USER MOD reduce.3.24.130724 H: found=0, std=0, add=261, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 261 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 Single : A 1 DA O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl -30:sc= -10.3! (180deg=-15.2!) USER MOD Single : A 6 DT C7 :methyl -30:sc= -1.94 (180deg=-6.57!) USER MOD Single : A 11 DT C7 :methyl -30:sc= 0 (180deg=-0.983) USER MOD Single : A 12 DT C7 :methyl -30:sc= -1.58 (180deg=-4.22!) USER MOD Single : A 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 18 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 23 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 0.834 8.886 8.323 1.00 0.13 O ATOM 2 C5' DA A 1 0.433 7.843 7.431 1.00 0.19 C ATOM 3 C4' DA A 1 -0.693 6.999 8.024 1.00 0.19 C ATOM 4 O4' DA A 1 -1.852 7.819 8.299 1.00 0.22 O ATOM 5 C3' DA A 1 -1.113 5.888 7.065 1.00 0.20 C ATOM 6 O3' DA A 1 -0.826 4.600 7.619 1.00 0.19 O ATOM 7 C2' DA A 1 -2.589 6.066 6.858 1.00 0.20 C ATOM 8 C1' DA A 1 -2.982 7.371 7.522 1.00 0.19 C ATOM 9 N9 DA A 1 -3.354 8.385 6.517 1.00 0.17 N ATOM 10 C8 DA A 1 -4.166 8.279 5.437 1.00 0.17 C ATOM 11 N7 DA A 1 -4.334 9.333 4.710 1.00 0.18 N ATOM 12 C5 DA A 1 -3.537 10.266 5.380 1.00 0.15 C ATOM 13 C6 DA A 1 -3.254 11.615 5.142 1.00 0.17 C ATOM 14 N6 DA A 1 -3.763 12.297 4.115 1.00 0.21 N ATOM 15 N1 DA A 1 -2.428 12.236 6.002 1.00 0.17 N ATOM 16 C2 DA A 1 -1.907 11.573 7.035 1.00 0.16 C ATOM 17 N3 DA A 1 -2.107 10.297 7.355 1.00 0.14 N ATOM 18 C4 DA A 1 -2.938 9.698 6.480 1.00 0.15 C ATOM 0 H5' DA A 1 1.288 7.205 7.208 1.00 0.19 H new ATOM 0 H5'' DA A 1 0.105 8.277 6.487 1.00 0.19 H new ATOM 0 H4' DA A 1 -0.314 6.561 8.947 1.00 0.19 H new ATOM 0 H3' DA A 1 -0.568 5.946 6.123 1.00 0.20 H new ATOM 0 H2' DA A 1 -2.828 6.088 5.795 1.00 0.20 H new ATOM 0 H2'' DA A 1 -3.141 5.232 7.292 1.00 0.20 H new ATOM 0 HO5' DA A 1 1.557 9.406 7.914 1.00 0.13 H new ATOM 0 H1' DA A 1 -3.852 7.220 8.161 1.00 0.19 H new ATOM 0 H8 DA A 1 -4.655 7.347 5.193 1.00 0.17 H new ATOM 0 H61 DA A 1 -3.524 13.280 3.987 1.00 0.21 H new ATOM 0 H62 DA A 1 -4.391 11.835 3.457 1.00 0.21 H new ATOM 0 H2 DA A 1 -1.250 12.134 7.684 1.00 0.16 H new ATOM 31 P DG A 2 0.673 4.016 7.594 1.00 0.18 P ATOM 32 OP1 DG A 2 1.521 4.878 8.447 1.00 0.19 O ATOM 33 OP2 DG A 2 1.052 3.772 6.185 1.00 0.24 O ATOM 34 O5' DG A 2 0.507 2.592 8.325 1.00 0.17 O ATOM 35 C5' DG A 2 -0.364 1.590 7.780 1.00 0.14 C ATOM 36 C4' DG A 2 -0.122 0.218 8.394 1.00 0.14 C ATOM 37 O4' DG A 2 -1.034 -0.756 7.836 1.00 0.16 O ATOM 38 C3' DG A 2 1.304 -0.257 8.130 1.00 0.14 C ATOM 39 O3' DG A 2 1.999 -0.482 9.364 1.00 0.16 O ATOM 40 C2' DG A 2 1.171 -1.536 7.352 1.00 0.19 C ATOM 41 C1' DG A 2 -0.307 -1.868 7.275 1.00 0.17 C ATOM 42 N9 DG A 2 -0.717 -2.109 5.878 1.00 0.18 N ATOM 43 C8 DG A 2 -0.926 -3.279 5.225 1.00 0.20 C ATOM 44 N7 DG A 2 -1.259 -3.219 3.980 1.00 0.20 N ATOM 45 C5 DG A 2 -1.283 -1.840 3.757 1.00 0.17 C ATOM 46 C6 DG A 2 -1.584 -1.113 2.572 1.00 0.18 C ATOM 47 O6 DG A 2 -1.890 -1.550 1.467 1.00 0.23 O ATOM 48 N1 DG A 2 -1.493 0.256 2.778 1.00 0.18 N ATOM 49 C2 DG A 2 -1.157 0.857 3.974 1.00 0.16 C ATOM 50 N2 DG A 2 -1.147 2.185 3.975 1.00 0.19 N ATOM 51 N3 DG A 2 -0.872 0.184 5.092 1.00 0.14 N ATOM 52 C4 DG A 2 -0.953 -1.153 4.916 1.00 0.15 C ATOM 0 H5' DG A 2 -0.219 1.533 6.701 1.00 0.14 H new ATOM 0 H5'' DG A 2 -1.401 1.883 7.947 1.00 0.14 H new ATOM 0 H4' DG A 2 -0.284 0.311 9.468 1.00 0.14 H new ATOM 0 H3' DG A 2 1.879 0.487 7.579 1.00 0.14 H new ATOM 0 H2' DG A 2 1.592 -1.423 6.353 1.00 0.19 H new ATOM 0 H2'' DG A 2 1.720 -2.341 7.840 1.00 0.19 H new ATOM 0 H1' DG A 2 -0.519 -2.779 7.834 1.00 0.17 H new ATOM 0 H8 DG A 2 -0.817 -4.228 5.729 1.00 0.20 H new ATOM 0 H1 DG A 2 -1.690 0.865 1.984 1.00 0.18 H new ATOM 0 H21 DG A 2 -0.907 2.693 4.827 1.00 0.19 H new ATOM 0 H22 DG A 2 -1.379 2.697 3.124 1.00 0.19 H new ATOM 64 P DG A 3 3.575 -0.176 9.487 1.00 0.13 P ATOM 65 OP1 DG A 3 3.961 -0.306 10.910 1.00 0.20 O ATOM 66 OP2 DG A 3 3.860 1.081 8.758 1.00 0.19 O ATOM 67 O5' DG A 3 4.240 -1.393 8.671 1.00 0.11 O ATOM 68 C5' DG A 3 4.195 -2.730 9.190 1.00 0.12 C ATOM 69 C4' DG A 3 4.584 -3.769 8.146 1.00 0.10 C ATOM 70 O4' DG A 3 3.780 -3.615 6.954 1.00 0.09 O ATOM 71 C3' DG A 3 6.051 -3.630 7.749 1.00 0.13 C ATOM 72 O3' DG A 3 6.806 -4.780 8.151 1.00 0.14 O ATOM 73 C2' DG A 3 6.055 -3.488 6.252 1.00 0.14 C ATOM 74 C1' DG A 3 4.623 -3.625 5.783 1.00 0.10 C ATOM 75 N9 DG A 3 4.276 -2.529 4.860 1.00 0.14 N ATOM 76 C8 DG A 3 4.303 -1.189 5.058 1.00 0.16 C ATOM 77 N7 DG A 3 3.994 -0.430 4.060 1.00 0.14 N ATOM 78 C5 DG A 3 3.721 -1.370 3.062 1.00 0.12 C ATOM 79 C6 DG A 3 3.323 -1.175 1.712 1.00 0.12 C ATOM 80 O6 DG A 3 3.130 -0.118 1.117 1.00 0.18 O ATOM 81 N1 DG A 3 3.154 -2.386 1.052 1.00 0.11 N ATOM 82 C2 DG A 3 3.346 -3.632 1.615 1.00 0.08 C ATOM 83 N2 DG A 3 3.127 -4.678 0.821 1.00 0.10 N ATOM 84 N3 DG A 3 3.722 -3.823 2.882 1.00 0.09 N ATOM 85 C4 DG A 3 3.891 -2.658 3.546 1.00 0.11 C ATOM 0 H5' DG A 3 3.190 -2.942 9.554 1.00 0.12 H new ATOM 0 H5'' DG A 3 4.867 -2.808 10.045 1.00 0.12 H new ATOM 0 H4' DG A 3 4.417 -4.750 8.591 1.00 0.10 H new ATOM 0 H3' DG A 3 6.514 -2.773 8.237 1.00 0.13 H new ATOM 0 H2' DG A 3 6.465 -2.521 5.959 1.00 0.14 H new ATOM 0 H2'' DG A 3 6.684 -4.252 5.795 1.00 0.14 H new ATOM 0 H1' DG A 3 4.483 -4.556 5.234 1.00 0.10 H new ATOM 0 H8 DG A 3 4.573 -0.771 6.016 1.00 0.16 H new ATOM 0 H1 DG A 3 2.865 -2.352 0.074 1.00 0.11 H new ATOM 0 H21 DG A 3 3.252 -5.625 1.179 1.00 0.10 H new ATOM 0 H22 DG A 3 2.834 -4.532 -0.145 1.00 0.10 H new ATOM 97 P DG A 4 6.506 -6.228 7.510 1.00 0.07 P ATOM 98 OP1 DG A 4 5.046 -6.464 7.563 1.00 0.16 O ATOM 99 OP2 DG A 4 7.434 -7.206 8.121 1.00 0.15 O ATOM 100 O5' DG A 4 6.928 -6.030 5.965 1.00 0.16 O ATOM 101 C5' DG A 4 6.443 -6.936 4.964 1.00 0.13 C ATOM 102 C4' DG A 4 6.822 -6.520 3.547 1.00 0.06 C ATOM 103 O4' DG A 4 6.382 -5.178 3.262 1.00 0.09 O ATOM 104 C3' DG A 4 8.336 -6.550 3.329 1.00 0.11 C ATOM 105 O3' DG A 4 8.792 -7.754 2.707 1.00 0.12 O ATOM 106 C2' DG A 4 8.615 -5.381 2.441 1.00 0.11 C ATOM 107 C1' DG A 4 7.405 -4.484 2.513 1.00 0.08 C ATOM 108 N9 DG A 4 7.765 -3.237 3.173 1.00 0.06 N ATOM 109 C8 DG A 4 8.405 -3.054 4.338 1.00 0.09 C ATOM 110 N7 DG A 4 8.611 -1.831 4.722 1.00 0.13 N ATOM 111 C5 DG A 4 8.030 -1.110 3.666 1.00 0.09 C ATOM 112 C6 DG A 4 7.911 0.296 3.453 1.00 0.10 C ATOM 113 O6 DG A 4 8.302 1.226 4.158 1.00 0.13 O ATOM 114 N1 DG A 4 7.259 0.566 2.262 1.00 0.07 N ATOM 115 C2 DG A 4 6.782 -0.376 1.381 1.00 0.10 C ATOM 116 N2 DG A 4 6.206 0.086 0.284 1.00 0.12 N ATOM 117 N3 DG A 4 6.887 -1.683 1.567 1.00 0.11 N ATOM 118 C4 DG A 4 7.515 -1.979 2.718 1.00 0.06 C ATOM 0 H5' DG A 4 5.358 -7.003 5.039 1.00 0.13 H new ATOM 0 H5'' DG A 4 6.838 -7.932 5.162 1.00 0.13 H new ATOM 0 H4' DG A 4 6.334 -7.236 2.887 1.00 0.06 H new ATOM 0 H3' DG A 4 8.858 -6.507 4.285 1.00 0.11 H new ATOM 0 H2' DG A 4 9.510 -4.851 2.768 1.00 0.11 H new ATOM 0 H2'' DG A 4 8.795 -5.707 1.417 1.00 0.11 H new ATOM 0 H1' DG A 4 7.036 -4.248 1.515 1.00 0.08 H new ATOM 0 H8 DG A 4 8.736 -3.892 4.933 1.00 0.09 H new ATOM 0 H1 DG A 4 7.121 1.547 2.017 1.00 0.07 H new ATOM 0 H21 DG A 4 5.832 -0.563 -0.408 1.00 0.12 H new ATOM 0 H22 DG A 4 6.135 1.092 0.130 1.00 0.12 H new ATOM 130 P DT A 5 10.335 -7.858 2.232 1.00 0.12 P ATOM 131 OP1 DT A 5 10.724 -9.286 2.221 1.00 0.11 O ATOM 132 OP2 DT A 5 11.126 -6.889 3.022 1.00 0.12 O ATOM 133 O5' DT A 5 10.282 -7.336 0.705 1.00 0.13 O ATOM 134 C5' DT A 5 11.315 -6.491 0.178 1.00 0.14 C ATOM 135 C4' DT A 5 11.336 -6.501 -1.355 1.00 0.08 C ATOM 136 O4' DT A 5 11.754 -7.792 -1.878 1.00 0.06 O ATOM 137 C3' DT A 5 9.956 -6.203 -1.923 1.00 0.09 C ATOM 138 O3' DT A 5 9.865 -4.864 -2.400 1.00 0.13 O ATOM 139 C2' DT A 5 9.778 -7.187 -3.042 1.00 0.09 C ATOM 140 C1' DT A 5 10.738 -8.316 -2.773 1.00 0.06 C ATOM 141 N1 DT A 5 10.018 -9.428 -2.128 1.00 0.10 N ATOM 142 C2 DT A 5 9.780 -10.585 -2.847 1.00 0.19 C ATOM 143 O2 DT A 5 10.190 -10.742 -3.995 1.00 0.36 O ATOM 144 N3 DT A 5 9.045 -11.559 -2.187 1.00 0.18 N ATOM 145 C4 DT A 5 8.542 -11.466 -0.895 1.00 0.12 C ATOM 146 O4 DT A 5 7.898 -12.390 -0.402 1.00 0.15 O ATOM 147 C5 DT A 5 8.854 -10.216 -0.240 1.00 0.10 C ATOM 148 C7 DT A 5 8.367 -9.933 1.177 1.00 0.24 C ATOM 149 C6 DT A 5 9.562 -9.274 -0.861 1.00 0.08 C ATOM 0 H5' DT A 5 12.282 -6.821 0.556 1.00 0.14 H new ATOM 0 H5'' DT A 5 11.166 -5.471 0.532 1.00 0.14 H new ATOM 0 H4' DT A 5 12.047 -5.731 -1.655 1.00 0.08 H new ATOM 0 H3' DT A 5 9.179 -6.298 -1.164 1.00 0.09 H new ATOM 0 H2' DT A 5 8.751 -7.551 -3.079 1.00 0.09 H new ATOM 0 H2'' DT A 5 9.986 -6.721 -4.005 1.00 0.09 H new ATOM 0 H1' DT A 5 11.186 -8.690 -3.694 1.00 0.06 H new ATOM 0 H3 DT A 5 8.857 -12.422 -2.697 1.00 0.18 H new ATOM 0 H71 DT A 5 7.427 -10.457 1.350 1.00 0.24 H new ATOM 0 H72 DT A 5 9.112 -10.279 1.894 1.00 0.24 H new ATOM 0 H73 DT A 5 8.214 -8.861 1.302 1.00 0.24 H new ATOM 0 H6 DT A 5 9.780 -8.355 -0.337 1.00 0.08 H new ATOM 162 P DT A 6 8.743 -4.496 -3.487 1.00 0.15 P ATOM 163 OP1 DT A 6 8.347 -3.086 -3.297 1.00 0.21 O ATOM 164 OP2 DT A 6 7.723 -5.567 -3.466 1.00 0.16 O ATOM 165 O5' DT A 6 9.556 -4.619 -4.868 1.00 0.18 O ATOM 166 C5' DT A 6 8.841 -4.682 -6.097 1.00 0.15 C ATOM 167 C4' DT A 6 8.676 -3.295 -6.713 1.00 0.11 C ATOM 168 O4' DT A 6 8.516 -2.295 -5.677 1.00 0.15 O ATOM 169 C3' DT A 6 9.879 -2.898 -7.562 1.00 0.07 C ATOM 170 O3' DT A 6 9.455 -2.506 -8.872 1.00 0.08 O ATOM 171 C2' DT A 6 10.519 -1.743 -6.845 1.00 0.11 C ATOM 172 C1' DT A 6 9.522 -1.263 -5.813 1.00 0.16 C ATOM 173 N1 DT A 6 10.187 -0.992 -4.517 1.00 0.19 N ATOM 174 C2 DT A 6 10.246 0.324 -4.090 1.00 0.18 C ATOM 175 O2 DT A 6 9.803 1.250 -4.766 1.00 0.20 O ATOM 176 N3 DT A 6 10.835 0.538 -2.857 1.00 0.20 N ATOM 177 C4 DT A 6 11.360 -0.433 -2.024 1.00 0.22 C ATOM 178 O4 DT A 6 11.861 -0.130 -0.944 1.00 0.26 O ATOM 179 C5 DT A 6 11.256 -1.777 -2.549 1.00 0.24 C ATOM 180 C7 DT A 6 11.758 -2.954 -1.712 1.00 0.29 C ATOM 181 C6 DT A 6 10.692 -2.010 -3.753 1.00 0.23 C ATOM 0 H5' DT A 6 7.860 -5.126 -5.927 1.00 0.15 H new ATOM 0 H5'' DT A 6 9.369 -5.332 -6.795 1.00 0.15 H new ATOM 0 H4' DT A 6 7.790 -3.342 -7.346 1.00 0.11 H new ATOM 0 H3' DT A 6 10.577 -3.726 -7.688 1.00 0.07 H new ATOM 0 H2' DT A 6 11.450 -2.051 -6.369 1.00 0.11 H new ATOM 0 H2'' DT A 6 10.767 -0.944 -7.544 1.00 0.11 H new ATOM 0 H1' DT A 6 9.065 -0.326 -6.130 1.00 0.16 H new ATOM 0 H3 DT A 6 10.887 1.503 -2.531 1.00 0.20 H new ATOM 0 H71 DT A 6 12.582 -2.625 -1.078 1.00 0.29 H new ATOM 0 H72 DT A 6 10.947 -3.328 -1.087 1.00 0.29 H new ATOM 0 H73 DT A 6 12.104 -3.749 -2.373 1.00 0.29 H new ATOM 0 H6 DT A 6 10.638 -3.023 -4.123 1.00 0.23 H new ATOM 194 P DA A 7 8.728 -3.560 -9.852 1.00 0.11 P ATOM 195 OP1 DA A 7 9.662 -4.682 -10.095 1.00 0.14 O ATOM 196 OP2 DA A 7 8.164 -2.811 -10.997 1.00 0.22 O ATOM 197 O5' DA A 7 7.504 -4.110 -8.957 1.00 0.18 O ATOM 198 C5' DA A 7 7.180 -5.503 -8.972 1.00 0.11 C ATOM 199 C4' DA A 7 6.042 -5.848 -8.010 1.00 0.15 C ATOM 200 O4' DA A 7 6.350 -5.444 -6.657 1.00 0.19 O ATOM 201 C3' DA A 7 4.742 -5.164 -8.398 1.00 0.19 C ATOM 202 O3' DA A 7 3.921 -6.019 -9.199 1.00 0.16 O ATOM 203 C2' DA A 7 4.078 -4.840 -7.085 1.00 0.29 C ATOM 204 C1' DA A 7 5.153 -4.949 -6.013 1.00 0.24 C ATOM 205 N9 DA A 7 5.409 -3.646 -5.352 1.00 0.21 N ATOM 206 C8 DA A 7 5.411 -2.383 -5.862 1.00 0.21 C ATOM 207 N7 DA A 7 5.684 -1.417 -5.056 1.00 0.19 N ATOM 208 C5 DA A 7 5.895 -2.099 -3.858 1.00 0.18 C ATOM 209 C6 DA A 7 6.235 -1.662 -2.581 1.00 0.14 C ATOM 210 N6 DA A 7 6.423 -0.386 -2.289 1.00 0.21 N ATOM 211 N1 DA A 7 6.374 -2.588 -1.618 1.00 0.14 N ATOM 212 C2 DA A 7 6.191 -3.877 -1.895 1.00 0.20 C ATOM 213 N3 DA A 7 5.863 -4.406 -3.076 1.00 0.23 N ATOM 214 C4 DA A 7 5.731 -3.452 -4.023 1.00 0.20 C ATOM 0 H5' DA A 7 8.065 -6.082 -8.706 1.00 0.11 H new ATOM 0 H5'' DA A 7 6.899 -5.797 -9.983 1.00 0.11 H new ATOM 0 H4' DA A 7 5.927 -6.930 -8.069 1.00 0.15 H new ATOM 0 H3' DA A 7 4.912 -4.274 -9.004 1.00 0.19 H new ATOM 0 H2' DA A 7 3.651 -3.837 -7.104 1.00 0.29 H new ATOM 0 H2'' DA A 7 3.260 -5.531 -6.884 1.00 0.29 H new ATOM 0 H1' DA A 7 4.825 -5.628 -5.226 1.00 0.24 H new ATOM 0 H8 DA A 7 5.192 -2.199 -6.903 1.00 0.21 H new ATOM 0 H61 DA A 7 6.671 -0.112 -1.339 1.00 0.21 H new ATOM 0 H62 DA A 7 6.320 0.324 -3.014 1.00 0.21 H new ATOM 0 H2 DA A 7 6.322 -4.569 -1.076 1.00 0.20 H new ATOM 226 P DG A 8 2.342 -5.738 -9.338 1.00 0.23 P ATOM 227 OP1 DG A 8 1.859 -6.397 -10.573 1.00 0.28 O ATOM 228 OP2 DG A 8 2.107 -4.292 -9.130 1.00 0.23 O ATOM 229 O5' DG A 8 1.745 -6.535 -8.075 1.00 0.29 O ATOM 230 C5' DG A 8 1.879 -7.959 -8.001 1.00 0.25 C ATOM 231 C4' DG A 8 1.381 -8.531 -6.683 1.00 0.17 C ATOM 232 O4' DG A 8 2.158 -8.052 -5.565 1.00 0.27 O ATOM 233 C3' DG A 8 -0.073 -8.149 -6.420 1.00 0.07 C ATOM 234 O3' DG A 8 -0.943 -9.261 -6.665 1.00 0.11 O ATOM 235 C2' DG A 8 -0.112 -7.733 -4.971 1.00 0.15 C ATOM 236 C1' DG A 8 1.289 -7.931 -4.426 1.00 0.20 C ATOM 237 N9 DG A 8 1.692 -6.819 -3.539 1.00 0.15 N ATOM 238 C8 DG A 8 2.107 -6.870 -2.250 1.00 0.13 C ATOM 239 N7 DG A 8 2.389 -5.757 -1.667 1.00 0.14 N ATOM 240 C5 DG A 8 2.138 -4.829 -2.679 1.00 0.11 C ATOM 241 C6 DG A 8 2.261 -3.415 -2.662 1.00 0.15 C ATOM 242 O6 DG A 8 2.616 -2.692 -1.734 1.00 0.27 O ATOM 243 N1 DG A 8 1.913 -2.856 -3.883 1.00 0.14 N ATOM 244 C2 DG A 8 1.495 -3.570 -4.992 1.00 0.15 C ATOM 245 N2 DG A 8 1.205 -2.855 -6.079 1.00 0.22 N ATOM 246 N3 DG A 8 1.375 -4.905 -5.018 1.00 0.16 N ATOM 247 C4 DG A 8 1.710 -5.470 -3.834 1.00 0.11 C ATOM 0 H5' DG A 8 2.927 -8.228 -8.136 1.00 0.25 H new ATOM 0 H5'' DG A 8 1.325 -8.414 -8.822 1.00 0.25 H new ATOM 0 H4' DG A 8 1.479 -9.613 -6.774 1.00 0.17 H new ATOM 0 H3' DG A 8 -0.414 -7.349 -7.078 1.00 0.07 H new ATOM 0 H2' DG A 8 -0.422 -6.692 -4.875 1.00 0.15 H new ATOM 0 H2'' DG A 8 -0.833 -8.333 -4.415 1.00 0.15 H new ATOM 0 H1' DG A 8 1.342 -8.827 -3.807 1.00 0.20 H new ATOM 0 H8 DG A 8 2.198 -7.812 -1.729 1.00 0.13 H new ATOM 0 H1 DG A 8 1.970 -1.841 -3.970 1.00 0.14 H new ATOM 0 H21 DG A 8 0.891 -3.324 -6.929 1.00 0.22 H new ATOM 0 H22 DG A 8 1.297 -1.839 -6.061 1.00 0.22 H new ATOM 259 P DG A 9 -2.542 -9.073 -6.662 1.00 0.09 P ATOM 260 OP1 DG A 9 -3.135 -10.138 -7.501 1.00 0.10 O ATOM 261 OP2 DG A 9 -2.843 -7.653 -6.950 1.00 0.10 O ATOM 262 O5' DG A 9 -2.926 -9.368 -5.127 1.00 0.11 O ATOM 263 C5' DG A 9 -2.528 -10.596 -4.503 1.00 0.09 C ATOM 264 C4' DG A 9 -2.820 -10.605 -3.010 1.00 0.12 C ATOM 265 O4' DG A 9 -2.210 -9.459 -2.371 1.00 0.18 O ATOM 266 C3' DG A 9 -4.324 -10.550 -2.740 1.00 0.12 C ATOM 267 O3' DG A 9 -4.746 -11.645 -1.912 1.00 0.12 O ATOM 268 C2' DG A 9 -4.559 -9.242 -2.046 1.00 0.16 C ATOM 269 C1' DG A 9 -3.203 -8.707 -1.644 1.00 0.18 C ATOM 270 N9 DG A 9 -3.100 -7.264 -1.931 1.00 0.19 N ATOM 271 C8 DG A 9 -3.309 -6.585 -3.088 1.00 0.20 C ATOM 272 N7 DG A 9 -3.169 -5.300 -3.061 1.00 0.18 N ATOM 273 C5 DG A 9 -2.823 -5.081 -1.723 1.00 0.14 C ATOM 274 C6 DG A 9 -2.535 -3.869 -1.043 1.00 0.15 C ATOM 275 O6 DG A 9 -2.527 -2.725 -1.492 1.00 0.21 O ATOM 276 N1 DG A 9 -2.235 -4.095 0.295 1.00 0.14 N ATOM 277 C2 DG A 9 -2.215 -5.330 0.908 1.00 0.14 C ATOM 278 N2 DG A 9 -1.904 -5.343 2.203 1.00 0.17 N ATOM 279 N3 DG A 9 -2.484 -6.474 0.276 1.00 0.17 N ATOM 280 C4 DG A 9 -2.780 -6.279 -1.028 1.00 0.16 C ATOM 0 H5' DG A 9 -1.461 -10.754 -4.663 1.00 0.09 H new ATOM 0 H5'' DG A 9 -3.048 -11.428 -4.978 1.00 0.09 H new ATOM 0 H4' DG A 9 -2.409 -11.531 -2.607 1.00 0.12 H new ATOM 0 H3' DG A 9 -4.895 -10.629 -3.665 1.00 0.12 H new ATOM 0 H2' DG A 9 -5.070 -8.541 -2.706 1.00 0.16 H new ATOM 0 H2'' DG A 9 -5.195 -9.378 -1.171 1.00 0.16 H new ATOM 0 H1' DG A 9 -3.049 -8.822 -0.571 1.00 0.18 H new ATOM 0 H8 DG A 9 -3.582 -7.099 -3.997 1.00 0.20 H new ATOM 0 H1 DG A 9 -2.012 -3.282 0.870 1.00 0.14 H new ATOM 0 H21 DG A 9 -1.873 -6.227 2.711 1.00 0.17 H new ATOM 0 H22 DG A 9 -1.697 -4.469 2.687 1.00 0.17 H new ATOM 292 P DG A 10 -3.997 -11.985 -0.522 1.00 0.11 P ATOM 293 OP1 DG A 10 -2.542 -12.045 -0.781 1.00 0.15 O ATOM 294 OP2 DG A 10 -4.681 -13.142 0.098 1.00 0.13 O ATOM 295 O5' DG A 10 -4.294 -10.685 0.383 1.00 0.07 O ATOM 296 C5' DG A 10 -5.481 -10.601 1.187 1.00 0.11 C ATOM 297 C4' DG A 10 -5.297 -9.697 2.401 1.00 0.12 C ATOM 298 O4' DG A 10 -4.686 -8.442 2.016 1.00 0.12 O ATOM 299 C3' DG A 10 -6.641 -9.384 3.063 1.00 0.18 C ATOM 300 O3' DG A 10 -6.634 -9.737 4.454 1.00 0.20 O ATOM 301 C2' DG A 10 -6.823 -7.905 2.896 1.00 0.22 C ATOM 302 C1' DG A 10 -5.478 -7.340 2.502 1.00 0.16 C ATOM 303 N9 DG A 10 -5.630 -6.295 1.475 1.00 0.10 N ATOM 304 C8 DG A 10 -5.887 -6.418 0.150 1.00 0.06 C ATOM 305 N7 DG A 10 -5.992 -5.335 -0.544 1.00 0.06 N ATOM 306 C5 DG A 10 -5.779 -4.354 0.429 1.00 0.09 C ATOM 307 C6 DG A 10 -5.767 -2.943 0.304 1.00 0.13 C ATOM 308 O6 DG A 10 -5.940 -2.268 -0.705 1.00 0.12 O ATOM 309 N1 DG A 10 -5.518 -2.323 1.519 1.00 0.16 N ATOM 310 C2 DG A 10 -5.304 -2.967 2.714 1.00 0.17 C ATOM 311 N2 DG A 10 -5.076 -2.175 3.765 1.00 0.18 N ATOM 312 N3 DG A 10 -5.313 -4.301 2.848 1.00 0.16 N ATOM 313 C4 DG A 10 -5.555 -4.931 1.670 1.00 0.12 C ATOM 0 H5' DG A 10 -5.762 -11.600 1.520 1.00 0.11 H new ATOM 0 H5'' DG A 10 -6.303 -10.225 0.578 1.00 0.11 H new ATOM 0 H4' DG A 10 -4.655 -10.230 3.102 1.00 0.12 H new ATOM 0 H3' DG A 10 -7.452 -9.955 2.610 1.00 0.18 H new ATOM 0 H2' DG A 10 -7.571 -7.692 2.132 1.00 0.22 H new ATOM 0 H2'' DG A 10 -7.176 -7.452 3.823 1.00 0.22 H new ATOM 0 H1' DG A 10 -4.989 -6.868 3.354 1.00 0.16 H new ATOM 0 H8 DG A 10 -6.000 -7.389 -0.309 1.00 0.06 H new ATOM 0 H1 DG A 10 -5.491 -1.303 1.526 1.00 0.16 H new ATOM 0 H21 DG A 10 -4.909 -2.583 4.685 1.00 0.18 H new ATOM 0 H22 DG A 10 -5.069 -1.162 3.648 1.00 0.18 H new ATOM 325 P DT A 11 -5.683 -8.966 5.506 1.00 0.19 P ATOM 326 OP1 DT A 11 -4.352 -8.791 4.882 1.00 0.18 O ATOM 327 OP2 DT A 11 -5.798 -9.646 6.815 1.00 0.21 O ATOM 328 O5' DT A 11 -6.372 -7.511 5.634 1.00 0.21 O ATOM 329 C5' DT A 11 -7.601 -7.333 6.353 1.00 0.16 C ATOM 330 C4' DT A 11 -7.833 -5.864 6.720 1.00 0.14 C ATOM 331 O4' DT A 11 -6.962 -5.460 7.800 1.00 0.12 O ATOM 332 C3' DT A 11 -7.566 -4.950 5.528 1.00 0.17 C ATOM 333 O3' DT A 11 -8.770 -4.309 5.089 1.00 0.18 O ATOM 334 C2' DT A 11 -6.554 -3.944 5.997 1.00 0.18 C ATOM 335 C1' DT A 11 -6.223 -4.273 7.440 1.00 0.13 C ATOM 336 N1 DT A 11 -4.772 -4.497 7.613 1.00 0.09 N ATOM 337 C2 DT A 11 -4.100 -3.701 8.523 1.00 0.20 C ATOM 338 O2 DT A 11 -4.666 -2.821 9.166 1.00 0.36 O ATOM 339 N3 DT A 11 -2.748 -3.954 8.668 1.00 0.21 N ATOM 340 C4 DT A 11 -2.022 -4.918 7.990 1.00 0.10 C ATOM 341 O4 DT A 11 -0.818 -5.058 8.198 1.00 0.18 O ATOM 342 C5 DT A 11 -2.806 -5.700 7.061 1.00 0.11 C ATOM 343 C7 DT A 11 -2.132 -6.800 6.245 1.00 0.27 C ATOM 344 C6 DT A 11 -4.126 -5.473 6.902 1.00 0.13 C ATOM 0 H5' DT A 11 -7.583 -7.937 7.260 1.00 0.16 H new ATOM 0 H5'' DT A 11 -8.433 -7.693 5.747 1.00 0.16 H new ATOM 0 H4' DT A 11 -8.875 -5.774 7.027 1.00 0.14 H new ATOM 0 H3' DT A 11 -7.195 -5.513 4.672 1.00 0.17 H new ATOM 0 H2' DT A 11 -5.657 -3.985 5.379 1.00 0.18 H new ATOM 0 H2'' DT A 11 -6.952 -2.933 5.915 1.00 0.18 H new ATOM 0 H1' DT A 11 -6.500 -3.439 8.085 1.00 0.13 H new ATOM 0 H3 DT A 11 -2.238 -3.376 9.337 1.00 0.21 H new ATOM 0 H71 DT A 11 -1.090 -6.534 6.066 1.00 0.27 H new ATOM 0 H72 DT A 11 -2.177 -7.740 6.795 1.00 0.27 H new ATOM 0 H73 DT A 11 -2.647 -6.913 5.291 1.00 0.27 H new ATOM 0 H6 DT A 11 -4.685 -6.073 6.199 1.00 0.13 H new ATOM 357 P DT A 12 -9.608 -3.348 6.071 1.00 0.17 P ATOM 358 OP1 DT A 12 -8.683 -2.783 7.079 1.00 0.14 O ATOM 359 OP2 DT A 12 -10.821 -4.077 6.508 1.00 0.24 O ATOM 360 O5' DT A 12 -10.062 -2.162 5.082 1.00 0.20 O ATOM 361 C5' DT A 12 -9.357 -0.918 5.063 1.00 0.17 C ATOM 362 C4' DT A 12 -9.704 -0.098 3.821 1.00 0.14 C ATOM 363 O4' DT A 12 -9.129 -0.691 2.637 1.00 0.14 O ATOM 364 C3' DT A 12 -11.216 -0.021 3.626 1.00 0.16 C ATOM 365 O3' DT A 12 -11.703 1.297 3.900 1.00 0.20 O ATOM 366 C2' DT A 12 -11.458 -0.396 2.190 1.00 0.15 C ATOM 367 C1' DT A 12 -10.131 -0.851 1.611 1.00 0.13 C ATOM 368 N1 DT A 12 -10.205 -2.260 1.179 1.00 0.09 N ATOM 369 C2 DT A 12 -10.495 -2.515 -0.149 1.00 0.10 C ATOM 370 O2 DT A 12 -10.683 -1.612 -0.963 1.00 0.18 O ATOM 371 N3 DT A 12 -10.560 -3.849 -0.511 1.00 0.14 N ATOM 372 C4 DT A 12 -10.364 -4.931 0.330 1.00 0.10 C ATOM 373 O4 DT A 12 -10.446 -6.080 -0.099 1.00 0.14 O ATOM 374 C5 DT A 12 -10.067 -4.567 1.697 1.00 0.12 C ATOM 375 C7 DT A 12 -9.828 -5.661 2.734 1.00 0.19 C ATOM 376 C6 DT A 12 -9.997 -3.275 2.072 1.00 0.15 C ATOM 0 H5' DT A 12 -8.284 -1.106 5.088 1.00 0.17 H new ATOM 0 H5'' DT A 12 -9.601 -0.346 5.958 1.00 0.17 H new ATOM 0 H4' DT A 12 -9.297 0.902 3.972 1.00 0.14 H new ATOM 0 H3' DT A 12 -11.742 -0.688 4.309 1.00 0.16 H new ATOM 0 H2' DT A 12 -12.200 -1.191 2.121 1.00 0.15 H new ATOM 0 H2'' DT A 12 -11.849 0.455 1.632 1.00 0.15 H new ATOM 0 H1' DT A 12 -9.879 -0.254 0.734 1.00 0.13 H new ATOM 0 H3 DT A 12 -10.772 -4.054 -1.487 1.00 0.14 H new ATOM 0 H71 DT A 12 -10.404 -6.547 2.467 1.00 0.19 H new ATOM 0 H72 DT A 12 -8.768 -5.912 2.761 1.00 0.19 H new ATOM 0 H73 DT A 12 -10.142 -5.306 3.716 1.00 0.19 H new ATOM 0 H6 DT A 12 -9.772 -3.035 3.101 1.00 0.15 H new ATOM 389 P DA A 13 -12.973 1.512 4.866 1.00 0.26 P ATOM 390 OP1 DA A 13 -12.829 0.611 6.031 1.00 0.35 O ATOM 391 OP2 DA A 13 -14.199 1.458 4.038 1.00 0.51 O ATOM 392 O5' DA A 13 -12.773 3.027 5.372 1.00 0.16 O ATOM 393 C5' DA A 13 -11.502 3.464 5.861 1.00 0.15 C ATOM 394 C4' DA A 13 -10.720 4.217 4.788 1.00 0.16 C ATOM 395 O4' DA A 13 -10.515 3.385 3.623 1.00 0.21 O ATOM 396 C3' DA A 13 -11.463 5.473 4.345 1.00 0.16 C ATOM 397 O3' DA A 13 -10.800 6.655 4.816 1.00 0.15 O ATOM 398 C2' DA A 13 -11.487 5.423 2.841 1.00 0.23 C ATOM 399 C1' DA A 13 -10.826 4.123 2.422 1.00 0.23 C ATOM 400 N9 DA A 13 -11.716 3.344 1.541 1.00 0.24 N ATOM 401 C8 DA A 13 -12.967 2.874 1.770 1.00 0.20 C ATOM 402 N7 DA A 13 -13.541 2.216 0.818 1.00 0.21 N ATOM 403 C5 DA A 13 -12.558 2.244 -0.176 1.00 0.25 C ATOM 404 C6 DA A 13 -12.507 1.723 -1.474 1.00 0.29 C ATOM 405 N6 DA A 13 -13.509 1.039 -2.024 1.00 0.28 N ATOM 406 N1 DA A 13 -11.382 1.935 -2.182 1.00 0.33 N ATOM 407 C2 DA A 13 -10.367 2.617 -1.648 1.00 0.37 C ATOM 408 N3 DA A 13 -10.308 3.152 -0.433 1.00 0.34 N ATOM 409 C4 DA A 13 -11.444 2.928 0.257 1.00 0.28 C ATOM 0 H5' DA A 13 -10.924 2.603 6.197 1.00 0.15 H new ATOM 0 H5'' DA A 13 -11.646 4.109 6.728 1.00 0.15 H new ATOM 0 H4' DA A 13 -9.761 4.491 5.228 1.00 0.16 H new ATOM 0 H3' DA A 13 -12.472 5.509 4.756 1.00 0.16 H new ATOM 0 H2' DA A 13 -12.511 5.470 2.471 1.00 0.23 H new ATOM 0 H2'' DA A 13 -10.957 6.277 2.420 1.00 0.23 H new ATOM 0 H1' DA A 13 -9.916 4.325 1.857 1.00 0.23 H new ATOM 0 H8 DA A 13 -13.465 3.043 2.713 1.00 0.20 H new ATOM 0 H61 DA A 13 -13.420 0.681 -2.975 1.00 0.28 H new ATOM 0 H62 DA A 13 -14.365 0.874 -1.494 1.00 0.28 H new ATOM 0 H2 DA A 13 -9.496 2.749 -2.273 1.00 0.37 H new ATOM 421 P DI A 14 -9.295 6.999 4.361 1.00 0.17 P ATOM 422 OP1 DI A 14 -8.462 7.129 5.578 1.00 0.27 O ATOM 423 OP2 DI A 14 -9.348 8.107 3.381 1.00 0.25 O ATOM 424 O5' DI A 14 -8.846 5.663 3.584 1.00 0.20 O ATOM 425 C5' DI A 14 -7.731 5.688 2.685 1.00 0.18 C ATOM 426 C4' DI A 14 -6.431 6.053 3.386 1.00 0.08 C ATOM 427 O4' DI A 14 -6.076 5.051 4.370 1.00 0.12 O ATOM 428 C3' DI A 14 -5.282 6.146 2.387 1.00 0.07 C ATOM 429 O3' DI A 14 -4.930 7.508 2.114 1.00 0.12 O ATOM 430 C2' DI A 14 -4.161 5.387 3.026 1.00 0.09 C ATOM 431 C1' DI A 14 -4.825 4.435 3.994 1.00 0.11 C ATOM 432 N9 DI A 14 -5.071 3.131 3.345 1.00 0.13 N ATOM 433 C8 DI A 14 -5.079 1.881 3.870 1.00 0.16 C ATOM 434 N7 DI A 14 -5.359 0.897 3.076 1.00 0.17 N ATOM 435 C5 DI A 14 -5.567 1.569 1.864 1.00 0.14 C ATOM 436 C6 DI A 14 -5.910 1.066 0.586 1.00 0.16 C ATOM 437 O6 DI A 14 -6.113 -0.093 0.250 1.00 0.18 O ATOM 438 N1 DI A 14 -6.019 2.081 -0.348 1.00 0.16 N ATOM 439 C2 DI A 14 -5.823 3.426 -0.101 1.00 0.14 C ATOM 440 N3 DI A 14 -5.504 3.902 1.089 1.00 0.11 N ATOM 441 C4 DI A 14 -5.391 2.931 2.023 1.00 0.12 C ATOM 0 H5'' DI A 14 -7.625 4.711 2.214 1.00 0.18 H new ATOM 0 H2'' DI A 14 -3.577 4.847 2.281 1.00 0.09 H new ATOM 0 H8 DI A 14 -4.858 1.710 4.924 1.00 0.16 H new ATOM 0 H5' DI A 14 -7.926 6.406 1.888 1.00 0.18 H new ATOM 0 H4' DI A 14 -6.590 7.017 3.869 1.00 0.08 H new ATOM 0 H3' DI A 14 -5.545 5.729 1.415 1.00 0.07 H new ATOM 0 H2' DI A 14 -3.475 6.059 3.543 1.00 0.09 H new ATOM 0 H2 DI A 14 -5.937 4.128 -0.927 1.00 0.14 H new ATOM 0 H1' DI A 14 -4.195 4.251 4.864 1.00 0.11 H new ATOM 0 H1 DI A 14 -6.265 1.813 -1.301 1.00 0.16 H new ATOM 452 P DG A 15 -5.888 8.409 1.180 1.00 0.13 P ATOM 453 OP1 DG A 15 -7.055 8.829 1.987 1.00 0.16 O ATOM 454 OP2 DG A 15 -6.097 7.688 -0.096 1.00 0.22 O ATOM 455 O5' DG A 15 -4.991 9.712 0.878 1.00 0.12 O ATOM 456 C5' DG A 15 -3.890 9.654 -0.041 1.00 0.11 C ATOM 457 C4' DG A 15 -2.553 9.573 0.677 1.00 0.12 C ATOM 458 O4' DG A 15 -2.470 8.355 1.453 1.00 0.12 O ATOM 459 C3' DG A 15 -1.377 9.579 -0.309 1.00 0.11 C ATOM 460 O3' DG A 15 -0.490 10.694 -0.078 1.00 0.08 O ATOM 461 C2' DG A 15 -0.667 8.274 -0.079 1.00 0.12 C ATOM 462 C1' DG A 15 -1.189 7.741 1.236 1.00 0.11 C ATOM 463 N9 DG A 15 -1.282 6.268 1.248 1.00 0.09 N ATOM 464 C8 DG A 15 -1.036 5.418 2.271 1.00 0.10 C ATOM 465 N7 DG A 15 -1.180 4.159 2.051 1.00 0.11 N ATOM 466 C5 DG A 15 -1.571 4.141 0.713 1.00 0.12 C ATOM 467 C6 DG A 15 -1.883 3.037 -0.122 1.00 0.18 C ATOM 468 O6 DG A 15 -1.879 1.840 0.166 1.00 0.24 O ATOM 469 N1 DG A 15 -2.226 3.449 -1.403 1.00 0.22 N ATOM 470 C2 DG A 15 -2.267 4.764 -1.831 1.00 0.23 C ATOM 471 N2 DG A 15 -2.611 4.957 -3.104 1.00 0.31 N ATOM 472 N3 DG A 15 -1.976 5.811 -1.047 1.00 0.18 N ATOM 473 C4 DG A 15 -1.637 5.431 0.207 1.00 0.12 C ATOM 0 H5' DG A 15 -3.905 10.536 -0.681 1.00 0.11 H new ATOM 0 H5'' DG A 15 -4.006 8.787 -0.691 1.00 0.11 H new ATOM 0 H4' DG A 15 -2.490 10.449 1.323 1.00 0.12 H new ATOM 0 H3' DG A 15 -1.722 9.686 -1.337 1.00 0.11 H new ATOM 0 H2' DG A 15 -0.866 7.574 -0.890 1.00 0.12 H new ATOM 0 H2'' DG A 15 0.413 8.419 -0.040 1.00 0.12 H new ATOM 0 H1' DG A 15 -0.498 7.988 2.042 1.00 0.11 H new ATOM 0 H8 DG A 15 -0.729 5.784 3.240 1.00 0.10 H new ATOM 0 H1 DG A 15 -2.466 2.726 -2.081 1.00 0.22 H new ATOM 0 H21 DG A 15 -2.660 5.903 -3.481 1.00 0.31 H new ATOM 0 H22 DG A 15 -2.825 4.158 -3.701 1.00 0.31 H new ATOM 485 P DG A 16 -0.044 11.158 1.409 1.00 0.12 P ATOM 486 OP1 DG A 16 -0.899 10.464 2.397 1.00 0.10 O ATOM 487 OP2 DG A 16 0.037 12.635 1.423 1.00 0.20 O ATOM 488 O5' DG A 16 1.454 10.575 1.555 1.00 0.15 O ATOM 489 C5' DG A 16 1.692 9.385 2.320 1.00 0.16 C ATOM 490 C4' DG A 16 3.035 9.381 3.029 1.00 0.10 C ATOM 491 O4' DG A 16 3.279 8.076 3.594 1.00 0.20 O ATOM 492 C3' DG A 16 4.180 9.704 2.070 1.00 0.11 C ATOM 493 O3' DG A 16 4.924 10.839 2.528 1.00 0.16 O ATOM 494 C2' DG A 16 5.043 8.472 2.045 1.00 0.19 C ATOM 495 C1' DG A 16 4.334 7.416 2.870 1.00 0.19 C ATOM 496 N9 DG A 16 3.800 6.342 2.003 1.00 0.13 N ATOM 497 C8 DG A 16 3.274 6.410 0.752 1.00 0.11 C ATOM 498 N7 DG A 16 2.944 5.301 0.179 1.00 0.09 N ATOM 499 C5 DG A 16 3.278 4.364 1.162 1.00 0.09 C ATOM 500 C6 DG A 16 3.154 2.948 1.149 1.00 0.09 C ATOM 501 O6 DG A 16 2.735 2.228 0.244 1.00 0.10 O ATOM 502 N1 DG A 16 3.600 2.388 2.340 1.00 0.12 N ATOM 503 C2 DG A 16 4.105 3.095 3.413 1.00 0.13 C ATOM 504 N2 DG A 16 4.465 2.376 4.476 1.00 0.13 N ATOM 505 N3 DG A 16 4.228 4.424 3.431 1.00 0.14 N ATOM 506 C4 DG A 16 3.799 4.994 2.283 1.00 0.13 C ATOM 0 H5' DG A 16 1.636 8.520 1.659 1.00 0.16 H new ATOM 0 H5'' DG A 16 0.899 9.273 3.059 1.00 0.16 H new ATOM 0 H4' DG A 16 2.997 10.144 3.806 1.00 0.10 H new ATOM 0 H3' DG A 16 3.813 9.958 1.076 1.00 0.11 H new ATOM 0 H2' DG A 16 5.192 8.126 1.022 1.00 0.19 H new ATOM 0 H2'' DG A 16 6.030 8.684 2.456 1.00 0.19 H new ATOM 0 H1' DG A 16 5.027 6.941 3.564 1.00 0.19 H new ATOM 0 H8 DG A 16 3.137 7.359 0.254 1.00 0.11 H new ATOM 0 H1 DG A 16 3.550 1.373 2.429 1.00 0.12 H new ATOM 0 H21 DG A 16 4.845 2.840 5.301 1.00 0.13 H new ATOM 0 H22 DG A 16 4.360 1.361 4.465 1.00 0.13 H new ATOM 518 P DT A 17 5.604 10.848 3.991 1.00 0.18 P ATOM 519 OP1 DT A 17 4.654 10.242 4.951 1.00 0.21 O ATOM 520 OP2 DT A 17 6.141 12.204 4.242 1.00 0.26 O ATOM 521 O5' DT A 17 6.848 9.840 3.809 1.00 0.20 O ATOM 522 C5' DT A 17 8.189 10.340 3.800 1.00 0.15 C ATOM 523 C4' DT A 17 9.212 9.217 3.967 1.00 0.09 C ATOM 524 O4' DT A 17 8.963 8.476 5.183 1.00 0.10 O ATOM 525 C3' DT A 17 9.159 8.239 2.796 1.00 0.08 C ATOM 526 O3' DT A 17 10.386 8.260 2.058 1.00 0.17 O ATOM 527 C2' DT A 17 8.932 6.884 3.407 1.00 0.10 C ATOM 528 C1' DT A 17 8.970 7.058 4.911 1.00 0.09 C ATOM 529 N1 DT A 17 7.814 6.392 5.542 1.00 0.13 N ATOM 530 C2 DT A 17 7.861 5.016 5.663 1.00 0.22 C ATOM 531 O2 DT A 17 8.825 4.359 5.275 1.00 0.26 O ATOM 532 N3 DT A 17 6.759 4.419 6.246 1.00 0.25 N ATOM 533 C4 DT A 17 5.631 5.070 6.712 1.00 0.20 C ATOM 534 O4 DT A 17 4.706 4.439 7.216 1.00 0.21 O ATOM 535 C5 DT A 17 5.671 6.507 6.544 1.00 0.13 C ATOM 536 C7 DT A 17 4.486 7.349 7.007 1.00 0.11 C ATOM 537 C6 DT A 17 6.735 7.112 5.979 1.00 0.10 C ATOM 0 H5' DT A 17 8.312 11.067 4.603 1.00 0.15 H new ATOM 0 H5'' DT A 17 8.375 10.866 2.863 1.00 0.15 H new ATOM 0 H4' DT A 17 10.195 9.686 4.006 1.00 0.09 H new ATOM 0 H3' DT A 17 8.368 8.502 2.093 1.00 0.08 H new ATOM 0 H2' DT A 17 7.972 6.476 3.091 1.00 0.10 H new ATOM 0 H2'' DT A 17 9.700 6.182 3.082 1.00 0.10 H new ATOM 0 H1' DT A 17 9.867 6.599 5.327 1.00 0.09 H new ATOM 0 H3 DT A 17 6.780 3.404 6.341 1.00 0.25 H new ATOM 0 H71 DT A 17 4.837 8.335 7.310 1.00 0.11 H new ATOM 0 H72 DT A 17 3.772 7.453 6.190 1.00 0.11 H new ATOM 0 H73 DT A 17 4.001 6.861 7.852 1.00 0.11 H new ATOM 0 H6 DT A 17 6.736 8.186 5.869 1.00 0.10 H new ATOM 550 P DT A 18 10.625 9.344 0.893 1.00 0.25 P ATOM 551 OP1 DT A 18 10.964 10.639 1.525 1.00 0.48 O ATOM 552 OP2 DT A 18 9.493 9.260 -0.057 1.00 0.42 O ATOM 553 O5' DT A 18 11.944 8.781 0.157 1.00 0.10 O ATOM 554 C5' DT A 18 12.244 9.150 -1.192 1.00 0.12 C ATOM 555 C4' DT A 18 12.006 7.990 -2.159 1.00 0.10 C ATOM 556 O4' DT A 18 12.835 6.858 -1.809 1.00 0.19 O ATOM 557 C3' DT A 18 10.547 7.537 -2.132 1.00 0.11 C ATOM 558 O3' DT A 18 9.946 7.682 -3.425 1.00 0.10 O ATOM 559 C2' DT A 18 10.581 6.089 -1.721 1.00 0.23 C ATOM 560 C1' DT A 18 12.034 5.662 -1.714 1.00 0.22 C ATOM 561 N1 DT A 18 12.361 4.910 -0.485 1.00 0.19 N ATOM 562 C2 DT A 18 12.207 3.536 -0.515 1.00 0.12 C ATOM 563 O2 DT A 18 11.798 2.945 -1.512 1.00 0.13 O ATOM 564 N3 DT A 18 12.539 2.863 0.646 1.00 0.11 N ATOM 565 C4 DT A 18 13.005 3.437 1.816 1.00 0.13 C ATOM 566 O4 DT A 18 13.274 2.740 2.792 1.00 0.16 O ATOM 567 C5 DT A 18 13.131 4.876 1.754 1.00 0.22 C ATOM 568 C7 DT A 18 13.635 5.640 2.976 1.00 0.27 C ATOM 569 C6 DT A 18 12.814 5.555 0.633 1.00 0.26 C ATOM 0 H5' DT A 18 13.283 9.473 -1.259 1.00 0.12 H new ATOM 0 H5'' DT A 18 11.627 10.000 -1.483 1.00 0.12 H new ATOM 0 H4' DT A 18 12.259 8.348 -3.157 1.00 0.10 H new ATOM 0 H3' DT A 18 9.953 8.138 -1.443 1.00 0.11 H new ATOM 0 H2' DT A 18 10.136 5.958 -0.734 1.00 0.23 H new ATOM 0 H2'' DT A 18 10.003 5.478 -2.415 1.00 0.23 H new ATOM 0 H1' DT A 18 12.236 4.998 -2.554 1.00 0.22 H new ATOM 0 H3 DT A 18 12.430 1.849 0.640 1.00 0.11 H new ATOM 0 H71 DT A 18 14.161 6.538 2.652 1.00 0.27 H new ATOM 0 H72 DT A 18 12.789 5.921 3.604 1.00 0.27 H new ATOM 0 H73 DT A 18 14.315 5.007 3.546 1.00 0.27 H new ATOM 0 H6 DT A 18 12.920 6.630 0.618 1.00 0.26 H new ATOM 582 P DA A 19 9.975 9.098 -4.190 1.00 0.10 P ATOM 583 OP1 DA A 19 11.245 9.190 -4.946 1.00 0.18 O ATOM 584 OP2 DA A 19 9.616 10.157 -3.220 1.00 0.10 O ATOM 585 O5' DA A 19 8.769 8.953 -5.247 1.00 0.13 O ATOM 586 C5' DA A 19 7.417 9.190 -4.845 1.00 0.14 C ATOM 587 C4' DA A 19 6.623 7.888 -4.736 1.00 0.14 C ATOM 588 O4' DA A 19 7.244 6.959 -3.819 1.00 0.19 O ATOM 589 C3' DA A 19 5.204 8.141 -4.236 1.00 0.15 C ATOM 590 O3' DA A 19 4.255 8.021 -5.302 1.00 0.24 O ATOM 591 C2' DA A 19 4.964 7.093 -3.180 1.00 0.24 C ATOM 592 C1' DA A 19 6.211 6.238 -3.115 1.00 0.22 C ATOM 593 N9 DA A 19 6.601 5.954 -1.716 1.00 0.25 N ATOM 594 C8 DA A 19 6.851 6.800 -0.684 1.00 0.30 C ATOM 595 N7 DA A 19 7.180 6.277 0.451 1.00 0.29 N ATOM 596 C5 DA A 19 7.147 4.911 0.153 1.00 0.23 C ATOM 597 C6 DA A 19 7.395 3.763 0.918 1.00 0.21 C ATOM 598 N6 DA A 19 7.746 3.798 2.211 1.00 0.20 N ATOM 599 N1 DA A 19 7.268 2.574 0.300 1.00 0.17 N ATOM 600 C2 DA A 19 6.918 2.511 -0.988 1.00 0.15 C ATOM 601 N3 DA A 19 6.662 3.529 -1.799 1.00 0.16 N ATOM 602 C4 DA A 19 6.795 4.709 -1.163 1.00 0.21 C ATOM 0 H5' DA A 19 6.934 9.852 -5.564 1.00 0.14 H new ATOM 0 H5'' DA A 19 7.408 9.703 -3.884 1.00 0.14 H new ATOM 0 H4' DA A 19 6.602 7.465 -5.741 1.00 0.14 H new ATOM 0 H3' DA A 19 5.088 9.150 -3.840 1.00 0.15 H new ATOM 0 H2' DA A 19 4.764 7.557 -2.214 1.00 0.24 H new ATOM 0 H2'' DA A 19 4.093 6.487 -3.429 1.00 0.24 H new ATOM 0 H1' DA A 19 6.038 5.266 -3.577 1.00 0.22 H new ATOM 0 H8 DA A 19 6.778 7.870 -0.807 1.00 0.30 H new ATOM 0 H61 DA A 19 7.914 2.929 2.718 1.00 0.20 H new ATOM 0 H62 DA A 19 7.845 4.694 2.688 1.00 0.20 H new ATOM 0 H2 DA A 19 6.834 1.523 -1.416 1.00 0.15 H new ATOM 614 P DG A 20 2.681 8.203 -5.019 1.00 0.21 P ATOM 615 OP1 DG A 20 2.336 9.627 -5.221 1.00 0.28 O ATOM 616 OP2 DG A 20 2.359 7.540 -3.735 1.00 0.29 O ATOM 617 O5' DG A 20 2.014 7.348 -6.208 1.00 0.12 O ATOM 618 C5' DG A 20 2.375 5.974 -6.401 1.00 0.16 C ATOM 619 C4' DG A 20 1.635 5.336 -7.567 1.00 0.10 C ATOM 620 O4' DG A 20 2.061 3.967 -7.746 1.00 0.10 O ATOM 621 C3' DG A 20 0.128 5.341 -7.331 1.00 0.10 C ATOM 622 O3' DG A 20 -0.561 5.984 -8.412 1.00 0.06 O ATOM 623 C2' DG A 20 -0.271 3.896 -7.226 1.00 0.13 C ATOM 624 C1' DG A 20 0.939 3.068 -7.612 1.00 0.09 C ATOM 625 N9 DG A 20 1.216 2.034 -6.598 1.00 0.05 N ATOM 626 C8 DG A 20 1.158 0.684 -6.706 1.00 0.10 C ATOM 627 N7 DG A 20 1.461 -0.014 -5.666 1.00 0.14 N ATOM 628 C5 DG A 20 1.763 0.980 -4.731 1.00 0.09 C ATOM 629 C6 DG A 20 2.173 0.859 -3.377 1.00 0.12 C ATOM 630 O6 DG A 20 2.350 -0.169 -2.726 1.00 0.17 O ATOM 631 N1 DG A 20 2.376 2.105 -2.791 1.00 0.10 N ATOM 632 C2 DG A 20 2.203 3.320 -3.425 1.00 0.11 C ATOM 633 N2 DG A 20 2.437 4.410 -2.689 1.00 0.19 N ATOM 634 N3 DG A 20 1.817 3.442 -4.702 1.00 0.10 N ATOM 635 C4 DG A 20 1.615 2.240 -5.293 1.00 0.05 C ATOM 0 H5' DG A 20 2.163 5.414 -5.490 1.00 0.16 H new ATOM 0 H5'' DG A 20 3.449 5.905 -6.575 1.00 0.16 H new ATOM 0 H4' DG A 20 1.866 5.922 -8.457 1.00 0.10 H new ATOM 0 H3' DG A 20 -0.132 5.896 -6.430 1.00 0.10 H new ATOM 0 H2' DG A 20 -0.592 3.658 -6.212 1.00 0.13 H new ATOM 0 H2'' DG A 20 -1.111 3.680 -7.886 1.00 0.13 H new ATOM 0 H1' DG A 20 0.754 2.550 -8.553 1.00 0.09 H new ATOM 0 H8 DG A 20 0.868 0.210 -7.632 1.00 0.10 H new ATOM 0 H1 DG A 20 2.676 2.122 -1.816 1.00 0.10 H new ATOM 0 H21 DG A 20 2.327 5.337 -3.101 1.00 0.19 H new ATOM 0 H22 DG A 20 2.726 4.316 -1.715 1.00 0.19 H new ATOM 647 P DG A 21 -0.357 5.502 -9.940 1.00 0.06 P ATOM 648 OP1 DG A 21 1.072 5.177 -10.141 1.00 0.16 O ATOM 649 OP2 DG A 21 -1.020 6.485 -10.825 1.00 0.14 O ATOM 650 O5' DG A 21 -1.197 4.129 -9.997 1.00 0.10 O ATOM 651 C5' DG A 21 -2.631 4.149 -9.972 1.00 0.14 C ATOM 652 C4' DG A 21 -3.229 2.748 -10.008 1.00 0.07 C ATOM 653 O4' DG A 21 -2.668 1.925 -8.960 1.00 0.10 O ATOM 654 C3' DG A 21 -4.743 2.787 -9.824 1.00 0.11 C ATOM 655 O3' DG A 21 -5.413 2.350 -11.011 1.00 0.17 O ATOM 656 C2' DG A 21 -5.037 1.862 -8.672 1.00 0.15 C ATOM 657 C1' DG A 21 -3.718 1.266 -8.223 1.00 0.11 C ATOM 658 N9 DG A 21 -3.522 1.439 -6.771 1.00 0.11 N ATOM 659 C8 DG A 21 -3.353 2.575 -6.049 1.00 0.13 C ATOM 660 N7 DG A 21 -3.160 2.455 -4.779 1.00 0.14 N ATOM 661 C5 DG A 21 -3.205 1.068 -4.614 1.00 0.10 C ATOM 662 C6 DG A 21 -3.059 0.289 -3.436 1.00 0.11 C ATOM 663 O6 DG A 21 -2.850 0.677 -2.288 1.00 0.14 O ATOM 664 N1 DG A 21 -3.172 -1.070 -3.707 1.00 0.09 N ATOM 665 C2 DG A 21 -3.396 -1.618 -4.953 1.00 0.08 C ATOM 666 N2 DG A 21 -3.478 -2.950 -5.007 1.00 0.07 N ATOM 667 N3 DG A 21 -3.533 -0.891 -6.068 1.00 0.08 N ATOM 668 C4 DG A 21 -3.427 0.437 -5.829 1.00 0.09 C ATOM 0 H5' DG A 21 -2.999 4.721 -10.824 1.00 0.14 H new ATOM 0 H5'' DG A 21 -2.969 4.663 -9.073 1.00 0.14 H new ATOM 0 H4' DG A 21 -2.991 2.326 -10.984 1.00 0.07 H new ATOM 0 H3' DG A 21 -5.096 3.799 -9.626 1.00 0.11 H new ATOM 0 H2' DG A 21 -5.511 2.405 -7.855 1.00 0.15 H new ATOM 0 H2'' DG A 21 -5.729 1.077 -8.977 1.00 0.15 H new ATOM 0 H1' DG A 21 -3.708 0.194 -8.419 1.00 0.11 H new ATOM 0 H8 DG A 21 -3.379 3.546 -6.521 1.00 0.13 H new ATOM 0 H1 DG A 21 -3.082 -1.714 -2.921 1.00 0.09 H new ATOM 0 H21 DG A 21 -3.643 -3.415 -5.900 1.00 0.07 H new ATOM 0 H22 DG A 21 -3.376 -3.502 -4.155 1.00 0.07 H new ATOM 680 P DG A 22 -7.017 2.205 -11.042 1.00 0.13 P ATOM 681 OP1 DG A 22 -7.460 2.260 -12.453 1.00 0.19 O ATOM 682 OP2 DG A 22 -7.585 3.146 -10.052 1.00 0.20 O ATOM 683 O5' DG A 22 -7.247 0.705 -10.501 1.00 0.08 O ATOM 684 C5' DG A 22 -6.969 -0.422 -11.344 1.00 0.07 C ATOM 685 C4' DG A 22 -7.390 -1.742 -10.710 1.00 0.08 C ATOM 686 O4' DG A 22 -6.689 -1.960 -9.467 1.00 0.15 O ATOM 687 C3' DG A 22 -8.888 -1.763 -10.422 1.00 0.13 C ATOM 688 O3' DG A 22 -9.564 -2.685 -11.282 1.00 0.11 O ATOM 689 C2' DG A 22 -9.018 -2.180 -8.983 1.00 0.20 C ATOM 690 C1' DG A 22 -7.618 -2.316 -8.421 1.00 0.18 C ATOM 691 N9 DG A 22 -7.441 -1.446 -7.245 1.00 0.17 N ATOM 692 C8 DG A 22 -7.477 -0.093 -7.157 1.00 0.24 C ATOM 693 N7 DG A 22 -7.276 0.434 -5.997 1.00 0.24 N ATOM 694 C5 DG A 22 -7.082 -0.698 -5.199 1.00 0.13 C ATOM 695 C6 DG A 22 -6.815 -0.794 -3.809 1.00 0.12 C ATOM 696 O6 DG A 22 -6.690 0.114 -2.991 1.00 0.18 O ATOM 697 N1 DG A 22 -6.691 -2.118 -3.407 1.00 0.13 N ATOM 698 C2 DG A 22 -6.806 -3.216 -4.231 1.00 0.14 C ATOM 699 N2 DG A 22 -6.659 -4.409 -3.650 1.00 0.26 N ATOM 700 N3 DG A 22 -7.056 -3.135 -5.542 1.00 0.11 N ATOM 701 C4 DG A 22 -7.182 -1.853 -5.958 1.00 0.09 C ATOM 0 H5' DG A 22 -5.902 -0.452 -11.564 1.00 0.07 H new ATOM 0 H5'' DG A 22 -7.488 -0.297 -12.295 1.00 0.07 H new ATOM 0 H4' DG A 22 -7.143 -2.530 -11.422 1.00 0.08 H new ATOM 0 H3' DG A 22 -9.342 -0.788 -10.601 1.00 0.13 H new ATOM 0 H2' DG A 22 -9.587 -1.441 -8.419 1.00 0.20 H new ATOM 0 H2'' DG A 22 -9.556 -3.125 -8.905 1.00 0.20 H new ATOM 0 H1' DG A 22 -7.441 -3.340 -8.092 1.00 0.18 H new ATOM 0 H8 DG A 22 -7.667 0.520 -8.026 1.00 0.24 H new ATOM 0 H1 DG A 22 -6.499 -2.291 -2.420 1.00 0.13 H new ATOM 0 H21 DG A 22 -6.733 -5.260 -4.207 1.00 0.26 H new ATOM 0 H22 DG A 22 -6.473 -4.469 -2.649 1.00 0.26 H new ATOM 713 P DT A 23 -11.167 -2.823 -11.233 1.00 0.17 P ATOM 714 OP1 DT A 23 -11.595 -3.662 -12.374 1.00 0.22 O ATOM 715 OP2 DT A 23 -11.742 -1.471 -11.055 1.00 0.29 O ATOM 716 O5' DT A 23 -11.410 -3.656 -9.876 1.00 0.17 O ATOM 717 C5' DT A 23 -11.111 -5.053 -9.821 1.00 0.08 C ATOM 718 C4' DT A 23 -11.534 -5.669 -8.490 1.00 0.07 C ATOM 719 O4' DT A 23 -10.852 -5.041 -7.383 1.00 0.10 O ATOM 720 C3' DT A 23 -13.032 -5.514 -8.255 1.00 0.14 C ATOM 721 O3' DT A 23 -13.721 -6.745 -8.494 1.00 0.11 O ATOM 722 C2' DT A 23 -13.169 -5.084 -6.820 1.00 0.33 C ATOM 723 C1' DT A 23 -11.766 -4.876 -6.279 1.00 0.19 C ATOM 724 N1 DT A 23 -11.626 -3.535 -5.669 1.00 0.10 N ATOM 725 C2 DT A 23 -11.336 -3.472 -4.316 1.00 0.09 C ATOM 726 O2 DT A 23 -11.192 -4.482 -3.632 1.00 0.15 O ATOM 727 N3 DT A 23 -11.217 -2.204 -3.778 1.00 0.17 N ATOM 728 C4 DT A 23 -11.361 -1.012 -4.463 1.00 0.19 C ATOM 729 O4 DT A 23 -11.235 0.064 -3.882 1.00 0.26 O ATOM 730 C5 DT A 23 -11.663 -1.173 -5.868 1.00 0.18 C ATOM 731 C7 DT A 23 -11.849 0.063 -6.742 1.00 0.26 C ATOM 732 C6 DT A 23 -11.784 -2.399 -6.418 1.00 0.16 C ATOM 0 H5' DT A 23 -10.041 -5.202 -9.967 1.00 0.08 H new ATOM 0 H5'' DT A 23 -11.619 -5.566 -10.637 1.00 0.08 H new ATOM 0 H4' DT A 23 -11.272 -6.726 -8.545 1.00 0.07 H new ATOM 0 H3' DT A 23 -13.473 -4.786 -8.936 1.00 0.14 H new ATOM 0 H2' DT A 23 -13.750 -4.164 -6.747 1.00 0.33 H new ATOM 0 H2'' DT A 23 -13.697 -5.841 -6.240 1.00 0.33 H new ATOM 0 HO3' DT A 23 -14.680 -6.619 -8.335 1.00 0.11 H new ATOM 0 H1' DT A 23 -11.549 -5.600 -5.494 1.00 0.19 H new ATOM 0 H3 DT A 23 -11.003 -2.142 -2.783 1.00 0.17 H new ATOM 0 H71 DT A 23 -11.543 -0.164 -7.763 1.00 0.26 H new ATOM 0 H72 DT A 23 -12.898 0.359 -6.735 1.00 0.26 H new ATOM 0 H73 DT A 23 -11.239 0.878 -6.354 1.00 0.26 H new ATOM 0 H6 DT A 23 -12.010 -2.487 -7.470 1.00 0.16 H new TER 746 DT A 23