USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 G O2' : rot 180:sc= -0.253 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot 180:sc= -0.382 USER MOD Single : A 3 A O2' : rot -29:sc= 0.144 USER MOD Single : A 4 U O2' : rot 180:sc= -0.237 USER MOD Single : A 5 G O2' : rot -16:sc= 0.2 USER MOD Single : A 6 U O2' : rot -16:sc= -0.437 USER MOD Single : A 7 C O2' : rot -12:sc= -0.206 USER MOD Single : A 8 C O2' : rot -18:sc= 0.165 USER MOD Single : A 8 C O3' : rot 180:sc= 0.187 USER MOD Single : B 9 G O2' : rot 180:sc= -0.228 USER MOD Single : B 9 G O5' : rot 180:sc= -0.0101 USER MOD Single : B 10 G O2' : rot -24:sc= 0.055 USER MOD Single : B 11 A O2' : rot -24:sc= 0.161 USER MOD Single : B 12 U O2' : rot -170:sc= -0.279 USER MOD Single : B 13 G O2' : rot -6:sc= 0.0854 USER MOD Single : B 14 U O2' : rot -16:sc= -0.413 USER MOD Single : B 15 C O2' : rot 180:sc= -0.283 USER MOD Single : B 16 C O2' : rot -20:sc= 0.177 USER MOD Single : B 16 C O3' : rot 180:sc= 0.172 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 5.378 -8.120 5.566 1.00 0.00 O ATOM 2 C5' G A 1 6.727 -8.521 5.667 1.00 0.00 C ATOM 3 C4' G A 1 7.645 -7.385 5.210 1.00 0.00 C ATOM 4 O4' G A 1 7.414 -7.047 3.843 1.00 0.00 O ATOM 5 C3' G A 1 7.413 -6.102 5.981 1.00 0.00 C ATOM 6 O3' G A 1 7.988 -6.131 7.275 1.00 0.00 O ATOM 7 C2' G A 1 8.109 -5.128 5.061 1.00 0.00 C ATOM 8 O2' G A 1 9.509 -5.271 5.180 1.00 0.00 O ATOM 9 C1' G A 1 7.677 -5.643 3.688 1.00 0.00 C ATOM 10 N9 G A 1 6.441 -4.946 3.273 1.00 0.00 N ATOM 11 C8 G A 1 5.149 -5.409 3.265 1.00 0.00 C ATOM 12 N7 G A 1 4.275 -4.532 2.856 1.00 0.00 N ATOM 13 C5 G A 1 5.038 -3.404 2.572 1.00 0.00 C ATOM 14 C6 G A 1 4.636 -2.123 2.092 1.00 0.00 C ATOM 15 O6 G A 1 3.503 -1.732 1.822 1.00 0.00 O ATOM 16 N1 G A 1 5.722 -1.270 1.937 1.00 0.00 N ATOM 17 C2 G A 1 7.032 -1.600 2.210 1.00 0.00 C ATOM 18 N2 G A 1 7.948 -0.647 2.006 1.00 0.00 N ATOM 19 N3 G A 1 7.414 -2.799 2.663 1.00 0.00 N ATOM 20 C4 G A 1 6.367 -3.650 2.821 1.00 0.00 C ATOM 0 H5' G A 1 6.899 -9.407 5.056 1.00 0.00 H new ATOM 0 H5'' G A 1 6.958 -8.795 6.697 1.00 0.00 H new ATOM 0 H4' G A 1 8.654 -7.762 5.376 1.00 0.00 H new ATOM 0 H3' G A 1 6.368 -5.874 6.191 1.00 0.00 H new ATOM 0 H2' G A 1 7.870 -4.083 5.258 1.00 0.00 H new ATOM 0 HO2' G A 1 9.955 -4.637 4.580 1.00 0.00 H new ATOM 0 HO5' G A 1 4.796 -8.852 5.858 1.00 0.00 H new ATOM 0 H1' G A 1 8.443 -5.467 2.933 1.00 0.00 H new ATOM 0 H8 G A 1 4.880 -6.410 3.570 1.00 0.00 H new ATOM 0 H1 G A 1 5.535 -0.327 1.595 1.00 0.00 H new ATOM 0 H21 G A 1 8.933 -0.838 2.192 1.00 0.00 H new ATOM 0 H22 G A 1 7.662 0.271 1.664 1.00 0.00 H new ATOM 33 P G A 2 7.605 -5.012 8.379 1.00 0.00 P ATOM 34 OP1 G A 2 8.337 -5.328 9.625 1.00 0.00 O ATOM 35 OP2 G A 2 6.131 -4.888 8.407 1.00 0.00 O ATOM 36 O5' G A 2 8.209 -3.644 7.778 1.00 0.00 O ATOM 37 C5' G A 2 9.600 -3.403 7.781 1.00 0.00 C ATOM 38 C4' G A 2 9.890 -2.047 7.131 1.00 0.00 C ATOM 39 O4' G A 2 9.394 -1.997 5.790 1.00 0.00 O ATOM 40 C3' G A 2 9.215 -0.890 7.846 1.00 0.00 C ATOM 41 O3' G A 2 9.891 -0.503 9.028 1.00 0.00 O ATOM 42 C2' G A 2 9.307 0.162 6.765 1.00 0.00 C ATOM 43 O2' G A 2 10.636 0.628 6.641 1.00 0.00 O ATOM 44 C1' G A 2 8.952 -0.654 5.528 1.00 0.00 C ATOM 45 N9 G A 2 7.482 -0.627 5.342 1.00 0.00 N ATOM 46 C8 G A 2 6.555 -1.595 5.634 1.00 0.00 C ATOM 47 N7 G A 2 5.326 -1.252 5.367 1.00 0.00 N ATOM 48 C5 G A 2 5.440 0.040 4.867 1.00 0.00 C ATOM 49 C6 G A 2 4.429 0.936 4.415 1.00 0.00 C ATOM 50 O6 G A 2 3.217 0.748 4.356 1.00 0.00 O ATOM 51 N1 G A 2 4.966 2.152 4.009 1.00 0.00 N ATOM 52 C2 G A 2 6.307 2.469 4.026 1.00 0.00 C ATOM 53 N2 G A 2 6.642 3.691 3.599 1.00 0.00 N ATOM 54 N3 G A 2 7.261 1.628 4.444 1.00 0.00 N ATOM 55 C4 G A 2 6.756 0.435 4.852 1.00 0.00 C ATOM 0 H5' G A 2 10.117 -4.195 7.239 1.00 0.00 H new ATOM 0 H5'' G A 2 9.979 -3.416 8.803 1.00 0.00 H new ATOM 0 H4' G A 2 10.975 -1.949 7.177 1.00 0.00 H new ATOM 0 H3' G A 2 8.208 -1.103 8.206 1.00 0.00 H new ATOM 0 H2' G A 2 8.681 1.036 6.943 1.00 0.00 H new ATOM 0 HO2' G A 2 10.680 1.308 5.936 1.00 0.00 H new ATOM 0 H1' G A 2 9.421 -0.259 4.627 1.00 0.00 H new ATOM 0 H8 G A 2 6.820 -2.556 6.049 1.00 0.00 H new ATOM 0 H1 G A 2 4.318 2.864 3.673 1.00 0.00 H new ATOM 0 H21 G A 2 7.621 3.978 3.591 1.00 0.00 H new ATOM 0 H22 G A 2 5.919 4.336 3.282 1.00 0.00 H new ATOM 67 P A A 3 9.162 0.432 10.137 1.00 0.00 P ATOM 68 OP1 A A 3 10.128 0.681 11.230 1.00 0.00 O ATOM 69 OP2 A A 3 7.848 -0.173 10.446 1.00 0.00 O ATOM 70 O5' A A 3 8.900 1.828 9.372 1.00 0.00 O ATOM 71 C5' A A 3 9.971 2.688 9.049 1.00 0.00 C ATOM 72 C4' A A 3 9.449 3.911 8.291 1.00 0.00 C ATOM 73 O4' A A 3 8.726 3.526 7.119 1.00 0.00 O ATOM 74 C3' A A 3 8.480 4.760 9.090 1.00 0.00 C ATOM 75 O3' A A 3 9.139 5.618 9.999 1.00 0.00 O ATOM 76 C2' A A 3 7.799 5.537 7.997 1.00 0.00 C ATOM 77 O2' A A 3 8.646 6.573 7.541 1.00 0.00 O ATOM 78 C1' A A 3 7.666 4.478 6.908 1.00 0.00 C ATOM 79 N9 A A 3 6.349 3.807 7.021 1.00 0.00 N ATOM 80 C8 A A 3 6.056 2.530 7.431 1.00 0.00 C ATOM 81 N7 A A 3 4.789 2.228 7.364 1.00 0.00 N ATOM 82 C5 A A 3 4.195 3.392 6.891 1.00 0.00 C ATOM 83 C6 A A 3 2.860 3.731 6.607 1.00 0.00 C ATOM 84 N6 A A 3 1.839 2.877 6.751 1.00 0.00 N ATOM 85 N1 A A 3 2.611 4.983 6.183 1.00 0.00 N ATOM 86 C2 A A 3 3.626 5.831 6.041 1.00 0.00 C ATOM 87 N3 A A 3 4.919 5.629 6.259 1.00 0.00 N ATOM 88 C4 A A 3 5.135 4.365 6.693 1.00 0.00 C ATOM 0 H5' A A 3 10.703 2.158 8.440 1.00 0.00 H new ATOM 0 H5'' A A 3 10.482 3.004 9.959 1.00 0.00 H new ATOM 0 H4' A A 3 10.350 4.481 8.064 1.00 0.00 H new ATOM 0 H3' A A 3 7.807 4.178 9.720 1.00 0.00 H new ATOM 0 H2' A A 3 6.861 6.002 8.299 1.00 0.00 H new ATOM 0 HO2' A A 3 9.233 6.860 8.271 1.00 0.00 H new ATOM 0 H1' A A 3 7.735 4.922 5.915 1.00 0.00 H new ATOM 0 H8 A A 3 6.808 1.837 7.778 1.00 0.00 H new ATOM 0 H61 A A 3 0.889 3.176 6.530 1.00 0.00 H new ATOM 0 H62 A A 3 2.011 1.927 7.081 1.00 0.00 H new ATOM 0 H2 A A 3 3.361 6.821 5.701 1.00 0.00 H new ATOM 100 P U A 4 8.734 5.633 11.551 1.00 0.00 P ATOM 101 OP1 U A 4 9.698 6.485 12.282 1.00 0.00 O ATOM 102 OP2 U A 4 8.490 4.242 11.989 1.00 0.00 O ATOM 103 O5' U A 4 7.325 6.405 11.475 1.00 0.00 O ATOM 104 C5' U A 4 7.282 7.777 11.136 1.00 0.00 C ATOM 105 C4' U A 4 5.842 8.202 10.847 1.00 0.00 C ATOM 106 O4' U A 4 5.321 7.502 9.720 1.00 0.00 O ATOM 107 C3' U A 4 4.893 7.894 11.986 1.00 0.00 C ATOM 108 O3' U A 4 4.993 8.843 13.033 1.00 0.00 O ATOM 109 C2' U A 4 3.569 7.975 11.261 1.00 0.00 C ATOM 110 O2' U A 4 3.215 9.327 11.061 1.00 0.00 O ATOM 111 C1' U A 4 3.906 7.356 9.902 1.00 0.00 C ATOM 112 N1 U A 4 3.528 5.921 9.885 1.00 0.00 N ATOM 113 C2 U A 4 2.197 5.624 9.642 1.00 0.00 C ATOM 114 O2 U A 4 1.362 6.504 9.445 1.00 0.00 O ATOM 115 N3 U A 4 1.856 4.280 9.632 1.00 0.00 N ATOM 116 C4 U A 4 2.724 3.222 9.849 1.00 0.00 C ATOM 117 O4 U A 4 2.314 2.064 9.829 1.00 0.00 O ATOM 118 C5 U A 4 4.097 3.621 10.080 1.00 0.00 C ATOM 119 C6 U A 4 4.453 4.928 10.088 1.00 0.00 C ATOM 0 H5' U A 4 7.907 7.963 10.262 1.00 0.00 H new ATOM 0 H5'' U A 4 7.689 8.374 11.952 1.00 0.00 H new ATOM 0 H4' U A 4 5.898 9.278 10.680 1.00 0.00 H new ATOM 0 H3' U A 4 5.076 6.945 12.490 1.00 0.00 H new ATOM 0 H2' U A 4 2.750 7.491 11.794 1.00 0.00 H new ATOM 0 HO2' U A 4 2.357 9.374 10.590 1.00 0.00 H new ATOM 0 H1' U A 4 3.358 7.850 9.099 1.00 0.00 H new ATOM 0 H3 U A 4 0.879 4.050 9.449 1.00 0.00 H new ATOM 0 H5 U A 4 4.849 2.864 10.249 1.00 0.00 H new ATOM 0 H6 U A 4 5.486 5.194 10.258 1.00 0.00 H new ATOM 130 P G A 5 4.222 8.615 14.432 1.00 0.00 P ATOM 131 OP1 G A 5 4.616 9.702 15.356 1.00 0.00 O ATOM 132 OP2 G A 5 4.413 7.204 14.833 1.00 0.00 O ATOM 133 O5' G A 5 2.672 8.822 14.049 1.00 0.00 O ATOM 134 C5' G A 5 2.141 10.115 13.832 1.00 0.00 C ATOM 135 C4' G A 5 0.656 9.996 13.484 1.00 0.00 C ATOM 136 O4' G A 5 0.462 9.214 12.311 1.00 0.00 O ATOM 137 C3' G A 5 -0.120 9.269 14.562 1.00 0.00 C ATOM 138 O3' G A 5 -0.407 10.100 15.678 1.00 0.00 O ATOM 139 C2' G A 5 -1.365 8.898 13.796 1.00 0.00 C ATOM 140 O2' G A 5 -2.254 9.992 13.774 1.00 0.00 O ATOM 141 C1' G A 5 -0.853 8.654 12.382 1.00 0.00 C ATOM 142 N9 G A 5 -0.822 7.203 12.122 1.00 0.00 N ATOM 143 C8 G A 5 0.226 6.335 12.227 1.00 0.00 C ATOM 144 N7 G A 5 -0.079 5.095 11.953 1.00 0.00 N ATOM 145 C5 G A 5 -1.437 5.146 11.652 1.00 0.00 C ATOM 146 C6 G A 5 -2.341 4.103 11.284 1.00 0.00 C ATOM 147 O6 G A 5 -2.114 2.905 11.127 1.00 0.00 O ATOM 148 N1 G A 5 -3.625 4.589 11.099 1.00 0.00 N ATOM 149 C2 G A 5 -4.007 5.903 11.231 1.00 0.00 C ATOM 150 N2 G A 5 -5.296 6.176 11.001 1.00 0.00 N ATOM 151 N3 G A 5 -3.167 6.885 11.566 1.00 0.00 N ATOM 152 C4 G A 5 -1.901 6.436 11.762 1.00 0.00 C ATOM 0 H5' G A 5 2.678 10.611 13.023 1.00 0.00 H new ATOM 0 H5'' G A 5 2.270 10.729 14.724 1.00 0.00 H new ATOM 0 H4' G A 5 0.309 11.022 13.360 1.00 0.00 H new ATOM 0 H3' G A 5 0.409 8.427 15.008 1.00 0.00 H new ATOM 0 H2' G A 5 -1.890 8.046 14.227 1.00 0.00 H new ATOM 0 HO2' G A 5 -1.993 10.640 14.461 1.00 0.00 H new ATOM 0 H1' G A 5 -1.497 9.115 11.633 1.00 0.00 H new ATOM 0 H8 G A 5 1.220 6.646 12.512 1.00 0.00 H new ATOM 0 H1 G A 5 -4.347 3.916 10.844 1.00 0.00 H new ATOM 0 H21 G A 5 -5.637 7.134 11.084 1.00 0.00 H new ATOM 0 H22 G A 5 -5.938 5.426 10.743 1.00 0.00 H new ATOM 164 P U A 6 -0.892 9.465 17.089 1.00 0.00 P ATOM 165 OP1 U A 6 -0.999 10.565 18.072 1.00 0.00 O ATOM 166 OP2 U A 6 -0.024 8.304 17.382 1.00 0.00 O ATOM 167 O5' U A 6 -2.383 8.909 16.801 1.00 0.00 O ATOM 168 C5' U A 6 -3.517 9.751 16.902 1.00 0.00 C ATOM 169 C4' U A 6 -4.799 8.933 16.671 1.00 0.00 C ATOM 170 O4' U A 6 -4.833 8.347 15.361 1.00 0.00 O ATOM 171 C3' U A 6 -4.932 7.762 17.632 1.00 0.00 C ATOM 172 O3' U A 6 -5.394 8.134 18.914 1.00 0.00 O ATOM 173 C2' U A 6 -5.962 6.944 16.899 1.00 0.00 C ATOM 174 O2' U A 6 -7.233 7.550 17.019 1.00 0.00 O ATOM 175 C1' U A 6 -5.504 7.072 15.460 1.00 0.00 C ATOM 176 N1 U A 6 -4.572 5.968 15.112 1.00 0.00 N ATOM 177 C2 U A 6 -5.119 4.808 14.580 1.00 0.00 C ATOM 178 O2 U A 6 -6.330 4.660 14.433 1.00 0.00 O ATOM 179 N3 U A 6 -4.221 3.817 14.224 1.00 0.00 N ATOM 180 C4 U A 6 -2.844 3.880 14.352 1.00 0.00 C ATOM 181 O4 U A 6 -2.142 2.927 14.025 1.00 0.00 O ATOM 182 C5 U A 6 -2.360 5.130 14.892 1.00 0.00 C ATOM 183 C6 U A 6 -3.220 6.110 15.254 1.00 0.00 C ATOM 0 H5' U A 6 -3.451 10.554 16.168 1.00 0.00 H new ATOM 0 H5'' U A 6 -3.546 10.219 17.886 1.00 0.00 H new ATOM 0 H4' U A 6 -5.604 9.653 16.816 1.00 0.00 H new ATOM 0 H3' U A 6 -3.988 7.261 17.848 1.00 0.00 H new ATOM 0 H2' U A 6 -6.046 5.921 17.265 1.00 0.00 H new ATOM 0 HO2' U A 6 -7.216 8.203 17.750 1.00 0.00 H new ATOM 0 H1' U A 6 -6.346 7.013 14.770 1.00 0.00 H new ATOM 0 H3 U A 6 -4.610 2.960 13.831 1.00 0.00 H new ATOM 0 H5 U A 6 -1.297 5.284 15.008 1.00 0.00 H new ATOM 0 H6 U A 6 -2.828 7.028 15.666 1.00 0.00 H new ATOM 194 P C A 7 -5.309 7.094 20.152 1.00 0.00 P ATOM 195 OP1 C A 7 -5.978 7.712 21.318 1.00 0.00 O ATOM 196 OP2 C A 7 -3.903 6.645 20.268 1.00 0.00 O ATOM 197 O5' C A 7 -6.196 5.826 19.676 1.00 0.00 O ATOM 198 C5' C A 7 -7.610 5.872 19.700 1.00 0.00 C ATOM 199 C4' C A 7 -8.187 4.521 19.251 1.00 0.00 C ATOM 200 O4' C A 7 -7.788 4.177 17.920 1.00 0.00 O ATOM 201 C3' C A 7 -7.701 3.374 20.111 1.00 0.00 C ATOM 202 O3' C A 7 -8.362 3.318 21.361 1.00 0.00 O ATOM 203 C2' C A 7 -8.064 2.204 19.225 1.00 0.00 C ATOM 204 O2' C A 7 -9.453 1.956 19.304 1.00 0.00 O ATOM 205 C1' C A 7 -7.743 2.736 17.827 1.00 0.00 C ATOM 206 N1 C A 7 -6.394 2.269 17.402 1.00 0.00 N ATOM 207 C2 C A 7 -6.273 0.934 17.023 1.00 0.00 C ATOM 208 O2 C A 7 -7.255 0.196 17.026 1.00 0.00 O ATOM 209 N3 C A 7 -5.044 0.477 16.653 1.00 0.00 N ATOM 210 C4 C A 7 -3.978 1.287 16.657 1.00 0.00 C ATOM 211 N4 C A 7 -2.791 0.799 16.285 1.00 0.00 N ATOM 212 C5 C A 7 -4.088 2.662 17.039 1.00 0.00 C ATOM 213 C6 C A 7 -5.312 3.107 17.395 1.00 0.00 C ATOM 0 H5' C A 7 -7.967 6.666 19.044 1.00 0.00 H new ATOM 0 H5'' C A 7 -7.957 6.109 20.706 1.00 0.00 H new ATOM 0 H4' C A 7 -9.266 4.652 19.328 1.00 0.00 H new ATOM 0 H3' C A 7 -6.648 3.431 20.388 1.00 0.00 H new ATOM 0 H2' C A 7 -7.545 1.283 19.490 1.00 0.00 H new ATOM 0 HO2' C A 7 -9.835 2.470 20.046 1.00 0.00 H new ATOM 0 H1' C A 7 -8.455 2.376 17.085 1.00 0.00 H new ATOM 0 H41 C A 7 -1.969 1.403 16.283 1.00 0.00 H new ATOM 0 H42 C A 7 -2.707 -0.178 16.003 1.00 0.00 H new ATOM 0 H5 C A 7 -3.228 3.316 17.042 1.00 0.00 H new ATOM 0 H6 C A 7 -5.439 4.141 17.679 1.00 0.00 H new ATOM 225 P C A 8 -7.787 2.402 22.559 1.00 0.00 P ATOM 226 OP1 C A 8 -8.699 2.532 23.717 1.00 0.00 O ATOM 227 OP2 C A 8 -6.350 2.714 22.720 1.00 0.00 O ATOM 228 O5' C A 8 -7.907 0.897 21.997 1.00 0.00 O ATOM 229 C5' C A 8 -9.147 0.221 21.973 1.00 0.00 C ATOM 230 C4' C A 8 -8.931 -1.207 21.466 1.00 0.00 C ATOM 231 O4' C A 8 -8.425 -1.221 20.136 1.00 0.00 O ATOM 232 C3' C A 8 -7.891 -1.944 22.284 1.00 0.00 C ATOM 233 O3' C A 8 -8.402 -2.407 23.516 1.00 0.00 O ATOM 234 C2' C A 8 -7.553 -3.080 21.351 1.00 0.00 C ATOM 235 O2' C A 8 -8.530 -4.095 21.455 1.00 0.00 O ATOM 236 C1' C A 8 -7.652 -2.422 19.974 1.00 0.00 C ATOM 237 N1 C A 8 -6.283 -2.097 19.515 1.00 0.00 N ATOM 238 C2 C A 8 -5.553 -3.111 18.901 1.00 0.00 C ATOM 239 O2 C A 8 -6.072 -4.204 18.681 1.00 0.00 O ATOM 240 N3 C A 8 -4.259 -2.859 18.561 1.00 0.00 N ATOM 241 C4 C A 8 -3.699 -1.671 18.825 1.00 0.00 C ATOM 242 N4 C A 8 -2.426 -1.463 18.472 1.00 0.00 N ATOM 243 C5 C A 8 -4.432 -0.630 19.481 1.00 0.00 C ATOM 244 C6 C A 8 -5.714 -0.890 19.800 1.00 0.00 C ATOM 0 H5' C A 8 -9.849 0.747 21.326 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.585 0.203 22.971 1.00 0.00 H new ATOM 0 H4' C A 8 -9.910 -1.681 21.535 1.00 0.00 H new ATOM 0 H3' C A 8 -7.040 -1.330 22.579 1.00 0.00 H new ATOM 0 H2' C A 8 -6.586 -3.539 21.556 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.033 -3.981 22.288 1.00 0.00 H new ATOM 0 HO3' C A 8 -7.696 -2.877 24.007 1.00 0.00 H new ATOM 0 H1' C A 8 -8.124 -3.075 19.240 1.00 0.00 H new ATOM 0 H41 C A 8 -1.983 -0.565 18.665 1.00 0.00 H new ATOM 0 H42 C A 8 -1.898 -2.203 18.010 1.00 0.00 H new ATOM 0 H5 C A 8 -3.976 0.322 19.710 1.00 0.00 H new ATOM 0 H6 C A 8 -6.303 -0.129 20.291 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 2.502 -9.063 13.465 1.00 0.00 O ATOM 259 C5' G B 9 1.983 -10.370 13.350 1.00 0.00 C ATOM 260 C4' G B 9 0.557 -10.417 13.905 1.00 0.00 C ATOM 261 O4' G B 9 0.527 -10.086 15.293 1.00 0.00 O ATOM 262 C3' G B 9 -0.364 -9.418 13.232 1.00 0.00 C ATOM 263 O3' G B 9 -0.801 -9.855 11.959 1.00 0.00 O ATOM 264 C2' G B 9 -1.485 -9.373 14.244 1.00 0.00 C ATOM 265 O2' G B 9 -2.271 -10.544 14.151 1.00 0.00 O ATOM 266 C1' G B 9 -0.708 -9.401 15.560 1.00 0.00 C ATOM 267 N9 G B 9 -0.425 -8.014 15.991 1.00 0.00 N ATOM 268 C8 G B 9 0.757 -7.319 15.943 1.00 0.00 C ATOM 269 N7 G B 9 0.672 -6.097 16.388 1.00 0.00 N ATOM 270 C5 G B 9 -0.663 -5.967 16.759 1.00 0.00 C ATOM 271 C6 G B 9 -1.355 -4.849 17.311 1.00 0.00 C ATOM 272 O6 G B 9 -0.910 -3.736 17.582 1.00 0.00 O ATOM 273 N1 G B 9 -2.695 -5.139 17.543 1.00 0.00 N ATOM 274 C2 G B 9 -3.299 -6.350 17.278 1.00 0.00 C ATOM 275 N2 G B 9 -4.602 -6.446 17.561 1.00 0.00 N ATOM 276 N3 G B 9 -2.654 -7.400 16.757 1.00 0.00 N ATOM 277 C4 G B 9 -1.342 -7.138 16.523 1.00 0.00 C ATOM 0 H5' G B 9 2.617 -11.071 13.893 1.00 0.00 H new ATOM 0 H5'' G B 9 1.986 -10.681 12.305 1.00 0.00 H new ATOM 0 H4' G B 9 0.221 -11.438 13.721 1.00 0.00 H new ATOM 0 H3' G B 9 0.092 -8.453 13.012 1.00 0.00 H new ATOM 0 H2' G B 9 -2.157 -8.524 14.123 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.994 -10.506 14.811 1.00 0.00 H new ATOM 0 HO5' G B 9 3.415 -9.041 13.110 1.00 0.00 H new ATOM 0 H1' G B 9 -1.273 -9.900 16.347 1.00 0.00 H new ATOM 0 H8 G B 9 1.676 -7.746 15.570 1.00 0.00 H new ATOM 0 H1 G B 9 -3.275 -4.400 17.939 1.00 0.00 H new ATOM 0 H21 G B 9 -5.099 -7.319 17.385 1.00 0.00 H new ATOM 0 H22 G B 9 -5.099 -5.646 17.953 1.00 0.00 H new ATOM 290 P G B 10 -1.497 -8.826 10.921 1.00 0.00 P ATOM 291 OP1 G B 10 -1.816 -9.570 9.683 1.00 0.00 O ATOM 292 OP2 G B 10 -0.651 -7.614 10.850 1.00 0.00 O ATOM 293 O5' G B 10 -2.885 -8.424 11.635 1.00 0.00 O ATOM 294 C5' G B 10 -3.962 -9.335 11.691 1.00 0.00 C ATOM 295 C4' G B 10 -5.138 -8.696 12.433 1.00 0.00 C ATOM 296 O4' G B 10 -4.767 -8.310 13.759 1.00 0.00 O ATOM 297 C3' G B 10 -5.633 -7.421 11.777 1.00 0.00 C ATOM 298 O3' G B 10 -6.431 -7.660 10.631 1.00 0.00 O ATOM 299 C2' G B 10 -6.438 -6.859 12.921 1.00 0.00 C ATOM 300 O2' G B 10 -7.612 -7.625 13.099 1.00 0.00 O ATOM 301 C1' G B 10 -5.503 -7.122 14.095 1.00 0.00 C ATOM 302 N9 G B 10 -4.573 -5.978 14.244 1.00 0.00 N ATOM 303 C8 G B 10 -3.250 -5.889 13.889 1.00 0.00 C ATOM 304 N7 G B 10 -2.707 -4.734 14.151 1.00 0.00 N ATOM 305 C5 G B 10 -3.743 -3.997 14.712 1.00 0.00 C ATOM 306 C6 G B 10 -3.752 -2.654 15.189 1.00 0.00 C ATOM 307 O6 G B 10 -2.824 -1.850 15.219 1.00 0.00 O ATOM 308 N1 G B 10 -5.007 -2.287 15.661 1.00 0.00 N ATOM 309 C2 G B 10 -6.115 -3.107 15.682 1.00 0.00 C ATOM 310 N2 G B 10 -7.243 -2.581 16.170 1.00 0.00 N ATOM 311 N3 G B 10 -6.108 -4.371 15.241 1.00 0.00 N ATOM 312 C4 G B 10 -4.892 -4.748 14.770 1.00 0.00 C ATOM 0 H5' G B 10 -3.652 -10.249 12.198 1.00 0.00 H new ATOM 0 H5'' G B 10 -4.265 -9.617 10.683 1.00 0.00 H new ATOM 0 H4' G B 10 -5.913 -9.462 12.422 1.00 0.00 H new ATOM 0 H3' G B 10 -4.848 -6.773 11.388 1.00 0.00 H new ATOM 0 H2' G B 10 -6.741 -5.820 12.790 1.00 0.00 H new ATOM 0 HO2' G B 10 -7.838 -8.078 12.260 1.00 0.00 H new ATOM 0 H1' G B 10 -6.048 -7.244 15.031 1.00 0.00 H new ATOM 0 H8 G B 10 -2.707 -6.704 13.433 1.00 0.00 H new ATOM 0 H1 G B 10 -5.116 -1.338 16.019 1.00 0.00 H new ATOM 0 H21 G B 10 -8.093 -3.144 16.209 1.00 0.00 H new ATOM 0 H22 G B 10 -7.254 -1.617 16.503 1.00 0.00 H new ATOM 324 P A B 11 -6.697 -6.485 9.541 1.00 0.00 P ATOM 325 OP1 A B 11 -7.575 -7.035 8.484 1.00 0.00 O ATOM 326 OP2 A B 11 -5.388 -5.902 9.175 1.00 0.00 O ATOM 327 O5' A B 11 -7.532 -5.363 10.350 1.00 0.00 O ATOM 328 C5' A B 11 -8.886 -5.572 10.691 1.00 0.00 C ATOM 329 C4' A B 11 -9.424 -4.365 11.464 1.00 0.00 C ATOM 330 O4' A B 11 -8.634 -4.100 12.626 1.00 0.00 O ATOM 331 C3' A B 11 -9.407 -3.073 10.671 1.00 0.00 C ATOM 332 O3' A B 11 -10.501 -2.976 9.783 1.00 0.00 O ATOM 333 C2' A B 11 -9.501 -2.053 11.772 1.00 0.00 C ATOM 334 O2' A B 11 -10.830 -1.977 12.247 1.00 0.00 O ATOM 335 C1' A B 11 -8.616 -2.677 12.845 1.00 0.00 C ATOM 336 N9 A B 11 -7.233 -2.161 12.716 1.00 0.00 N ATOM 337 C8 A B 11 -6.095 -2.817 12.315 1.00 0.00 C ATOM 338 N7 A B 11 -5.017 -2.085 12.361 1.00 0.00 N ATOM 339 C5 A B 11 -5.471 -0.851 12.810 1.00 0.00 C ATOM 340 C6 A B 11 -4.818 0.368 13.068 1.00 0.00 C ATOM 341 N6 A B 11 -3.500 0.542 12.915 1.00 0.00 N ATOM 342 N1 A B 11 -5.573 1.405 13.476 1.00 0.00 N ATOM 343 C2 A B 11 -6.882 1.232 13.629 1.00 0.00 C ATOM 344 N3 A B 11 -7.607 0.138 13.435 1.00 0.00 N ATOM 345 C4 A B 11 -6.823 -0.884 13.017 1.00 0.00 C ATOM 0 H5' A B 11 -8.982 -6.474 11.296 1.00 0.00 H new ATOM 0 H5'' A B 11 -9.477 -5.729 9.789 1.00 0.00 H new ATOM 0 H4' A B 11 -10.450 -4.644 11.705 1.00 0.00 H new ATOM 0 H3' A B 11 -8.535 -2.965 10.027 1.00 0.00 H new ATOM 0 H2' A B 11 -9.211 -1.046 11.472 1.00 0.00 H new ATOM 0 HO2' A B 11 -11.445 -2.288 11.550 1.00 0.00 H new ATOM 0 H1' A B 11 -8.977 -2.433 13.844 1.00 0.00 H new ATOM 0 H8 A B 11 -6.093 -3.847 11.991 1.00 0.00 H new ATOM 0 H61 A B 11 -3.078 1.449 13.117 1.00 0.00 H new ATOM 0 H62 A B 11 -2.917 -0.232 12.597 1.00 0.00 H new ATOM 0 H2 A B 11 -7.431 2.102 13.957 1.00 0.00 H new ATOM 357 P U B 12 -10.266 -2.696 8.221 1.00 0.00 P ATOM 358 OP1 U B 12 -11.561 -2.830 7.517 1.00 0.00 O ATOM 359 OP2 U B 12 -9.093 -3.477 7.773 1.00 0.00 O ATOM 360 O5' U B 12 -9.866 -1.140 8.261 1.00 0.00 O ATOM 361 C5' U B 12 -10.833 -0.163 8.591 1.00 0.00 C ATOM 362 C4' U B 12 -10.153 1.180 8.850 1.00 0.00 C ATOM 363 O4' U B 12 -9.276 1.097 9.970 1.00 0.00 O ATOM 364 C3' U B 12 -9.286 1.636 7.696 1.00 0.00 C ATOM 365 O3' U B 12 -10.050 2.187 6.639 1.00 0.00 O ATOM 366 C2' U B 12 -8.440 2.674 8.395 1.00 0.00 C ATOM 367 O2' U B 12 -9.192 3.854 8.577 1.00 0.00 O ATOM 368 C1' U B 12 -8.209 2.033 9.767 1.00 0.00 C ATOM 369 N1 U B 12 -6.900 1.336 9.793 1.00 0.00 N ATOM 370 C2 U B 12 -5.778 2.119 10.005 1.00 0.00 C ATOM 371 O2 U B 12 -5.859 3.335 10.167 1.00 0.00 O ATOM 372 N3 U B 12 -4.559 1.459 10.025 1.00 0.00 N ATOM 373 C4 U B 12 -4.371 0.098 9.844 1.00 0.00 C ATOM 374 O4 U B 12 -3.242 -0.385 9.868 1.00 0.00 O ATOM 375 C5 U B 12 -5.598 -0.647 9.643 1.00 0.00 C ATOM 376 C6 U B 12 -6.799 -0.022 9.627 1.00 0.00 C ATOM 0 H5' U B 12 -11.389 -0.474 9.475 1.00 0.00 H new ATOM 0 H5'' U B 12 -11.554 -0.064 7.779 1.00 0.00 H new ATOM 0 H4' U B 12 -10.972 1.881 9.011 1.00 0.00 H new ATOM 0 H3' U B 12 -8.721 0.843 7.206 1.00 0.00 H new ATOM 0 H2' U B 12 -7.531 2.934 7.853 1.00 0.00 H new ATOM 0 HO2' U B 12 -8.602 4.574 8.883 1.00 0.00 H new ATOM 0 H1' U B 12 -8.196 2.786 10.555 1.00 0.00 H new ATOM 0 H3 U B 12 -3.726 2.026 10.187 1.00 0.00 H new ATOM 0 H5 U B 12 -5.554 -1.717 9.504 1.00 0.00 H new ATOM 0 H6 U B 12 -7.696 -0.605 9.480 1.00 0.00 H new ATOM 387 P G B 13 -9.358 2.577 5.235 1.00 0.00 P ATOM 388 OP1 G B 13 -10.422 3.005 4.300 1.00 0.00 O ATOM 389 OP2 G B 13 -8.446 1.476 4.854 1.00 0.00 O ATOM 390 O5' G B 13 -8.464 3.865 5.600 1.00 0.00 O ATOM 391 C5' G B 13 -9.059 5.133 5.801 1.00 0.00 C ATOM 392 C4' G B 13 -7.969 6.152 6.140 1.00 0.00 C ATOM 393 O4' G B 13 -7.258 5.777 7.314 1.00 0.00 O ATOM 394 C3' G B 13 -6.912 6.224 5.059 1.00 0.00 C ATOM 395 O3' G B 13 -7.331 6.988 3.939 1.00 0.00 O ATOM 396 C2' G B 13 -5.792 6.895 5.813 1.00 0.00 C ATOM 397 O2' G B 13 -5.985 8.294 5.818 1.00 0.00 O ATOM 398 C1' G B 13 -5.956 6.369 7.233 1.00 0.00 C ATOM 399 N9 G B 13 -4.905 5.372 7.503 1.00 0.00 N ATOM 400 C8 G B 13 -4.966 4.011 7.409 1.00 0.00 C ATOM 401 N7 G B 13 -3.843 3.407 7.688 1.00 0.00 N ATOM 402 C5 G B 13 -2.968 4.449 7.982 1.00 0.00 C ATOM 403 C6 G B 13 -1.588 4.422 8.351 1.00 0.00 C ATOM 404 O6 G B 13 -0.853 3.449 8.514 1.00 0.00 O ATOM 405 N1 G B 13 -1.087 5.700 8.531 1.00 0.00 N ATOM 406 C2 G B 13 -1.804 6.865 8.390 1.00 0.00 C ATOM 407 N2 G B 13 -1.142 8.005 8.615 1.00 0.00 N ATOM 408 N3 G B 13 -3.096 6.899 8.051 1.00 0.00 N ATOM 409 C4 G B 13 -3.612 5.658 7.862 1.00 0.00 C ATOM 0 H5' G B 13 -9.789 5.081 6.609 1.00 0.00 H new ATOM 0 H5'' G B 13 -9.596 5.442 4.904 1.00 0.00 H new ATOM 0 H4' G B 13 -8.492 7.101 6.259 1.00 0.00 H new ATOM 0 H3' G B 13 -6.654 5.260 4.621 1.00 0.00 H new ATOM 0 H2' G B 13 -4.812 6.696 5.380 1.00 0.00 H new ATOM 0 HO2' G B 13 -6.749 8.521 5.248 1.00 0.00 H new ATOM 0 H1' G B 13 -5.862 7.164 7.973 1.00 0.00 H new ATOM 0 H8 G B 13 -5.864 3.481 7.129 1.00 0.00 H new ATOM 0 H1 G B 13 -0.104 5.785 8.790 1.00 0.00 H new ATOM 0 H21 G B 13 -1.623 8.900 8.525 1.00 0.00 H new ATOM 0 H22 G B 13 -0.156 7.979 8.876 1.00 0.00 H new ATOM 421 P U B 14 -6.505 6.950 2.547 1.00 0.00 P ATOM 422 OP1 U B 14 -7.227 7.786 1.563 1.00 0.00 O ATOM 423 OP2 U B 14 -6.220 5.533 2.233 1.00 0.00 O ATOM 424 O5' U B 14 -5.099 7.676 2.881 1.00 0.00 O ATOM 425 C5' U B 14 -4.983 9.086 2.897 1.00 0.00 C ATOM 426 C4' U B 14 -3.517 9.488 3.137 1.00 0.00 C ATOM 427 O4' U B 14 -3.050 9.069 4.427 1.00 0.00 O ATOM 428 C3' U B 14 -2.561 8.846 2.143 1.00 0.00 C ATOM 429 O3' U B 14 -2.543 9.485 0.882 1.00 0.00 O ATOM 430 C2' U B 14 -1.264 9.051 2.876 1.00 0.00 C ATOM 431 O2' U B 14 -0.890 10.411 2.809 1.00 0.00 O ATOM 432 C1' U B 14 -1.653 8.732 4.305 1.00 0.00 C ATOM 433 N1 U B 14 -1.448 7.291 4.596 1.00 0.00 N ATOM 434 C2 U B 14 -0.224 6.908 5.129 1.00 0.00 C ATOM 435 O2 U B 14 0.694 7.706 5.305 1.00 0.00 O ATOM 436 N3 U B 14 -0.091 5.569 5.453 1.00 0.00 N ATOM 437 C4 U B 14 -1.060 4.592 5.295 1.00 0.00 C ATOM 438 O4 U B 14 -0.826 3.426 5.600 1.00 0.00 O ATOM 439 C5 U B 14 -2.307 5.082 4.752 1.00 0.00 C ATOM 440 C6 U B 14 -2.455 6.384 4.419 1.00 0.00 C ATOM 0 H5' U B 14 -5.616 9.503 3.680 1.00 0.00 H new ATOM 0 H5'' U B 14 -5.332 9.499 1.951 1.00 0.00 H new ATOM 0 H4' U B 14 -3.519 10.573 3.037 1.00 0.00 H new ATOM 0 H3' U B 14 -2.813 7.816 1.889 1.00 0.00 H new ATOM 0 H2' U B 14 -0.440 8.456 2.482 1.00 0.00 H new ATOM 0 HO2' U B 14 -1.397 10.855 2.098 1.00 0.00 H new ATOM 0 H1' U B 14 -1.041 9.293 5.011 1.00 0.00 H new ATOM 0 H3 U B 14 0.804 5.274 5.844 1.00 0.00 H new ATOM 0 H5 U B 14 -3.131 4.399 4.610 1.00 0.00 H new ATOM 0 H6 U B 14 -3.394 6.716 4.002 1.00 0.00 H new ATOM 451 P C B 15 -1.822 8.782 -0.384 1.00 0.00 P ATOM 452 OP1 C B 15 -1.847 9.735 -1.516 1.00 0.00 O ATOM 453 OP2 C B 15 -2.413 7.435 -0.549 1.00 0.00 O ATOM 454 O5' C B 15 -0.283 8.594 0.082 1.00 0.00 O ATOM 455 C5' C B 15 0.617 9.684 0.094 1.00 0.00 C ATOM 456 C4' C B 15 2.011 9.209 0.529 1.00 0.00 C ATOM 457 O4' C B 15 2.004 8.639 1.843 1.00 0.00 O ATOM 458 C3' C B 15 2.547 8.111 -0.363 1.00 0.00 C ATOM 459 O3' C B 15 3.013 8.604 -1.606 1.00 0.00 O ATOM 460 C2' C B 15 3.672 7.596 0.504 1.00 0.00 C ATOM 461 O2' C B 15 4.762 8.491 0.449 1.00 0.00 O ATOM 462 C1' C B 15 3.063 7.659 1.906 1.00 0.00 C ATOM 463 N1 C B 15 2.536 6.322 2.294 1.00 0.00 N ATOM 464 C2 C B 15 3.467 5.350 2.652 1.00 0.00 C ATOM 465 O2 C B 15 4.668 5.613 2.654 1.00 0.00 O ATOM 466 N3 C B 15 3.012 4.113 2.996 1.00 0.00 N ATOM 467 C4 C B 15 1.701 3.835 2.984 1.00 0.00 C ATOM 468 N4 C B 15 1.296 2.610 3.332 1.00 0.00 N ATOM 469 C5 C B 15 0.732 4.823 2.621 1.00 0.00 C ATOM 470 C6 C B 15 1.195 6.048 2.292 1.00 0.00 C ATOM 0 H5' C B 15 0.258 10.455 0.775 1.00 0.00 H new ATOM 0 H5'' C B 15 0.670 10.134 -0.898 1.00 0.00 H new ATOM 0 H4' C B 15 2.627 10.107 0.480 1.00 0.00 H new ATOM 0 H3' C B 15 1.811 7.361 -0.655 1.00 0.00 H new ATOM 0 H2' C B 15 4.031 6.610 0.209 1.00 0.00 H new ATOM 0 HO2' C B 15 5.490 8.155 1.013 1.00 0.00 H new ATOM 0 H1' C B 15 3.802 7.939 2.656 1.00 0.00 H new ATOM 0 H41 C B 15 0.302 2.381 3.328 1.00 0.00 H new ATOM 0 H42 C B 15 1.981 1.904 3.601 1.00 0.00 H new ATOM 0 H5 C B 15 -0.324 4.599 2.611 1.00 0.00 H new ATOM 0 H6 C B 15 0.495 6.825 2.023 1.00 0.00 H new ATOM 482 P C B 16 3.336 7.596 -2.825 1.00 0.00 P ATOM 483 OP1 C B 16 3.814 8.399 -3.973 1.00 0.00 O ATOM 484 OP2 C B 16 2.171 6.700 -2.994 1.00 0.00 O ATOM 485 O5' C B 16 4.568 6.710 -2.287 1.00 0.00 O ATOM 486 C5' C B 16 5.883 7.226 -2.256 1.00 0.00 C ATOM 487 C4' C B 16 6.837 6.138 -1.757 1.00 0.00 C ATOM 488 O4' C B 16 6.503 5.717 -0.438 1.00 0.00 O ATOM 489 C3' C B 16 6.751 4.883 -2.600 1.00 0.00 C ATOM 490 O3' C B 16 7.467 5.000 -3.812 1.00 0.00 O ATOM 491 C2' C B 16 7.382 3.874 -1.673 1.00 0.00 C ATOM 492 O2' C B 16 8.790 3.964 -1.753 1.00 0.00 O ATOM 493 C1' C B 16 6.921 4.349 -0.294 1.00 0.00 C ATOM 494 N1 C B 16 5.784 3.503 0.133 1.00 0.00 N ATOM 495 C2 C B 16 6.080 2.288 0.742 1.00 0.00 C ATOM 496 O2 C B 16 7.246 1.980 0.980 1.00 0.00 O ATOM 497 N3 C B 16 5.048 1.456 1.056 1.00 0.00 N ATOM 498 C4 C B 16 3.783 1.794 0.773 1.00 0.00 C ATOM 499 N4 C B 16 2.799 0.950 1.101 1.00 0.00 N ATOM 500 C5 C B 16 3.470 3.030 0.121 1.00 0.00 C ATOM 501 C6 C B 16 4.499 3.847 -0.173 1.00 0.00 C ATOM 0 H5' C B 16 5.930 8.096 -1.601 1.00 0.00 H new ATOM 0 H5'' C B 16 6.180 7.559 -3.251 1.00 0.00 H new ATOM 0 H4' C B 16 7.829 6.587 -1.804 1.00 0.00 H new ATOM 0 H3' C B 16 5.740 4.633 -2.922 1.00 0.00 H new ATOM 0 H2' C B 16 7.109 2.844 -1.901 1.00 0.00 H new ATOM 0 HO2' C B 16 9.042 4.410 -2.588 1.00 0.00 H new ATOM 0 HO3' C B 16 7.385 4.167 -4.322 1.00 0.00 H new ATOM 0 H1' C B 16 7.713 4.276 0.452 1.00 0.00 H new ATOM 0 H41 C B 16 1.830 1.191 0.893 1.00 0.00 H new ATOM 0 H42 C B 16 3.018 0.065 1.559 1.00 0.00 H new ATOM 0 H5 C B 16 2.452 3.295 -0.124 1.00 0.00 H new ATOM 0 H6 C B 16 4.304 4.791 -0.660 1.00 0.00 H new TER 514 C B 16