00 0.36 C ATOM 655 C4' DG A 21 -1.334 2.522 -12.220 1.00 0.35 C ATOM 656 O4' DG A 21 -1.625 1.992 -10.931 1.00 0.27 O ATOM 657 C3' DG A 21 -1.126 4.016 -12.033 1.00 0.40 C ATOM 658 O3' DG A 21 -1.461 4.748 -13.216 1.00 0.64 O ATOM 659 C2' DG A 21 -2.073 4.348 -10.891 1.00 0.35 C ATOM 660 C1' DG A 21 -2.170 3.033 -10.115 1.00 0.24 C ATOM 661 N9 DG A 21 -1.437 3.025 -8.836 1.00 0.18 N ATOM 662 C8 DG A 21 -0.089 3.083 -8.605 1.00 0.17 C ATOM 663 N7 DG A 21 0.236 2.999 -7.348 1.00 0.16 N ATOM 664 C5 DG A 21 -0.985 2.886 -6.699 1.00 0.14 C ATOM 665 C6 DG A 21 -1.275 2.767 -5.317 1.00 0.14 C ATOM 666 O6 DG A 21 -0.503 2.742 -4.371 1.00 0.16 O ATOM 667 N1 DG A 21 -2.629 2.683 -5.092 1.00 0.13 N ATOM 668 C2 DG A 21 -3.598 2.723 -6.071 1.00 0.16 C ATOM 669 N2 DG A 21 -4.855 2.712 -5.657 1.00 0.18 N ATOM 670 N3 DG A 21 -3.333 2.827 -7.366 1.00 0.18 N ATOM 671 C4 DG A 21 -2.011 2.905 -7.605 1.00 0.16 C ATOM 0 H5' DG A 21 -0.359 0.739 -12.924 1.00 0.36 H new ATOM 0 H5'' DG A 21 0.090 2.190 -13.797 1.00 0.36 H new ATOM 0 H4' DG A 21 -2.140 2.372 -12.938 1.00 0.35 H new ATOM 0 H3' DG A 21 -0.089 4.280 -11.826 1.00 0.40 H new ATOM 0 H2' DG A 21 -1.684 5.154 -10.268 1.00 0.35 H new ATOM 0 H2'' DG A 21 -3.047 4.670 -11.258 1.00 0.35 H new ATOM 0 HO3' DG A 21 -1.317 5.705 -13.060 1.00 0.64 H new ATOM 0 H1' DG A 21 -3.225 2.891 -9.880 1.00 0.24 H new ATOM 0 H8 DG A 21 0.639 3.189 -9.395 1.00 0.17 H new ATOM 0 H1 DG A 21 -2.940 2.583 -4.126 1.00 0.13 H new ATOM 0 H21 DG A 21 -5.616 2.740 -6.336 1.00 0.18 H new ATOM 0 H22 DG A 21 -5.063 2.675 -4.659 1.00 0.18 H new TER 684 DG A 21