USER MOD reduce.3.24.130724 H: found=0, std=0, add=186, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 186 hydrogens (10 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 PSU O2' : rot -124:sc= -0.162 USER MOD Single : A 2 C O2' : rot -26:sc= 0.123 USER MOD Single : A 3 G O2' : rot -25:sc= 0.0853 USER MOD Single : A 4 G O2' : rot -19:sc= 0.0717 USER MOD Single : A 5 G O2' : rot -20:sc= 0.11 USER MOD Single : A 6 C O2' : rot -18:sc= 0.0957 USER MOD Single : A 7 C O2' : rot -170:sc= 0.165 USER MOD Single : A 8 C O2' : rot -10:sc= -1.43! USER MOD Single : A 9 A O2' : rot -22:sc= 0.0526 USER MOD Single : A 10 U O2' : rot 27:sc= -3.8! USER MOD Single : A 11 A O2' : rot -30:sc= 0.111 USER MOD Single : A 12 C O2' : rot -19:sc= 0.0802 USER MOD Single : A 13 C O2' : rot -23:sc= 0.0972 USER MOD Single : A 14 C O2' : rot 180:sc= -0.012 USER MOD Single : A 15 C O2' : rot -20:sc= 0.0824 USER MOD Single : A 16 G O2' : rot 180:sc= -0.571 USER MOD Single : A 17 A O2' : rot -28:sc= 0.0904 USER MOD Single : A 17 A O3' : rot 180:sc= 0.102 USER MOD ----------------------------------------------------------------- HETATM 1 N1 PSU A 1 2.639 4.179 -8.945 1.00 0.00 N HETATM 2 C2 PSU A 1 2.429 3.573 -10.166 1.00 0.00 C HETATM 3 N3 PSU A 1 1.363 4.057 -10.876 1.00 0.00 N HETATM 4 C4 PSU A 1 0.509 5.069 -10.505 1.00 0.00 C HETATM 5 C5 PSU A 1 0.797 5.655 -9.229 1.00 0.00 C HETATM 6 C6 PSU A 1 1.825 5.198 -8.504 1.00 0.00 C HETATM 7 O2 PSU A 1 3.149 2.692 -10.598 1.00 0.00 O HETATM 8 O4 PSU A 1 -0.405 5.392 -11.262 1.00 0.00 O HETATM 9 C1' PSU A 1 -0.054 6.752 -8.765 1.00 0.00 C HETATM 10 C2' PSU A 1 -1.275 6.298 -7.958 1.00 0.00 C HETATM 11 O2' PSU A 1 -2.388 7.074 -8.359 1.00 0.00 O HETATM 12 C3' PSU A 1 -0.867 6.637 -6.525 1.00 0.00 C HETATM 13 C4' PSU A 1 0.052 7.838 -6.694 1.00 0.00 C HETATM 14 O3' PSU A 1 -1.995 6.965 -5.714 1.00 0.00 O HETATM 15 O4' PSU A 1 0.729 7.605 -7.953 1.00 0.00 O HETATM 16 C5' PSU A 1 1.090 8.013 -5.609 1.00 0.00 C HETATM 17 O5' PSU A 1 1.957 6.874 -5.540 1.00 0.00 O HETATM 0 HO2' PSU A 1 -2.783 7.509 -7.575 1.00 0.00 H new HETATM 0 H5'' PSU A 1 1.677 8.910 -5.804 1.00 0.00 H new HETATM 0 HN3 PSU A 1 1.182 3.619 -11.779 1.00 0.00 H new HETATM 0 HN1 PSU A 1 3.412 3.866 -8.358 1.00 0.00 H new HETATM 0 H6 PSU A 1 2.025 5.648 -7.531 1.00 0.00 H new HETATM 0 H5' PSU A 1 0.596 8.158 -4.648 1.00 0.00 H new HETATM 0 H4' PSU A 1 -0.548 8.747 -6.650 1.00 0.00 H new HETATM 0 H3' PSU A 1 -0.390 5.798 -6.019 1.00 0.00 H new HETATM 0 H2' PSU A 1 -1.547 5.250 -8.084 1.00 0.00 H new HETATM 0 H1' PSU A 1 -0.437 7.254 -9.654 1.00 0.00 H new ATOM 28 P C A 2 -2.686 5.832 -4.802 1.00 0.00 P ATOM 29 OP1 C A 2 -3.917 6.420 -4.215 1.00 0.00 O ATOM 30 OP2 C A 2 -1.648 5.259 -3.907 1.00 0.00 O ATOM 31 O5' C A 2 -3.120 4.701 -5.838 1.00 0.00 O ATOM 32 C5' C A 2 -4.234 4.881 -6.713 1.00 0.00 C ATOM 33 C4' C A 2 -4.380 3.678 -7.618 1.00 0.00 C ATOM 34 O4' C A 2 -3.209 3.593 -8.472 1.00 0.00 O ATOM 35 C3' C A 2 -4.437 2.331 -6.909 1.00 0.00 C ATOM 36 O3' C A 2 -5.772 2.011 -6.519 1.00 0.00 O ATOM 37 C2' C A 2 -3.894 1.365 -7.959 1.00 0.00 C ATOM 38 O2' C A 2 -4.896 0.997 -8.888 1.00 0.00 O ATOM 39 C1' C A 2 -2.865 2.235 -8.684 1.00 0.00 C ATOM 40 N1 C A 2 -1.475 2.037 -8.233 1.00 0.00 N ATOM 41 C2 C A 2 -0.623 1.243 -9.005 1.00 0.00 C ATOM 42 O2 C A 2 -1.070 0.693 -10.022 1.00 0.00 O ATOM 43 N3 C A 2 0.664 1.089 -8.621 1.00 0.00 N ATOM 44 C4 C A 2 1.106 1.687 -7.514 1.00 0.00 C ATOM 45 N4 C A 2 2.387 1.520 -7.182 1.00 0.00 N ATOM 46 C5 C A 2 0.257 2.486 -6.699 1.00 0.00 C ATOM 47 C6 C A 2 -1.015 2.628 -7.089 1.00 0.00 C ATOM 0 H5' C A 2 -4.095 5.782 -7.311 1.00 0.00 H new ATOM 0 H5'' C A 2 -5.145 5.022 -6.131 1.00 0.00 H new ATOM 0 H4' C A 2 -5.325 3.839 -8.137 1.00 0.00 H new ATOM 0 H3' C A 2 -3.865 2.302 -5.981 1.00 0.00 H new ATOM 0 H2' C A 2 -3.510 0.442 -7.525 1.00 0.00 H new ATOM 0 HO2' C A 2 -5.777 1.070 -8.465 1.00 0.00 H new ATOM 0 H1' C A 2 -2.896 1.946 -9.735 1.00 0.00 H new ATOM 0 H41 C A 2 2.758 1.963 -6.342 1.00 0.00 H new ATOM 0 H42 C A 2 2.996 0.949 -7.769 1.00 0.00 H new ATOM 0 H5 C A 2 0.625 2.959 -5.801 1.00 0.00 H new ATOM 0 H6 C A 2 -1.691 3.220 -6.489 1.00 0.00 H new ATOM 59 P G A 3 -6.141 1.851 -4.960 1.00 0.00 P ATOM 60 OP1 G A 3 -7.603 2.072 -4.811 1.00 0.00 O ATOM 61 OP2 G A 3 -5.193 2.680 -4.173 1.00 0.00 O ATOM 62 O5' G A 3 -5.832 0.318 -4.649 1.00 0.00 O ATOM 63 C5' G A 3 -6.825 -0.688 -4.847 1.00 0.00 C ATOM 64 C4' G A 3 -6.218 -2.062 -4.678 1.00 0.00 C ATOM 65 O4' G A 3 -5.167 -2.236 -5.666 1.00 0.00 O ATOM 66 C3' G A 3 -5.531 -2.316 -3.343 1.00 0.00 C ATOM 67 O3' G A 3 -6.457 -2.747 -2.347 1.00 0.00 O ATOM 68 C2' G A 3 -4.512 -3.396 -3.692 1.00 0.00 C ATOM 69 O2' G A 3 -5.119 -4.673 -3.758 1.00 0.00 O ATOM 70 C1' G A 3 -4.102 -2.982 -5.105 1.00 0.00 C ATOM 71 N9 G A 3 -2.893 -2.165 -5.149 1.00 0.00 N ATOM 72 C8 G A 3 -2.811 -0.798 -5.255 1.00 0.00 C ATOM 73 N7 G A 3 -1.583 -0.354 -5.266 1.00 0.00 N ATOM 74 C5 G A 3 -0.806 -1.500 -5.160 1.00 0.00 C ATOM 75 C6 G A 3 0.605 -1.658 -5.118 1.00 0.00 C ATOM 76 O6 G A 3 1.484 -0.786 -5.168 1.00 0.00 O ATOM 77 N1 G A 3 0.966 -2.996 -5.005 1.00 0.00 N ATOM 78 C2 G A 3 0.088 -4.047 -4.943 1.00 0.00 C ATOM 79 N2 G A 3 0.631 -5.264 -4.838 1.00 0.00 N ATOM 80 N3 G A 3 -1.225 -3.917 -4.982 1.00 0.00 N ATOM 81 C4 G A 3 -1.600 -2.626 -5.089 1.00 0.00 C ATOM 0 H5' G A 3 -7.256 -0.593 -5.844 1.00 0.00 H new ATOM 0 H5'' G A 3 -7.638 -0.552 -4.134 1.00 0.00 H new ATOM 0 H4' G A 3 -7.064 -2.743 -4.771 1.00 0.00 H new ATOM 0 H3' G A 3 -5.074 -1.425 -2.913 1.00 0.00 H new ATOM 0 H2' G A 3 -3.702 -3.471 -2.966 1.00 0.00 H new ATOM 0 HO2' G A 3 -5.922 -4.683 -3.196 1.00 0.00 H new ATOM 0 H1' G A 3 -3.887 -3.894 -5.662 1.00 0.00 H new ATOM 0 H8 G A 3 -3.676 -0.155 -5.323 1.00 0.00 H new ATOM 0 H1 G A 3 1.962 -3.212 -4.965 1.00 0.00 H new ATOM 0 H21 G A 3 0.031 -6.087 -4.788 1.00 0.00 H new ATOM 0 H22 G A 3 1.645 -5.369 -4.808 1.00 0.00 H new ATOM 93 P G A 4 -6.021 -2.754 -0.797 1.00 0.00 P ATOM 94 OP1 G A 4 -7.244 -2.941 0.025 1.00 0.00 O ATOM 95 OP2 G A 4 -5.157 -1.569 -0.562 1.00 0.00 O ATOM 96 O5' G A 4 -5.109 -4.053 -0.656 1.00 0.00 O ATOM 97 C5' G A 4 -5.665 -5.330 -0.337 1.00 0.00 C ATOM 98 C4' G A 4 -4.554 -6.309 -0.033 1.00 0.00 C ATOM 99 O4' G A 4 -3.514 -6.186 -1.044 1.00 0.00 O ATOM 100 C3' G A 4 -3.827 -6.068 1.283 1.00 0.00 C ATOM 101 O3' G A 4 -4.517 -6.676 2.374 1.00 0.00 O ATOM 102 C2' G A 4 -2.461 -6.692 1.025 1.00 0.00 C ATOM 103 O2' G A 4 -2.513 -8.103 1.129 1.00 0.00 O ATOM 104 C1' G A 4 -2.237 -6.319 -0.440 1.00 0.00 C ATOM 105 N9 G A 4 -1.503 -5.068 -0.630 1.00 0.00 N ATOM 106 C8 G A 4 -2.035 -3.812 -0.801 1.00 0.00 C ATOM 107 N7 G A 4 -1.133 -2.886 -0.957 1.00 0.00 N ATOM 108 C5 G A 4 0.072 -3.566 -0.882 1.00 0.00 C ATOM 109 C6 G A 4 1.394 -3.085 -0.980 1.00 0.00 C ATOM 110 O6 G A 4 1.774 -1.928 -1.168 1.00 0.00 O ATOM 111 N1 G A 4 2.324 -4.105 -0.842 1.00 0.00 N ATOM 112 C2 G A 4 2.019 -5.428 -0.641 1.00 0.00 C ATOM 113 N2 G A 4 3.061 -6.259 -0.533 1.00 0.00 N ATOM 114 N3 G A 4 0.784 -5.896 -0.552 1.00 0.00 N ATOM 115 C4 G A 4 -0.135 -4.915 -0.679 1.00 0.00 C ATOM 0 H5' G A 4 -6.265 -5.694 -1.171 1.00 0.00 H new ATOM 0 H5'' G A 4 -6.331 -5.243 0.522 1.00 0.00 H new ATOM 0 H4' G A 4 -5.051 -7.278 0.001 1.00 0.00 H new ATOM 0 H3' G A 4 -3.759 -5.018 1.567 1.00 0.00 H new ATOM 0 H2' G A 4 -1.694 -6.357 1.723 1.00 0.00 H new ATOM 0 HO2' G A 4 -3.313 -8.365 1.631 1.00 0.00 H new ATOM 0 H1' G A 4 -1.630 -7.105 -0.889 1.00 0.00 H new ATOM 0 H8 G A 4 -3.096 -3.613 -0.806 1.00 0.00 H new ATOM 0 H1 G A 4 3.311 -3.852 -0.894 1.00 0.00 H new ATOM 0 H21 G A 4 2.905 -7.256 -0.383 1.00 0.00 H new ATOM 0 H22 G A 4 4.012 -5.896 -0.601 1.00 0.00 H new ATOM 127 P G A 5 -4.752 -5.855 3.739 1.00 0.00 P ATOM 128 OP1 G A 5 -5.847 -6.521 4.488 1.00 0.00 O ATOM 129 OP2 G A 5 -4.863 -4.409 3.416 1.00 0.00 O ATOM 130 O5' G A 5 -3.400 -6.072 4.555 1.00 0.00 O ATOM 131 C5' G A 5 -2.901 -7.383 4.810 1.00 0.00 C ATOM 132 C4' G A 5 -1.444 -7.319 5.204 1.00 0.00 C ATOM 133 O4' G A 5 -0.665 -6.870 4.063 1.00 0.00 O ATOM 134 C3' G A 5 -1.107 -6.327 6.308 1.00 0.00 C ATOM 135 O3' G A 5 -1.302 -6.894 7.598 1.00 0.00 O ATOM 136 C2' G A 5 0.356 -6.009 6.031 1.00 0.00 C ATOM 137 O2' G A 5 1.197 -7.041 6.515 1.00 0.00 O ATOM 138 C1' G A 5 0.375 -6.014 4.501 1.00 0.00 C ATOM 139 N9 G A 5 0.164 -4.695 3.913 1.00 0.00 N ATOM 140 C8 G A 5 -0.985 -4.218 3.325 1.00 0.00 C ATOM 141 N7 G A 5 -0.868 -2.995 2.882 1.00 0.00 N ATOM 142 C5 G A 5 0.438 -2.641 3.201 1.00 0.00 C ATOM 143 C6 G A 5 1.143 -1.430 2.977 1.00 0.00 C ATOM 144 O6 G A 5 0.742 -0.393 2.436 1.00 0.00 O ATOM 145 N1 G A 5 2.447 -1.500 3.460 1.00 0.00 N ATOM 146 C2 G A 5 2.999 -2.592 4.081 1.00 0.00 C ATOM 147 N2 G A 5 4.273 -2.468 4.475 1.00 0.00 N ATOM 148 N3 G A 5 2.353 -3.724 4.301 1.00 0.00 N ATOM 149 C4 G A 5 1.086 -3.679 3.838 1.00 0.00 C ATOM 0 H5' G A 5 -3.018 -8.004 3.922 1.00 0.00 H new ATOM 0 H5'' G A 5 -3.480 -7.852 5.605 1.00 0.00 H new ATOM 0 H4' G A 5 -1.217 -8.326 5.556 1.00 0.00 H new ATOM 0 H3' G A 5 -1.741 -5.441 6.308 1.00 0.00 H new ATOM 0 H2' G A 5 0.704 -5.087 6.498 1.00 0.00 H new ATOM 0 HO2' G A 5 0.714 -7.569 7.184 1.00 0.00 H new ATOM 0 H1' G A 5 1.362 -6.349 4.182 1.00 0.00 H new ATOM 0 H8 G A 5 -1.893 -4.797 3.239 1.00 0.00 H new ATOM 0 H1 G A 5 3.037 -0.676 3.343 1.00 0.00 H new ATOM 0 H21 G A 5 4.740 -3.245 4.943 1.00 0.00 H new ATOM 0 H22 G A 5 4.776 -1.597 4.307 1.00 0.00 H new ATOM 161 P C A 6 -2.052 -6.046 8.739 1.00 0.00 P ATOM 162 OP1 C A 6 -2.054 -6.854 9.984 1.00 0.00 O ATOM 163 OP2 C A 6 -3.340 -5.569 8.172 1.00 0.00 O ATOM 164 O5' C A 6 -1.107 -4.781 8.961 1.00 0.00 O ATOM 165 C5' C A 6 0.234 -4.937 9.424 1.00 0.00 C ATOM 166 C4' C A 6 0.892 -3.587 9.591 1.00 0.00 C ATOM 167 O4' C A 6 1.217 -3.037 8.288 1.00 0.00 O ATOM 168 C3' C A 6 0.026 -2.507 10.217 1.00 0.00 C ATOM 169 O3' C A 6 -0.015 -2.616 11.636 1.00 0.00 O ATOM 170 C2' C A 6 0.711 -1.224 9.754 1.00 0.00 C ATOM 171 O2' C A 6 1.833 -0.924 10.561 1.00 0.00 O ATOM 172 C1' C A 6 1.207 -1.621 8.361 1.00 0.00 C ATOM 173 N1 C A 6 0.364 -1.098 7.271 1.00 0.00 N ATOM 174 C2 C A 6 0.271 0.288 7.095 1.00 0.00 C ATOM 175 O2 C A 6 0.919 1.035 7.843 1.00 0.00 O ATOM 176 N3 C A 6 -0.521 0.777 6.115 1.00 0.00 N ATOM 177 C4 C A 6 -1.197 -0.059 5.326 1.00 0.00 C ATOM 178 N4 C A 6 -1.970 0.469 4.378 1.00 0.00 N ATOM 179 C5 C A 6 -1.108 -1.474 5.473 1.00 0.00 C ATOM 180 C6 C A 6 -0.322 -1.945 6.446 1.00 0.00 C ATOM 0 H5' C A 6 0.802 -5.541 8.717 1.00 0.00 H new ATOM 0 H5'' C A 6 0.238 -5.471 10.374 1.00 0.00 H new ATOM 0 H4' C A 6 1.742 -3.801 10.239 1.00 0.00 H new ATOM 0 H3' C A 6 -1.021 -2.563 9.920 1.00 0.00 H new ATOM 0 H2' C A 6 0.056 -0.354 9.789 1.00 0.00 H new ATOM 0 HO2' C A 6 1.772 -1.421 11.403 1.00 0.00 H new ATOM 0 H1' C A 6 2.200 -1.191 8.228 1.00 0.00 H new ATOM 0 H41 C A 6 -2.502 -0.140 3.756 1.00 0.00 H new ATOM 0 H42 C A 6 -2.030 1.482 4.274 1.00 0.00 H new ATOM 0 H5 C A 6 -1.655 -2.140 4.823 1.00 0.00 H new ATOM 0 H6 C A 6 -0.227 -3.012 6.583 1.00 0.00 H new ATOM 192 P C A 7 -1.366 -2.242 12.425 1.00 0.00 P ATOM 193 OP1 C A 7 -0.978 -1.869 13.810 1.00 0.00 O ATOM 194 OP2 C A 7 -2.349 -3.335 12.209 1.00 0.00 O ATOM 195 O5' C A 7 -1.900 -0.936 11.683 1.00 0.00 O ATOM 196 C5' C A 7 -1.365 0.352 11.985 1.00 0.00 C ATOM 197 C4' C A 7 -1.972 1.401 11.080 1.00 0.00 C ATOM 198 O4' C A 7 -1.942 0.930 9.706 1.00 0.00 O ATOM 199 C3' C A 7 -3.438 1.719 11.344 1.00 0.00 C ATOM 200 O3' C A 7 -3.589 2.707 12.363 1.00 0.00 O ATOM 201 C2' C A 7 -3.924 2.223 9.989 1.00 0.00 C ATOM 202 O2' C A 7 -3.563 3.576 9.795 1.00 0.00 O ATOM 203 C1' C A 7 -3.107 1.362 9.022 1.00 0.00 C ATOM 204 N1 C A 7 -3.814 0.168 8.520 1.00 0.00 N ATOM 205 C2 C A 7 -5.065 0.318 7.906 1.00 0.00 C ATOM 206 O2 C A 7 -5.546 1.455 7.784 1.00 0.00 O ATOM 207 N3 C A 7 -5.715 -0.780 7.457 1.00 0.00 N ATOM 208 C4 C A 7 -5.164 -1.987 7.601 1.00 0.00 C ATOM 209 N4 C A 7 -5.843 -3.041 7.147 1.00 0.00 N ATOM 210 C5 C A 7 -3.893 -2.167 8.217 1.00 0.00 C ATOM 211 C6 C A 7 -3.259 -1.073 8.655 1.00 0.00 C ATOM 0 H5' C A 7 -0.282 0.340 11.863 1.00 0.00 H new ATOM 0 H5'' C A 7 -1.566 0.601 13.027 1.00 0.00 H new ATOM 0 H4' C A 7 -1.376 2.293 11.272 1.00 0.00 H new ATOM 0 H3' C A 7 -4.004 0.863 11.710 1.00 0.00 H new ATOM 0 H2' C A 7 -5.006 2.160 9.872 1.00 0.00 H new ATOM 0 HO2' C A 7 -4.016 3.924 8.999 1.00 0.00 H new ATOM 0 H1' C A 7 -2.892 1.982 8.152 1.00 0.00 H new ATOM 0 H41 C A 7 -5.452 -3.978 7.240 1.00 0.00 H new ATOM 0 H42 C A 7 -6.753 -2.910 6.706 1.00 0.00 H new ATOM 0 H5 C A 7 -3.457 -3.149 8.327 1.00 0.00 H new ATOM 0 H6 C A 7 -2.291 -1.173 9.124 1.00 0.00 H new ATOM 223 P C A 8 -4.981 2.830 13.163 1.00 0.00 P ATOM 224 OP1 C A 8 -4.700 2.614 14.606 1.00 0.00 O ATOM 225 OP2 C A 8 -5.987 1.978 12.479 1.00 0.00 O ATOM 226 O5' C A 8 -5.415 4.352 12.963 1.00 0.00 O ATOM 227 C5' C A 8 -6.431 4.938 13.780 1.00 0.00 C ATOM 228 C4' C A 8 -6.930 6.227 13.163 1.00 0.00 C ATOM 229 O4' C A 8 -5.997 7.286 13.485 1.00 0.00 O ATOM 230 C3' C A 8 -7.025 6.235 11.643 1.00 0.00 C ATOM 231 O3' C A 8 -8.299 5.753 11.222 1.00 0.00 O ATOM 232 C2' C A 8 -6.815 7.706 11.274 1.00 0.00 C ATOM 233 O2' C A 8 -8.038 8.416 11.302 1.00 0.00 O ATOM 234 C1' C A 8 -5.943 8.219 12.425 1.00 0.00 C ATOM 235 N1 C A 8 -4.528 8.419 12.073 1.00 0.00 N ATOM 236 C2 C A 8 -4.079 9.708 11.765 1.00 0.00 C ATOM 237 O2 C A 8 -4.891 10.645 11.770 1.00 0.00 O ATOM 238 N3 C A 8 -2.773 9.899 11.471 1.00 0.00 N ATOM 239 C4 C A 8 -1.929 8.864 11.477 1.00 0.00 C ATOM 240 N4 C A 8 -0.648 9.105 11.197 1.00 0.00 N ATOM 241 C5 C A 8 -2.363 7.538 11.774 1.00 0.00 C ATOM 242 C6 C A 8 -3.659 7.366 12.063 1.00 0.00 C ATOM 0 H5' C A 8 -6.036 5.134 14.777 1.00 0.00 H new ATOM 0 H5'' C A 8 -7.260 4.239 13.897 1.00 0.00 H new ATOM 0 H4' C A 8 -7.934 6.353 13.568 1.00 0.00 H new ATOM 0 H3' C A 8 -6.296 5.586 11.158 1.00 0.00 H new ATOM 0 H2' C A 8 -6.389 7.828 10.278 1.00 0.00 H new ATOM 0 HO2' C A 8 -8.781 7.784 11.398 1.00 0.00 H new ATOM 0 H1' C A 8 -6.345 9.195 12.698 1.00 0.00 H new ATOM 0 H41 C A 8 0.026 8.339 11.192 1.00 0.00 H new ATOM 0 H42 C A 8 -0.342 10.055 10.988 1.00 0.00 H new ATOM 0 H5 C A 8 -1.674 6.706 11.766 1.00 0.00 H new ATOM 0 H6 C A 8 -4.024 6.376 12.293 1.00 0.00 H new ATOM 254 P A A 9 -8.467 5.097 9.764 1.00 0.00 P ATOM 255 OP1 A A 9 -9.919 4.932 9.494 1.00 0.00 O ATOM 256 OP2 A A 9 -7.572 3.914 9.701 1.00 0.00 O ATOM 257 O5' A A 9 -7.890 6.202 8.772 1.00 0.00 O ATOM 258 C5' A A 9 -8.640 7.374 8.453 1.00 0.00 C ATOM 259 C4' A A 9 -7.928 8.166 7.384 1.00 0.00 C ATOM 260 O4' A A 9 -6.753 8.805 7.961 1.00 0.00 O ATOM 261 C3' A A 9 -7.366 7.335 6.241 1.00 0.00 C ATOM 262 O3' A A 9 -8.340 7.042 5.243 1.00 0.00 O ATOM 263 C2' A A 9 -6.249 8.228 5.718 1.00 0.00 C ATOM 264 O2' A A 9 -6.760 9.304 4.953 1.00 0.00 O ATOM 265 C1' A A 9 -5.686 8.773 7.026 1.00 0.00 C ATOM 266 N9 A A 9 -4.615 7.931 7.556 1.00 0.00 N ATOM 267 C8 A A 9 -4.727 6.645 8.016 1.00 0.00 C ATOM 268 N7 A A 9 -3.599 6.138 8.447 1.00 0.00 N ATOM 269 C5 A A 9 -2.676 7.151 8.235 1.00 0.00 C ATOM 270 C6 A A 9 -1.296 7.235 8.472 1.00 0.00 C ATOM 271 N6 A A 9 -0.575 6.248 9.008 1.00 0.00 N ATOM 272 N1 A A 9 -0.670 8.381 8.136 1.00 0.00 N ATOM 273 C2 A A 9 -1.391 9.370 7.599 1.00 0.00 C ATOM 274 N3 A A 9 -2.695 9.418 7.341 1.00 0.00 N ATOM 275 C4 A A 9 -3.287 8.262 7.684 1.00 0.00 C ATOM 0 H5' A A 9 -8.770 7.987 9.345 1.00 0.00 H new ATOM 0 H5'' A A 9 -9.636 7.096 8.109 1.00 0.00 H new ATOM 0 H4' A A 9 -8.688 8.848 7.003 1.00 0.00 H new ATOM 0 H3' A A 9 -7.026 6.347 6.552 1.00 0.00 H new ATOM 0 H2' A A 9 -5.540 7.709 5.072 1.00 0.00 H new ATOM 0 HO2' A A 9 -7.652 9.073 4.618 1.00 0.00 H new ATOM 0 H1' A A 9 -5.264 9.762 6.848 1.00 0.00 H new ATOM 0 H8 A A 9 -5.659 6.100 8.023 1.00 0.00 H new ATOM 0 H61 A A 9 0.427 6.370 9.156 1.00 0.00 H new ATOM 0 H62 A A 9 -1.026 5.371 9.270 1.00 0.00 H new ATOM 0 H2 A A 9 -0.835 10.258 7.337 1.00 0.00 H new ATOM 287 P U A 10 -8.192 5.712 4.349 1.00 0.00 P ATOM 288 OP1 U A 10 -9.210 5.800 3.272 1.00 0.00 O ATOM 289 OP2 U A 10 -8.192 4.538 5.259 1.00 0.00 O ATOM 290 O5' U A 10 -6.753 5.854 3.668 1.00 0.00 O ATOM 291 C5' U A 10 -5.641 5.047 4.078 1.00 0.00 C ATOM 292 C4' U A 10 -5.136 4.211 2.917 1.00 0.00 C ATOM 293 O4' U A 10 -6.212 4.063 1.951 1.00 0.00 O ATOM 294 C3' U A 10 -3.952 4.799 2.148 1.00 0.00 C ATOM 295 O3' U A 10 -3.022 3.795 1.752 1.00 0.00 O ATOM 296 C2' U A 10 -4.598 5.470 0.939 1.00 0.00 C ATOM 297 O2' U A 10 -3.776 5.392 -0.209 1.00 0.00 O ATOM 298 C1' U A 10 -5.814 4.582 0.699 1.00 0.00 C ATOM 299 N1 U A 10 -6.941 5.326 0.126 1.00 0.00 N ATOM 300 C2 U A 10 -7.359 5.006 -1.152 1.00 0.00 C ATOM 301 O2 U A 10 -6.837 4.132 -1.821 1.00 0.00 O ATOM 302 N3 U A 10 -8.413 5.751 -1.618 1.00 0.00 N ATOM 303 C4 U A 10 -9.073 6.759 -0.949 1.00 0.00 C ATOM 304 O4 U A 10 -10.008 7.339 -1.502 1.00 0.00 O ATOM 305 C5 U A 10 -8.576 7.027 0.365 1.00 0.00 C ATOM 306 C6 U A 10 -7.550 6.320 0.846 1.00 0.00 C ATOM 0 H5' U A 10 -5.940 4.396 4.900 1.00 0.00 H new ATOM 0 H5'' U A 10 -4.839 5.684 4.451 1.00 0.00 H new ATOM 0 H4' U A 10 -4.801 3.277 3.368 1.00 0.00 H new ATOM 0 H3' U A 10 -3.370 5.493 2.754 1.00 0.00 H new ATOM 0 H2' U A 10 -4.801 6.527 1.113 1.00 0.00 H new ATOM 0 HO2' U A 10 -3.194 4.607 -0.142 1.00 0.00 H new ATOM 0 H1' U A 10 -5.540 3.799 -0.009 1.00 0.00 H new ATOM 0 H3 U A 10 -8.743 5.536 -2.559 1.00 0.00 H new ATOM 0 H5 U A 10 -9.030 7.800 0.967 1.00 0.00 H new ATOM 0 H6 U A 10 -7.187 6.540 1.839 1.00 0.00 H new ATOM 317 P A A 11 -1.487 3.894 2.226 1.00 0.00 P ATOM 318 OP1 A A 11 -0.652 3.139 1.259 1.00 0.00 O ATOM 319 OP2 A A 11 -1.449 3.529 3.665 1.00 0.00 O ATOM 320 O5' A A 11 -1.130 5.443 2.095 1.00 0.00 O ATOM 321 C5' A A 11 -1.228 6.123 0.843 1.00 0.00 C ATOM 322 C4' A A 11 -0.733 7.546 0.977 1.00 0.00 C ATOM 323 O4' A A 11 -1.220 8.108 2.233 1.00 0.00 O ATOM 324 C3' A A 11 0.785 7.689 1.023 1.00 0.00 C ATOM 325 O3' A A 11 1.327 7.922 -0.271 1.00 0.00 O ATOM 326 C2' A A 11 0.993 8.880 1.948 1.00 0.00 C ATOM 327 O2' A A 11 0.780 10.105 1.271 1.00 0.00 O ATOM 328 C1' A A 11 -0.139 8.671 2.948 1.00 0.00 C ATOM 329 N9 A A 11 0.193 7.777 4.056 1.00 0.00 N ATOM 330 C8 A A 11 -0.539 6.717 4.527 1.00 0.00 C ATOM 331 N7 A A 11 0.012 6.107 5.549 1.00 0.00 N ATOM 332 C5 A A 11 1.189 6.814 5.763 1.00 0.00 C ATOM 333 C6 A A 11 2.230 6.665 6.699 1.00 0.00 C ATOM 334 N6 A A 11 2.258 5.716 7.636 1.00 0.00 N ATOM 335 N1 A A 11 3.260 7.534 6.634 1.00 0.00 N ATOM 336 C2 A A 11 3.242 8.481 5.688 1.00 0.00 C ATOM 337 N3 A A 11 2.320 8.729 4.764 1.00 0.00 N ATOM 338 C4 A A 11 1.309 7.847 4.854 1.00 0.00 C ATOM 0 H5' A A 11 -2.263 6.122 0.501 1.00 0.00 H new ATOM 0 H5'' A A 11 -0.643 5.597 0.089 1.00 0.00 H new ATOM 0 H4' A A 11 -1.103 8.058 0.089 1.00 0.00 H new ATOM 0 H3' A A 11 1.289 6.789 1.374 1.00 0.00 H new ATOM 0 H2' A A 11 1.998 8.933 2.368 1.00 0.00 H new ATOM 0 HO2' A A 11 1.009 9.999 0.324 1.00 0.00 H new ATOM 0 H1' A A 11 -0.366 9.639 3.396 1.00 0.00 H new ATOM 0 H8 A A 11 -1.482 6.413 4.096 1.00 0.00 H new ATOM 0 H61 A A 11 3.043 5.663 8.285 1.00 0.00 H new ATOM 0 H62 A A 11 1.494 5.043 7.704 1.00 0.00 H new ATOM 0 H2 A A 11 4.100 9.137 5.674 1.00 0.00 H new ATOM 350 P C A 12 2.588 7.062 -0.776 1.00 0.00 P ATOM 351 OP1 C A 12 3.214 7.789 -1.909 1.00 0.00 O ATOM 352 OP2 C A 12 2.124 5.665 -0.970 1.00 0.00 O ATOM 353 O5' C A 12 3.598 7.084 0.458 1.00 0.00 O ATOM 354 C5' C A 12 4.461 8.199 0.682 1.00 0.00 C ATOM 355 C4' C A 12 5.575 7.821 1.633 1.00 0.00 C ATOM 356 O4' C A 12 5.040 7.723 2.982 1.00 0.00 O ATOM 357 C3' C A 12 6.232 6.472 1.387 1.00 0.00 C ATOM 358 O3' C A 12 7.250 6.568 0.392 1.00 0.00 O ATOM 359 C2' C A 12 6.784 6.128 2.765 1.00 0.00 C ATOM 360 O2' C A 12 7.965 6.859 3.038 1.00 0.00 O ATOM 361 C1' C A 12 5.666 6.650 3.668 1.00 0.00 C ATOM 362 N1 C A 12 4.638 5.646 3.991 1.00 0.00 N ATOM 363 C2 C A 12 4.911 4.688 4.974 1.00 0.00 C ATOM 364 O2 C A 12 6.017 4.697 5.533 1.00 0.00 O ATOM 365 N3 C A 12 3.962 3.777 5.289 1.00 0.00 N ATOM 366 C4 C A 12 2.785 3.793 4.660 1.00 0.00 C ATOM 367 N4 C A 12 1.875 2.886 5.016 1.00 0.00 N ATOM 368 C5 C A 12 2.488 4.741 3.639 1.00 0.00 C ATOM 369 C6 C A 12 3.433 5.644 3.343 1.00 0.00 C ATOM 0 H5' C A 12 3.890 9.032 1.093 1.00 0.00 H new ATOM 0 H5'' C A 12 4.882 8.537 -0.265 1.00 0.00 H new ATOM 0 H4' C A 12 6.320 8.602 1.481 1.00 0.00 H new ATOM 0 H3' C A 12 5.557 5.708 1.001 1.00 0.00 H new ATOM 0 H2' C A 12 7.036 5.074 2.883 1.00 0.00 H new ATOM 0 HO2' C A 12 8.347 7.189 2.198 1.00 0.00 H new ATOM 0 H1' C A 12 6.118 6.946 4.615 1.00 0.00 H new ATOM 0 H41 C A 12 0.965 2.869 4.556 1.00 0.00 H new ATOM 0 H42 C A 12 2.089 2.209 5.748 1.00 0.00 H new ATOM 0 H5 C A 12 1.539 4.732 3.124 1.00 0.00 H new ATOM 0 H6 C A 12 3.240 6.383 2.580 1.00 0.00 H new ATOM 381 P C A 13 7.405 5.411 -0.715 1.00 0.00 P ATOM 382 OP1 C A 13 8.440 5.844 -1.689 1.00 0.00 O ATOM 383 OP2 C A 13 6.048 5.051 -1.200 1.00 0.00 O ATOM 384 O5' C A 13 7.983 4.173 0.104 1.00 0.00 O ATOM 385 C5' C A 13 9.278 4.229 0.700 1.00 0.00 C ATOM 386 C4' C A 13 9.468 3.068 1.649 1.00 0.00 C ATOM 387 O4' C A 13 8.466 3.149 2.699 1.00 0.00 O ATOM 388 C3' C A 13 9.280 1.685 1.038 1.00 0.00 C ATOM 389 O3' C A 13 10.494 1.221 0.446 1.00 0.00 O ATOM 390 C2' C A 13 8.846 0.852 2.239 1.00 0.00 C ATOM 391 O2' C A 13 9.952 0.508 3.053 1.00 0.00 O ATOM 392 C1' C A 13 7.974 1.854 2.996 1.00 0.00 C ATOM 393 N1 C A 13 6.548 1.808 2.629 1.00 0.00 N ATOM 394 C2 C A 13 5.739 0.796 3.166 1.00 0.00 C ATOM 395 O2 C A 13 6.247 -0.044 3.925 1.00 0.00 O ATOM 396 N3 C A 13 4.426 0.760 2.843 1.00 0.00 N ATOM 397 C4 C A 13 3.918 1.678 2.017 1.00 0.00 C ATOM 398 N4 C A 13 2.618 1.613 1.734 1.00 0.00 N ATOM 399 C5 C A 13 4.720 2.708 1.446 1.00 0.00 C ATOM 400 C6 C A 13 6.015 2.737 1.779 1.00 0.00 C ATOM 0 H5' C A 13 9.399 5.170 1.237 1.00 0.00 H new ATOM 0 H5'' C A 13 10.044 4.204 -0.075 1.00 0.00 H new ATOM 0 H4' C A 13 10.500 3.160 1.986 1.00 0.00 H new ATOM 0 H3' C A 13 8.556 1.647 0.224 1.00 0.00 H new ATOM 0 H2' C A 13 8.362 -0.085 1.963 1.00 0.00 H new ATOM 0 HO2' C A 13 10.775 0.550 2.522 1.00 0.00 H new ATOM 0 H1' C A 13 8.030 1.602 4.055 1.00 0.00 H new ATOM 0 H41 C A 13 2.198 2.299 1.107 1.00 0.00 H new ATOM 0 H42 C A 13 2.043 0.878 2.145 1.00 0.00 H new ATOM 0 H5 C A 13 4.298 3.437 0.770 1.00 0.00 H new ATOM 0 H6 C A 13 6.651 3.508 1.369 1.00 0.00 H new ATOM 412 P C A 14 10.534 0.821 -1.115 1.00 0.00 P ATOM 413 OP1 C A 14 11.936 0.998 -1.570 1.00 0.00 O ATOM 414 OP2 C A 14 9.439 1.525 -1.832 1.00 0.00 O ATOM 415 O5' C A 14 10.206 -0.738 -1.123 1.00 0.00 O ATOM 416 C5' C A 14 11.065 -1.671 -0.470 1.00 0.00 C ATOM 417 C4' C A 14 10.382 -3.013 -0.348 1.00 0.00 C ATOM 418 O4' C A 14 9.328 -2.932 0.654 1.00 0.00 O ATOM 419 C3' C A 14 9.668 -3.506 -1.595 1.00 0.00 C ATOM 420 O3' C A 14 10.580 -4.123 -2.500 1.00 0.00 O ATOM 421 C2' C A 14 8.648 -4.472 -1.007 1.00 0.00 C ATOM 422 O2' C A 14 9.255 -5.681 -0.587 1.00 0.00 O ATOM 423 C1' C A 14 8.208 -3.694 0.232 1.00 0.00 C ATOM 424 N1 C A 14 7.083 -2.773 -0.012 1.00 0.00 N ATOM 425 C2 C A 14 5.802 -3.303 -0.198 1.00 0.00 C ATOM 426 O2 C A 14 5.644 -4.532 -0.155 1.00 0.00 O ATOM 427 N3 C A 14 4.767 -2.461 -0.421 1.00 0.00 N ATOM 428 C4 C A 14 4.975 -1.144 -0.462 1.00 0.00 C ATOM 429 N4 C A 14 3.927 -0.355 -0.682 1.00 0.00 N ATOM 430 C5 C A 14 6.268 -0.579 -0.277 1.00 0.00 C ATOM 431 C6 C A 14 7.283 -1.421 -0.058 1.00 0.00 C ATOM 0 H5' C A 14 11.332 -1.300 0.519 1.00 0.00 H new ATOM 0 H5'' C A 14 11.993 -1.777 -1.032 1.00 0.00 H new ATOM 0 H4' C A 14 11.199 -3.695 -0.113 1.00 0.00 H new ATOM 0 H3' C A 14 9.205 -2.724 -2.197 1.00 0.00 H new ATOM 0 H2' C A 14 7.862 -4.754 -1.707 1.00 0.00 H new ATOM 0 HO2' C A 14 8.573 -6.277 -0.214 1.00 0.00 H new ATOM 0 H1' C A 14 7.863 -4.410 0.978 1.00 0.00 H new ATOM 0 H41 C A 14 4.049 0.657 -0.720 1.00 0.00 H new ATOM 0 H42 C A 14 3.001 -0.762 -0.813 1.00 0.00 H new ATOM 0 H5 C A 14 6.423 0.489 -0.312 1.00 0.00 H new ATOM 0 H6 C A 14 8.278 -1.027 0.085 1.00 0.00 H new ATOM 443 P C A 15 10.349 -3.989 -4.086 1.00 0.00 P ATOM 444 OP1 C A 15 11.558 -4.533 -4.755 1.00 0.00 O ATOM 445 OP2 C A 15 9.898 -2.608 -4.398 1.00 0.00 O ATOM 446 O5' C A 15 9.139 -4.984 -4.371 1.00 0.00 O ATOM 447 C5' C A 15 9.193 -6.339 -3.934 1.00 0.00 C ATOM 448 C4' C A 15 7.798 -6.902 -3.811 1.00 0.00 C ATOM 449 O4' C A 15 7.032 -6.068 -2.901 1.00 0.00 O ATOM 450 C3' C A 15 6.976 -6.910 -5.091 1.00 0.00 C ATOM 451 O3' C A 15 7.269 -8.055 -5.887 1.00 0.00 O ATOM 452 C2' C A 15 5.549 -6.912 -4.556 1.00 0.00 C ATOM 453 O2' C A 15 5.172 -8.201 -4.111 1.00 0.00 O ATOM 454 C1' C A 15 5.687 -5.994 -3.340 1.00 0.00 C ATOM 455 N1 C A 15 5.361 -4.585 -3.624 1.00 0.00 N ATOM 456 C2 C A 15 4.023 -4.235 -3.812 1.00 0.00 C ATOM 457 O2 C A 15 3.156 -5.116 -3.725 1.00 0.00 O ATOM 458 N3 C A 15 3.704 -2.952 -4.082 1.00 0.00 N ATOM 459 C4 C A 15 4.663 -2.030 -4.167 1.00 0.00 C ATOM 460 N4 C A 15 4.296 -0.778 -4.443 1.00 0.00 N ATOM 461 C5 C A 15 6.039 -2.353 -3.974 1.00 0.00 C ATOM 462 C6 C A 15 6.340 -3.631 -3.706 1.00 0.00 C ATOM 0 H5' C A 15 9.703 -6.399 -2.973 1.00 0.00 H new ATOM 0 H5'' C A 15 9.772 -6.934 -4.640 1.00 0.00 H new ATOM 0 H4' C A 15 7.955 -7.931 -3.487 1.00 0.00 H new ATOM 0 H3' C A 15 7.176 -6.070 -5.757 1.00 0.00 H new ATOM 0 H2' C A 15 4.808 -6.610 -5.296 1.00 0.00 H new ATOM 0 HO2' C A 15 5.759 -8.872 -4.518 1.00 0.00 H new ATOM 0 H1' C A 15 4.977 -6.332 -2.585 1.00 0.00 H new ATOM 0 H41 C A 15 5.001 -0.044 -4.516 1.00 0.00 H new ATOM 0 H42 C A 15 3.310 -0.554 -4.581 1.00 0.00 H new ATOM 0 H5 C A 15 6.808 -1.597 -4.041 1.00 0.00 H new ATOM 0 H6 C A 15 7.371 -3.913 -3.552 1.00 0.00 H new ATOM 474 P G A 16 7.586 -7.883 -7.456 1.00 0.00 P ATOM 475 OP1 G A 16 8.163 -9.170 -7.922 1.00 0.00 O ATOM 476 OP2 G A 16 8.345 -6.623 -7.666 1.00 0.00 O ATOM 477 O5' G A 16 6.147 -7.720 -8.121 1.00 0.00 O ATOM 478 C5' G A 16 5.310 -8.853 -8.346 1.00 0.00 C ATOM 479 C4' G A 16 3.865 -8.422 -8.460 1.00 0.00 C ATOM 480 O4' G A 16 3.581 -7.439 -7.430 1.00 0.00 O ATOM 481 C3' G A 16 3.488 -7.726 -9.759 1.00 0.00 C ATOM 482 O3' G A 16 3.174 -8.670 -10.781 1.00 0.00 O ATOM 483 C2' G A 16 2.280 -6.890 -9.349 1.00 0.00 C ATOM 484 O2' G A 16 1.106 -7.678 -9.289 1.00 0.00 O ATOM 485 C1' G A 16 2.663 -6.482 -7.925 1.00 0.00 C ATOM 486 N9 G A 16 3.282 -5.162 -7.840 1.00 0.00 N ATOM 487 C8 G A 16 4.579 -4.871 -7.495 1.00 0.00 C ATOM 488 N7 G A 16 4.839 -3.593 -7.500 1.00 0.00 N ATOM 489 C5 G A 16 3.640 -3.003 -7.876 1.00 0.00 C ATOM 490 C6 G A 16 3.304 -1.637 -8.058 1.00 0.00 C ATOM 491 O6 G A 16 4.021 -0.639 -7.918 1.00 0.00 O ATOM 492 N1 G A 16 1.977 -1.485 -8.444 1.00 0.00 N ATOM 493 C2 G A 16 1.087 -2.511 -8.633 1.00 0.00 C ATOM 494 N2 G A 16 -0.147 -2.159 -9.012 1.00 0.00 N ATOM 495 N3 G A 16 1.385 -3.786 -8.466 1.00 0.00 N ATOM 496 C4 G A 16 2.669 -3.959 -8.090 1.00 0.00 C ATOM 0 H5' G A 16 5.421 -9.564 -7.528 1.00 0.00 H new ATOM 0 H5'' G A 16 5.617 -9.365 -9.258 1.00 0.00 H new ATOM 0 H4' G A 16 3.304 -9.353 -8.384 1.00 0.00 H new ATOM 0 H3' G A 16 4.291 -7.126 -10.186 1.00 0.00 H new ATOM 0 H2' G A 16 2.072 -6.071 -10.037 1.00 0.00 H new ATOM 0 HO2' G A 16 0.348 -7.116 -9.022 1.00 0.00 H new ATOM 0 H1' G A 16 1.744 -6.439 -7.341 1.00 0.00 H new ATOM 0 H8 G A 16 5.311 -5.625 -7.245 1.00 0.00 H new ATOM 0 H1 G A 16 1.639 -0.535 -8.599 1.00 0.00 H new ATOM 0 H21 G A 16 -0.856 -2.875 -9.169 1.00 0.00 H new ATOM 0 H22 G A 16 -0.379 -1.174 -9.144 1.00 0.00 H new ATOM 508 P A A 17 3.330 -8.259 -12.330 1.00 0.00 P ATOM 509 OP1 A A 17 3.108 -9.489 -13.132 1.00 0.00 O ATOM 510 OP2 A A 17 4.590 -7.492 -12.502 1.00 0.00 O ATOM 511 O5' A A 17 2.106 -7.273 -12.598 1.00 0.00 O ATOM 512 C5' A A 17 0.759 -7.739 -12.543 1.00 0.00 C ATOM 513 C4' A A 17 -0.158 -6.768 -13.250 1.00 0.00 C ATOM 514 O4' A A 17 -0.431 -5.653 -12.360 1.00 0.00 O ATOM 515 C3' A A 17 0.413 -6.133 -14.511 1.00 0.00 C ATOM 516 O3' A A 17 0.188 -6.947 -15.667 1.00 0.00 O ATOM 517 C2' A A 17 -0.320 -4.797 -14.577 1.00 0.00 C ATOM 518 O2' A A 17 -1.624 -4.947 -15.110 1.00 0.00 O ATOM 519 C1' A A 17 -0.437 -4.443 -13.094 1.00 0.00 C ATOM 520 N9 A A 17 0.653 -3.602 -12.601 1.00 0.00 N ATOM 521 C8 A A 17 1.870 -4.004 -12.107 1.00 0.00 C ATOM 522 N7 A A 17 2.643 -3.012 -11.737 1.00 0.00 N ATOM 523 C5 A A 17 1.886 -1.881 -12.006 1.00 0.00 C ATOM 524 C6 A A 17 2.141 -0.509 -11.836 1.00 0.00 C ATOM 525 N6 A A 17 3.278 -0.025 -11.335 1.00 0.00 N ATOM 526 N1 A A 17 1.175 0.360 -12.205 1.00 0.00 N ATOM 527 C2 A A 17 0.034 -0.126 -12.709 1.00 0.00 C ATOM 528 N3 A A 17 -0.323 -1.392 -12.916 1.00 0.00 N ATOM 529 C4 A A 17 0.658 -2.229 -12.539 1.00 0.00 C ATOM 0 H5' A A 17 0.448 -7.854 -11.505 1.00 0.00 H new ATOM 0 H5'' A A 17 0.687 -8.722 -13.008 1.00 0.00 H new ATOM 0 H4' A A 17 -1.029 -7.362 -13.527 1.00 0.00 H new ATOM 0 H3' A A 17 1.496 -6.016 -14.487 1.00 0.00 H new ATOM 0 H2' A A 17 0.186 -4.061 -15.202 1.00 0.00 H new ATOM 0 HO2' A A 17 -1.641 -5.712 -15.722 1.00 0.00 H new ATOM 0 HO3' A A 17 0.567 -6.506 -16.456 1.00 0.00 H new ATOM 0 H1' A A 17 -1.357 -3.873 -12.967 1.00 0.00 H new ATOM 0 H8 A A 17 2.163 -5.041 -12.031 1.00 0.00 H new ATOM 0 H61 A A 17 3.404 0.982 -11.236 1.00 0.00 H new ATOM 0 H62 A A 17 4.022 -0.662 -11.051 1.00 0.00 H new ATOM 0 H2 A A 17 -0.702 0.614 -12.987 1.00 0.00 H new TER 542 A A 17