USER MOD reduce.3.24.130724 H: found=0, std=0, add=261, rem=0, adj=2 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 36:sc= 0.2 USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.89! (180deg=-1.89!) USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.147 (180deg=-0.147) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DT C7 :methyl 150:sc= -0.565 (180deg=-0.565) USER MOD Single : A 17 DT C7 :methyl 150:sc= -1.99 (180deg=-1.99) 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 -6.442 3.816 8.855 1.00 0.10 O ATOM 2 C5' DA A 1 -5.392 3.062 8.245 1.00 0.15 C ATOM 3 C4' DA A 1 -4.071 3.828 8.256 1.00 0.16 C ATOM 4 O4' DA A 1 -4.199 5.072 7.531 1.00 0.23 O ATOM 5 C3' DA A 1 -3.634 4.149 9.683 1.00 0.10 C ATOM 6 O3' DA A 1 -2.420 3.465 10.010 1.00 0.09 O ATOM 7 C2' DA A 1 -3.436 5.640 9.725 1.00 0.17 C ATOM 8 C1' DA A 1 -3.832 6.189 8.369 1.00 0.24 C ATOM 9 N9 DA A 1 -4.954 7.137 8.495 1.00 0.29 N ATOM 10 C8 DA A 1 -6.152 6.983 9.109 1.00 0.39 C ATOM 11 N7 DA A 1 -6.971 7.981 9.077 1.00 0.36 N ATOM 12 C5 DA A 1 -6.236 8.925 8.353 1.00 0.20 C ATOM 13 C6 DA A 1 -6.516 10.235 7.947 1.00 0.15 C ATOM 14 N6 DA A 1 -7.664 10.854 8.221 1.00 0.18 N ATOM 15 N1 DA A 1 -5.567 10.881 7.246 1.00 0.23 N ATOM 16 C2 DA A 1 -4.410 10.280 6.961 1.00 0.25 C ATOM 17 N3 DA A 1 -4.042 9.046 7.296 1.00 0.17 N ATOM 18 C4 DA A 1 -5.008 8.420 7.996 1.00 0.18 C ATOM 0 H5' DA A 1 -5.665 2.822 7.218 1.00 0.15 H new ATOM 0 H5'' DA A 1 -5.269 2.116 8.772 1.00 0.15 H new ATOM 0 H4' DA A 1 -3.325 3.192 7.780 1.00 0.16 H new ATOM 0 H3' DA A 1 -4.378 3.824 10.411 1.00 0.10 H new ATOM 0 H2' DA A 1 -4.044 6.086 10.512 1.00 0.17 H new ATOM 0 H2'' DA A 1 -2.397 5.883 9.949 1.00 0.17 H new ATOM 0 HO5' DA A 1 -6.323 4.767 8.650 1.00 0.10 H new ATOM 0 H1' DA A 1 -2.998 6.734 7.927 1.00 0.24 H new ATOM 0 H8 DA A 1 -6.412 6.060 9.606 1.00 0.39 H new ATOM 0 H61 DA A 1 -7.817 11.810 7.901 1.00 0.18 H new ATOM 0 H62 DA A 1 -8.390 10.371 8.751 1.00 0.18 H new ATOM 0 H2 DA A 1 -3.694 10.859 6.397 1.00 0.25 H new ATOM 31 P DG A 2 -2.332 1.860 9.899 1.00 0.07 P ATOM 32 OP1 DG A 2 -3.694 1.309 10.087 1.00 0.07 O ATOM 33 OP2 DG A 2 -1.223 1.396 10.761 1.00 0.11 O ATOM 34 O5' DG A 2 -1.906 1.636 8.363 1.00 0.13 O ATOM 35 C5' DG A 2 -0.523 1.496 8.005 1.00 0.16 C ATOM 36 C4' DG A 2 0.050 0.150 8.430 1.00 0.13 C ATOM 37 O4' DG A 2 -0.670 -0.930 7.793 1.00 0.12 O ATOM 38 C3' DG A 2 1.524 0.033 8.049 1.00 0.10 C ATOM 39 O3' DG A 2 2.328 -0.216 9.209 1.00 0.11 O ATOM 40 C2' DG A 2 1.602 -1.119 7.087 1.00 0.06 C ATOM 41 C1' DG A 2 0.234 -1.767 7.041 1.00 0.08 C ATOM 42 N9 DG A 2 -0.221 -1.913 5.646 1.00 0.08 N ATOM 43 C8 DG A 2 -0.516 -3.034 4.945 1.00 0.07 C ATOM 44 N7 DG A 2 -0.872 -2.892 3.713 1.00 0.07 N ATOM 45 C5 DG A 2 -0.811 -1.505 3.556 1.00 0.08 C ATOM 46 C6 DG A 2 -1.087 -0.704 2.415 1.00 0.09 C ATOM 47 O6 DG A 2 -1.444 -1.068 1.297 1.00 0.14 O ATOM 48 N1 DG A 2 -0.902 0.646 2.685 1.00 0.10 N ATOM 49 C2 DG A 2 -0.503 1.165 3.902 1.00 0.09 C ATOM 50 N2 DG A 2 -0.391 2.489 3.970 1.00 0.11 N ATOM 51 N3 DG A 2 -0.241 0.419 4.977 1.00 0.08 N ATOM 52 C4 DG A 2 -0.413 -0.899 4.738 1.00 0.08 C ATOM 0 H5' DG A 2 0.053 2.297 8.469 1.00 0.16 H new ATOM 0 H5'' DG A 2 -0.416 1.610 6.926 1.00 0.16 H new ATOM 0 H4' DG A 2 -0.052 0.083 9.513 1.00 0.13 H new ATOM 0 H3' DG A 2 1.900 0.954 7.603 1.00 0.10 H new ATOM 0 H2' DG A 2 1.895 -0.772 6.096 1.00 0.06 H new ATOM 0 H2'' DG A 2 2.356 -1.837 7.409 1.00 0.06 H new ATOM 0 H1' DG A 2 0.269 -2.766 7.475 1.00 0.08 H new ATOM 0 H8 DG A 2 -0.455 -4.011 5.401 1.00 0.07 H new ATOM 0 H1 DG A 2 -1.074 1.305 1.926 1.00 0.10 H new ATOM 0 H21 DG A 2 -0.100 2.932 4.842 1.00 0.11 H new ATOM 0 H22 DG A 2 -0.596 3.061 3.151 1.00 0.11 H new ATOM 64 P DG A 3 3.922 0.027 9.177 1.00 0.10 P ATOM 65 OP1 DG A 3 4.405 0.106 10.574 1.00 0.13 O ATOM 66 OP2 DG A 3 4.203 1.134 8.237 1.00 0.12 O ATOM 67 O5' DG A 3 4.479 -1.339 8.528 1.00 0.20 O ATOM 68 C5' DG A 3 4.167 -2.607 9.122 1.00 0.13 C ATOM 69 C4' DG A 3 4.208 -3.744 8.109 1.00 0.11 C ATOM 70 O4' DG A 3 3.429 -3.404 6.938 1.00 0.14 O ATOM 71 C3' DG A 3 5.637 -4.036 7.653 1.00 0.10 C ATOM 72 O3' DG A 3 5.942 -5.426 7.814 1.00 0.09 O ATOM 73 C2' DG A 3 5.672 -3.658 6.203 1.00 0.09 C ATOM 74 C1' DG A 3 4.233 -3.567 5.754 1.00 0.09 C ATOM 75 N9 DG A 3 4.041 -2.451 4.810 1.00 0.08 N ATOM 76 C8 DG A 3 4.155 -1.114 5.003 1.00 0.12 C ATOM 77 N7 DG A 3 3.926 -0.343 3.992 1.00 0.14 N ATOM 78 C5 DG A 3 3.620 -1.271 2.991 1.00 0.11 C ATOM 79 C6 DG A 3 3.271 -1.066 1.628 1.00 0.14 C ATOM 80 O6 DG A 3 3.162 -0.005 1.021 1.00 0.18 O ATOM 81 N1 DG A 3 3.043 -2.270 0.974 1.00 0.11 N ATOM 82 C2 DG A 3 3.139 -3.518 1.554 1.00 0.05 C ATOM 83 N2 DG A 3 2.891 -4.557 0.760 1.00 0.05 N ATOM 84 N3 DG A 3 3.464 -3.720 2.830 1.00 0.04 N ATOM 85 C4 DG A 3 3.689 -2.563 3.488 1.00 0.06 C ATOM 0 H5' DG A 3 3.176 -2.561 9.573 1.00 0.13 H new ATOM 0 H5'' DG A 3 4.874 -2.813 9.926 1.00 0.13 H new ATOM 0 H4' DG A 3 3.796 -4.624 8.602 1.00 0.11 H new ATOM 0 H3' DG A 3 6.371 -3.482 8.238 1.00 0.10 H new ATOM 0 H2' DG A 3 6.184 -2.706 6.062 1.00 0.09 H new ATOM 0 H2'' DG A 3 6.215 -4.402 5.620 1.00 0.09 H new ATOM 0 H1' DG A 3 3.938 -4.470 5.220 1.00 0.09 H new ATOM 0 H8 DG A 3 4.427 -0.708 5.966 1.00 0.12 H new ATOM 0 H1 DG A 3 2.784 -2.228 -0.012 1.00 0.11 H new ATOM 0 H21 DG A 3 2.946 -5.506 1.130 1.00 0.05 H new ATOM 0 H22 DG A 3 2.646 -4.404 -0.218 1.00 0.05 H new ATOM 97 P DG A 4 5.179 -6.535 6.923 1.00 0.05 P ATOM 98 OP1 DG A 4 3.732 -6.227 6.939 1.00 0.11 O ATOM 99 OP2 DG A 4 5.655 -7.872 7.342 1.00 0.13 O ATOM 100 O5' DG A 4 5.743 -6.241 5.442 1.00 0.09 O ATOM 101 C5' DG A 4 5.130 -6.832 4.283 1.00 0.15 C ATOM 102 C4' DG A 4 5.873 -6.472 3.003 1.00 0.15 C ATOM 103 O4' DG A 4 5.996 -5.036 2.881 1.00 0.12 O ATOM 104 C3' DG A 4 7.285 -7.055 3.019 1.00 0.13 C ATOM 105 O3' DG A 4 7.591 -7.732 1.784 1.00 0.14 O ATOM 106 C2' DG A 4 8.180 -5.876 3.205 1.00 0.11 C ATOM 107 C1' DG A 4 7.384 -4.696 2.714 1.00 0.12 C ATOM 108 N9 DG A 4 7.721 -3.438 3.400 1.00 0.11 N ATOM 109 C8 DG A 4 8.288 -3.199 4.605 1.00 0.13 C ATOM 110 N7 DG A 4 8.457 -1.959 4.950 1.00 0.13 N ATOM 111 C5 DG A 4 7.941 -1.287 3.835 1.00 0.11 C ATOM 112 C6 DG A 4 7.825 0.109 3.561 1.00 0.11 C ATOM 113 O6 DG A 4 8.164 1.069 4.252 1.00 0.11 O ATOM 114 N1 DG A 4 7.247 0.327 2.321 1.00 0.11 N ATOM 115 C2 DG A 4 6.835 -0.652 1.451 1.00 0.10 C ATOM 116 N2 DG A 4 6.319 -0.241 0.306 1.00 0.16 N ATOM 117 N3 DG A 4 6.941 -1.949 1.694 1.00 0.12 N ATOM 118 C4 DG A 4 7.495 -2.196 2.892 1.00 0.11 C ATOM 0 H5' DG A 4 4.095 -6.497 4.209 1.00 0.15 H new ATOM 0 H5'' DG A 4 5.107 -7.916 4.397 1.00 0.15 H new ATOM 0 H4' DG A 4 5.305 -6.881 2.168 1.00 0.15 H new ATOM 0 H3' DG A 4 7.404 -7.799 3.806 1.00 0.13 H new ATOM 0 H2' DG A 4 8.459 -5.755 4.252 1.00 0.11 H new ATOM 0 H2'' DG A 4 9.105 -5.990 2.639 1.00 0.11 H new ATOM 0 H1' DG A 4 7.623 -4.505 1.668 1.00 0.12 H new ATOM 0 H8 DG A 4 8.588 -4.008 5.254 1.00 0.13 H new ATOM 0 H1 DG A 4 7.117 1.296 2.030 1.00 0.11 H new ATOM 0 H21 DG A 4 5.995 -0.922 -0.381 1.00 0.16 H new ATOM 0 H22 DG A 4 6.245 0.757 0.109 1.00 0.16 H new ATOM 130 P DT A 5 7.931 -6.911 0.420 1.00 0.14 P ATOM 131 OP1 DT A 5 7.137 -5.664 0.409 1.00 0.20 O ATOM 132 OP2 DT A 5 7.821 -7.855 -0.715 1.00 0.22 O ATOM 133 O5' DT A 5 9.495 -6.525 0.595 1.00 0.12 O ATOM 134 C5' DT A 5 9.998 -5.214 0.269 1.00 0.10 C ATOM 135 C4' DT A 5 10.749 -5.178 -1.070 1.00 0.06 C ATOM 136 O4' DT A 5 11.733 -6.236 -1.156 1.00 0.06 O ATOM 137 C3' DT A 5 9.792 -5.324 -2.246 1.00 0.08 C ATOM 138 O3' DT A 5 9.831 -4.156 -3.075 1.00 0.08 O ATOM 139 C2' DT A 5 10.258 -6.532 -3.014 1.00 0.12 C ATOM 140 C1' DT A 5 11.434 -7.122 -2.260 1.00 0.06 C ATOM 141 N1 DT A 5 11.092 -8.454 -1.746 1.00 0.09 N ATOM 142 C2 DT A 5 11.285 -9.557 -2.555 1.00 0.10 C ATOM 143 O2 DT A 5 11.769 -9.470 -3.682 1.00 0.15 O ATOM 144 N3 DT A 5 10.897 -10.773 -2.012 1.00 0.07 N ATOM 145 C4 DT A 5 10.343 -10.961 -0.753 1.00 0.07 C ATOM 146 O4 DT A 5 10.030 -12.085 -0.364 1.00 0.10 O ATOM 147 C5 DT A 5 10.190 -9.737 0.001 1.00 0.11 C ATOM 148 C7 DT A 5 9.561 -9.749 1.385 1.00 0.18 C ATOM 149 C6 DT A 5 10.563 -8.565 -0.506 1.00 0.11 C ATOM 0 H5' DT A 5 10.665 -4.879 1.063 1.00 0.10 H new ATOM 0 H5'' DT A 5 9.167 -4.510 0.233 1.00 0.10 H new ATOM 0 H4' DT A 5 11.247 -4.210 -1.116 1.00 0.06 H new ATOM 0 H3' DT A 5 8.762 -5.440 -1.908 1.00 0.08 H new ATOM 0 H2' DT A 5 9.454 -7.263 -3.105 1.00 0.12 H new ATOM 0 H2'' DT A 5 10.551 -6.254 -4.026 1.00 0.12 H new ATOM 0 H1' DT A 5 12.295 -7.223 -2.921 1.00 0.06 H new ATOM 0 H3 DT A 5 11.031 -11.603 -2.589 1.00 0.07 H new ATOM 0 H71 DT A 5 9.984 -8.942 1.984 1.00 0.18 H new ATOM 0 H72 DT A 5 8.484 -9.609 1.296 1.00 0.18 H new ATOM 0 H73 DT A 5 9.764 -10.704 1.869 1.00 0.18 H new ATOM 0 H6 DT A 5 10.440 -7.674 0.091 1.00 0.11 H new ATOM 162 P DT A 6 11.222 -3.654 -3.720 1.00 0.08 P ATOM 163 OP1 DT A 6 12.054 -4.842 -4.017 1.00 0.13 O ATOM 164 OP2 DT A 6 11.762 -2.571 -2.867 1.00 0.13 O ATOM 165 O5' DT A 6 10.752 -3.008 -5.117 1.00 0.16 O ATOM 166 C5' DT A 6 9.761 -3.652 -5.922 1.00 0.15 C ATOM 167 C4' DT A 6 8.601 -2.709 -6.225 1.00 0.16 C ATOM 168 O4' DT A 6 8.049 -2.182 -4.998 1.00 0.19 O ATOM 169 C3' DT A 6 9.060 -1.533 -7.081 1.00 0.15 C ATOM 170 O3' DT A 6 8.240 -1.407 -8.250 1.00 0.17 O ATOM 171 C2' DT A 6 8.926 -0.322 -6.203 1.00 0.17 C ATOM 172 C1' DT A 6 8.117 -0.741 -4.991 1.00 0.18 C ATOM 173 N1 DT A 6 8.728 -0.248 -3.737 1.00 0.13 N ATOM 174 C2 DT A 6 9.050 1.095 -3.667 1.00 0.12 C ATOM 175 O2 DT A 6 8.865 1.861 -4.609 1.00 0.19 O ATOM 176 N3 DT A 6 9.595 1.527 -2.472 1.00 0.08 N ATOM 177 C4 DT A 6 9.842 0.744 -1.357 1.00 0.07 C ATOM 178 O4 DT A 6 10.332 1.234 -0.342 1.00 0.10 O ATOM 179 C5 DT A 6 9.475 -0.646 -1.522 1.00 0.11 C ATOM 180 C7 DT A 6 9.695 -1.621 -0.368 1.00 0.18 C ATOM 181 C6 DT A 6 8.942 -1.092 -2.679 1.00 0.13 C ATOM 0 H5' DT A 6 9.389 -4.537 -5.407 1.00 0.15 H new ATOM 0 H5'' DT A 6 10.211 -3.992 -6.855 1.00 0.15 H new ATOM 0 H4' DT A 6 7.848 -3.283 -6.765 1.00 0.16 H new ATOM 0 H3' DT A 6 10.083 -1.664 -7.432 1.00 0.15 H new ATOM 0 H2' DT A 6 9.907 0.047 -5.903 1.00 0.17 H new ATOM 0 H2'' DT A 6 8.430 0.488 -6.737 1.00 0.17 H new ATOM 0 H1' DT A 6 7.118 -0.308 -5.039 1.00 0.18 H new ATOM 0 H3 DT A 6 9.838 2.515 -2.406 1.00 0.08 H new ATOM 0 H71 DT A 6 8.945 -2.411 -0.411 1.00 0.18 H new ATOM 0 H72 DT A 6 10.690 -2.060 -0.447 1.00 0.18 H new ATOM 0 H73 DT A 6 9.608 -1.089 0.579 1.00 0.18 H new ATOM 0 H6 DT A 6 8.679 -2.135 -2.773 1.00 0.13 H new ATOM 194 P DA A 7 8.166 -2.598 -9.332 1.00 0.16 P ATOM 195 OP1 DA A 7 9.527 -3.152 -9.503 1.00 0.40 O ATOM 196 OP2 DA A 7 7.416 -2.106 -10.509 1.00 0.37 O ATOM 197 O5' DA A 7 7.262 -3.702 -8.584 1.00 0.18 O ATOM 198 C5' DA A 7 7.404 -5.089 -8.905 1.00 0.10 C ATOM 199 C4' DA A 7 6.455 -5.963 -8.085 1.00 0.09 C ATOM 200 O4' DA A 7 6.661 -5.753 -6.669 1.00 0.11 O ATOM 201 C3' DA A 7 4.997 -5.649 -8.403 1.00 0.09 C ATOM 202 O3' DA A 7 4.403 -6.691 -9.181 1.00 0.11 O ATOM 203 C2' DA A 7 4.314 -5.524 -7.068 1.00 0.12 C ATOM 204 C1' DA A 7 5.406 -5.468 -6.012 1.00 0.07 C ATOM 205 N9 DA A 7 5.459 -4.146 -5.343 1.00 0.12 N ATOM 206 C8 DA A 7 5.245 -2.896 -5.842 1.00 0.21 C ATOM 207 N7 DA A 7 5.391 -1.902 -5.040 1.00 0.23 N ATOM 208 C5 DA A 7 5.747 -2.544 -3.855 1.00 0.15 C ATOM 209 C6 DA A 7 6.055 -2.059 -2.589 1.00 0.17 C ATOM 210 N6 DA A 7 6.067 -0.763 -2.307 1.00 0.25 N ATOM 211 N1 DA A 7 6.368 -2.953 -1.635 1.00 0.14 N ATOM 212 C2 DA A 7 6.379 -4.259 -1.915 1.00 0.11 C ATOM 213 N3 DA A 7 6.103 -4.831 -3.088 1.00 0.06 N ATOM 214 C4 DA A 7 5.791 -3.907 -4.023 1.00 0.08 C ATOM 0 H5' DA A 7 8.433 -5.400 -8.723 1.00 0.10 H new ATOM 0 H5'' DA A 7 7.209 -5.238 -9.967 1.00 0.10 H new ATOM 0 H4' DA A 7 6.671 -6.998 -8.348 1.00 0.09 H new ATOM 0 H3' DA A 7 4.904 -4.737 -8.993 1.00 0.09 H new ATOM 0 H2' DA A 7 3.698 -4.626 -7.033 1.00 0.12 H new ATOM 0 H2'' DA A 7 3.652 -6.372 -6.893 1.00 0.12 H new ATOM 0 H1' DA A 7 5.199 -6.202 -5.233 1.00 0.07 H new ATOM 0 H8 DA A 7 4.963 -2.746 -6.874 1.00 0.21 H new ATOM 0 H61 DA A 7 6.298 -0.448 -1.365 1.00 0.25 H new ATOM 0 H62 DA A 7 5.845 -0.081 -3.032 1.00 0.25 H new ATOM 0 H2 DA A 7 6.639 -4.923 -1.104 1.00 0.11 H new ATOM 226 P DG A 8 2.819 -6.686 -9.457 1.00 0.07 P ATOM 227 OP1 DG A 8 2.530 -7.666 -10.527 1.00 0.11 O ATOM 228 OP2 DG A 8 2.378 -5.280 -9.604 1.00 0.10 O ATOM 229 O5' DG A 8 2.226 -7.258 -8.074 1.00 0.10 O ATOM 230 C5' DG A 8 2.301 -8.658 -7.790 1.00 0.07 C ATOM 231 C4' DG A 8 1.658 -9.024 -6.462 1.00 0.08 C ATOM 232 O4' DG A 8 2.375 -8.456 -5.345 1.00 0.11 O ATOM 233 C3' DG A 8 0.219 -8.519 -6.375 1.00 0.09 C ATOM 234 O3' DG A 8 -0.714 -9.588 -6.566 1.00 0.10 O ATOM 235 C2' DG A 8 0.095 -7.933 -4.991 1.00 0.13 C ATOM 236 C1' DG A 8 1.427 -8.166 -4.305 1.00 0.12 C ATOM 237 N9 DG A 8 1.837 -7.007 -3.485 1.00 0.12 N ATOM 238 C8 DG A 8 2.235 -6.985 -2.192 1.00 0.18 C ATOM 239 N7 DG A 8 2.510 -5.842 -1.668 1.00 0.19 N ATOM 240 C5 DG A 8 2.271 -4.972 -2.732 1.00 0.15 C ATOM 241 C6 DG A 8 2.394 -3.559 -2.790 1.00 0.16 C ATOM 242 O6 DG A 8 2.734 -2.786 -1.897 1.00 0.19 O ATOM 243 N1 DG A 8 2.062 -3.068 -4.044 1.00 0.18 N ATOM 244 C2 DG A 8 1.658 -3.840 -5.118 1.00 0.18 C ATOM 245 N2 DG A 8 1.384 -3.185 -6.245 1.00 0.25 N ATOM 246 N3 DG A 8 1.538 -5.175 -5.072 1.00 0.13 N ATOM 247 C4 DG A 8 1.859 -5.676 -3.856 1.00 0.11 C ATOM 0 H5' DG A 8 3.346 -8.967 -7.780 1.00 0.07 H new ATOM 0 H5'' DG A 8 1.812 -9.213 -8.591 1.00 0.07 H new ATOM 0 H4' DG A 8 1.683 -10.113 -6.414 1.00 0.08 H new ATOM 0 H3' DG A 8 -0.003 -7.785 -7.150 1.00 0.09 H new ATOM 0 H2' DG A 8 -0.136 -6.869 -5.039 1.00 0.13 H new ATOM 0 H2'' DG A 8 -0.715 -8.410 -4.439 1.00 0.13 H new ATOM 0 H1' DG A 8 1.361 -8.997 -3.603 1.00 0.12 H new ATOM 0 H8 DG A 8 2.319 -7.896 -1.619 1.00 0.18 H new ATOM 0 H1 DG A 8 2.120 -2.059 -4.185 1.00 0.18 H new ATOM 0 H21 DG A 8 1.081 -3.699 -7.073 1.00 0.25 H new ATOM 0 H22 DG A 8 1.477 -2.170 -6.280 1.00 0.25 H new ATOM 259 P DG A 9 -2.298 -9.301 -6.557 1.00 0.08 P ATOM 260 OP1 DG A 9 -2.843 -9.669 -7.882 1.00 0.10 O ATOM 261 OP2 DG A 9 -2.519 -7.940 -6.020 1.00 0.11 O ATOM 262 O5' DG A 9 -2.842 -10.363 -5.474 1.00 0.09 O ATOM 263 C5' DG A 9 -4.020 -10.085 -4.701 1.00 0.13 C ATOM 264 C4' DG A 9 -3.728 -10.030 -3.207 1.00 0.10 C ATOM 265 O4' DG A 9 -2.762 -8.995 -2.914 1.00 0.08 O ATOM 266 C3' DG A 9 -4.995 -9.732 -2.406 1.00 0.14 C ATOM 267 O3' DG A 9 -5.380 -10.856 -1.601 1.00 0.20 O ATOM 268 C2' DG A 9 -4.656 -8.547 -1.545 1.00 0.13 C ATOM 269 C1' DG A 9 -3.190 -8.246 -1.759 1.00 0.11 C ATOM 270 N9 DG A 9 -2.979 -6.799 -1.945 1.00 0.08 N ATOM 271 C8 DG A 9 -3.170 -6.024 -3.041 1.00 0.13 C ATOM 272 N7 DG A 9 -2.936 -4.760 -2.927 1.00 0.16 N ATOM 273 C5 DG A 9 -2.538 -4.662 -1.590 1.00 0.09 C ATOM 274 C6 DG A 9 -2.145 -3.524 -0.837 1.00 0.10 C ATOM 275 O6 DG A 9 -2.070 -2.353 -1.206 1.00 0.13 O ATOM 276 N1 DG A 9 -1.823 -3.866 0.472 1.00 0.12 N ATOM 277 C2 DG A 9 -1.875 -5.143 0.995 1.00 0.18 C ATOM 278 N2 DG A 9 -1.529 -5.273 2.275 1.00 0.22 N ATOM 279 N3 DG A 9 -2.244 -6.217 0.293 1.00 0.17 N ATOM 280 C4 DG A 9 -2.562 -5.908 -0.984 1.00 0.10 C ATOM 0 H5' DG A 9 -4.769 -10.852 -4.895 1.00 0.13 H new ATOM 0 H5'' DG A 9 -4.447 -9.135 -5.021 1.00 0.13 H new ATOM 0 H4' DG A 9 -3.335 -11.006 -2.924 1.00 0.10 H new ATOM 0 H3' DG A 9 -5.841 -9.527 -3.062 1.00 0.14 H new ATOM 0 H2' DG A 9 -5.269 -7.687 -1.815 1.00 0.13 H new ATOM 0 H2'' DG A 9 -4.855 -8.764 -0.496 1.00 0.13 H new ATOM 0 H1' DG A 9 -2.603 -8.537 -0.888 1.00 0.11 H new ATOM 0 H8 DG A 9 -3.506 -6.449 -3.975 1.00 0.13 H new ATOM 0 H1 DG A 9 -1.525 -3.115 1.094 1.00 0.12 H new ATOM 0 H21 DG A 9 -1.547 -6.192 2.718 1.00 0.22 H new ATOM 0 H22 DG A 9 -1.246 -4.454 2.812 1.00 0.22 H new ATOM 292 P DG A 10 -4.381 -11.469 -0.494 1.00 0.20 P ATOM 293 OP1 DG A 10 -3.023 -11.531 -1.080 1.00 0.21 O ATOM 294 OP2 DG A 10 -5.000 -12.696 0.058 1.00 0.26 O ATOM 295 O5' DG A 10 -4.380 -10.345 0.659 1.00 0.15 O ATOM 296 C5' DG A 10 -5.503 -10.191 1.543 1.00 0.15 C ATOM 297 C4' DG A 10 -5.184 -9.286 2.726 1.00 0.11 C ATOM 298 O4' DG A 10 -4.626 -8.032 2.271 1.00 0.09 O ATOM 299 C3' DG A 10 -6.435 -8.979 3.546 1.00 0.14 C ATOM 300 O3' DG A 10 -6.273 -9.411 4.903 1.00 0.16 O ATOM 301 C2' DG A 10 -6.601 -7.487 3.481 1.00 0.09 C ATOM 302 C1' DG A 10 -5.337 -6.928 2.865 1.00 0.08 C ATOM 303 N9 DG A 10 -5.642 -5.892 1.858 1.00 0.09 N ATOM 304 C8 DG A 10 -6.063 -6.025 0.574 1.00 0.15 C ATOM 305 N7 DG A 10 -6.226 -4.946 -0.117 1.00 0.14 N ATOM 306 C5 DG A 10 -5.873 -3.959 0.810 1.00 0.05 C ATOM 307 C6 DG A 10 -5.842 -2.549 0.667 1.00 0.06 C ATOM 308 O6 DG A 10 -6.117 -1.877 -0.322 1.00 0.09 O ATOM 309 N1 DG A 10 -5.432 -1.925 1.838 1.00 0.13 N ATOM 310 C2 DG A 10 -5.093 -2.571 3.008 1.00 0.18 C ATOM 311 N2 DG A 10 -4.729 -1.791 4.026 1.00 0.19 N ATOM 312 N3 DG A 10 -5.119 -3.901 3.154 1.00 0.14 N ATOM 313 C4 DG A 10 -5.516 -4.531 2.022 1.00 0.08 C ATOM 0 H5' DG A 10 -5.812 -11.170 1.910 1.00 0.15 H new ATOM 0 H5'' DG A 10 -6.346 -9.778 0.989 1.00 0.15 H new ATOM 0 H4' DG A 10 -4.463 -9.818 3.347 1.00 0.11 H new ATOM 0 H3' DG A 10 -7.309 -9.501 3.156 1.00 0.14 H new ATOM 0 H2' DG A 10 -7.472 -7.222 2.882 1.00 0.09 H new ATOM 0 H2'' DG A 10 -6.761 -7.073 4.477 1.00 0.09 H new ATOM 0 H1' DG A 10 -4.727 -6.446 3.629 1.00 0.08 H new ATOM 0 H8 DG A 10 -6.255 -6.998 0.146 1.00 0.15 H new ATOM 0 H1 DG A 10 -5.377 -0.906 1.832 1.00 0.13 H new ATOM 0 H21 DG A 10 -4.466 -2.208 4.919 1.00 0.19 H new ATOM 0 H22 DG A 10 -4.713 -0.778 3.912 1.00 0.19 H new ATOM 325 P DT A 11 -7.498 -9.320 5.947 1.00 0.17 P ATOM 326 OP1 DT A 11 -7.157 -10.141 7.131 1.00 0.25 O ATOM 327 OP2 DT A 11 -8.754 -9.578 5.209 1.00 0.22 O ATOM 328 O5' DT A 11 -7.484 -7.770 6.390 1.00 0.15 O ATOM 329 C5' DT A 11 -8.518 -7.250 7.236 1.00 0.14 C ATOM 330 C4' DT A 11 -8.539 -5.721 7.236 1.00 0.17 C ATOM 331 O4' DT A 11 -7.338 -5.189 7.839 1.00 0.21 O ATOM 332 C3' DT A 11 -8.641 -5.179 5.816 1.00 0.15 C ATOM 333 O3' DT A 11 -9.844 -4.414 5.649 1.00 0.16 O ATOM 334 C2' DT A 11 -7.411 -4.330 5.614 1.00 0.18 C ATOM 335 C1' DT A 11 -6.696 -4.253 6.948 1.00 0.19 C ATOM 336 N1 DT A 11 -5.264 -4.582 6.799 1.00 0.16 N ATOM 337 C2 DT A 11 -4.350 -3.549 6.904 1.00 0.14 C ATOM 338 O2 DT A 11 -4.697 -2.386 7.104 1.00 0.15 O ATOM 339 N3 DT A 11 -3.020 -3.899 6.770 1.00 0.14 N ATOM 340 C4 DT A 11 -2.532 -5.175 6.544 1.00 0.16 C ATOM 341 O4 DT A 11 -1.324 -5.375 6.442 1.00 0.16 O ATOM 342 C5 DT A 11 -3.559 -6.188 6.449 1.00 0.19 C ATOM 343 C7 DT A 11 -3.163 -7.642 6.204 1.00 0.18 C ATOM 344 C6 DT A 11 -4.863 -5.870 6.576 1.00 0.19 C ATOM 0 H5' DT A 11 -8.370 -7.611 8.254 1.00 0.14 H new ATOM 0 H5'' DT A 11 -9.485 -7.626 6.901 1.00 0.14 H new ATOM 0 H4' DT A 11 -9.410 -5.412 7.813 1.00 0.17 H new ATOM 0 H3' DT A 11 -8.689 -5.980 5.078 1.00 0.15 H new ATOM 0 H2' DT A 11 -6.763 -4.767 4.855 1.00 0.18 H new ATOM 0 H2'' DT A 11 -7.684 -3.334 5.266 1.00 0.18 H new ATOM 0 H1' DT A 11 -6.754 -3.240 7.347 1.00 0.19 H new ATOM 0 H3 DT A 11 -2.334 -3.148 6.844 1.00 0.14 H new ATOM 0 H71 DT A 11 -3.897 -8.302 6.666 1.00 0.18 H new ATOM 0 H72 DT A 11 -3.127 -7.834 5.132 1.00 0.18 H new ATOM 0 H73 DT A 11 -2.181 -7.830 6.639 1.00 0.18 H new ATOM 0 H6 DT A 11 -5.607 -6.649 6.500 1.00 0.19 H new ATOM 357 P DT A 12 -9.986 -2.933 6.264 1.00 0.13 P ATOM 358 OP1 DT A 12 -8.897 -2.731 7.245 1.00 0.17 O ATOM 359 OP2 DT A 12 -11.394 -2.732 6.673 1.00 0.22 O ATOM 360 O5' DT A 12 -9.693 -2.002 4.983 1.00 0.14 O ATOM 361 C5' DT A 12 -9.147 -0.691 5.141 1.00 0.19 C ATOM 362 C4' DT A 12 -9.433 0.184 3.923 1.00 0.12 C ATOM 363 O4' DT A 12 -8.860 -0.402 2.732 1.00 0.13 O ATOM 364 C3' DT A 12 -10.933 0.343 3.697 1.00 0.20 C ATOM 365 O3' DT A 12 -11.354 1.683 3.976 1.00 0.23 O ATOM 366 C2' DT A 12 -11.166 0.002 2.252 1.00 0.29 C ATOM 367 C1' DT A 12 -9.839 -0.448 1.673 1.00 0.19 C ATOM 368 N1 DT A 12 -9.953 -1.814 1.121 1.00 0.15 N ATOM 369 C2 DT A 12 -10.247 -1.938 -0.223 1.00 0.18 C ATOM 370 O2 DT A 12 -10.386 -0.960 -0.953 1.00 0.31 O ATOM 371 N3 DT A 12 -10.374 -3.230 -0.700 1.00 0.09 N ATOM 372 C4 DT A 12 -10.236 -4.389 0.040 1.00 0.11 C ATOM 373 O4 DT A 12 -10.374 -5.490 -0.488 1.00 0.18 O ATOM 374 C5 DT A 12 -9.928 -4.161 1.433 1.00 0.14 C ATOM 375 C7 DT A 12 -9.759 -5.354 2.368 1.00 0.27 C ATOM 376 C6 DT A 12 -9.797 -2.911 1.922 1.00 0.11 C ATOM 0 H5' DT A 12 -8.070 -0.760 5.296 1.00 0.19 H new ATOM 0 H5'' DT A 12 -9.568 -0.225 6.032 1.00 0.19 H new ATOM 0 H4' DT A 12 -8.987 1.159 4.117 1.00 0.12 H new ATOM 0 H3' DT A 12 -11.506 -0.305 4.360 1.00 0.20 H new ATOM 0 H2' DT A 12 -11.913 -0.787 2.159 1.00 0.29 H new ATOM 0 H2'' DT A 12 -11.548 0.867 1.710 1.00 0.29 H new ATOM 0 H1' DT A 12 -9.538 0.208 0.856 1.00 0.19 H new ATOM 0 H3 DT A 12 -10.590 -3.338 -1.691 1.00 0.09 H new ATOM 0 H71 DT A 12 -9.055 -5.099 3.160 1.00 0.27 H new ATOM 0 H72 DT A 12 -10.723 -5.611 2.808 1.00 0.27 H new ATOM 0 H73 DT A 12 -9.379 -6.206 1.805 1.00 0.27 H new ATOM 0 H6 DT A 12 -9.564 -2.774 2.968 1.00 0.11 H new ATOM 389 P DA A 13 -12.272 2.006 5.259 1.00 0.17 P ATOM 390 OP1 DA A 13 -11.740 1.248 6.413 1.00 0.23 O ATOM 391 OP2 DA A 13 -13.690 1.854 4.865 1.00 0.16 O ATOM 392 O5' DA A 13 -11.983 3.571 5.508 1.00 0.19 O ATOM 393 C5' DA A 13 -10.643 4.037 5.685 1.00 0.17 C ATOM 394 C4' DA A 13 -10.080 4.641 4.399 1.00 0.10 C ATOM 395 O4' DA A 13 -10.207 3.711 3.299 1.00 0.07 O ATOM 396 C3' DA A 13 -10.814 5.925 4.021 1.00 0.12 C ATOM 397 O3' DA A 13 -9.923 7.050 4.056 1.00 0.12 O ATOM 398 C2' DA A 13 -11.344 5.697 2.631 1.00 0.12 C ATOM 399 C1' DA A 13 -10.793 4.368 2.155 1.00 0.10 C ATOM 400 N9 DA A 13 -11.858 3.543 1.557 1.00 0.11 N ATOM 401 C8 DA A 13 -13.009 3.082 2.106 1.00 0.24 C ATOM 402 N7 DA A 13 -13.786 2.375 1.356 1.00 0.36 N ATOM 403 C5 DA A 13 -13.074 2.353 0.153 1.00 0.27 C ATOM 404 C6 DA A 13 -13.330 1.765 -1.091 1.00 0.34 C ATOM 405 N6 DA A 13 -14.426 1.051 -1.347 1.00 0.51 N ATOM 406 N1 DA A 13 -12.414 1.942 -2.060 1.00 0.27 N ATOM 407 C2 DA A 13 -11.311 2.653 -1.824 1.00 0.16 C ATOM 408 N3 DA A 13 -10.967 3.252 -0.687 1.00 0.12 N ATOM 409 C4 DA A 13 -11.899 3.062 0.268 1.00 0.12 C ATOM 0 H5' DA A 13 -10.010 3.210 6.006 1.00 0.17 H new ATOM 0 H5'' DA A 13 -10.619 4.784 6.479 1.00 0.17 H new ATOM 0 H4' DA A 13 -9.029 4.862 4.586 1.00 0.10 H new ATOM 0 H3' DA A 13 -11.619 6.149 4.721 1.00 0.12 H new ATOM 0 H2' DA A 13 -12.434 5.684 2.632 1.00 0.12 H new ATOM 0 H2'' DA A 13 -11.036 6.502 1.965 1.00 0.12 H new ATOM 0 H1' DA A 13 -10.041 4.520 1.380 1.00 0.10 H new ATOM 0 H8 DA A 13 -13.266 3.298 3.132 1.00 0.24 H new ATOM 0 H61 DA A 13 -14.565 0.643 -2.272 1.00 0.51 H new ATOM 0 H62 DA A 13 -15.126 0.912 -0.618 1.00 0.51 H new ATOM 0 H2 DA A 13 -10.620 2.754 -2.648 1.00 0.16 H new ATOM 421 P DI A 14 -8.705 7.175 3.008 1.00 0.07 P ATOM 422 OP1 DI A 14 -8.866 8.442 2.261 1.00 0.15 O ATOM 423 OP2 DI A 14 -8.592 5.896 2.273 1.00 0.16 O ATOM 424 O5' DI A 14 -7.419 7.317 3.967 1.00 0.12 O ATOM 425 C5' DI A 14 -6.763 6.151 4.481 1.00 0.09 C ATOM 426 C4' DI A 14 -5.258 6.335 4.608 1.00 0.09 C ATOM 427 O4' DI A 14 -4.644 5.133 5.130 1.00 0.07 O ATOM 428 C3' DI A 14 -4.619 6.634 3.253 1.00 0.14 C ATOM 429 O3' DI A 14 -4.230 8.011 3.146 1.00 0.13 O ATOM 430 C2' DI A 14 -3.430 5.728 3.181 1.00 0.17 C ATOM 431 C1' DI A 14 -3.686 4.621 4.181 1.00 0.13 C ATOM 432 N9 DI A 14 -4.208 3.398 3.525 1.00 0.11 N ATOM 433 C8 DI A 14 -4.361 2.155 4.037 1.00 0.11 C ATOM 434 N7 DI A 14 -4.826 1.235 3.260 1.00 0.10 N ATOM 435 C5 DI A 14 -5.017 1.942 2.069 1.00 0.08 C ATOM 436 C6 DI A 14 -5.511 1.499 0.819 1.00 0.14 C ATOM 437 O6 DI A 14 -5.882 0.374 0.500 1.00 0.18 O ATOM 438 N1 DI A 14 -5.544 2.528 -0.108 1.00 0.15 N ATOM 439 C2 DI A 14 -5.150 3.834 0.125 1.00 0.12 C ATOM 440 N3 DI A 14 -4.685 4.255 1.295 1.00 0.08 N ATOM 441 C4 DI A 14 -4.644 3.267 2.220 1.00 0.07 C ATOM 0 H5'' DI A 14 -7.179 5.905 5.458 1.00 0.09 H new ATOM 0 H2'' DI A 14 -3.307 5.325 2.176 1.00 0.17 H new ATOM 0 H8 DI A 14 -4.100 1.937 5.073 1.00 0.11 H new ATOM 0 H5' DI A 14 -6.968 5.305 3.825 1.00 0.09 H new ATOM 0 H4' DI A 14 -5.095 7.174 5.285 1.00 0.09 H new ATOM 0 H3' DI A 14 -5.315 6.464 2.431 1.00 0.14 H new ATOM 0 H2' DI A 14 -2.514 6.267 3.422 1.00 0.17 H new ATOM 0 H2 DI A 14 -5.225 4.552 -0.692 1.00 0.12 H new ATOM 0 H1' DI A 14 -2.755 4.334 4.670 1.00 0.13 H new ATOM 0 H1 DI A 14 -5.888 2.304 -1.042 1.00 0.15 H new ATOM 452 P DG A 15 -5.029 9.021 2.175 1.00 0.10 P ATOM 453 OP1 DG A 15 -4.301 10.309 2.143 1.00 0.12 O ATOM 454 OP2 DG A 15 -6.459 8.997 2.557 1.00 0.21 O ATOM 455 O5' DG A 15 -4.884 8.314 0.733 1.00 0.19 O ATOM 456 C5' DG A 15 -3.898 8.744 -0.222 1.00 0.26 C ATOM 457 C4' DG A 15 -2.628 9.278 0.430 1.00 0.23 C ATOM 458 O4' DG A 15 -2.121 8.335 1.399 1.00 0.24 O ATOM 459 C3' DG A 15 -1.537 9.512 -0.613 1.00 0.20 C ATOM 460 O3' DG A 15 -0.939 10.808 -0.459 1.00 0.24 O ATOM 461 C2' DG A 15 -0.524 8.428 -0.372 1.00 0.19 C ATOM 462 C1' DG A 15 -0.818 7.859 1.003 1.00 0.19 C ATOM 463 N9 DG A 15 -0.785 6.381 1.011 1.00 0.17 N ATOM 464 C8 DG A 15 -0.470 5.543 2.025 1.00 0.16 C ATOM 465 N7 DG A 15 -0.566 4.278 1.808 1.00 0.14 N ATOM 466 C5 DG A 15 -0.997 4.244 0.483 1.00 0.14 C ATOM 467 C6 DG A 15 -1.289 3.130 -0.347 1.00 0.16 C ATOM 468 O6 DG A 15 -1.234 1.934 -0.064 1.00 0.17 O ATOM 469 N1 DG A 15 -1.690 3.532 -1.616 1.00 0.21 N ATOM 470 C2 DG A 15 -1.798 4.843 -2.037 1.00 0.27 C ATOM 471 N2 DG A 15 -2.185 5.026 -3.299 1.00 0.35 N ATOM 472 N3 DG A 15 -1.527 5.898 -1.259 1.00 0.26 N ATOM 473 C4 DG A 15 -1.133 5.530 -0.018 1.00 0.19 C ATOM 0 H5' DG A 15 -4.328 9.520 -0.855 1.00 0.26 H new ATOM 0 H5'' DG A 15 -3.642 7.908 -0.872 1.00 0.26 H new ATOM 0 H4' DG A 15 -2.885 10.219 0.917 1.00 0.23 H new ATOM 0 H3' DG A 15 -1.938 9.482 -1.626 1.00 0.20 H new ATOM 0 H2' DG A 15 -0.596 7.653 -1.136 1.00 0.19 H new ATOM 0 H2'' DG A 15 0.489 8.827 -0.418 1.00 0.19 H new ATOM 0 H1' DG A 15 -0.050 8.188 1.703 1.00 0.19 H new ATOM 0 H8 DG A 15 -0.149 5.922 2.984 1.00 0.16 H new ATOM 0 H1 DG A 15 -1.923 2.802 -2.289 1.00 0.21 H new ATOM 0 H21 DG A 15 -2.284 5.971 -3.670 1.00 0.35 H new ATOM 0 H22 DG A 15 -2.382 4.221 -3.894 1.00 0.35 H new ATOM 485 P DG A 16 -0.506 11.366 0.992 1.00 0.23 P ATOM 486 OP1 DG A 16 -1.685 11.302 1.886 1.00 0.25 O ATOM 487 OP2 DG A 16 0.201 12.651 0.800 1.00 0.26 O ATOM 488 O5' DG A 16 0.567 10.274 1.497 1.00 0.19 O ATOM 489 C5' DG A 16 1.970 10.464 1.266 1.00 0.17 C ATOM 490 C4' DG A 16 2.826 9.840 2.360 1.00 0.16 C ATOM 491 O4' DG A 16 2.439 8.468 2.592 1.00 0.19 O ATOM 492 C3' DG A 16 4.305 9.860 1.984 1.00 0.17 C ATOM 493 O3' DG A 16 5.030 10.798 2.793 1.00 0.18 O ATOM 494 C2' DG A 16 4.796 8.452 2.201 1.00 0.23 C ATOM 495 C1' DG A 16 3.602 7.615 2.620 1.00 0.16 C ATOM 496 N9 DG A 16 3.420 6.460 1.721 1.00 0.16 N ATOM 497 C8 DG A 16 3.128 6.429 0.397 1.00 0.14 C ATOM 498 N7 DG A 16 2.996 5.273 -0.162 1.00 0.15 N ATOM 499 C5 DG A 16 3.229 4.410 0.915 1.00 0.13 C ATOM 500 C6 DG A 16 3.227 2.991 0.958 1.00 0.15 C ATOM 501 O6 DG A 16 3.018 2.201 0.039 1.00 0.22 O ATOM 502 N1 DG A 16 3.507 2.521 2.237 1.00 0.11 N ATOM 503 C2 DG A 16 3.758 3.313 3.339 1.00 0.12 C ATOM 504 N2 DG A 16 4.011 2.672 4.480 1.00 0.15 N ATOM 505 N3 DG A 16 3.760 4.649 3.305 1.00 0.15 N ATOM 506 C4 DG A 16 3.490 5.131 2.070 1.00 0.12 C ATOM 0 H5' DG A 16 2.184 11.531 1.204 1.00 0.17 H new ATOM 0 H5'' DG A 16 2.240 10.028 0.304 1.00 0.17 H new ATOM 0 H4' DG A 16 2.670 10.431 3.262 1.00 0.16 H new ATOM 0 H3' DG A 16 4.454 10.178 0.952 1.00 0.17 H new ATOM 0 H2' DG A 16 5.241 8.056 1.288 1.00 0.23 H new ATOM 0 H2'' DG A 16 5.569 8.429 2.969 1.00 0.23 H new ATOM 0 H1' DG A 16 3.760 7.217 3.622 1.00 0.16 H new ATOM 0 H8 DG A 16 3.010 7.340 -0.170 1.00 0.14 H new ATOM 0 H1 DG A 16 3.529 1.510 2.371 1.00 0.11 H new ATOM 0 H21 DG A 16 4.204 3.201 5.330 1.00 0.15 H new ATOM 0 H22 DG A 16 4.011 1.652 4.503 1.00 0.15 H new ATOM 518 P DT A 17 5.104 10.633 4.394 1.00 0.24 P ATOM 519 OP1 DT A 17 4.077 9.650 4.807 1.00 0.33 O ATOM 520 OP2 DT A 17 5.120 11.984 4.998 1.00 0.39 O ATOM 521 O5' DT A 17 6.555 9.967 4.610 1.00 0.28 O ATOM 522 C5' DT A 17 7.747 10.734 4.412 1.00 0.17 C ATOM 523 C4' DT A 17 8.923 9.843 4.028 1.00 0.05 C ATOM 524 O4' DT A 17 9.181 8.866 5.063 1.00 0.12 O ATOM 525 C3' DT A 17 8.639 9.100 2.728 1.00 0.11 C ATOM 526 O3' DT A 17 9.496 9.560 1.678 1.00 0.12 O ATOM 527 C2' DT A 17 8.880 7.647 3.031 1.00 0.16 C ATOM 528 C1' DT A 17 9.086 7.528 4.528 1.00 0.16 C ATOM 529 N1 DT A 17 7.963 6.796 5.151 1.00 0.19 N ATOM 530 C2 DT A 17 8.082 5.423 5.278 1.00 0.27 C ATOM 531 O2 DT A 17 9.084 4.817 4.904 1.00 0.35 O ATOM 532 N3 DT A 17 7.007 4.771 5.853 1.00 0.30 N ATOM 533 C4 DT A 17 5.840 5.364 6.303 1.00 0.25 C ATOM 534 O4 DT A 17 4.943 4.686 6.800 1.00 0.33 O ATOM 535 C5 DT A 17 5.805 6.800 6.130 1.00 0.17 C ATOM 536 C7 DT A 17 4.576 7.585 6.579 1.00 0.16 C ATOM 537 C6 DT A 17 6.842 7.457 5.573 1.00 0.16 C ATOM 0 H5' DT A 17 7.985 11.281 5.324 1.00 0.17 H new ATOM 0 H5'' DT A 17 7.579 11.475 3.630 1.00 0.17 H new ATOM 0 H4' DT A 17 9.792 10.488 3.900 1.00 0.05 H new ATOM 0 H3' DT A 17 7.619 9.270 2.382 1.00 0.11 H new ATOM 0 H2' DT A 17 8.032 7.042 2.710 1.00 0.16 H new ATOM 0 H2'' DT A 17 9.754 7.282 2.492 1.00 0.16 H new ATOM 0 H1' DT A 17 9.997 6.969 4.743 1.00 0.16 H new ATOM 0 H3 DT A 17 7.081 3.759 5.955 1.00 0.30 H new ATOM 0 H71 DT A 17 4.875 8.589 6.880 1.00 0.16 H new ATOM 0 H72 DT A 17 3.865 7.650 5.756 1.00 0.16 H new ATOM 0 H73 DT A 17 4.109 7.078 7.423 1.00 0.16 H new ATOM 0 H6 DT A 17 6.787 8.529 5.457 1.00 0.16 H new ATOM 550 P DT A 18 9.257 11.003 0.997 1.00 0.16 P ATOM 551 OP1 DT A 18 9.575 12.047 1.997 1.00 0.31 O ATOM 552 OP2 DT A 18 7.933 10.992 0.337 1.00 0.29 O ATOM 553 O5' DT A 18 10.391 11.035 -0.145 1.00 0.16 O ATOM 554 C5' DT A 18 11.503 10.141 -0.066 1.00 0.17 C ATOM 555 C4' DT A 18 11.574 9.217 -1.284 1.00 0.17 C ATOM 556 O4' DT A 18 12.525 8.148 -1.062 1.00 0.17 O ATOM 557 C3' DT A 18 10.216 8.586 -1.573 1.00 0.18 C ATOM 558 O3' DT A 18 9.625 9.158 -2.749 1.00 0.20 O ATOM 559 C2' DT A 18 10.483 7.113 -1.755 1.00 0.19 C ATOM 560 C1' DT A 18 11.928 6.866 -1.364 1.00 0.17 C ATOM 561 N1 DT A 18 12.002 5.961 -0.197 1.00 0.13 N ATOM 562 C2 DT A 18 11.490 4.686 -0.346 1.00 0.18 C ATOM 563 O2 DT A 18 11.019 4.290 -1.411 1.00 0.28 O ATOM 564 N3 DT A 18 11.536 3.878 0.776 1.00 0.17 N ATOM 565 C4 DT A 18 12.042 4.232 2.014 1.00 0.13 C ATOM 566 O4 DT A 18 12.033 3.433 2.948 1.00 0.18 O ATOM 567 C5 DT A 18 12.555 5.584 2.074 1.00 0.08 C ATOM 568 C7 DT A 18 13.107 6.125 3.389 1.00 0.09 C ATOM 569 C6 DT A 18 12.526 6.386 0.992 1.00 0.08 C ATOM 0 H5' DT A 18 11.425 9.542 0.841 1.00 0.17 H new ATOM 0 H5'' DT A 18 12.427 10.715 0.010 1.00 0.17 H new ATOM 0 H4' DT A 18 11.886 9.828 -2.131 1.00 0.17 H new ATOM 0 H3' DT A 18 9.509 8.763 -0.763 1.00 0.18 H new ATOM 0 H2' DT A 18 9.810 6.521 -1.135 1.00 0.19 H new ATOM 0 H2'' DT A 18 10.308 6.815 -2.789 1.00 0.19 H new ATOM 0 H1' DT A 18 12.467 6.384 -2.180 1.00 0.17 H new ATOM 0 H3 DT A 18 11.162 2.934 0.682 1.00 0.17 H new ATOM 0 H71 DT A 18 13.886 6.859 3.182 1.00 0.09 H new ATOM 0 H72 DT A 18 12.303 6.598 3.954 1.00 0.09 H new ATOM 0 H73 DT A 18 13.527 5.305 3.972 1.00 0.09 H new ATOM 0 H6 DT A 18 12.925 7.387 1.065 1.00 0.08 H new ATOM 582 P DA A 19 10.352 9.056 -4.184 1.00 0.12 P ATOM 583 OP1 DA A 19 11.515 8.149 -4.053 1.00 0.13 O ATOM 584 OP2 DA A 19 10.539 10.427 -4.709 1.00 0.30 O ATOM 585 O5' DA A 19 9.236 8.318 -5.082 1.00 0.19 O ATOM 586 C5' DA A 19 7.854 8.659 -4.939 1.00 0.14 C ATOM 587 C4' DA A 19 6.971 7.411 -4.899 1.00 0.15 C ATOM 588 O4' DA A 19 7.467 6.448 -3.944 1.00 0.18 O ATOM 589 C3' DA A 19 5.534 7.749 -4.505 1.00 0.15 C ATOM 590 O3' DA A 19 4.660 7.658 -5.634 1.00 0.15 O ATOM 591 C2' DA A 19 5.160 6.735 -3.453 1.00 0.16 C ATOM 592 C1' DA A 19 6.353 5.817 -3.281 1.00 0.18 C ATOM 593 N9 DA A 19 6.650 5.571 -1.853 1.00 0.16 N ATOM 594 C8 DA A 19 6.822 6.446 -0.831 1.00 0.13 C ATOM 595 N7 DA A 19 7.104 5.959 0.332 1.00 0.11 N ATOM 596 C5 DA A 19 7.125 4.586 0.065 1.00 0.10 C ATOM 597 C6 DA A 19 7.368 3.464 0.868 1.00 0.10 C ATOM 598 N6 DA A 19 7.656 3.543 2.175 1.00 0.13 N ATOM 599 N1 DA A 19 7.306 2.257 0.273 1.00 0.12 N ATOM 600 C2 DA A 19 7.026 2.154 -1.030 1.00 0.15 C ATOM 601 N3 DA A 19 6.783 3.146 -1.877 1.00 0.17 N ATOM 602 C4 DA A 19 6.849 4.345 -1.264 1.00 0.14 C ATOM 0 H5' DA A 19 7.548 9.297 -5.768 1.00 0.14 H new ATOM 0 H5'' DA A 19 7.713 9.235 -4.025 1.00 0.14 H new ATOM 0 H4' DA A 19 6.993 6.993 -5.906 1.00 0.15 H new ATOM 0 H3' DA A 19 5.447 8.770 -4.132 1.00 0.15 H new ATOM 0 H2' DA A 19 4.913 7.228 -2.512 1.00 0.16 H new ATOM 0 H2'' DA A 19 4.279 6.170 -3.757 1.00 0.16 H new ATOM 0 H1' DA A 19 6.146 4.840 -3.718 1.00 0.18 H new ATOM 0 H8 DA A 19 6.727 7.511 -0.984 1.00 0.13 H new ATOM 0 H61 DA A 19 7.824 2.693 2.712 1.00 0.13 H new ATOM 0 H62 DA A 19 7.707 4.454 2.632 1.00 0.13 H new ATOM 0 H2 DA A 19 6.994 1.154 -1.438 1.00 0.15 H new ATOM 614 P DG A 20 3.082 7.930 -5.471 1.00 0.20 P ATOM 615 OP1 DG A 20 2.832 9.369 -5.710 1.00 0.26 O ATOM 616 OP2 DG A 20 2.632 7.303 -4.208 1.00 0.25 O ATOM 617 O5' DG A 20 2.456 7.098 -6.697 1.00 0.20 O ATOM 618 C5' DG A 20 2.743 5.702 -6.846 1.00 0.22 C ATOM 619 C4' DG A 20 1.834 5.029 -7.865 1.00 0.14 C ATOM 620 O4' DG A 20 2.177 3.631 -8.003 1.00 0.13 O ATOM 621 C3' DG A 20 0.371 5.124 -7.443 1.00 0.10 C ATOM 622 O3' DG A 20 -0.395 5.832 -8.424 1.00 0.08 O ATOM 623 C2' DG A 20 -0.109 3.705 -7.311 1.00 0.15 C ATOM 624 C1' DG A 20 1.019 2.802 -7.774 1.00 0.12 C ATOM 625 N9 DG A 20 1.309 1.767 -6.764 1.00 0.12 N ATOM 626 C8 DG A 20 1.276 0.416 -6.879 1.00 0.12 C ATOM 627 N7 DG A 20 1.571 -0.282 -5.834 1.00 0.06 N ATOM 628 C5 DG A 20 1.838 0.716 -4.891 1.00 0.05 C ATOM 629 C6 DG A 20 2.223 0.598 -3.529 1.00 0.09 C ATOM 630 O6 DG A 20 2.403 -0.428 -2.875 1.00 0.11 O ATOM 631 N1 DG A 20 2.394 1.846 -2.937 1.00 0.11 N ATOM 632 C2 DG A 20 2.215 3.058 -3.574 1.00 0.10 C ATOM 633 N2 DG A 20 2.425 4.148 -2.834 1.00 0.17 N ATOM 634 N3 DG A 20 1.851 3.177 -4.855 1.00 0.09 N ATOM 635 C4 DG A 20 1.681 1.975 -5.453 1.00 0.07 C ATOM 0 H5' DG A 20 2.633 5.206 -5.882 1.00 0.22 H new ATOM 0 H5'' DG A 20 3.782 5.578 -7.152 1.00 0.22 H new ATOM 0 H4' DG A 20 1.973 5.545 -8.815 1.00 0.14 H new ATOM 0 H3' DG A 20 0.259 5.672 -6.507 1.00 0.10 H new ATOM 0 H2' DG A 20 -0.378 3.485 -6.278 1.00 0.15 H new ATOM 0 H2'' DG A 20 -1.002 3.544 -7.914 1.00 0.15 H new ATOM 0 H1' DG A 20 0.736 2.285 -8.691 1.00 0.12 H new ATOM 0 H8 DG A 20 1.012 -0.059 -7.812 1.00 0.12 H new ATOM 0 H1 DG A 20 2.673 1.867 -1.956 1.00 0.11 H new ATOM 0 H21 DG A 20 2.309 5.074 -3.246 1.00 0.17 H new ATOM 0 H22 DG A 20 2.701 4.055 -1.856 1.00 0.17 H new ATOM 647 P DG A 21 -1.958 6.133 -8.183 1.00 0.11 P ATOM 648 OP1 DG A 21 -2.396 7.138 -9.178 1.00 0.20 O ATOM 649 OP2 DG A 21 -2.165 6.385 -6.739 1.00 0.18 O ATOM 650 O5' DG A 21 -2.651 4.726 -8.553 1.00 0.16 O ATOM 651 C5' DG A 21 -2.629 4.237 -9.901 1.00 0.14 C ATOM 652 C4' DG A 21 -3.306 2.881 -10.037 1.00 0.14 C ATOM 653 O4' DG A 21 -2.679 1.909 -9.168 1.00 0.16 O ATOM 654 C3' DG A 21 -4.785 2.963 -9.671 1.00 0.15 C ATOM 655 O3' DG A 21 -5.607 2.732 -10.819 1.00 0.15 O ATOM 656 C2' DG A 21 -5.008 1.901 -8.629 1.00 0.16 C ATOM 657 C1' DG A 21 -3.661 1.287 -8.313 1.00 0.15 C ATOM 658 N9 DG A 21 -3.316 1.483 -6.892 1.00 0.14 N ATOM 659 C8 DG A 21 -3.045 2.627 -6.218 1.00 0.15 C ATOM 660 N7 DG A 21 -2.759 2.529 -4.962 1.00 0.14 N ATOM 661 C5 DG A 21 -2.847 1.148 -4.758 1.00 0.12 C ATOM 662 C6 DG A 21 -2.642 0.389 -3.575 1.00 0.14 C ATOM 663 O6 DG A 21 -2.336 0.790 -2.454 1.00 0.17 O ATOM 664 N1 DG A 21 -2.829 -0.970 -3.803 1.00 0.17 N ATOM 665 C2 DG A 21 -3.171 -1.533 -5.017 1.00 0.16 C ATOM 666 N2 DG A 21 -3.308 -2.858 -5.035 1.00 0.20 N ATOM 667 N3 DG A 21 -3.364 -0.824 -6.133 1.00 0.14 N ATOM 668 C4 DG A 21 -3.187 0.501 -5.936 1.00 0.12 C ATOM 0 H5' DG A 21 -1.596 4.160 -10.240 1.00 0.14 H new ATOM 0 H5'' DG A 21 -3.126 4.955 -10.553 1.00 0.14 H new ATOM 0 H4' DG A 21 -3.204 2.575 -11.078 1.00 0.14 H new ATOM 0 H3' DG A 21 -5.050 3.952 -9.296 1.00 0.15 H new ATOM 0 H2' DG A 21 -5.454 2.331 -7.732 1.00 0.16 H new ATOM 0 H2'' DG A 21 -5.699 1.142 -8.996 1.00 0.16 H new ATOM 0 H1' DG A 21 -3.688 0.212 -8.492 1.00 0.15 H new ATOM 0 H8 DG A 21 -3.067 3.586 -6.713 1.00 0.15 H new ATOM 0 H1 DG A 21 -2.704 -1.601 -3.011 1.00 0.17 H new ATOM 0 H21 DG A 21 -3.560 -3.333 -5.902 1.00 0.20 H new ATOM 0 H22 DG A 21 -3.161 -3.397 -4.182 1.00 0.20 H new ATOM 680 P DG A 22 -7.200 2.556 -10.663 1.00 0.10 P ATOM 681 OP1 DG A 22 -7.807 2.607 -12.012 1.00 0.11 O ATOM 682 OP2 DG A 22 -7.668 3.484 -9.609 1.00 0.14 O ATOM 683 O5' DG A 22 -7.333 1.051 -10.105 1.00 0.10 O ATOM 684 C5' DG A 22 -7.090 -0.067 -10.970 1.00 0.11 C ATOM 685 C4' DG A 22 -7.561 -1.384 -10.366 1.00 0.08 C ATOM 686 O4' DG A 22 -6.829 -1.689 -9.158 1.00 0.11 O ATOM 687 C3' DG A 22 -9.045 -1.329 -10.022 1.00 0.12 C ATOM 688 O3' DG A 22 -9.806 -2.149 -10.914 1.00 0.16 O ATOM 689 C2' DG A 22 -9.151 -1.827 -8.607 1.00 0.15 C ATOM 690 C1' DG A 22 -7.739 -1.986 -8.076 1.00 0.14 C ATOM 691 N9 DG A 22 -7.499 -1.082 -6.936 1.00 0.22 N ATOM 692 C8 DG A 22 -7.440 0.271 -6.905 1.00 0.32 C ATOM 693 N7 DG A 22 -7.178 0.835 -5.774 1.00 0.40 N ATOM 694 C5 DG A 22 -7.043 -0.271 -4.930 1.00 0.32 C ATOM 695 C6 DG A 22 -6.751 -0.324 -3.540 1.00 0.34 C ATOM 696 O6 DG A 22 -6.541 0.611 -2.767 1.00 0.43 O ATOM 697 N1 DG A 22 -6.708 -1.634 -3.079 1.00 0.27 N ATOM 698 C2 DG A 22 -6.918 -2.758 -3.849 1.00 0.19 C ATOM 699 N2 DG A 22 -6.840 -3.931 -3.214 1.00 0.23 N ATOM 700 N3 DG A 22 -7.193 -2.719 -5.159 1.00 0.14 N ATOM 701 C4 DG A 22 -7.240 -1.451 -5.633 1.00 0.21 C ATOM 0 H5' DG A 22 -6.023 -0.131 -11.186 1.00 0.11 H new ATOM 0 H5'' DG A 22 -7.598 0.096 -11.920 1.00 0.11 H new ATOM 0 H4' DG A 22 -7.384 -2.158 -11.113 1.00 0.08 H new ATOM 0 H3' DG A 22 -9.444 -0.319 -10.121 1.00 0.12 H new ATOM 0 H2' DG A 22 -9.715 -1.124 -7.994 1.00 0.15 H new ATOM 0 H2'' DG A 22 -9.683 -2.778 -8.573 1.00 0.15 H new ATOM 0 H1' DG A 22 -7.587 -3.004 -7.717 1.00 0.14 H new ATOM 0 H8 DG A 22 -7.607 0.858 -7.796 1.00 0.32 H new ATOM 0 H1 DG A 22 -6.504 -1.776 -2.090 1.00 0.27 H new ATOM 0 H21 DG A 22 -6.986 -4.800 -3.728 1.00 0.23 H new ATOM 0 H22 DG A 22 -6.635 -3.958 -2.215 1.00 0.23 H new ATOM 713 P DT A 23 -11.414 -2.058 -10.937 1.00 0.09 P ATOM 714 OP1 DT A 23 -11.901 -2.772 -12.137 1.00 0.24 O ATOM 715 OP2 DT A 23 -11.801 -0.648 -10.707 1.00 0.23 O ATOM 716 O5' DT A 23 -11.829 -2.913 -9.639 1.00 0.16 O ATOM 717 C5' DT A 23 -11.606 -4.324 -9.601 1.00 0.21 C ATOM 718 C4' DT A 23 -11.882 -4.901 -8.215 1.00 0.20 C ATOM 719 O4' DT A 23 -11.041 -4.279 -7.220 1.00 0.23 O ATOM 720 C3' DT A 23 -13.332 -4.680 -7.802 1.00 0.17 C ATOM 721 O3' DT A 23 -14.084 -5.894 -7.895 1.00 0.25 O ATOM 722 C2' DT A 23 -13.273 -4.187 -6.381 1.00 0.22 C ATOM 723 C1' DT A 23 -11.806 -4.038 -6.020 1.00 0.25 C ATOM 724 N1 DT A 23 -11.533 -2.689 -5.475 1.00 0.25 N ATOM 725 C2 DT A 23 -11.183 -2.598 -4.140 1.00 0.29 C ATOM 726 O2 DT A 23 -11.086 -3.590 -3.422 1.00 0.37 O ATOM 727 N3 DT A 23 -10.950 -1.324 -3.658 1.00 0.30 N ATOM 728 C4 DT A 23 -11.032 -0.151 -4.384 1.00 0.27 C ATOM 729 O4 DT A 23 -10.804 0.932 -3.850 1.00 0.28 O ATOM 730 C5 DT A 23 -11.401 -0.340 -5.767 1.00 0.24 C ATOM 731 C7 DT A 23 -11.528 0.876 -6.678 1.00 0.25 C ATOM 732 C6 DT A 23 -11.635 -1.573 -6.263 1.00 0.23 C ATOM 0 H5' DT A 23 -10.576 -4.538 -9.886 1.00 0.21 H new ATOM 0 H5'' DT A 23 -12.247 -4.814 -10.334 1.00 0.21 H new ATOM 0 H4' DT A 23 -11.671 -5.969 -8.274 1.00 0.20 H new ATOM 0 H3' DT A 23 -13.832 -3.965 -8.455 1.00 0.17 H new ATOM 0 H2' DT A 23 -13.793 -3.234 -6.282 1.00 0.22 H new ATOM 0 H2'' DT A 23 -13.766 -4.890 -5.709 1.00 0.22 H new ATOM 0 HO3' DT A 23 -15.011 -5.727 -7.623 1.00 0.25 H new ATOM 0 H1' DT A 23 -11.528 -4.752 -5.245 1.00 0.25 H new ATOM 0 H3 DT A 23 -10.693 -1.242 -2.674 1.00 0.30 H new ATOM 0 H71 DT A 23 -11.281 0.592 -7.701 1.00 0.25 H new ATOM 0 H72 DT A 23 -12.550 1.252 -6.642 1.00 0.25 H new ATOM 0 H73 DT A 23 -10.843 1.655 -6.343 1.00 0.25 H new ATOM 0 H6 DT A 23 -11.908 -1.682 -7.302 1.00 0.23 H new TER 746 DT A 23