USER MOD reduce.3.24.130724 H: found=0, std=0, add=250, rem=0, adj=3 USER MOD reduce.3.24.130724 removed 250 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 29:sc= 0.00432 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 15 DT C7 :methyl -30:sc= 0 (180deg=-0.000766) USER MOD Single : A 22 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 22 DT O3' : rot 162:sc= 1.96 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 3.575 -4.511 2.071 1.00 0.42 O ATOM 2 C5' DT A 1 4.274 -3.353 1.674 1.00 0.13 C ATOM 3 C4' DT A 1 3.545 -2.089 2.089 1.00 0.02 C ATOM 4 O4' DT A 1 2.216 -2.067 1.523 1.00 0.05 O ATOM 5 C3' DT A 1 3.336 -1.938 3.602 1.00 0.20 C ATOM 6 O3' DT A 1 4.316 -1.044 4.142 1.00 0.16 O ATOM 7 C2' DT A 1 1.910 -1.342 3.764 1.00 0.29 C ATOM 8 C1' DT A 1 1.390 -1.221 2.304 1.00 0.14 C ATOM 9 N1 DT A 1 -0.011 -1.654 2.146 1.00 0.22 N ATOM 10 C2 DT A 1 -0.948 -0.705 1.757 1.00 0.26 C ATOM 11 O2 DT A 1 -0.660 0.458 1.526 1.00 0.26 O ATOM 12 N3 DT A 1 -2.239 -1.175 1.649 1.00 0.36 N ATOM 13 C4 DT A 1 -2.676 -2.468 1.890 1.00 0.44 C ATOM 14 O4 DT A 1 -3.867 -2.744 1.764 1.00 0.56 O ATOM 15 C5 DT A 1 -1.643 -3.412 2.288 1.00 0.43 C ATOM 16 C7 DT A 1 -2.029 -4.831 2.567 1.00 0.60 C ATOM 17 C6 DT A 1 -0.375 -2.970 2.395 1.00 0.31 C ATOM 0 H5' DT A 1 4.404 -3.359 0.592 1.00 0.13 H new ATOM 0 H5'' DT A 1 5.271 -3.360 2.115 1.00 0.13 H new ATOM 0 H4' DT A 1 4.188 -1.285 1.731 1.00 0.02 H new ATOM 0 H3' DT A 1 3.437 -2.887 4.129 1.00 0.20 H new ATOM 0 H2' DT A 1 1.271 -1.991 4.364 1.00 0.29 H new ATOM 0 H2'' DT A 1 1.936 -0.372 4.261 1.00 0.29 H new ATOM 0 HO5' DT A 1 2.614 -4.319 2.100 1.00 0.42 H new ATOM 0 H1' DT A 1 1.425 -0.175 2.001 1.00 0.14 H new ATOM 0 H3 DT A 1 -2.948 -0.500 1.361 1.00 0.36 H new ATOM 0 H71 DT A 1 -1.193 -5.489 2.328 1.00 0.60 H new ATOM 0 H72 DT A 1 -2.285 -4.938 3.621 1.00 0.60 H new ATOM 0 H73 DT A 1 -2.890 -5.101 1.955 1.00 0.60 H new ATOM 0 H6 DT A 1 0.393 -3.671 2.688 1.00 0.31 H new ATOM 31 P DA A 2 5.608 -1.634 4.898 1.00 0.30 P ATOM 32 OP1 DA A 2 5.639 -3.111 4.744 1.00 0.46 O ATOM 33 OP2 DA A 2 5.636 -1.090 6.278 1.00 0.49 O ATOM 34 O5' DA A 2 6.822 -1.007 4.071 1.00 0.12 O ATOM 35 C5' DA A 2 7.023 -1.279 2.682 1.00 0.02 C ATOM 36 C4' DA A 2 6.930 0.014 1.877 1.00 0.83 C ATOM 37 O4' DA A 2 5.576 0.497 1.912 1.00 0.91 O ATOM 38 C3' DA A 2 7.782 1.156 2.412 1.00 0.80 C ATOM 39 O3' DA A 2 8.961 1.304 1.620 1.00 0.89 O ATOM 40 C2' DA A 2 6.909 2.414 2.265 1.00 0.85 C ATOM 41 C1' DA A 2 5.562 1.901 1.763 1.00 0.91 C ATOM 42 N9 DA A 2 4.428 2.438 2.529 1.00 0.08 N ATOM 43 C8 DA A 2 4.018 2.050 3.773 1.00 0.09 C ATOM 44 N7 DA A 2 2.978 2.707 4.225 1.00 0.32 N ATOM 45 C5 DA A 2 2.680 3.597 3.205 1.00 0.51 C ATOM 46 C6 DA A 2 1.677 4.588 3.063 1.00 0.88 C ATOM 47 N6 DA A 2 0.753 4.851 3.993 1.00 0.07 N ATOM 48 N1 DA A 2 1.659 5.309 1.913 1.00 0.11 N ATOM 49 C2 DA A 2 2.589 5.048 0.976 1.00 0.97 C ATOM 50 N3 DA A 2 3.579 4.143 0.994 1.00 0.61 N ATOM 51 C4 DA A 2 3.570 3.442 2.148 1.00 0.39 C ATOM 0 H5' DA A 2 6.275 -1.990 2.331 1.00 0.02 H new ATOM 0 H5'' DA A 2 7.998 -1.741 2.531 1.00 0.02 H new ATOM 0 H4' DA A 2 7.284 -0.250 0.880 1.00 0.83 H new ATOM 0 H3' DA A 2 8.092 0.980 3.442 1.00 0.80 H new ATOM 0 H2' DA A 2 6.804 2.935 3.217 1.00 0.85 H new ATOM 0 H2'' DA A 2 7.350 3.121 1.562 1.00 0.85 H new ATOM 0 H1' DA A 2 5.431 2.218 0.728 1.00 0.91 H new ATOM 0 H8 DA A 2 4.509 1.269 4.335 1.00 0.09 H new ATOM 0 H61 DA A 2 0.057 5.579 3.829 1.00 0.07 H new ATOM 0 H62 DA A 2 0.744 4.324 4.866 1.00 0.07 H new ATOM 0 H2 DA A 2 2.530 5.653 0.083 1.00 0.97 H new ATOM 63 P DG A 3 10.394 1.532 2.306 1.00 0.99 P ATOM 64 OP1 DG A 3 10.305 1.212 3.754 1.00 0.37 O ATOM 65 OP2 DG A 3 10.892 2.879 1.930 1.00 0.27 O ATOM 66 O5' DG A 3 11.293 0.423 1.586 1.00 0.79 O ATOM 67 C5' DG A 3 11.564 0.468 0.185 1.00 0.71 C ATOM 68 C4' DG A 3 10.751 -0.579 -0.554 1.00 0.69 C ATOM 69 O4' DG A 3 9.338 -0.280 -0.430 1.00 0.65 O ATOM 70 C3' DG A 3 11.023 -0.692 -2.066 1.00 0.72 C ATOM 71 O3' DG A 3 11.270 -2.062 -2.387 1.00 0.80 O ATOM 72 C2' DG A 3 9.725 -0.210 -2.723 1.00 0.68 C ATOM 73 C1' DG A 3 8.685 -0.508 -1.656 1.00 0.61 C ATOM 74 N9 DG A 3 7.455 0.322 -1.694 1.00 0.53 N ATOM 75 C8 DG A 3 7.353 1.701 -1.766 1.00 0.51 C ATOM 76 N7 DG A 3 6.119 2.125 -1.787 1.00 0.46 N ATOM 77 C5 DG A 3 5.355 0.974 -1.717 1.00 0.43 C ATOM 78 C6 DG A 3 3.938 0.813 -1.695 1.00 0.40 C ATOM 79 O6 DG A 3 3.071 1.689 -1.746 1.00 0.42 O ATOM 80 N1 DG A 3 3.568 -0.530 -1.607 1.00 0.40 N ATOM 81 C2 DG A 3 4.454 -1.588 -1.550 1.00 0.44 C ATOM 82 N2 DG A 3 3.928 -2.820 -1.464 1.00 0.46 N ATOM 83 N3 DG A 3 5.781 -1.447 -1.575 1.00 0.48 N ATOM 84 C4 DG A 3 6.162 -0.148 -1.657 1.00 0.47 C ATOM 0 H5' DG A 3 12.627 0.300 0.010 1.00 0.71 H new ATOM 0 H5'' DG A 3 11.329 1.459 -0.204 1.00 0.71 H new ATOM 0 H4' DG A 3 11.050 -1.517 -0.087 1.00 0.69 H new ATOM 0 H3' DG A 3 11.885 -0.113 -2.398 1.00 0.72 H new ATOM 0 H2' DG A 3 9.764 0.852 -2.967 1.00 0.68 H new ATOM 0 H2'' DG A 3 9.518 -0.743 -3.651 1.00 0.68 H new ATOM 0 H1' DG A 3 8.330 -1.526 -1.815 1.00 0.61 H new ATOM 0 H8 DG A 3 8.208 2.359 -1.801 1.00 0.51 H new ATOM 0 H1 DG A 3 2.571 -0.746 -1.583 1.00 0.40 H new ATOM 0 H21 DG A 3 4.541 -3.634 -1.419 1.00 0.46 H new ATOM 0 H22 DG A 3 2.916 -2.942 -1.443 1.00 0.46 H new ATOM 96 P DG A 4 11.977 -2.456 -3.767 1.00 0.89 P ATOM 97 OP1 DG A 4 13.386 -2.842 -3.497 1.00 0.14 O ATOM 98 OP2 DG A 4 11.738 -1.381 -4.763 1.00 0.02 O ATOM 99 O5' DG A 4 11.155 -3.752 -4.190 1.00 0.79 O ATOM 100 C5' DG A 4 10.643 -4.651 -3.208 1.00 0.67 C ATOM 101 C4' DG A 4 9.476 -5.439 -3.757 1.00 0.53 C ATOM 102 O4' DG A 4 8.253 -4.657 -3.617 1.00 0.47 O ATOM 103 C3' DG A 4 9.577 -5.790 -5.250 1.00 0.47 C ATOM 104 O3' DG A 4 9.134 -7.131 -5.469 1.00 0.47 O ATOM 105 C2' DG A 4 8.652 -4.784 -5.883 1.00 0.42 C ATOM 106 C1' DG A 4 7.559 -4.672 -4.844 1.00 0.41 C ATOM 107 N9 DG A 4 6.760 -3.450 -4.951 1.00 0.40 N ATOM 108 C8 DG A 4 7.242 -2.185 -5.127 1.00 0.42 C ATOM 109 N7 DG A 4 6.310 -1.277 -5.186 1.00 0.43 N ATOM 110 C5 DG A 4 5.132 -1.987 -5.047 1.00 0.41 C ATOM 111 C6 DG A 4 3.785 -1.530 -5.041 1.00 0.41 C ATOM 112 O6 DG A 4 3.380 -0.369 -5.153 1.00 0.44 O ATOM 113 N1 DG A 4 2.879 -2.584 -4.883 1.00 0.39 N ATOM 114 C2 DG A 4 3.237 -3.914 -4.747 1.00 0.38 C ATOM 115 N2 DG A 4 2.229 -4.790 -4.626 1.00 0.38 N ATOM 116 N3 DG A 4 4.498 -4.350 -4.746 1.00 0.39 N ATOM 117 C4 DG A 4 5.389 -3.338 -4.901 1.00 0.39 C ATOM 0 H5' DG A 4 10.328 -4.093 -2.327 1.00 0.67 H new ATOM 0 H5'' DG A 4 11.430 -5.334 -2.888 1.00 0.67 H new ATOM 0 H4' DG A 4 9.477 -6.366 -3.184 1.00 0.53 H new ATOM 0 H3' DG A 4 10.588 -5.747 -5.656 1.00 0.47 H new ATOM 0 H2' DG A 4 9.147 -3.829 -6.061 1.00 0.42 H new ATOM 0 H2'' DG A 4 8.269 -5.128 -6.844 1.00 0.42 H new ATOM 0 H1' DG A 4 6.849 -5.491 -4.961 1.00 0.41 H new ATOM 0 H8 DG A 4 8.295 -1.959 -5.209 1.00 0.42 H new ATOM 0 H1 DG A 4 1.885 -2.356 -4.867 1.00 0.39 H new ATOM 0 H21 DG A 4 2.428 -5.785 -4.523 1.00 0.38 H new ATOM 0 H22 DG A 4 1.264 -4.461 -4.637 1.00 0.38 H new ATOM 129 P DG A 5 9.123 -7.749 -6.949 1.00 0.49 P ATOM 130 OP1 DG A 5 9.741 -9.099 -6.912 1.00 0.62 O ATOM 131 OP2 DG A 5 9.692 -6.762 -7.902 1.00 0.52 O ATOM 132 O5' DG A 5 7.562 -7.904 -7.221 1.00 0.54 O ATOM 133 C5' DG A 5 6.732 -8.582 -6.286 1.00 0.51 C ATOM 134 C4' DG A 5 5.377 -8.927 -6.881 1.00 0.46 C ATOM 135 O4' DG A 5 4.489 -7.773 -6.834 1.00 0.46 O ATOM 136 C3' DG A 5 5.385 -9.362 -8.312 1.00 0.48 C ATOM 137 O3' DG A 5 4.278 -10.234 -8.581 1.00 0.57 O ATOM 138 C2' DG A 5 5.223 -8.050 -9.039 1.00 0.47 C ATOM 139 C1' DG A 5 4.155 -7.386 -8.163 1.00 0.45 C ATOM 140 N9 DG A 5 4.074 -5.907 -8.216 1.00 0.42 N ATOM 141 C8 DG A 5 5.103 -4.982 -8.194 1.00 0.41 C ATOM 142 N7 DG A 5 4.681 -3.746 -8.238 1.00 0.43 N ATOM 143 C5 DG A 5 3.303 -3.852 -8.295 1.00 0.42 C ATOM 144 C6 DG A 5 2.304 -2.835 -8.358 1.00 0.43 C ATOM 145 O6 DG A 5 2.467 -1.611 -8.376 1.00 0.47 O ATOM 146 N1 DG A 5 1.014 -3.375 -8.405 1.00 0.44 N ATOM 147 C2 DG A 5 0.731 -4.729 -8.390 1.00 0.44 C ATOM 148 N2 DG A 5 -0.560 -5.077 -8.450 1.00 0.45 N ATOM 149 N3 DG A 5 1.657 -5.681 -8.330 1.00 0.43 N ATOM 150 C4 DG A 5 2.913 -5.176 -8.284 1.00 0.42 C ATOM 0 H5' DG A 5 6.593 -7.958 -5.403 1.00 0.51 H new ATOM 0 H5'' DG A 5 7.227 -9.495 -5.956 1.00 0.51 H new ATOM 0 H4' DG A 5 5.046 -9.765 -6.268 1.00 0.46 H new ATOM 0 H3' DG A 5 6.276 -9.919 -8.602 1.00 0.48 H new ATOM 0 H2' DG A 5 6.149 -7.476 -9.073 1.00 0.47 H new ATOM 0 H2'' DG A 5 4.892 -8.183 -10.069 1.00 0.47 H new ATOM 0 H1' DG A 5 3.180 -7.712 -8.526 1.00 0.45 H new ATOM 0 H8 DG A 5 6.147 -5.254 -8.145 1.00 0.41 H new ATOM 0 H1 DG A 5 0.229 -2.726 -8.454 1.00 0.44 H new ATOM 0 H21 DG A 5 -0.823 -6.062 -8.442 1.00 0.45 H new ATOM 0 H22 DG A 5 -1.280 -4.357 -8.504 1.00 0.45 H new ATOM 162 P DT A 6 4.498 -11.824 -8.596 1.00 0.82 P ATOM 163 OP1 DT A 6 5.343 -12.211 -7.437 1.00 0.98 O ATOM 164 OP2 DT A 6 4.972 -12.219 -9.947 1.00 0.19 O ATOM 165 O5' DT A 6 3.013 -12.384 -8.378 1.00 0.80 O ATOM 166 C5' DT A 6 2.403 -12.443 -7.085 1.00 0.80 C ATOM 167 C4' DT A 6 1.624 -11.178 -6.797 1.00 0.86 C ATOM 168 O4' DT A 6 0.455 -11.102 -7.673 1.00 0.17 O ATOM 169 C3' DT A 6 1.065 -11.064 -5.365 1.00 0.92 C ATOM 170 O3' DT A 6 1.037 -9.684 -4.965 1.00 0.01 O ATOM 171 C2' DT A 6 -0.369 -11.565 -5.577 1.00 0.27 C ATOM 172 C1' DT A 6 -0.686 -10.859 -6.881 1.00 0.40 C ATOM 173 N1 DT A 6 -1.904 -11.312 -7.583 1.00 0.79 N ATOM 174 C2 DT A 6 -2.956 -10.412 -7.690 1.00 0.19 C ATOM 175 O2 DT A 6 -2.912 -9.282 -7.233 1.00 0.27 O ATOM 176 N3 DT A 6 -4.065 -10.890 -8.354 1.00 0.59 N ATOM 177 C4 DT A 6 -4.224 -12.152 -8.907 1.00 0.65 C ATOM 178 O4 DT A 6 -5.275 -12.443 -9.474 1.00 3.07 O ATOM 179 C5 DT A 6 -3.084 -13.045 -8.756 1.00 0.27 C ATOM 180 C7 DT A 6 -3.167 -14.432 -9.311 1.00 0.43 C ATOM 181 C6 DT A 6 -1.991 -12.592 -8.113 1.00 0.85 C ATOM 0 H5' DT A 6 3.170 -12.584 -6.323 1.00 0.80 H new ATOM 0 H5'' DT A 6 1.738 -13.305 -7.031 1.00 0.80 H new ATOM 0 H4' DT A 6 2.351 -10.381 -6.954 1.00 0.86 H new ATOM 0 H3' DT A 6 1.634 -11.602 -4.607 1.00 0.92 H new ATOM 0 H2' DT A 6 -0.426 -12.650 -5.663 1.00 0.27 H new ATOM 0 H2'' DT A 6 -1.039 -11.274 -4.768 1.00 0.27 H new ATOM 0 H1' DT A 6 -0.901 -9.809 -6.684 1.00 0.40 H new ATOM 0 H3 DT A 6 -4.852 -10.248 -8.449 1.00 0.59 H new ATOM 0 H71 DT A 6 -2.172 -14.767 -9.603 1.00 0.43 H new ATOM 0 H72 DT A 6 -3.568 -15.104 -8.552 1.00 0.43 H new ATOM 0 H73 DT A 6 -3.822 -14.437 -10.182 1.00 0.43 H new ATOM 0 H6 DT A 6 -1.145 -13.254 -8.005 1.00 0.85 H new ATOM 194 P DG A 7 1.990 -9.141 -3.791 1.00 0.72 P ATOM 195 OP1 DG A 7 2.628 -7.879 -4.246 1.00 0.78 O ATOM 196 OP2 DG A 7 2.877 -10.238 -3.328 1.00 0.73 O ATOM 197 O5' DG A 7 0.946 -8.778 -2.642 1.00 0.91 O ATOM 198 C5' DG A 7 0.568 -9.706 -1.626 1.00 0.73 C ATOM 199 C4' DG A 7 -0.609 -9.170 -0.823 1.00 0.58 C ATOM 200 O4' DG A 7 -0.279 -7.855 -0.268 1.00 0.49 O ATOM 201 C3' DG A 7 -1.881 -8.936 -1.631 1.00 0.57 C ATOM 202 O3' DG A 7 -3.048 -9.073 -0.816 1.00 0.58 O ATOM 203 C2' DG A 7 -1.706 -7.519 -2.072 1.00 0.49 C ATOM 204 C1' DG A 7 -1.168 -6.881 -0.812 1.00 0.43 C ATOM 205 N9 DG A 7 -0.431 -5.610 -1.010 1.00 0.39 N ATOM 206 C8 DG A 7 0.934 -5.438 -1.099 1.00 0.39 C ATOM 207 N7 DG A 7 1.290 -4.191 -1.252 1.00 0.38 N ATOM 208 C5 DG A 7 0.097 -3.491 -1.275 1.00 0.36 C ATOM 209 C6 DG A 7 -0.140 -2.094 -1.417 1.00 0.35 C ATOM 210 O6 DG A 7 0.693 -1.193 -1.547 1.00 0.36 O ATOM 211 N1 DG A 7 -1.502 -1.788 -1.388 1.00 0.36 N ATOM 212 C2 DG A 7 -2.514 -2.715 -1.242 1.00 0.39 C ATOM 213 N2 DG A 7 -3.767 -2.224 -1.233 1.00 0.43 N ATOM 214 N3 DG A 7 -2.306 -4.031 -1.106 1.00 0.40 N ATOM 215 C4 DG A 7 -0.982 -4.348 -1.130 1.00 0.38 C ATOM 0 H5' DG A 7 1.413 -9.892 -0.963 1.00 0.73 H new ATOM 0 H5'' DG A 7 0.302 -10.661 -2.079 1.00 0.73 H new ATOM 0 H4' DG A 7 -0.790 -9.941 -0.074 1.00 0.58 H new ATOM 0 H3' DG A 7 -2.018 -9.645 -2.447 1.00 0.57 H new ATOM 0 H2' DG A 7 -1.010 -7.431 -2.907 1.00 0.49 H new ATOM 0 H2'' DG A 7 -2.646 -7.069 -2.392 1.00 0.49 H new ATOM 0 H1' DG A 7 -2.006 -6.610 -0.170 1.00 0.43 H new ATOM 0 H8 DG A 7 1.639 -6.254 -1.047 1.00 0.39 H new ATOM 0 H1 DG A 7 -1.768 -0.808 -1.482 1.00 0.36 H new ATOM 0 H21 DG A 7 -4.561 -2.855 -1.129 1.00 0.43 H new ATOM 0 H22 DG A 7 -3.922 -1.221 -1.331 1.00 0.43 H new ATOM 227 P DG A 8 -4.462 -9.352 -1.521 1.00 0.72 P ATOM 228 OP1 DG A 8 -5.545 -9.170 -0.519 1.00 0.82 O ATOM 229 OP2 DG A 8 -4.393 -10.657 -2.224 1.00 0.03 O ATOM 230 O5' DG A 8 -4.553 -8.181 -2.604 1.00 0.65 O ATOM 231 C5' DG A 8 -5.637 -7.260 -2.614 1.00 0.54 C ATOM 232 C4' DG A 8 -5.522 -6.280 -3.766 1.00 0.46 C ATOM 233 O4' DG A 8 -4.375 -5.437 -3.613 1.00 0.42 O ATOM 234 C3' DG A 8 -5.348 -6.895 -5.158 1.00 0.46 C ATOM 235 O3' DG A 8 -6.616 -6.906 -5.823 1.00 0.60 O ATOM 236 C2' DG A 8 -4.352 -5.951 -5.862 1.00 0.44 C ATOM 237 C1' DG A 8 -4.171 -4.827 -4.853 1.00 0.40 C ATOM 238 N9 DG A 8 -2.856 -4.150 -4.846 1.00 0.36 N ATOM 239 C8 DG A 8 -1.603 -4.720 -4.750 1.00 0.37 C ATOM 240 N7 DG A 8 -0.636 -3.842 -4.746 1.00 0.35 N ATOM 241 C5 DG A 8 -1.279 -2.622 -4.854 1.00 0.34 C ATOM 242 C6 DG A 8 -0.745 -1.299 -4.903 1.00 0.35 C ATOM 243 O6 DG A 8 0.440 -0.954 -4.858 1.00 0.37 O ATOM 244 N1 DG A 8 -1.752 -0.334 -5.021 1.00 0.37 N ATOM 245 C2 DG A 8 -3.105 -0.617 -5.085 1.00 0.37 C ATOM 246 N2 DG A 8 -3.945 0.422 -5.205 1.00 0.41 N ATOM 247 N3 DG A 8 -3.608 -1.848 -5.037 1.00 0.36 N ATOM 248 C4 DG A 8 -2.649 -2.795 -4.921 1.00 0.35 C ATOM 0 H5' DG A 8 -5.661 -6.714 -1.671 1.00 0.54 H new ATOM 0 H5'' DG A 8 -6.578 -7.805 -2.691 1.00 0.54 H new ATOM 0 H4' DG A 8 -6.477 -5.758 -3.718 1.00 0.46 H new ATOM 0 H3' DG A 8 -4.987 -7.923 -5.146 1.00 0.46 H new ATOM 0 H2' DG A 8 -3.409 -6.451 -6.082 1.00 0.44 H new ATOM 0 H2'' DG A 8 -4.746 -5.583 -6.809 1.00 0.44 H new ATOM 0 H1' DG A 8 -4.866 -4.027 -5.108 1.00 0.40 H new ATOM 0 H8 DG A 8 -1.438 -5.785 -4.685 1.00 0.37 H new ATOM 0 H1 DG A 8 -1.469 0.645 -5.063 1.00 0.37 H new ATOM 0 H21 DG A 8 -4.951 0.261 -5.256 1.00 0.41 H new ATOM 0 H22 DG A 8 -3.578 1.373 -5.245 1.00 0.41 H new ATOM 260 P DG A 9 -6.778 -7.543 -7.286 1.00 0.63 P ATOM 261 OP1 DG A 9 -7.935 -8.475 -7.277 1.00 0.79 O ATOM 262 OP2 DG A 9 -5.474 -8.080 -7.743 1.00 0.67 O ATOM 263 O5' DG A 9 -7.159 -6.263 -8.156 1.00 0.68 O ATOM 264 C5' DG A 9 -8.265 -5.443 -7.789 1.00 0.69 C ATOM 265 C4' DG A 9 -8.183 -4.072 -8.425 1.00 0.60 C ATOM 266 O4' DG A 9 -6.932 -3.442 -8.059 1.00 0.56 O ATOM 267 C3' DG A 9 -8.230 -4.061 -9.965 1.00 0.60 C ATOM 268 O3' DG A 9 -9.255 -3.168 -10.413 1.00 0.64 O ATOM 269 C2' DG A 9 -6.852 -3.545 -10.383 1.00 0.58 C ATOM 270 C1' DG A 9 -6.419 -2.741 -9.168 1.00 0.51 C ATOM 271 N9 DG A 9 -4.963 -2.598 -8.994 1.00 0.46 N ATOM 272 C8 DG A 9 -4.036 -3.609 -8.868 1.00 0.45 C ATOM 273 N7 DG A 9 -2.818 -3.169 -8.720 1.00 0.45 N ATOM 274 C5 DG A 9 -2.936 -1.793 -8.753 1.00 0.44 C ATOM 275 C6 DG A 9 -1.936 -0.787 -8.641 1.00 0.45 C ATOM 276 O6 DG A 9 -0.718 -0.941 -8.492 1.00 0.47 O ATOM 277 N1 DG A 9 -2.479 0.499 -8.725 1.00 0.45 N ATOM 278 C2 DG A 9 -3.824 0.775 -8.896 1.00 0.46 C ATOM 279 N2 DG A 9 -4.175 2.070 -8.953 1.00 0.47 N ATOM 280 N3 DG A 9 -4.765 -0.161 -9.002 1.00 0.46 N ATOM 281 C4 DG A 9 -4.255 -1.418 -8.922 1.00 0.45 C ATOM 0 H5' DG A 9 -8.297 -5.339 -6.704 1.00 0.69 H new ATOM 0 H5'' DG A 9 -9.193 -5.929 -8.090 1.00 0.69 H new ATOM 0 H4' DG A 9 -9.064 -3.548 -8.056 1.00 0.60 H new ATOM 0 H3' DG A 9 -8.451 -5.040 -10.389 1.00 0.60 H new ATOM 0 H2' DG A 9 -6.161 -4.360 -10.597 1.00 0.58 H new ATOM 0 H2'' DG A 9 -6.905 -2.928 -11.280 1.00 0.58 H new ATOM 0 H1' DG A 9 -6.791 -1.723 -9.284 1.00 0.51 H new ATOM 0 H8 DG A 9 -4.292 -4.658 -8.890 1.00 0.45 H new ATOM 0 H1 DG A 9 -1.838 1.289 -8.655 1.00 0.45 H new ATOM 0 H21 DG A 9 -5.154 2.328 -9.078 1.00 0.47 H new ATOM 0 H22 DG A 9 -3.463 2.795 -8.871 1.00 0.47 H new ATOM 293 P DT A 10 -10.685 -3.753 -10.852 1.00 0.64 P ATOM 294 OP1 DT A 10 -10.478 -4.935 -11.727 1.00 0.68 O ATOM 295 OP2 DT A 10 -11.506 -2.640 -11.391 1.00 0.93 O ATOM 296 O5' DT A 10 -11.311 -4.237 -9.463 1.00 0.63 O ATOM 297 C5' DT A 10 -12.201 -5.348 -9.402 1.00 0.08 C ATOM 298 C4' DT A 10 -12.908 -5.421 -8.062 1.00 0.04 C ATOM 299 O4' DT A 10 -14.087 -6.251 -8.205 1.00 0.69 O ATOM 300 C3' DT A 10 -12.119 -6.092 -6.935 1.00 0.93 C ATOM 301 O3' DT A 10 -12.669 -5.737 -5.662 1.00 0.75 O ATOM 302 C2' DT A 10 -12.382 -7.552 -7.225 1.00 0.58 C ATOM 303 C1' DT A 10 -13.860 -7.520 -7.596 1.00 0.86 C ATOM 304 N1 DT A 10 -14.279 -8.572 -8.530 1.00 0.63 N ATOM 305 C2 DT A 10 -15.290 -9.425 -8.126 1.00 3.14 C ATOM 306 O2 DT A 10 -15.836 -9.337 -7.038 1.00 0.98 O ATOM 307 N3 DT A 10 -15.637 -10.388 -9.046 1.00 3.88 N ATOM 308 C4 DT A 10 -15.083 -10.578 -10.304 1.00 4.16 C ATOM 309 O4 DT A 10 -15.495 -11.485 -11.020 1.00 4.86 O ATOM 310 C5 DT A 10 -14.022 -9.646 -10.664 1.00 3.62 C ATOM 311 C7 DT A 10 -13.360 -9.777 -12.002 1.00 3.93 C ATOM 312 C6 DT A 10 -13.672 -8.699 -9.776 1.00 0.88 C ATOM 0 H5' DT A 10 -11.646 -6.270 -9.572 1.00 0.08 H new ATOM 0 H5'' DT A 10 -12.939 -5.269 -10.200 1.00 0.08 H new ATOM 0 H4' DT A 10 -13.090 -4.380 -7.796 1.00 0.04 H new ATOM 0 H3' DT A 10 -11.065 -5.818 -6.897 1.00 0.93 H new ATOM 0 H2' DT A 10 -11.762 -7.928 -8.039 1.00 0.58 H new ATOM 0 H2'' DT A 10 -12.189 -8.185 -6.359 1.00 0.58 H new ATOM 0 H1' DT A 10 -14.441 -7.689 -6.689 1.00 0.86 H new ATOM 0 H3 DT A 10 -16.381 -11.031 -8.774 1.00 3.88 H new ATOM 0 H71 DT A 10 -13.025 -8.796 -12.340 1.00 3.93 H new ATOM 0 H72 DT A 10 -12.503 -10.445 -11.920 1.00 3.93 H new ATOM 0 H73 DT A 10 -14.070 -10.185 -12.721 1.00 3.93 H new ATOM 0 H6 DT A 10 -12.886 -8.007 -10.041 1.00 0.88 H new ATOM 325 P DT A 11 -11.858 -6.059 -4.318 1.00 0.91 P ATOM 326 OP1 DT A 11 -10.540 -6.650 -4.670 1.00 0.39 O ATOM 327 OP2 DT A 11 -12.735 -6.830 -3.400 1.00 0.10 O ATOM 328 O5' DT A 11 -11.630 -4.604 -3.718 1.00 0.92 O ATOM 329 C5' DT A 11 -11.411 -3.486 -4.568 1.00 0.75 C ATOM 330 C4' DT A 11 -10.142 -2.784 -4.199 1.00 0.67 C ATOM 331 O4' DT A 11 -9.425 -2.455 -5.408 1.00 0.62 O ATOM 332 C3' DT A 11 -10.328 -1.474 -3.437 1.00 0.63 C ATOM 333 O3' DT A 11 -9.436 -1.433 -2.320 1.00 0.66 O ATOM 334 C2' DT A 11 -9.955 -0.403 -4.453 1.00 0.59 C ATOM 335 C1' DT A 11 -8.960 -1.132 -5.327 1.00 0.57 C ATOM 336 N1 DT A 11 -8.830 -0.580 -6.675 1.00 0.56 N ATOM 337 C2 DT A 11 -7.582 -0.149 -7.076 1.00 0.55 C ATOM 338 O2 DT A 11 -6.600 -0.192 -6.352 1.00 0.55 O ATOM 339 N3 DT A 11 -7.529 0.353 -8.356 1.00 0.61 N ATOM 340 C4 DT A 11 -8.588 0.475 -9.247 1.00 0.68 C ATOM 341 O4 DT A 11 -8.399 0.952 -10.363 1.00 0.78 O ATOM 342 C5 DT A 11 -9.871 0.005 -8.746 1.00 0.68 C ATOM 343 C7 DT A 11 -11.084 0.094 -9.606 1.00 0.78 C ATOM 344 C6 DT A 11 -9.930 -0.495 -7.511 1.00 0.61 C ATOM 0 H5' DT A 11 -12.250 -2.795 -4.492 1.00 0.75 H new ATOM 0 H5'' DT A 11 -11.362 -3.816 -5.606 1.00 0.75 H new ATOM 0 H4' DT A 11 -9.612 -3.475 -3.544 1.00 0.67 H new ATOM 0 H3' DT A 11 -11.337 -1.346 -3.045 1.00 0.63 H new ATOM 0 H2' DT A 11 -10.820 -0.059 -5.019 1.00 0.59 H new ATOM 0 H2'' DT A 11 -9.515 0.474 -3.978 1.00 0.59 H new ATOM 0 H1' DT A 11 -7.968 -1.041 -4.885 1.00 0.57 H new ATOM 0 H3 DT A 11 -6.617 0.669 -8.685 1.00 0.61 H new ATOM 0 H71 DT A 11 -11.769 -0.715 -9.353 1.00 0.78 H new ATOM 0 H72 DT A 11 -11.577 1.052 -9.442 1.00 0.78 H new ATOM 0 H73 DT A 11 -10.794 0.010 -10.653 1.00 0.78 H new ATOM 0 H6 DT A 11 -10.882 -0.851 -7.146 1.00 0.61 H new ATOM 357 P DG A 12 -9.842 -0.622 -1.002 1.00 0.61 P ATOM 358 OP1 DG A 12 -9.012 -1.098 0.133 1.00 0.73 O ATOM 359 OP2 DG A 12 -11.318 -0.677 -0.840 1.00 0.78 O ATOM 360 O5' DG A 12 -9.414 0.873 -1.362 1.00 0.60 O ATOM 361 C5' DG A 12 -9.796 1.953 -0.521 1.00 0.62 C ATOM 362 C4' DG A 12 -9.072 3.237 -0.880 1.00 0.61 C ATOM 363 O4' DG A 12 -7.682 3.134 -0.492 1.00 0.53 O ATOM 364 C3' DG A 12 -9.081 3.617 -2.349 1.00 0.65 C ATOM 365 O3' DG A 12 -9.307 5.019 -2.504 1.00 0.77 O ATOM 366 C2' DG A 12 -7.713 3.222 -2.839 1.00 0.54 C ATOM 367 C1' DG A 12 -6.851 3.436 -1.595 1.00 0.49 C ATOM 368 N9 DG A 12 -5.657 2.584 -1.528 1.00 0.44 N ATOM 369 C8 DG A 12 -5.598 1.223 -1.314 1.00 0.42 C ATOM 370 N7 DG A 12 -4.372 0.754 -1.321 1.00 0.41 N ATOM 371 C5 DG A 12 -3.582 1.879 -1.548 1.00 0.40 C ATOM 372 C6 DG A 12 -2.163 2.016 -1.658 1.00 0.40 C ATOM 373 O6 DG A 12 -1.305 1.133 -1.582 1.00 0.42 O ATOM 374 N1 DG A 12 -1.782 3.348 -1.885 1.00 0.42 N ATOM 375 C2 DG A 12 -2.665 4.409 -1.994 1.00 0.48 C ATOM 376 N2 DG A 12 -2.147 5.632 -2.197 1.00 0.54 N ATOM 377 N3 DG A 12 -3.982 4.285 -1.897 1.00 0.49 N ATOM 378 C4 DG A 12 -4.368 3.009 -1.675 1.00 0.43 C ATOM 0 H5' DG A 12 -9.585 1.696 0.517 1.00 0.62 H new ATOM 0 H5'' DG A 12 -10.872 2.110 -0.598 1.00 0.62 H new ATOM 0 H4' DG A 12 -9.625 4.009 -0.344 1.00 0.61 H new ATOM 0 H3' DG A 12 -9.875 3.125 -2.910 1.00 0.65 H new ATOM 0 H2' DG A 12 -7.686 2.187 -3.180 1.00 0.54 H new ATOM 0 H2'' DG A 12 -7.385 3.842 -3.674 1.00 0.54 H new ATOM 0 H1' DG A 12 -6.479 4.461 -1.608 1.00 0.49 H new ATOM 0 H8 DG A 12 -6.471 0.606 -1.157 1.00 0.42 H new ATOM 0 H1 DG A 12 -0.786 3.548 -1.976 1.00 0.42 H new ATOM 0 H21 DG A 12 -2.764 6.439 -2.283 1.00 0.54 H new ATOM 0 H22 DG A 12 -1.136 5.753 -2.265 1.00 0.54 H new ATOM 390 P DG A 13 -9.835 5.585 -3.908 1.00 0.89 P ATOM 391 OP1 DG A 13 -10.852 6.639 -3.653 1.00 0.17 O ATOM 392 OP2 DG A 13 -10.230 4.447 -4.775 1.00 0.99 O ATOM 393 O5' DG A 13 -8.526 6.262 -4.509 1.00 0.73 O ATOM 394 C5' DG A 13 -7.905 7.368 -3.866 1.00 0.70 C ATOM 395 C4' DG A 13 -6.685 7.814 -4.635 1.00 0.56 C ATOM 396 O4' DG A 13 -5.576 6.954 -4.310 1.00 0.52 O ATOM 397 C3' DG A 13 -6.829 7.755 -6.165 1.00 0.49 C ATOM 398 O3' DG A 13 -6.734 9.074 -6.709 1.00 0.56 O ATOM 399 C2' DG A 13 -5.664 6.880 -6.635 1.00 0.45 C ATOM 400 C1' DG A 13 -4.735 6.848 -5.432 1.00 0.47 C ATOM 401 N9 DG A 13 -3.992 5.596 -5.335 1.00 0.44 N ATOM 402 C8 DG A 13 -4.532 4.344 -5.207 1.00 0.43 C ATOM 403 N7 DG A 13 -3.629 3.399 -5.163 1.00 0.42 N ATOM 404 C5 DG A 13 -2.420 4.075 -5.268 1.00 0.41 C ATOM 405 C6 DG A 13 -1.082 3.581 -5.281 1.00 0.41 C ATOM 406 O6 DG A 13 -0.706 2.410 -5.197 1.00 0.42 O ATOM 407 N1 DG A 13 -0.146 4.615 -5.406 1.00 0.42 N ATOM 408 C2 DG A 13 -0.472 5.959 -5.505 1.00 0.43 C ATOM 409 N2 DG A 13 0.544 6.820 -5.616 1.00 0.47 N ATOM 410 N3 DG A 13 -1.717 6.424 -5.493 1.00 0.43 N ATOM 411 C4 DG A 13 -2.633 5.437 -5.373 1.00 0.42 C ATOM 0 H5' DG A 13 -7.621 7.092 -2.851 1.00 0.70 H new ATOM 0 H5'' DG A 13 -8.613 8.193 -3.786 1.00 0.70 H new ATOM 0 H4' DG A 13 -6.538 8.854 -4.345 1.00 0.56 H new ATOM 0 H3' DG A 13 -7.789 7.349 -6.485 1.00 0.49 H new ATOM 0 H2' DG A 13 -5.999 5.880 -6.910 1.00 0.45 H new ATOM 0 H2'' DG A 13 -5.172 7.303 -7.511 1.00 0.45 H new ATOM 0 H1' DG A 13 -3.999 7.649 -5.509 1.00 0.47 H new ATOM 0 H8 DG A 13 -5.594 4.156 -5.148 1.00 0.43 H new ATOM 0 H1 DG A 13 0.842 4.362 -5.426 1.00 0.42 H new ATOM 0 H21 DG A 13 0.359 7.820 -5.692 1.00 0.47 H new ATOM 0 H22 DG A 13 1.505 6.477 -5.625 1.00 0.47 H new ATOM 423 P DG A 14 -6.913 9.301 -8.286 1.00 0.62 P ATOM 424 OP1 DG A 14 -7.566 10.615 -8.514 1.00 0.78 O ATOM 425 OP2 DG A 14 -7.554 8.101 -8.881 1.00 0.71 O ATOM 426 O5' DG A 14 -5.400 9.384 -8.778 1.00 0.55 O ATOM 427 C5' DG A 14 -4.493 10.304 -8.182 1.00 0.65 C ATOM 428 C4' DG A 14 -3.066 10.009 -8.581 1.00 0.60 C ATOM 429 O4' DG A 14 -2.704 8.661 -8.181 1.00 0.53 O ATOM 430 C3' DG A 14 -2.799 10.083 -10.095 1.00 0.59 C ATOM 431 O3' DG A 14 -1.695 10.960 -10.351 1.00 0.70 O ATOM 432 C2' DG A 14 -2.397 8.625 -10.469 1.00 0.56 C ATOM 433 C1' DG A 14 -1.844 8.127 -9.156 1.00 0.50 C ATOM 434 N9 DG A 14 -1.786 6.664 -8.996 1.00 0.45 N ATOM 435 C8 DG A 14 -2.835 5.775 -8.893 1.00 0.43 C ATOM 436 N7 DG A 14 -2.442 4.533 -8.762 1.00 0.42 N ATOM 437 C5 DG A 14 -1.057 4.605 -8.776 1.00 0.43 C ATOM 438 C6 DG A 14 -0.076 3.573 -8.668 1.00 0.45 C ATOM 439 O6 DG A 14 -0.261 2.362 -8.544 1.00 0.48 O ATOM 440 N1 DG A 14 1.226 4.081 -8.724 1.00 0.47 N ATOM 441 C2 DG A 14 1.540 5.421 -8.868 1.00 0.49 C ATOM 442 N2 DG A 14 2.842 5.741 -8.890 1.00 0.52 N ATOM 443 N3 DG A 14 0.631 6.387 -8.975 1.00 0.49 N ATOM 444 C4 DG A 14 -0.638 5.913 -8.921 1.00 0.45 C ATOM 0 H5' DG A 14 -4.586 10.258 -7.097 1.00 0.65 H new ATOM 0 H5'' DG A 14 -4.753 11.319 -8.481 1.00 0.65 H new ATOM 0 H4' DG A 14 -2.479 10.780 -8.081 1.00 0.60 H new ATOM 0 H3' DG A 14 -3.654 10.455 -10.660 1.00 0.59 H new ATOM 0 H2' DG A 14 -3.250 8.036 -10.806 1.00 0.56 H new ATOM 0 H2'' DG A 14 -1.654 8.595 -11.266 1.00 0.56 H new ATOM 0 H1' DG A 14 -0.803 8.441 -9.081 1.00 0.50 H new ATOM 0 H8 DG A 14 -3.873 6.072 -8.918 1.00 0.43 H new ATOM 0 H1 DG A 14 1.998 3.418 -8.654 1.00 0.47 H new ATOM 0 H21 DG A 14 3.126 6.715 -8.994 1.00 0.52 H new ATOM 0 H22 DG A 14 3.548 5.010 -8.803 1.00 0.52 H new ATOM 456 P DT A 15 -1.940 12.534 -10.540 1.00 0.83 P ATOM 457 OP1 DT A 15 -3.401 12.808 -10.533 1.00 0.22 O ATOM 458 OP2 DT A 15 -1.162 13.000 -11.716 1.00 0.15 O ATOM 459 O5' DT A 15 -1.299 13.145 -9.216 1.00 0.82 O ATOM 460 C5' DT A 15 0.061 12.906 -8.864 1.00 0.82 C ATOM 461 C4' DT A 15 0.407 13.605 -7.570 1.00 0.86 C ATOM 462 O4' DT A 15 0.502 15.021 -7.822 1.00 0.86 O ATOM 463 C3' DT A 15 -0.634 13.428 -6.456 1.00 0.99 C ATOM 464 O3' DT A 15 -0.018 12.843 -5.301 1.00 0.30 O ATOM 465 C2' DT A 15 -1.137 14.842 -6.143 1.00 0.06 C ATOM 466 C1' DT A 15 -0.109 15.755 -6.780 1.00 0.93 C ATOM 467 N1 DT A 15 -0.649 17.010 -7.354 1.00 0.85 N ATOM 468 C2 DT A 15 -0.227 18.218 -6.807 1.00 0.21 C ATOM 469 O2 DT A 15 0.557 18.289 -5.874 1.00 0.66 O ATOM 470 N3 DT A 15 -0.768 19.344 -7.397 1.00 0.32 N ATOM 471 C4 DT A 15 -1.669 19.382 -8.452 1.00 0.06 C ATOM 472 O4 DT A 15 -2.064 20.464 -8.879 1.00 0.29 O ATOM 473 C5 DT A 15 -2.071 18.087 -8.975 1.00 0.99 C ATOM 474 C7 DT A 15 -3.059 18.037 -10.102 1.00 0.44 C ATOM 475 C6 DT A 15 -1.550 16.974 -8.416 1.00 0.96 C ATOM 0 H5' DT A 15 0.716 13.259 -9.661 1.00 0.82 H new ATOM 0 H5'' DT A 15 0.233 11.834 -8.762 1.00 0.82 H new ATOM 0 H4' DT A 15 1.341 13.156 -7.231 1.00 0.86 H new ATOM 0 H3' DT A 15 -1.450 12.769 -6.753 1.00 0.99 H new ATOM 0 H2' DT A 15 -2.131 15.012 -6.558 1.00 0.06 H new ATOM 0 H2'' DT A 15 -1.207 15.010 -5.068 1.00 0.06 H new ATOM 0 H1' DT A 15 0.576 16.063 -5.990 1.00 0.93 H new ATOM 0 H3 DT A 15 -0.474 20.244 -7.017 1.00 0.32 H new ATOM 0 H71 DT A 15 -3.726 18.897 -10.039 1.00 0.44 H new ATOM 0 H72 DT A 15 -2.527 18.059 -11.053 1.00 0.44 H new ATOM 0 H73 DT A 15 -3.643 17.119 -10.034 1.00 0.44 H new ATOM 0 H6 DT A 15 -1.845 16.013 -8.810 1.00 0.96 H new ATOM 488 P DG A 16 -0.847 11.788 -4.420 1.00 0.50 P ATOM 489 OP1 DG A 16 -1.075 10.561 -5.226 1.00 0.97 O ATOM 490 OP2 DG A 16 -2.036 12.471 -3.856 1.00 0.09 O ATOM 491 O5' DG A 16 0.163 11.435 -3.237 1.00 0.06 O ATOM 492 C5' DG A 16 0.919 12.433 -2.551 1.00 0.76 C ATOM 493 C4' DG A 16 2.339 11.961 -2.313 1.00 0.69 C ATOM 494 O4' DG A 16 2.314 10.651 -1.673 1.00 0.65 O ATOM 495 C3' DG A 16 3.173 11.776 -3.586 1.00 0.69 C ATOM 496 O3' DG A 16 4.559 12.025 -3.326 1.00 0.79 O ATOM 497 C2' DG A 16 2.959 10.304 -3.898 1.00 0.60 C ATOM 498 C1' DG A 16 2.953 9.693 -2.507 1.00 0.59 C ATOM 499 N9 DG A 16 2.212 8.425 -2.417 1.00 0.53 N ATOM 500 C8 DG A 16 0.847 8.267 -2.401 1.00 0.51 C ATOM 501 N7 DG A 16 0.473 7.017 -2.317 1.00 0.50 N ATOM 502 C5 DG A 16 1.659 6.305 -2.276 1.00 0.48 C ATOM 503 C6 DG A 16 1.886 4.900 -2.184 1.00 0.46 C ATOM 504 O6 DG A 16 1.047 3.998 -2.117 1.00 0.48 O ATOM 505 N1 DG A 16 3.249 4.593 -2.168 1.00 0.46 N ATOM 506 C2 DG A 16 4.265 5.526 -2.236 1.00 0.51 C ATOM 507 N2 DG A 16 5.516 5.049 -2.199 1.00 0.57 N ATOM 508 N3 DG A 16 4.064 6.842 -2.324 1.00 0.55 N ATOM 509 C4 DG A 16 2.746 7.160 -2.337 1.00 0.50 C ATOM 0 H5' DG A 16 0.443 12.665 -1.598 1.00 0.76 H new ATOM 0 H5'' DG A 16 0.930 13.353 -3.135 1.00 0.76 H new ATOM 0 H4' DG A 16 2.793 12.744 -1.706 1.00 0.69 H new ATOM 0 H3' DG A 16 2.890 12.451 -4.394 1.00 0.69 H new ATOM 0 H2' DG A 16 2.022 10.129 -4.426 1.00 0.60 H new ATOM 0 H2'' DG A 16 3.756 9.897 -4.521 1.00 0.60 H new ATOM 0 H1' DG A 16 3.978 9.462 -2.218 1.00 0.59 H new ATOM 0 H8 DG A 16 0.153 9.093 -2.453 1.00 0.51 H new ATOM 0 H1 DG A 16 3.512 3.610 -2.101 1.00 0.46 H new ATOM 0 H21 DG A 16 6.308 5.690 -2.246 1.00 0.57 H new ATOM 0 H22 DG A 16 5.677 4.045 -2.124 1.00 0.57 H new ATOM 521 P DG A 17 5.582 12.149 -4.560 1.00 0.89 P ATOM 522 OP1 DG A 17 6.691 13.057 -4.174 1.00 0.14 O ATOM 523 OP2 DG A 17 4.814 12.490 -5.784 1.00 0.10 O ATOM 524 O5' DG A 17 6.153 10.659 -4.706 1.00 0.65 O ATOM 525 C5' DG A 17 7.328 10.242 -4.014 1.00 0.62 C ATOM 526 C4' DG A 17 7.809 8.884 -4.491 1.00 0.50 C ATOM 527 O4' DG A 17 6.762 7.898 -4.315 1.00 0.49 O ATOM 528 C3' DG A 17 8.210 8.801 -5.982 1.00 0.51 C ATOM 529 O3' DG A 17 9.561 8.333 -6.094 1.00 0.64 O ATOM 530 C2' DG A 17 7.232 7.782 -6.575 1.00 0.44 C ATOM 531 C1' DG A 17 6.849 6.963 -5.363 1.00 0.44 C ATOM 532 N9 DG A 17 5.567 6.239 -5.464 1.00 0.43 N ATOM 533 C8 DG A 17 4.310 6.774 -5.615 1.00 0.45 C ATOM 534 N7 DG A 17 3.369 5.874 -5.646 1.00 0.46 N ATOM 535 C5 DG A 17 4.033 4.671 -5.516 1.00 0.44 C ATOM 536 C6 DG A 17 3.524 3.342 -5.484 1.00 0.47 C ATOM 537 O6 DG A 17 2.343 2.979 -5.553 1.00 0.51 O ATOM 538 N1 DG A 17 4.549 2.395 -5.344 1.00 0.46 N ATOM 539 C2 DG A 17 5.896 2.708 -5.248 1.00 0.45 C ATOM 540 N2 DG A 17 6.755 1.683 -5.139 1.00 0.47 N ATOM 541 N3 DG A 17 6.374 3.950 -5.270 1.00 0.44 N ATOM 542 C4 DG A 17 5.396 4.876 -5.407 1.00 0.43 C ATOM 0 H5' DG A 17 7.125 10.201 -2.944 1.00 0.62 H new ATOM 0 H5'' DG A 17 8.117 10.979 -4.160 1.00 0.62 H new ATOM 0 H4' DG A 17 8.699 8.701 -3.888 1.00 0.50 H new ATOM 0 H3' DG A 17 8.165 9.762 -6.494 1.00 0.51 H new ATOM 0 H2' DG A 17 6.367 8.265 -7.030 1.00 0.44 H new ATOM 0 H2'' DG A 17 7.699 7.171 -7.348 1.00 0.44 H new ATOM 0 H1' DG A 17 7.592 6.178 -5.226 1.00 0.44 H new ATOM 0 H8 DG A 17 4.122 7.834 -5.699 1.00 0.45 H new ATOM 0 H1 DG A 17 4.286 1.410 -5.311 1.00 0.46 H new ATOM 0 H21 DG A 17 7.756 1.862 -5.066 1.00 0.47 H new ATOM 0 H22 DG A 17 6.407 0.724 -5.130 1.00 0.47 H new ATOM 554 P DG A 18 10.220 8.112 -7.542 1.00 0.86 P ATOM 555 OP1 DG A 18 11.688 8.316 -7.441 1.00 0.18 O ATOM 556 OP2 DG A 18 9.482 8.930 -8.537 1.00 0.96 O ATOM 557 O5' DG A 18 9.930 6.564 -7.819 1.00 0.78 O ATOM 558 C5' DG A 18 10.617 5.538 -7.104 1.00 0.81 C ATOM 559 C4' DG A 18 10.684 4.243 -7.950 1.00 0.65 C ATOM 560 O4' DG A 18 9.423 3.526 -7.803 1.00 0.67 O ATOM 561 C3' DG A 18 10.847 4.477 -9.441 1.00 0.56 C ATOM 562 O3' DG A 18 11.608 3.419 -10.032 1.00 0.55 O ATOM 563 C2' DG A 18 9.407 4.454 -9.934 1.00 0.48 C ATOM 564 C1' DG A 18 8.838 3.333 -9.074 1.00 0.47 C ATOM 565 N9 DG A 18 7.360 3.273 -8.910 1.00 0.44 N ATOM 566 C8 DG A 18 6.440 4.312 -8.844 1.00 0.45 C ATOM 567 N7 DG A 18 5.212 3.898 -8.711 1.00 0.45 N ATOM 568 C5 DG A 18 5.305 2.524 -8.679 1.00 0.43 C ATOM 569 C6 DG A 18 4.282 1.542 -8.550 1.00 0.44 C ATOM 570 O6 DG A 18 3.065 1.726 -8.448 1.00 0.46 O ATOM 571 N1 DG A 18 4.803 0.244 -8.555 1.00 0.44 N ATOM 572 C2 DG A 18 6.147 -0.062 -8.674 1.00 0.45 C ATOM 573 N2 DG A 18 6.476 -1.362 -8.641 1.00 0.48 N ATOM 574 N3 DG A 18 7.109 0.852 -8.802 1.00 0.45 N ATOM 575 C4 DG A 18 6.621 2.117 -8.797 1.00 0.43 C ATOM 0 H5' DG A 18 10.107 5.338 -6.162 1.00 0.81 H new ATOM 0 H5'' DG A 18 11.625 5.871 -6.856 1.00 0.81 H new ATOM 0 H4' DG A 18 11.556 3.700 -7.585 1.00 0.65 H new ATOM 0 H3' DG A 18 11.375 5.397 -9.690 1.00 0.56 H new ATOM 0 H2' DG A 18 8.897 5.403 -9.769 1.00 0.48 H new ATOM 0 H2'' DG A 18 9.337 4.236 -11.000 1.00 0.48 H new ATOM 0 H1' DG A 18 9.070 2.394 -9.577 1.00 0.47 H new ATOM 0 H8 DG A 18 6.715 5.355 -8.897 1.00 0.45 H new ATOM 0 H1 DG A 18 4.146 -0.531 -8.465 1.00 0.44 H new ATOM 0 H21 DG A 18 7.453 -1.643 -8.725 1.00 0.48 H new ATOM 0 H22 DG A 18 5.749 -2.069 -8.532 1.00 0.48 H new ATOM 587 P DG A 19 12.091 3.546 -11.556 1.00 0.68 P ATOM 588 OP1 DG A 19 13.305 2.713 -11.750 1.00 0.83 O ATOM 589 OP2 DG A 19 12.181 4.983 -11.915 1.00 0.86 O ATOM 590 O5' DG A 19 10.880 2.884 -12.356 1.00 0.68 O ATOM 591 C5' DG A 19 10.476 1.543 -12.096 1.00 0.61 C ATOM 592 C4' DG A 19 9.077 1.268 -12.602 1.00 0.66 C ATOM 593 O4' DG A 19 8.180 2.357 -12.231 1.00 0.65 O ATOM 594 C3' DG A 19 8.960 1.129 -14.111 1.00 0.86 C ATOM 595 O3' DG A 19 7.963 0.155 -14.441 1.00 0.00 O ATOM 596 C2' DG A 19 8.504 2.530 -14.534 1.00 0.88 C ATOM 597 C1' DG A 19 7.531 2.849 -13.388 1.00 0.72 C ATOM 598 N9 DG A 19 7.166 4.274 -13.149 1.00 0.70 N ATOM 599 C8 DG A 19 7.925 5.430 -13.316 1.00 0.75 C ATOM 600 N7 DG A 19 7.284 6.515 -12.973 1.00 0.80 N ATOM 601 C5 DG A 19 6.038 6.073 -12.560 1.00 0.75 C ATOM 602 C6 DG A 19 4.909 6.804 -12.070 1.00 0.81 C ATOM 603 O6 DG A 19 4.798 8.025 -11.903 1.00 0.92 O ATOM 604 N1 DG A 19 3.838 5.961 -11.761 1.00 0.76 N ATOM 605 C2 DG A 19 3.848 4.592 -11.910 1.00 0.73 C ATOM 606 N2 DG A 19 2.723 3.956 -11.561 1.00 0.78 N ATOM 607 N3 DG A 19 4.891 3.899 -12.364 1.00 0.70 N ATOM 608 C4 DG A 19 5.947 4.696 -12.668 1.00 0.69 C ATOM 0 H5' DG A 19 10.518 1.352 -11.024 1.00 0.61 H new ATOM 0 H5'' DG A 19 11.176 0.855 -12.570 1.00 0.61 H new ATOM 0 H4' DG A 19 8.812 0.316 -12.142 1.00 0.66 H new ATOM 0 H3' DG A 19 9.879 0.803 -14.599 1.00 0.86 H new ATOM 0 H2' DG A 19 9.330 3.239 -14.589 1.00 0.88 H new ATOM 0 H2'' DG A 19 8.016 2.533 -15.509 1.00 0.88 H new ATOM 0 H1' DG A 19 6.575 2.396 -13.650 1.00 0.72 H new ATOM 0 H8 DG A 19 8.938 5.429 -13.690 1.00 0.75 H new ATOM 0 H1 DG A 19 2.987 6.391 -11.399 1.00 0.76 H new ATOM 0 H21 DG A 19 2.663 2.941 -11.647 1.00 0.78 H new ATOM 0 H22 DG A 19 1.926 4.486 -11.209 1.00 0.78 H new ATOM 620 P DA A 20 8.071 -0.650 -15.824 1.00 0.32 P ATOM 621 OP1 DA A 20 8.249 -2.095 -15.530 1.00 0.59 O ATOM 622 OP2 DA A 20 9.088 0.006 -16.684 1.00 0.51 O ATOM 623 O5' DA A 20 6.632 -0.424 -16.466 1.00 0.27 O ATOM 624 C5' DA A 20 5.569 -1.344 -16.244 1.00 0.25 C ATOM 625 C4' DA A 20 4.241 -0.749 -16.647 1.00 0.13 C ATOM 626 O4' DA A 20 4.061 0.533 -15.989 1.00 0.03 O ATOM 627 C3' DA A 20 4.088 -0.474 -18.158 1.00 0.20 C ATOM 628 O3' DA A 20 2.873 -1.063 -18.631 1.00 0.21 O ATOM 629 C2' DA A 20 3.994 1.070 -18.240 1.00 0.13 C ATOM 630 C1' DA A 20 3.394 1.398 -16.869 1.00 0.94 C ATOM 631 N9 DA A 20 3.559 2.789 -16.377 1.00 0.88 N ATOM 632 C8 DA A 20 4.658 3.629 -16.464 1.00 0.97 C ATOM 633 N7 DA A 20 4.467 4.807 -15.922 1.00 0.99 N ATOM 634 C5 DA A 20 3.168 4.754 -15.441 1.00 0.90 C ATOM 635 C6 DA A 20 2.366 5.697 -14.754 1.00 0.94 C ATOM 636 N6 DA A 20 2.771 6.933 -14.450 1.00 0.08 N ATOM 637 N1 DA A 20 1.105 5.326 -14.406 1.00 0.88 N ATOM 638 C2 DA A 20 0.688 4.090 -14.736 1.00 0.81 C ATOM 639 N3 DA A 20 1.347 3.118 -15.383 1.00 0.80 N ATOM 640 C4 DA A 20 2.596 3.516 -15.711 1.00 0.83 C ATOM 0 H5' DA A 20 5.541 -1.624 -15.191 1.00 0.25 H new ATOM 0 H5'' DA A 20 5.749 -2.257 -16.812 1.00 0.25 H new ATOM 0 H4' DA A 20 3.504 -1.498 -16.356 1.00 0.13 H new ATOM 0 H3' DA A 20 4.902 -0.883 -18.756 1.00 0.20 H new ATOM 0 H2' DA A 20 4.969 1.536 -18.386 1.00 0.13 H new ATOM 0 H2'' DA A 20 3.356 1.402 -19.060 1.00 0.13 H new ATOM 0 H1' DA A 20 2.313 1.281 -16.940 1.00 0.94 H new ATOM 0 H8 DA A 20 5.586 3.340 -16.935 1.00 0.97 H new ATOM 0 H61 DA A 20 2.145 7.567 -13.953 1.00 0.08 H new ATOM 0 H62 DA A 20 3.706 7.243 -14.715 1.00 0.08 H new ATOM 0 H2 DA A 20 -0.321 3.846 -14.437 1.00 0.81 H new ATOM 652 P DA A 21 2.752 -1.521 -20.164 1.00 0.39 P ATOM 653 OP1 DA A 21 3.167 -2.942 -20.277 1.00 0.60 O ATOM 654 OP2 DA A 21 3.456 -0.531 -21.018 1.00 0.66 O ATOM 655 O5' DA A 21 1.180 -1.415 -20.427 1.00 0.22 O ATOM 656 C5' DA A 21 0.268 -2.368 -19.882 1.00 0.09 C ATOM 657 C4' DA A 21 0.123 -2.184 -18.391 1.00 0.95 C ATOM 658 O4' DA A 21 -1.070 -1.406 -18.135 1.00 0.87 O ATOM 659 C3' DA A 21 -0.041 -3.489 -17.581 1.00 0.97 C ATOM 660 O3' DA A 21 0.885 -3.503 -16.487 1.00 0.92 O ATOM 661 C2' DA A 21 -1.488 -3.396 -17.050 1.00 0.92 C ATOM 662 C1' DA A 21 -1.682 -1.883 -16.966 1.00 0.80 C ATOM 663 N9 DA A 21 -3.082 -1.393 -16.935 1.00 0.79 N ATOM 664 C8 DA A 21 -4.252 -2.085 -16.675 1.00 0.87 C ATOM 665 N7 DA A 21 -5.329 -1.337 -16.719 1.00 0.89 N ATOM 666 C5 DA A 21 -4.849 -0.072 -17.022 1.00 0.81 C ATOM 667 C6 DA A 21 -5.492 1.178 -17.209 1.00 0.84 C ATOM 668 N6 DA A 21 -6.813 1.359 -17.112 1.00 0.92 N ATOM 669 N1 DA A 21 -4.713 2.253 -17.505 1.00 0.82 N ATOM 670 C2 DA A 21 -3.383 2.071 -17.602 1.00 0.78 C ATOM 671 N3 DA A 21 -2.670 0.954 -17.448 1.00 0.75 N ATOM 672 C4 DA A 21 -3.469 -0.094 -17.157 1.00 0.76 C ATOM 0 H5' DA A 21 0.620 -3.377 -20.095 1.00 0.09 H new ATOM 0 H5'' DA A 21 -0.705 -2.262 -20.362 1.00 0.09 H new ATOM 0 H4' DA A 21 1.050 -1.707 -18.073 1.00 0.95 H new ATOM 0 H3' DA A 21 0.145 -4.389 -18.167 1.00 0.97 H new ATOM 0 H2' DA A 21 -2.204 -3.865 -17.725 1.00 0.92 H new ATOM 0 H2'' DA A 21 -1.601 -3.879 -16.079 1.00 0.92 H new ATOM 0 H1' DA A 21 -1.267 -1.534 -16.020 1.00 0.80 H new ATOM 0 H8 DA A 21 -4.276 -3.142 -16.456 1.00 0.87 H new ATOM 0 H61 DA A 21 -7.213 2.286 -17.258 1.00 0.92 H new ATOM 0 H62 DA A 21 -7.421 0.570 -16.892 1.00 0.92 H new ATOM 0 H2 DA A 21 -2.811 2.956 -17.838 1.00 0.78 H new ATOM 684 P DT A 22 2.105 -4.552 -16.468 1.00 0.05 P ATOM 685 OP1 DT A 22 3.360 -3.832 -16.134 1.00 0.05 O ATOM 686 OP2 DT A 22 2.091 -5.340 -17.726 1.00 0.44 O ATOM 687 O5' DT A 22 1.729 -5.520 -15.250 1.00 0.98 O ATOM 688 C5' DT A 22 1.086 -5.049 -14.063 1.00 0.88 C ATOM 689 C4' DT A 22 1.881 -3.946 -13.396 1.00 0.76 C ATOM 690 O4' DT A 22 1.403 -2.665 -13.832 1.00 0.73 O ATOM 691 C3' DT A 22 1.737 -3.884 -11.884 1.00 0.81 C ATOM 692 O3' DT A 22 2.687 -4.747 -11.255 1.00 0.90 O ATOM 693 C2' DT A 22 2.045 -2.402 -11.559 1.00 0.80 C ATOM 694 C1' DT A 22 1.831 -1.675 -12.918 1.00 0.72 C ATOM 695 N1 DT A 22 0.810 -0.611 -12.875 1.00 0.70 N ATOM 696 C2 DT A 22 1.228 0.709 -12.966 1.00 0.75 C ATOM 697 O2 DT A 22 2.400 1.031 -13.076 1.00 0.84 O ATOM 698 N3 DT A 22 0.214 1.643 -12.920 1.00 0.78 N ATOM 699 C4 DT A 22 -1.144 1.391 -12.791 1.00 0.74 C ATOM 700 O4 DT A 22 -1.938 2.329 -12.756 1.00 0.79 O ATOM 701 C5 DT A 22 -1.511 -0.012 -12.701 1.00 0.71 C ATOM 702 C7 DT A 22 -2.955 -0.378 -12.577 1.00 0.77 C ATOM 703 C6 DT A 22 -0.532 -0.935 -12.744 1.00 0.70 C ATOM 0 H5' DT A 22 0.957 -5.877 -13.366 1.00 0.88 H new ATOM 0 H5'' DT A 22 0.090 -4.682 -14.310 1.00 0.88 H new ATOM 0 H4' DT A 22 2.913 -4.168 -13.667 1.00 0.76 H new ATOM 0 H3' DT A 22 0.756 -4.204 -11.531 1.00 0.81 H new ATOM 0 H2' DT A 22 1.379 -2.014 -10.788 1.00 0.80 H new ATOM 0 H2'' DT A 22 3.064 -2.276 -11.193 1.00 0.80 H new ATOM 0 HO3' DT A 22 2.789 -4.491 -10.315 1.00 0.90 H new ATOM 0 H1' DT A 22 2.766 -1.188 -13.197 1.00 0.72 H new ATOM 0 H3 DT A 22 0.492 2.622 -12.988 1.00 0.78 H new ATOM 0 H71 DT A 22 -3.124 -1.352 -13.037 1.00 0.77 H new ATOM 0 H72 DT A 22 -3.230 -0.421 -11.523 1.00 0.77 H new ATOM 0 H73 DT A 22 -3.565 0.372 -13.081 1.00 0.77 H new ATOM 0 H6 DT A 22 -0.805 -1.978 -12.673 1.00 0.70 H new TER 717 DT A 22