USER MOD reduce.3.24.130724 H: found=0, std=0, add=254, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 256 hydrogens (42 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 Set 1.1: A 100 TOA O2 : rot 159:sc= 1.7 USER MOD Set 1.2: A 101 2TB N1 :NH3+ 171:sc= -0.585! (180deg=-0.873!) USER MOD Set 2.1: A 100 TOA O6 : rot -120:sc= 1.05 USER MOD Set 2.2: A 101 2TB O5 : rot -173:sc= 0.489 USER MOD Set 2.3: A 102 TOC N2 :NH3+ 154:sc= 3.28 (180deg=1.44) USER MOD Single : A 4 A O2' : rot -126:sc= 1.11 USER MOD Single : A 4 A O5' : rot 12:sc= 0.104 USER MOD Single : A 5 C O2' : rot -17:sc= 0.232 USER MOD Single : A 6 U O2' : rot -23:sc= 0.293 USER MOD Single : A 7 U O2' : rot -24:sc= 0.329 USER MOD Single : A 8 G O2' : rot -15:sc= 0.481 USER MOD Single : A 9 G O2' : rot -30:sc= 0.172 USER MOD Single : A 10 U O2' : rot -28:sc= 0.34 USER MOD Single : A 11 U O2' : rot 171:sc= 0.81 USER MOD Single : A 12 U O2' : rot -144:sc= 1.28 USER MOD Single : A 13 A O2' : rot -78:sc= 1.18 USER MOD Single : A 14 G O2' : rot -27:sc= 0.368 USER MOD Single : A 15 G O2' : rot -42:sc= 0.853 USER MOD Single : A 16 U O2' : rot -73:sc= 1.16 USER MOD Single : A 17 A O2' : rot -78:sc= 1.08 USER MOD Single : A 18 A O2' : rot -17:sc= 0.281 USER MOD Single : A 19 U O2' : rot -22:sc= 0.411 USER MOD Single : A 20 G O2' : rot -31:sc= 0.255 USER MOD Single : A 21 A O2' : rot -18:sc= 0.347 USER MOD Single : A 22 G O2' : rot -30:sc= 0.309 USER MOD Single : A 23 U O2' : rot 140:sc= 0.674 USER MOD Single : A 23 U O3' : rot 131:sc= 0.0981 USER MOD Single : A 100 TOA N3 :NH3+ -116:sc= 2.6 (180deg=-0.99!) USER MOD Single : A 100 TOA O4 : rot 170:sc= 0.335 USER MOD Single : A 101 2TB N3 :NH3+ -172:sc= 1.27 (180deg=1.13) USER MOD Single : A 102 TOC N6 :NH3+ 161:sc= 0.851 (180deg=0.548!) USER MOD Single : A 102 TOC O4 : rot 74:sc= 1.44! USER MOD ----------------------------------------------------------------- ATOM 1 O5' A A 4 5.552 7.323 -8.249 1.00 2.73 O ATOM 2 C5' A A 4 5.020 8.650 -8.214 1.00 2.53 C ATOM 3 C4' A A 4 4.080 8.832 -7.026 1.00 2.30 C ATOM 4 O4' A A 4 3.464 10.120 -7.091 1.00 2.15 O ATOM 5 C3' A A 4 2.899 7.882 -6.997 1.00 2.10 C ATOM 6 O3' A A 4 3.336 6.684 -6.335 1.00 2.26 O ATOM 7 C2' A A 4 1.933 8.612 -6.075 1.00 1.86 C ATOM 8 O2' A A 4 2.279 8.408 -4.703 1.00 1.94 O ATOM 9 C1' A A 4 2.158 10.073 -6.486 1.00 1.88 C ATOM 10 N9 A A 4 1.164 10.542 -7.472 1.00 1.66 N ATOM 11 C8 A A 4 1.202 10.450 -8.841 1.00 1.69 C ATOM 12 N7 A A 4 0.164 10.977 -9.430 1.00 1.48 N ATOM 13 C5 A A 4 -0.613 11.448 -8.376 1.00 1.30 C ATOM 14 C6 A A 4 -1.849 12.115 -8.324 1.00 1.07 C ATOM 15 N6 A A 4 -2.559 12.442 -9.401 1.00 0.98 N ATOM 16 N1 A A 4 -2.334 12.437 -7.118 1.00 1.00 N ATOM 17 C2 A A 4 -1.636 12.118 -6.034 1.00 1.11 C ATOM 18 N3 A A 4 -0.471 11.497 -5.947 1.00 1.32 N ATOM 19 C4 A A 4 -0.012 11.188 -7.177 1.00 1.41 C ATOM 0 H5' A A 4 4.484 8.855 -9.141 1.00 2.53 H new ATOM 0 H5'' A A 4 5.835 9.371 -8.151 1.00 2.53 H new ATOM 0 H4' A A 4 4.720 8.665 -6.159 1.00 2.30 H new ATOM 0 H3' A A 4 2.482 7.628 -7.972 1.00 2.10 H new ATOM 0 H2' A A 4 0.899 8.279 -6.162 1.00 1.86 H new ATOM 0 HO2' A A 4 1.502 8.061 -4.218 1.00 1.94 H new ATOM 0 HO5' A A 4 5.061 6.757 -7.617 1.00 2.73 H new ATOM 0 H1' A A 4 2.065 10.716 -5.611 1.00 1.88 H new ATOM 0 H8 A A 4 2.014 9.985 -9.380 1.00 1.69 H new ATOM 0 H61 A A 4 -3.450 12.926 -9.296 1.00 0.98 H new ATOM 0 H62 A A 4 -2.212 12.208 -10.331 1.00 0.98 H new ATOM 0 H2 A A 4 -2.081 12.405 -5.093 1.00 1.11 H new ATOM 32 P C A 5 2.405 5.369 -6.295 1.00 2.25 P ATOM 33 OP1 C A 5 3.287 4.182 -6.224 1.00 2.57 O ATOM 34 OP2 C A 5 1.403 5.479 -7.381 1.00 2.07 O ATOM 35 O5' C A 5 1.642 5.516 -4.883 1.00 2.12 O ATOM 36 C5' C A 5 0.245 5.222 -4.770 1.00 1.88 C ATOM 37 C4' C A 5 -0.447 6.157 -3.783 1.00 1.61 C ATOM 38 O4' C A 5 -0.233 7.521 -4.188 1.00 1.51 O ATOM 39 C3' C A 5 -1.962 6.021 -3.730 1.00 1.30 C ATOM 40 O3' C A 5 -2.276 5.074 -2.699 1.00 1.38 O ATOM 41 C2' C A 5 -2.379 7.397 -3.242 1.00 1.04 C ATOM 42 O2' C A 5 -2.107 7.552 -1.847 1.00 1.13 O ATOM 43 C1' C A 5 -1.456 8.274 -4.080 1.00 1.19 C ATOM 44 N1 C A 5 -1.991 8.524 -5.440 1.00 1.07 N ATOM 45 C2 C A 5 -3.030 9.438 -5.573 1.00 0.81 C ATOM 46 O2 C A 5 -3.502 9.998 -4.587 1.00 0.72 O ATOM 47 N3 C A 5 -3.527 9.685 -6.813 1.00 0.73 N ATOM 48 C4 C A 5 -3.028 9.060 -7.884 1.00 0.90 C ATOM 49 N4 C A 5 -3.552 9.351 -9.069 1.00 0.84 N ATOM 50 C5 C A 5 -1.965 8.116 -7.759 1.00 1.19 C ATOM 51 C6 C A 5 -1.478 7.880 -6.529 1.00 1.26 C ATOM 0 H5' C A 5 0.115 4.189 -4.446 1.00 1.88 H new ATOM 0 H5'' C A 5 -0.227 5.311 -5.749 1.00 1.88 H new ATOM 0 H4' C A 5 -0.021 5.891 -2.815 1.00 1.61 H new ATOM 0 H3' C A 5 -2.429 5.709 -4.664 1.00 1.30 H new ATOM 0 H2' C A 5 -3.441 7.618 -3.346 1.00 1.04 H new ATOM 0 HO2' C A 5 -1.964 6.671 -1.442 1.00 1.13 H new ATOM 0 H1' C A 5 -1.333 9.252 -3.615 1.00 1.19 H new ATOM 0 H41 C A 5 -3.197 8.894 -9.909 1.00 0.84 H new ATOM 0 H42 C A 5 -4.309 10.031 -9.139 1.00 0.84 H new ATOM 0 H5 C A 5 -1.565 7.608 -8.624 1.00 1.19 H new ATOM 0 H6 C A 5 -0.672 7.173 -6.401 1.00 1.26 H new ATOM 63 P U A 6 -3.736 4.396 -2.619 1.00 1.37 P ATOM 64 OP1 U A 6 -3.729 3.399 -1.526 1.00 1.58 O ATOM 65 OP2 U A 6 -4.141 3.988 -3.987 1.00 1.54 O ATOM 66 O5' U A 6 -4.670 5.633 -2.175 1.00 1.00 O ATOM 67 C5' U A 6 -5.088 5.801 -0.813 1.00 0.97 C ATOM 68 C4' U A 6 -6.458 6.468 -0.731 1.00 0.82 C ATOM 69 O4' U A 6 -6.387 7.775 -1.326 1.00 0.68 O ATOM 70 C3' U A 6 -7.554 5.758 -1.512 1.00 0.87 C ATOM 71 O3' U A 6 -8.220 4.869 -0.603 1.00 1.05 O ATOM 72 C2' U A 6 -8.509 6.892 -1.838 1.00 0.76 C ATOM 73 O2' U A 6 -9.287 7.252 -0.692 1.00 0.80 O ATOM 74 C1' U A 6 -7.518 8.000 -2.189 1.00 0.60 C ATOM 75 N1 U A 6 -7.062 7.948 -3.598 1.00 0.54 N ATOM 76 C2 U A 6 -7.899 8.476 -4.563 1.00 0.50 C ATOM 77 O2 U A 6 -8.998 8.950 -4.302 1.00 0.53 O ATOM 78 N3 U A 6 -7.425 8.440 -5.854 1.00 0.47 N ATOM 79 C4 U A 6 -6.214 7.935 -6.265 1.00 0.49 C ATOM 80 O4 U A 6 -5.912 7.967 -7.452 1.00 0.50 O ATOM 81 C5 U A 6 -5.396 7.398 -5.207 1.00 0.54 C ATOM 82 C6 U A 6 -5.842 7.422 -3.926 1.00 0.56 C ATOM 0 H5' U A 6 -4.355 6.404 -0.277 1.00 0.97 H new ATOM 0 H5'' U A 6 -5.124 4.830 -0.319 1.00 0.97 H new ATOM 0 H4' U A 6 -6.704 6.462 0.331 1.00 0.82 H new ATOM 0 H3' U A 6 -7.206 5.203 -2.383 1.00 0.87 H new ATOM 0 H2' U A 6 -9.237 6.664 -2.617 1.00 0.76 H new ATOM 0 HO2' U A 6 -9.324 6.495 -0.071 1.00 0.80 H new ATOM 0 H1' U A 6 -7.990 8.974 -2.060 1.00 0.60 H new ATOM 0 H3 U A 6 -8.032 8.826 -6.577 1.00 0.47 H new ATOM 0 H5 U A 6 -4.428 6.976 -5.434 1.00 0.54 H new ATOM 0 H6 U A 6 -5.218 7.015 -3.144 1.00 0.56 H new ATOM 93 P U A 7 -9.142 3.670 -1.154 1.00 0.64 P ATOM 94 OP1 U A 7 -10.520 4.184 -1.318 1.00 0.95 O ATOM 95 OP2 U A 7 -8.896 2.475 -0.317 1.00 0.69 O ATOM 96 O5' U A 7 -8.509 3.395 -2.617 1.00 0.52 O ATOM 97 C5' U A 7 -9.329 3.030 -3.736 1.00 0.45 C ATOM 98 C4' U A 7 -10.378 4.095 -4.056 1.00 0.43 C ATOM 99 O4' U A 7 -9.750 5.389 -4.120 1.00 0.45 O ATOM 100 C3' U A 7 -11.053 3.920 -5.416 1.00 0.40 C ATOM 101 O3' U A 7 -12.337 3.331 -5.180 1.00 0.40 O ATOM 102 C2' U A 7 -11.280 5.350 -5.872 1.00 0.42 C ATOM 103 O2' U A 7 -12.404 5.927 -5.204 1.00 0.45 O ATOM 104 C1' U A 7 -9.981 5.984 -5.402 1.00 0.43 C ATOM 105 N1 U A 7 -8.824 5.673 -6.269 1.00 0.42 N ATOM 106 C2 U A 7 -8.919 5.964 -7.617 1.00 0.43 C ATOM 107 O2 U A 7 -9.925 6.452 -8.127 1.00 0.44 O ATOM 108 N3 U A 7 -7.814 5.661 -8.376 1.00 0.44 N ATOM 109 C4 U A 7 -6.642 5.099 -7.923 1.00 0.45 C ATOM 110 O4 U A 7 -5.737 4.854 -8.714 1.00 0.49 O ATOM 111 C5 U A 7 -6.613 4.825 -6.507 1.00 0.45 C ATOM 112 C6 U A 7 -7.688 5.116 -5.740 1.00 0.44 C ATOM 0 H5' U A 7 -9.827 2.084 -3.526 1.00 0.45 H new ATOM 0 H5'' U A 7 -8.698 2.870 -4.610 1.00 0.45 H new ATOM 0 H4' U A 7 -11.121 3.999 -3.264 1.00 0.43 H new ATOM 0 H3' U A 7 -10.486 3.315 -6.123 1.00 0.40 H new ATOM 0 H2' U A 7 -11.495 5.469 -6.934 1.00 0.42 H new ATOM 0 HO2' U A 7 -13.004 5.215 -4.899 1.00 0.45 H new ATOM 0 H1' U A 7 -10.074 7.070 -5.402 1.00 0.43 H new ATOM 0 H3 U A 7 -7.868 5.873 -9.372 1.00 0.44 H new ATOM 0 H5 U A 7 -5.733 4.387 -6.060 1.00 0.45 H new ATOM 0 H6 U A 7 -7.651 4.904 -4.682 1.00 0.44 H new ATOM 123 P G A 8 -12.484 1.738 -5.031 1.00 0.37 P ATOM 124 OP1 G A 8 -11.937 1.335 -3.719 1.00 0.45 O ATOM 125 OP2 G A 8 -11.956 1.117 -6.273 1.00 0.37 O ATOM 126 O5' G A 8 -14.079 1.523 -5.011 1.00 0.38 O ATOM 127 C5' G A 8 -14.812 1.348 -6.231 1.00 0.37 C ATOM 128 C4' G A 8 -15.082 2.677 -6.929 1.00 0.37 C ATOM 129 O4' G A 8 -13.860 3.253 -7.370 1.00 0.37 O ATOM 130 C3' G A 8 -15.858 2.577 -8.223 1.00 0.36 C ATOM 131 O3' G A 8 -17.253 2.555 -7.890 1.00 0.41 O ATOM 132 C2' G A 8 -15.559 3.918 -8.897 1.00 0.37 C ATOM 133 O2' G A 8 -16.516 4.901 -8.496 1.00 0.43 O ATOM 134 C1' G A 8 -14.159 4.271 -8.342 1.00 0.37 C ATOM 135 N9 G A 8 -13.100 4.258 -9.373 1.00 0.35 N ATOM 136 C8 G A 8 -11.747 4.128 -9.199 1.00 0.37 C ATOM 137 N7 G A 8 -11.072 4.124 -10.313 1.00 0.38 N ATOM 138 C5 G A 8 -12.046 4.266 -11.296 1.00 0.35 C ATOM 139 C6 G A 8 -11.917 4.328 -12.710 1.00 0.36 C ATOM 140 O6 G A 8 -10.900 4.230 -13.384 1.00 0.40 O ATOM 141 N1 G A 8 -13.141 4.479 -13.330 1.00 0.36 N ATOM 142 C2 G A 8 -14.346 4.557 -12.681 1.00 0.35 C ATOM 143 N2 G A 8 -15.429 4.694 -13.431 1.00 0.39 N ATOM 144 N3 G A 8 -14.485 4.496 -11.358 1.00 0.34 N ATOM 145 C4 G A 8 -13.293 4.352 -10.731 1.00 0.33 C ATOM 0 H5' G A 8 -15.759 0.851 -6.018 1.00 0.37 H new ATOM 0 H5'' G A 8 -14.253 0.694 -6.900 1.00 0.37 H new ATOM 0 H4' G A 8 -15.637 3.241 -6.179 1.00 0.37 H new ATOM 0 H3' G A 8 -15.610 1.707 -8.831 1.00 0.36 H new ATOM 0 H2' G A 8 -15.599 3.878 -9.986 1.00 0.37 H new ATOM 0 HO2' G A 8 -17.283 4.459 -8.076 1.00 0.43 H new ATOM 0 H1' G A 8 -14.180 5.282 -7.934 1.00 0.37 H new ATOM 0 H8 G A 8 -11.283 4.037 -8.228 1.00 0.37 H new ATOM 0 H1 G A 8 -13.150 4.537 -14.348 1.00 0.36 H new ATOM 0 H21 G A 8 -16.348 4.756 -12.993 1.00 0.39 H new ATOM 0 H22 G A 8 -15.344 4.737 -14.447 1.00 0.39 H new ATOM 157 P G A 9 -18.080 1.169 -7.901 1.00 0.43 P ATOM 158 OP1 G A 9 -19.461 1.449 -7.450 1.00 0.54 O ATOM 159 OP2 G A 9 -17.268 0.139 -7.208 1.00 0.47 O ATOM 160 O5' G A 9 -18.124 0.797 -9.469 1.00 0.37 O ATOM 161 C5' G A 9 -17.207 -0.152 -10.029 1.00 0.32 C ATOM 162 C4' G A 9 -17.192 -0.087 -11.552 1.00 0.29 C ATOM 163 O4' G A 9 -16.714 1.203 -11.976 1.00 0.29 O ATOM 164 C3' G A 9 -16.230 -1.053 -12.227 1.00 0.27 C ATOM 165 O3' G A 9 -16.919 -2.290 -12.440 1.00 0.31 O ATOM 166 C2' G A 9 -16.039 -0.376 -13.569 1.00 0.28 C ATOM 167 O2' G A 9 -17.227 -0.459 -14.363 1.00 0.34 O ATOM 168 C1' G A 9 -15.803 1.049 -13.083 1.00 0.27 C ATOM 169 N9 G A 9 -14.430 1.245 -12.588 1.00 0.24 N ATOM 170 C8 G A 9 -14.018 1.484 -11.308 1.00 0.24 C ATOM 171 N7 G A 9 -12.725 1.548 -11.175 1.00 0.25 N ATOM 172 C5 G A 9 -12.246 1.342 -12.462 1.00 0.24 C ATOM 173 C6 G A 9 -10.912 1.303 -12.943 1.00 0.27 C ATOM 174 O6 G A 9 -9.870 1.430 -12.308 1.00 0.32 O ATOM 175 N1 G A 9 -10.867 1.071 -14.303 1.00 0.28 N ATOM 176 C2 G A 9 -11.963 0.896 -15.108 1.00 0.28 C ATOM 177 N2 G A 9 -11.733 0.677 -16.393 1.00 0.33 N ATOM 178 N3 G A 9 -13.220 0.930 -14.672 1.00 0.26 N ATOM 179 C4 G A 9 -13.285 1.156 -13.339 1.00 0.24 C ATOM 0 H5' G A 9 -17.483 -1.157 -9.710 1.00 0.32 H new ATOM 0 H5'' G A 9 -16.205 0.040 -9.646 1.00 0.32 H new ATOM 0 H4' G A 9 -18.219 -0.322 -11.833 1.00 0.29 H new ATOM 0 H3' G A 9 -15.311 -1.256 -11.677 1.00 0.27 H new ATOM 0 H2' G A 9 -15.258 -0.796 -14.203 1.00 0.28 H new ATOM 0 HO2' G A 9 -17.715 -1.278 -14.137 1.00 0.34 H new ATOM 0 H1' G A 9 -15.953 1.765 -13.891 1.00 0.27 H new ATOM 0 H8 G A 9 -14.702 1.608 -10.482 1.00 0.24 H new ATOM 0 H1 G A 9 -9.948 1.026 -14.743 1.00 0.28 H new ATOM 0 H21 G A 9 -12.514 0.540 -17.035 1.00 0.33 H new ATOM 0 H22 G A 9 -10.775 0.645 -16.741 1.00 0.33 H new ATOM 191 P U A 10 -16.156 -3.688 -12.208 1.00 0.30 P ATOM 192 OP1 U A 10 -17.151 -4.781 -12.251 1.00 0.40 O ATOM 193 OP2 U A 10 -15.273 -3.536 -11.017 1.00 0.32 O ATOM 194 O5' U A 10 -15.218 -3.798 -13.513 1.00 0.31 O ATOM 195 C5' U A 10 -15.795 -3.890 -14.824 1.00 0.34 C ATOM 196 C4' U A 10 -14.750 -3.697 -15.922 1.00 0.31 C ATOM 197 O4' U A 10 -14.106 -2.429 -15.744 1.00 0.30 O ATOM 198 C3' U A 10 -13.608 -4.699 -15.902 1.00 0.29 C ATOM 199 O3' U A 10 -13.986 -5.783 -16.764 1.00 0.38 O ATOM 200 C2' U A 10 -12.488 -3.936 -16.592 1.00 0.29 C ATOM 201 O2' U A 10 -12.663 -3.952 -18.012 1.00 0.35 O ATOM 202 C1' U A 10 -12.699 -2.529 -16.029 1.00 0.27 C ATOM 203 N1 U A 10 -11.946 -2.288 -14.791 1.00 0.22 N ATOM 204 C2 U A 10 -10.566 -2.355 -14.854 1.00 0.23 C ATOM 205 O2 U A 10 -9.959 -2.608 -15.887 1.00 0.30 O ATOM 206 N3 U A 10 -9.899 -2.102 -13.681 1.00 0.22 N ATOM 207 C4 U A 10 -10.478 -1.793 -12.471 1.00 0.21 C ATOM 208 O4 U A 10 -9.771 -1.588 -11.489 1.00 0.25 O ATOM 209 C5 U A 10 -11.924 -1.741 -12.492 1.00 0.22 C ATOM 210 C6 U A 10 -12.595 -1.987 -13.632 1.00 0.23 C ATOM 0 H5' U A 10 -16.576 -3.137 -14.930 1.00 0.34 H new ATOM 0 H5'' U A 10 -16.271 -4.863 -14.943 1.00 0.34 H new ATOM 0 H4' U A 10 -15.311 -3.804 -16.850 1.00 0.31 H new ATOM 0 H3' U A 10 -13.350 -5.076 -14.912 1.00 0.29 H new ATOM 0 H2' U A 10 -11.491 -4.343 -16.421 1.00 0.29 H new ATOM 0 HO2' U A 10 -13.152 -4.760 -18.272 1.00 0.35 H new ATOM 0 H1' U A 10 -12.348 -1.792 -16.752 1.00 0.27 H new ATOM 0 H3 U A 10 -8.880 -2.147 -13.709 1.00 0.22 H new ATOM 0 H5 U A 10 -12.467 -1.504 -11.589 1.00 0.22 H new ATOM 0 H6 U A 10 -13.674 -1.945 -13.628 1.00 0.23 H new ATOM 221 P U A 11 -13.172 -7.172 -16.755 1.00 0.41 P ATOM 222 OP1 U A 11 -14.076 -8.238 -17.244 1.00 0.57 O ATOM 223 OP2 U A 11 -12.512 -7.314 -15.435 1.00 0.44 O ATOM 224 O5' U A 11 -12.031 -6.929 -17.870 1.00 0.40 O ATOM 225 C5' U A 11 -10.858 -7.753 -17.890 1.00 0.42 C ATOM 226 C4' U A 11 -9.612 -6.981 -17.459 1.00 0.34 C ATOM 227 O4' U A 11 -9.923 -6.166 -16.342 1.00 0.31 O ATOM 228 C3' U A 11 -8.466 -7.860 -16.965 1.00 0.33 C ATOM 229 O3' U A 11 -7.475 -7.872 -18.003 1.00 0.38 O ATOM 230 C2' U A 11 -7.866 -7.107 -15.761 1.00 0.31 C ATOM 231 O2' U A 11 -6.493 -6.787 -15.999 1.00 0.42 O ATOM 232 C1' U A 11 -8.710 -5.835 -15.680 1.00 0.26 C ATOM 233 N1 U A 11 -9.035 -5.448 -14.290 1.00 0.23 N ATOM 234 C2 U A 11 -7.989 -5.218 -13.410 1.00 0.25 C ATOM 235 O2 U A 11 -6.810 -5.332 -13.726 1.00 0.30 O ATOM 236 N3 U A 11 -8.346 -4.868 -12.130 1.00 0.25 N ATOM 237 C4 U A 11 -9.630 -4.731 -11.650 1.00 0.23 C ATOM 238 O4 U A 11 -9.814 -4.423 -10.473 1.00 0.27 O ATOM 239 C5 U A 11 -10.666 -4.988 -12.622 1.00 0.23 C ATOM 240 C6 U A 11 -10.340 -5.328 -13.889 1.00 0.23 C ATOM 0 H5' U A 11 -10.710 -8.150 -18.894 1.00 0.42 H new ATOM 0 H5'' U A 11 -11.003 -8.607 -17.228 1.00 0.42 H new ATOM 0 H4' U A 11 -9.306 -6.436 -18.352 1.00 0.34 H new ATOM 0 H3' U A 11 -8.781 -8.872 -16.710 1.00 0.33 H new ATOM 0 H2' U A 11 -7.886 -7.691 -14.841 1.00 0.31 H new ATOM 0 HO2' U A 11 -6.170 -6.187 -15.295 1.00 0.42 H new ATOM 0 H1' U A 11 -8.167 -4.998 -16.119 1.00 0.26 H new ATOM 0 H3 U A 11 -7.587 -4.693 -11.472 1.00 0.25 H new ATOM 0 H5 U A 11 -11.704 -4.908 -12.336 1.00 0.23 H new ATOM 0 H6 U A 11 -11.129 -5.510 -14.604 1.00 0.23 H new ATOM 251 P U A 12 -6.626 -9.204 -18.327 1.00 0.44 P ATOM 252 OP1 U A 12 -5.705 -8.904 -19.448 1.00 0.53 O ATOM 253 OP2 U A 12 -7.569 -10.340 -18.436 1.00 0.50 O ATOM 254 O5' U A 12 -5.745 -9.402 -16.990 1.00 0.44 O ATOM 255 C5' U A 12 -6.192 -10.261 -15.932 1.00 0.43 C ATOM 256 C4' U A 12 -5.132 -10.409 -14.844 1.00 0.43 C ATOM 257 O4' U A 12 -4.862 -9.125 -14.263 1.00 0.41 O ATOM 258 C3' U A 12 -5.545 -11.248 -13.646 1.00 0.44 C ATOM 259 O3' U A 12 -5.238 -12.621 -13.936 1.00 0.52 O ATOM 260 C2' U A 12 -4.568 -10.764 -12.596 1.00 0.45 C ATOM 261 O2' U A 12 -3.247 -11.253 -12.851 1.00 0.51 O ATOM 262 C1' U A 12 -4.644 -9.263 -12.845 1.00 0.40 C ATOM 263 N1 U A 12 -5.764 -8.627 -12.122 1.00 0.35 N ATOM 264 C2 U A 12 -5.496 -8.087 -10.881 1.00 0.35 C ATOM 265 O2 U A 12 -4.388 -8.130 -10.364 1.00 0.39 O ATOM 266 N3 U A 12 -6.557 -7.496 -10.238 1.00 0.33 N ATOM 267 C4 U A 12 -7.844 -7.402 -10.714 1.00 0.32 C ATOM 268 O4 U A 12 -8.700 -6.841 -10.039 1.00 0.33 O ATOM 269 C5 U A 12 -8.051 -7.992 -12.015 1.00 0.32 C ATOM 270 C6 U A 12 -7.018 -8.574 -12.666 1.00 0.33 C ATOM 0 H5' U A 12 -6.437 -11.242 -16.338 1.00 0.43 H new ATOM 0 H5'' U A 12 -7.107 -9.858 -15.497 1.00 0.43 H new ATOM 0 H4' U A 12 -4.296 -10.881 -15.360 1.00 0.43 H new ATOM 0 H3' U A 12 -6.597 -11.170 -13.370 1.00 0.44 H new ATOM 0 H2' U A 12 -4.792 -11.083 -11.578 1.00 0.45 H new ATOM 0 HO2' U A 12 -2.802 -11.452 -12.001 1.00 0.51 H new ATOM 0 H1' U A 12 -3.734 -8.777 -12.495 1.00 0.40 H new ATOM 0 H3 U A 12 -6.373 -7.089 -9.321 1.00 0.33 H new ATOM 0 H5 U A 12 -9.031 -7.969 -12.469 1.00 0.32 H new ATOM 0 H6 U A 12 -7.188 -9.008 -13.640 1.00 0.33 H new ATOM 281 P A A 13 -6.213 -13.811 -13.449 1.00 0.62 P ATOM 282 OP1 A A 13 -5.372 -14.955 -13.028 1.00 0.84 O ATOM 283 OP2 A A 13 -7.256 -14.004 -14.482 1.00 0.80 O ATOM 284 O5' A A 13 -6.913 -13.183 -12.138 1.00 0.55 O ATOM 285 C5' A A 13 -7.453 -14.020 -11.102 1.00 0.57 C ATOM 286 C4' A A 13 -6.728 -13.803 -9.777 1.00 0.56 C ATOM 287 O4' A A 13 -5.373 -14.206 -9.913 1.00 0.60 O ATOM 288 C3' A A 13 -6.618 -12.352 -9.351 1.00 0.50 C ATOM 289 O3' A A 13 -7.748 -12.074 -8.504 1.00 0.51 O ATOM 290 C2' A A 13 -5.360 -12.316 -8.473 1.00 0.54 C ATOM 291 O2' A A 13 -5.710 -12.405 -7.089 1.00 0.61 O ATOM 292 C1' A A 13 -4.580 -13.562 -8.911 1.00 0.58 C ATOM 293 N9 A A 13 -3.267 -13.238 -9.496 1.00 0.59 N ATOM 294 C8 A A 13 -2.948 -13.042 -10.812 1.00 0.60 C ATOM 295 N7 A A 13 -1.683 -12.795 -11.015 1.00 0.63 N ATOM 296 C5 A A 13 -1.131 -12.830 -9.738 1.00 0.64 C ATOM 297 C6 A A 13 0.176 -12.647 -9.262 1.00 0.71 C ATOM 298 N6 A A 13 1.214 -12.374 -10.047 1.00 0.76 N ATOM 299 N1 A A 13 0.381 -12.749 -7.942 1.00 0.76 N ATOM 300 C2 A A 13 -0.650 -13.015 -7.148 1.00 0.74 C ATOM 301 N3 A A 13 -1.921 -13.209 -7.469 1.00 0.67 N ATOM 302 C4 A A 13 -2.089 -13.099 -8.804 1.00 0.62 C ATOM 0 H5' A A 13 -7.370 -15.066 -11.397 1.00 0.57 H new ATOM 0 H5'' A A 13 -8.515 -13.807 -10.977 1.00 0.57 H new ATOM 0 H4' A A 13 -7.314 -14.367 -9.051 1.00 0.56 H new ATOM 0 H3' A A 13 -6.582 -11.651 -10.185 1.00 0.50 H new ATOM 0 H2' A A 13 -4.789 -11.394 -8.586 1.00 0.54 H new ATOM 0 HO2' A A 13 -6.025 -11.532 -6.774 1.00 0.61 H new ATOM 0 H1' A A 13 -4.395 -14.188 -8.038 1.00 0.58 H new ATOM 0 H8 A A 13 -3.676 -13.088 -11.609 1.00 0.60 H new ATOM 0 H61 A A 13 2.142 -12.251 -9.641 1.00 0.76 H new ATOM 0 H62 A A 13 1.082 -12.287 -11.055 1.00 0.76 H new ATOM 0 H2 A A 13 -0.421 -13.083 -6.095 1.00 0.74 H new ATOM 314 P G A 14 -8.164 -10.556 -8.174 1.00 0.44 P ATOM 315 OP1 G A 14 -9.437 -10.552 -7.415 1.00 0.47 O ATOM 316 OP2 G A 14 -8.062 -9.768 -9.421 1.00 0.41 O ATOM 317 O5' G A 14 -6.989 -10.071 -7.181 1.00 0.45 O ATOM 318 C5' G A 14 -6.165 -8.955 -7.530 1.00 0.45 C ATOM 319 C4' G A 14 -4.915 -8.864 -6.662 1.00 0.46 C ATOM 320 O4' G A 14 -4.012 -9.913 -7.023 1.00 0.49 O ATOM 321 C3' G A 14 -4.099 -7.600 -6.867 1.00 0.45 C ATOM 322 O3' G A 14 -4.578 -6.624 -5.931 1.00 0.48 O ATOM 323 C2' G A 14 -2.714 -8.024 -6.404 1.00 0.49 C ATOM 324 O2' G A 14 -2.634 -7.992 -4.976 1.00 0.57 O ATOM 325 C1' G A 14 -2.645 -9.463 -6.920 1.00 0.50 C ATOM 326 N9 G A 14 -2.005 -9.567 -8.247 1.00 0.48 N ATOM 327 C8 G A 14 -2.552 -9.988 -9.431 1.00 0.47 C ATOM 328 N7 G A 14 -1.711 -9.993 -10.428 1.00 0.49 N ATOM 329 C5 G A 14 -0.522 -9.542 -9.862 1.00 0.51 C ATOM 330 C6 G A 14 0.754 -9.336 -10.456 1.00 0.55 C ATOM 331 O6 G A 14 1.099 -9.535 -11.617 1.00 0.57 O ATOM 332 N1 G A 14 1.673 -8.873 -9.535 1.00 0.58 N ATOM 333 C2 G A 14 1.409 -8.636 -8.211 1.00 0.58 C ATOM 334 N2 G A 14 2.411 -8.191 -7.466 1.00 0.63 N ATOM 335 N3 G A 14 0.223 -8.826 -7.641 1.00 0.55 N ATOM 336 C4 G A 14 -0.694 -9.278 -8.526 1.00 0.51 C ATOM 0 H5' G A 14 -6.742 -8.035 -7.430 1.00 0.45 H new ATOM 0 H5'' G A 14 -5.872 -9.036 -8.577 1.00 0.45 H new ATOM 0 H4' G A 14 -5.288 -8.906 -5.639 1.00 0.46 H new ATOM 0 H3' G A 14 -4.136 -7.200 -7.880 1.00 0.45 H new ATOM 0 H2' G A 14 -1.905 -7.386 -6.760 1.00 0.49 H new ATOM 0 HO2' G A 14 -3.275 -7.338 -4.627 1.00 0.57 H new ATOM 0 H1' G A 14 -2.043 -10.064 -6.239 1.00 0.50 H new ATOM 0 H8 G A 14 -3.585 -10.288 -9.529 1.00 0.47 H new ATOM 0 H1 G A 14 2.621 -8.694 -9.865 1.00 0.58 H new ATOM 0 H21 G A 14 2.264 -8.000 -6.475 1.00 0.63 H new ATOM 0 H22 G A 14 3.329 -8.040 -7.884 1.00 0.63 H new ATOM 348 P G A 15 -5.958 -5.831 -6.180 1.00 0.45 P ATOM 349 OP1 G A 15 -6.915 -6.207 -5.117 1.00 0.52 O ATOM 350 OP2 G A 15 -6.346 -6.002 -7.602 1.00 0.40 O ATOM 351 O5' G A 15 -5.536 -4.289 -5.956 1.00 0.46 O ATOM 352 C5' G A 15 -4.264 -3.955 -5.383 1.00 0.50 C ATOM 353 C4' G A 15 -3.132 -4.226 -6.367 1.00 0.48 C ATOM 354 O4' G A 15 -3.168 -3.232 -7.409 1.00 0.47 O ATOM 355 C3' G A 15 -1.724 -4.128 -5.791 1.00 0.54 C ATOM 356 O3' G A 15 -0.893 -4.890 -6.675 1.00 0.52 O ATOM 357 C2' G A 15 -1.397 -2.654 -5.984 1.00 0.59 C ATOM 358 O2' G A 15 0.014 -2.422 -5.982 1.00 0.65 O ATOM 359 C1' G A 15 -1.981 -2.420 -7.369 1.00 0.52 C ATOM 360 N9 G A 15 -2.354 -1.007 -7.573 1.00 0.56 N ATOM 361 C8 G A 15 -1.812 -0.095 -8.440 1.00 0.66 C ATOM 362 N7 G A 15 -2.338 1.096 -8.345 1.00 0.70 N ATOM 363 C5 G A 15 -3.296 0.959 -7.345 1.00 0.63 C ATOM 364 C6 G A 15 -4.192 1.919 -6.799 1.00 0.70 C ATOM 365 O6 G A 15 -4.347 3.090 -7.125 1.00 0.77 O ATOM 366 N1 G A 15 -4.986 1.371 -5.811 1.00 0.75 N ATOM 367 C2 G A 15 -4.937 0.065 -5.398 1.00 0.74 C ATOM 368 N2 G A 15 -5.802 -0.301 -4.467 1.00 0.88 N ATOM 369 N3 G A 15 -4.106 -0.845 -5.897 1.00 0.63 N ATOM 370 C4 G A 15 -3.314 -0.326 -6.867 1.00 0.58 C ATOM 0 H5' G A 15 -4.107 -4.536 -4.474 1.00 0.50 H new ATOM 0 H5'' G A 15 -4.256 -2.904 -5.095 1.00 0.50 H new ATOM 0 H4' G A 15 -3.303 -5.251 -6.697 1.00 0.48 H new ATOM 0 H3' G A 15 -1.606 -4.469 -4.763 1.00 0.54 H new ATOM 0 H2' G A 15 -1.785 -2.002 -5.202 1.00 0.59 H new ATOM 0 HO2' G A 15 0.431 -2.951 -5.270 1.00 0.65 H new ATOM 0 H1' G A 15 -1.258 -2.670 -8.145 1.00 0.52 H new ATOM 0 H8 G A 15 -1.024 -0.339 -9.137 1.00 0.66 H new ATOM 0 H1 G A 15 -5.660 1.985 -5.354 1.00 0.75 H new ATOM 0 H21 G A 15 -5.807 -1.262 -4.125 1.00 0.88 H new ATOM 0 H22 G A 15 -6.464 0.378 -4.091 1.00 0.88 H new ATOM 382 P U A 16 0.559 -5.442 -6.240 1.00 0.57 P ATOM 383 OP1 U A 16 0.413 -6.831 -5.759 1.00 0.64 O ATOM 384 OP2 U A 16 1.221 -4.433 -5.385 1.00 0.65 O ATOM 385 O5' U A 16 1.315 -5.469 -7.660 1.00 0.54 O ATOM 386 C5' U A 16 0.825 -4.674 -8.753 1.00 0.53 C ATOM 387 C4' U A 16 0.764 -5.474 -10.046 1.00 0.48 C ATOM 388 O4' U A 16 -0.226 -6.511 -9.940 1.00 0.46 O ATOM 389 C3' U A 16 0.327 -4.694 -11.275 1.00 0.46 C ATOM 390 O3' U A 16 1.497 -4.086 -11.849 1.00 0.51 O ATOM 391 C2' U A 16 -0.121 -5.826 -12.186 1.00 0.43 C ATOM 392 O2' U A 16 1.002 -6.568 -12.672 1.00 0.48 O ATOM 393 C1' U A 16 -0.927 -6.657 -11.198 1.00 0.42 C ATOM 394 N1 U A 16 -2.303 -6.155 -11.029 1.00 0.38 N ATOM 395 C2 U A 16 -3.114 -6.087 -12.149 1.00 0.36 C ATOM 396 O2 U A 16 -2.744 -6.447 -13.259 1.00 0.40 O ATOM 397 N3 U A 16 -4.381 -5.588 -11.946 1.00 0.33 N ATOM 398 C4 U A 16 -4.901 -5.158 -10.743 1.00 0.32 C ATOM 399 O4 U A 16 -6.059 -4.745 -10.689 1.00 0.33 O ATOM 400 C5 U A 16 -3.995 -5.262 -9.622 1.00 0.36 C ATOM 401 C6 U A 16 -2.745 -5.754 -9.805 1.00 0.38 C ATOM 0 H5' U A 16 1.471 -3.807 -8.891 1.00 0.53 H new ATOM 0 H5'' U A 16 -0.168 -4.296 -8.512 1.00 0.53 H new ATOM 0 H4' U A 16 1.789 -5.822 -10.172 1.00 0.48 H new ATOM 0 H3' U A 16 -0.420 -3.920 -11.099 1.00 0.46 H new ATOM 0 H2' U A 16 -0.661 -5.512 -13.079 1.00 0.43 H new ATOM 0 HO2' U A 16 1.481 -6.036 -13.341 1.00 0.48 H new ATOM 0 H1' U A 16 -1.011 -7.686 -11.547 1.00 0.42 H new ATOM 0 H3 U A 16 -4.992 -5.531 -12.761 1.00 0.33 H new ATOM 0 H5 U A 16 -4.313 -4.948 -8.639 1.00 0.36 H new ATOM 0 H6 U A 16 -2.081 -5.830 -8.956 1.00 0.38 H new ATOM 412 P A A 17 1.446 -3.416 -13.316 1.00 0.48 P ATOM 413 OP1 A A 17 2.762 -2.795 -13.590 1.00 0.56 O ATOM 414 OP2 A A 17 0.210 -2.605 -13.410 1.00 0.51 O ATOM 415 O5' A A 17 1.288 -4.709 -14.264 1.00 0.45 O ATOM 416 C5' A A 17 1.219 -4.609 -15.689 1.00 0.43 C ATOM 417 C4' A A 17 -0.146 -4.123 -16.181 1.00 0.41 C ATOM 418 O4' A A 17 -1.169 -4.440 -15.237 1.00 0.39 O ATOM 419 C3' A A 17 -0.311 -2.627 -16.296 1.00 0.44 C ATOM 420 O3' A A 17 0.255 -2.221 -17.553 1.00 0.49 O ATOM 421 C2' A A 17 -1.830 -2.490 -16.409 1.00 0.41 C ATOM 422 O2' A A 17 -2.242 -2.571 -17.777 1.00 0.45 O ATOM 423 C1' A A 17 -2.346 -3.710 -15.627 1.00 0.37 C ATOM 424 N9 A A 17 -3.159 -3.338 -14.441 1.00 0.34 N ATOM 425 C8 A A 17 -2.785 -3.168 -13.125 1.00 0.38 C ATOM 426 N7 A A 17 -3.776 -2.831 -12.340 1.00 0.36 N ATOM 427 C5 A A 17 -4.876 -2.779 -13.193 1.00 0.30 C ATOM 428 C6 A A 17 -6.235 -2.480 -12.985 1.00 0.27 C ATOM 429 N6 A A 17 -6.756 -2.190 -11.797 1.00 0.30 N ATOM 430 N1 A A 17 -7.055 -2.518 -14.044 1.00 0.25 N ATOM 431 C2 A A 17 -6.556 -2.837 -15.232 1.00 0.27 C ATOM 432 N3 A A 17 -5.309 -3.135 -15.559 1.00 0.30 N ATOM 433 C4 A A 17 -4.511 -3.086 -14.472 1.00 0.30 C ATOM 0 H5' A A 17 1.433 -5.583 -16.128 1.00 0.43 H new ATOM 0 H5'' A A 17 1.992 -3.925 -16.039 1.00 0.43 H new ATOM 0 H4' A A 17 -0.217 -4.608 -17.155 1.00 0.41 H new ATOM 0 H3' A A 17 0.143 -2.054 -15.488 1.00 0.44 H new ATOM 0 H2' A A 17 -2.205 -1.539 -16.031 1.00 0.41 H new ATOM 0 HO2' A A 17 -2.073 -1.714 -18.221 1.00 0.45 H new ATOM 0 H1' A A 17 -3.017 -4.304 -16.248 1.00 0.37 H new ATOM 0 H8 A A 17 -1.772 -3.300 -12.776 1.00 0.38 H new ATOM 0 H61 A A 17 -7.751 -1.982 -11.714 1.00 0.30 H new ATOM 0 H62 A A 17 -6.161 -2.176 -10.969 1.00 0.30 H new ATOM 0 H2 A A 17 -7.267 -2.856 -16.045 1.00 0.27 H new ATOM 445 P A A 18 0.842 -0.731 -17.758 1.00 0.55 P ATOM 446 OP1 A A 18 0.510 -0.287 -19.131 1.00 0.59 O ATOM 447 OP2 A A 18 2.252 -0.727 -17.307 1.00 0.67 O ATOM 448 O5' A A 18 -0.023 0.142 -16.710 1.00 0.52 O ATOM 449 C5' A A 18 -0.719 1.336 -17.105 1.00 0.56 C ATOM 450 C4' A A 18 -1.812 1.052 -18.135 1.00 0.53 C ATOM 451 O4' A A 18 -2.532 -0.122 -17.747 1.00 0.46 O ATOM 452 C3' A A 18 -2.885 2.127 -18.237 1.00 0.57 C ATOM 453 O3' A A 18 -2.505 3.032 -19.283 1.00 0.68 O ATOM 454 C2' A A 18 -4.087 1.343 -18.730 1.00 0.52 C ATOM 455 O2' A A 18 -3.969 1.060 -20.128 1.00 0.59 O ATOM 456 C1' A A 18 -3.946 0.067 -17.906 1.00 0.44 C ATOM 457 N9 A A 18 -4.562 0.166 -16.570 1.00 0.38 N ATOM 458 C8 A A 18 -3.969 0.026 -15.342 1.00 0.38 C ATOM 459 N7 A A 18 -4.794 0.150 -14.344 1.00 0.37 N ATOM 460 C5 A A 18 -6.017 0.386 -14.956 1.00 0.34 C ATOM 461 C6 A A 18 -7.299 0.602 -14.445 1.00 0.34 C ATOM 462 N6 A A 18 -7.570 0.598 -13.147 1.00 0.37 N ATOM 463 N1 A A 18 -8.297 0.806 -15.317 1.00 0.35 N ATOM 464 C2 A A 18 -8.027 0.793 -16.617 1.00 0.37 C ATOM 465 N3 A A 18 -6.866 0.600 -17.224 1.00 0.38 N ATOM 466 C4 A A 18 -5.890 0.399 -16.313 1.00 0.36 C ATOM 0 H5' A A 18 -0.007 2.049 -17.520 1.00 0.56 H new ATOM 0 H5'' A A 18 -1.163 1.804 -16.226 1.00 0.56 H new ATOM 0 H4' A A 18 -1.280 0.975 -19.083 1.00 0.53 H new ATOM 0 H3' A A 18 -3.051 2.681 -17.313 1.00 0.57 H new ATOM 0 H2' A A 18 -5.043 1.855 -18.620 1.00 0.52 H new ATOM 0 HO2' A A 18 -3.298 1.653 -20.526 1.00 0.59 H new ATOM 0 H1' A A 18 -4.451 -0.755 -18.413 1.00 0.44 H new ATOM 0 H8 A A 18 -2.914 -0.169 -15.215 1.00 0.38 H new ATOM 0 H61 A A 18 -8.524 0.761 -12.825 1.00 0.37 H new ATOM 0 H62 A A 18 -6.825 0.432 -12.471 1.00 0.37 H new ATOM 0 H2 A A 18 -8.871 0.963 -17.269 1.00 0.37 H new ATOM 478 P U A 19 -1.868 4.467 -18.924 1.00 1.02 P ATOM 479 OP1 U A 19 -2.302 5.439 -19.955 1.00 1.41 O ATOM 480 OP2 U A 19 -0.425 4.277 -18.653 1.00 1.41 O ATOM 481 O5' U A 19 -2.599 4.836 -17.533 1.00 0.89 O ATOM 482 C5' U A 19 -3.709 5.743 -17.484 1.00 0.87 C ATOM 483 C4' U A 19 -4.945 5.194 -18.200 1.00 0.76 C ATOM 484 O4' U A 19 -5.303 3.927 -17.630 1.00 0.64 O ATOM 485 C3' U A 19 -6.188 6.058 -18.045 1.00 0.71 C ATOM 486 O3' U A 19 -6.273 6.880 -19.219 1.00 0.81 O ATOM 487 C2' U A 19 -7.325 5.052 -18.120 1.00 0.63 C ATOM 488 O2' U A 19 -7.629 4.734 -19.482 1.00 0.73 O ATOM 489 C1' U A 19 -6.723 3.844 -17.408 1.00 0.58 C ATOM 490 N1 U A 19 -6.971 3.834 -15.951 1.00 0.50 N ATOM 491 C2 U A 19 -8.283 3.801 -15.517 1.00 0.46 C ATOM 492 O2 U A 19 -9.238 3.771 -16.286 1.00 0.51 O ATOM 493 N3 U A 19 -8.465 3.777 -14.154 1.00 0.42 N ATOM 494 C4 U A 19 -7.474 3.778 -13.199 1.00 0.43 C ATOM 495 O4 U A 19 -7.768 3.738 -12.005 1.00 0.45 O ATOM 496 C5 U A 19 -6.132 3.812 -13.726 1.00 0.48 C ATOM 497 C6 U A 19 -5.930 3.840 -15.065 1.00 0.51 C ATOM 0 H5' U A 19 -3.420 6.691 -17.939 1.00 0.87 H new ATOM 0 H5'' U A 19 -3.958 5.952 -16.444 1.00 0.87 H new ATOM 0 H4' U A 19 -4.664 5.147 -19.252 1.00 0.76 H new ATOM 0 H3' U A 19 -6.197 6.670 -17.143 1.00 0.71 H new ATOM 0 H2' U A 19 -8.259 5.405 -17.683 1.00 0.63 H new ATOM 0 HO2' U A 19 -7.305 5.452 -20.066 1.00 0.73 H new ATOM 0 H1' U A 19 -7.180 2.936 -17.801 1.00 0.58 H new ATOM 0 H3 U A 19 -9.428 3.756 -13.818 1.00 0.42 H new ATOM 0 H5 U A 19 -5.288 3.815 -13.053 1.00 0.48 H new ATOM 0 H6 U A 19 -4.919 3.868 -15.443 1.00 0.51 H new ATOM 508 P G A 20 -6.531 8.466 -19.109 1.00 0.75 P ATOM 509 OP1 G A 20 -6.290 9.065 -20.442 1.00 0.87 O ATOM 510 OP2 G A 20 -5.796 8.976 -17.930 1.00 0.78 O ATOM 511 O5' G A 20 -8.111 8.547 -18.799 1.00 0.63 O ATOM 512 C5' G A 20 -8.594 9.214 -17.627 1.00 0.52 C ATOM 513 C4' G A 20 -10.079 8.949 -17.392 1.00 0.42 C ATOM 514 O4' G A 20 -10.281 7.541 -17.164 1.00 0.40 O ATOM 515 C3' G A 20 -10.646 9.620 -16.144 1.00 0.36 C ATOM 516 O3' G A 20 -11.286 10.835 -16.558 1.00 0.38 O ATOM 517 C2' G A 20 -11.735 8.651 -15.720 1.00 0.36 C ATOM 518 O2' G A 20 -12.874 8.750 -16.581 1.00 0.43 O ATOM 519 C1' G A 20 -10.999 7.341 -15.937 1.00 0.37 C ATOM 520 N9 G A 20 -10.027 7.057 -14.866 1.00 0.37 N ATOM 521 C8 G A 20 -8.697 6.754 -14.985 1.00 0.40 C ATOM 522 N7 G A 20 -8.101 6.551 -13.845 1.00 0.43 N ATOM 523 C5 G A 20 -9.109 6.733 -12.903 1.00 0.41 C ATOM 524 C6 G A 20 -9.062 6.643 -11.488 1.00 0.45 C ATOM 525 O6 G A 20 -8.105 6.358 -10.776 1.00 0.51 O ATOM 526 N1 G A 20 -10.293 6.901 -10.916 1.00 0.45 N ATOM 527 C2 G A 20 -11.433 7.209 -11.612 1.00 0.43 C ATOM 528 N2 G A 20 -12.526 7.440 -10.900 1.00 0.48 N ATOM 529 N3 G A 20 -11.497 7.295 -12.940 1.00 0.40 N ATOM 530 C4 G A 20 -10.296 7.046 -13.519 1.00 0.38 C ATOM 0 H5' G A 20 -8.428 10.287 -17.725 1.00 0.52 H new ATOM 0 H5'' G A 20 -8.024 8.882 -16.759 1.00 0.52 H new ATOM 0 H4' G A 20 -10.576 9.342 -18.279 1.00 0.42 H new ATOM 0 H3' G A 20 -9.907 9.835 -15.372 1.00 0.36 H new ATOM 0 H2' G A 20 -12.133 8.803 -14.717 1.00 0.36 H new ATOM 0 HO2' G A 20 -12.956 9.669 -16.910 1.00 0.43 H new ATOM 0 H1' G A 20 -11.697 6.504 -15.952 1.00 0.37 H new ATOM 0 H8 G A 20 -8.189 6.689 -15.936 1.00 0.40 H new ATOM 0 H1 G A 20 -10.358 6.859 -9.899 1.00 0.45 H new ATOM 0 H21 G A 20 -13.401 7.673 -11.370 1.00 0.48 H new ATOM 0 H22 G A 20 -12.493 7.384 -9.882 1.00 0.48 H new ATOM 542 P A A 21 -11.208 12.156 -15.639 1.00 0.55 P ATOM 543 OP1 A A 21 -11.998 13.223 -16.295 1.00 0.67 O ATOM 544 OP2 A A 21 -9.788 12.397 -15.295 1.00 0.71 O ATOM 545 O5' A A 21 -11.980 11.702 -14.299 1.00 0.72 O ATOM 546 C5' A A 21 -13.400 11.865 -14.171 1.00 0.76 C ATOM 547 C4' A A 21 -13.836 11.853 -12.709 1.00 0.64 C ATOM 548 O4' A A 21 -13.522 10.578 -12.132 1.00 0.59 O ATOM 549 C3' A A 21 -13.114 12.862 -11.827 1.00 0.52 C ATOM 550 O3' A A 21 -13.939 14.035 -11.770 1.00 0.60 O ATOM 551 C2' A A 21 -13.156 12.206 -10.457 1.00 0.43 C ATOM 552 O2' A A 21 -14.426 12.414 -9.831 1.00 0.52 O ATOM 553 C1' A A 21 -12.962 10.735 -10.819 1.00 0.46 C ATOM 554 N9 A A 21 -11.541 10.341 -10.859 1.00 0.37 N ATOM 555 C8 A A 21 -10.711 10.223 -11.945 1.00 0.34 C ATOM 556 N7 A A 21 -9.504 9.835 -11.637 1.00 0.32 N ATOM 557 C5 A A 21 -9.545 9.688 -10.255 1.00 0.30 C ATOM 558 C6 A A 21 -8.584 9.298 -9.309 1.00 0.34 C ATOM 559 N6 A A 21 -7.336 8.962 -9.621 1.00 0.41 N ATOM 560 N1 A A 21 -8.954 9.258 -8.020 1.00 0.36 N ATOM 561 C2 A A 21 -10.200 9.585 -7.697 1.00 0.38 C ATOM 562 N3 A A 21 -11.190 9.965 -8.486 1.00 0.39 N ATOM 563 C4 A A 21 -10.782 9.994 -9.771 1.00 0.33 C ATOM 0 H5' A A 21 -13.909 11.066 -14.710 1.00 0.76 H new ATOM 0 H5'' A A 21 -13.702 12.804 -14.634 1.00 0.76 H new ATOM 0 H4' A A 21 -14.900 12.090 -12.734 1.00 0.64 H new ATOM 0 H3' A A 21 -12.110 13.120 -12.164 1.00 0.52 H new ATOM 0 H2' A A 21 -12.420 12.594 -9.753 1.00 0.43 H new ATOM 0 HO2' A A 21 -14.889 13.158 -10.269 1.00 0.52 H new ATOM 0 H1' A A 21 -13.439 10.108 -10.066 1.00 0.46 H new ATOM 0 H8 A A 21 -11.026 10.431 -12.957 1.00 0.34 H new ATOM 0 H61 A A 21 -6.683 8.687 -8.887 1.00 0.41 H new ATOM 0 H62 A A 21 -7.031 8.979 -10.594 1.00 0.41 H new ATOM 0 H2 A A 21 -10.437 9.533 -6.645 1.00 0.38 H new ATOM 575 P G A 22 -13.373 15.420 -11.170 1.00 0.63 P ATOM 576 OP1 G A 22 -14.442 16.439 -11.276 1.00 0.79 O ATOM 577 OP2 G A 22 -12.046 15.678 -11.772 1.00 0.63 O ATOM 578 O5' G A 22 -13.164 15.072 -9.609 1.00 0.61 O ATOM 579 C5' G A 22 -12.008 15.546 -8.907 1.00 0.61 C ATOM 580 C4' G A 22 -11.932 14.991 -7.486 1.00 0.58 C ATOM 581 O4' G A 22 -11.814 13.560 -7.538 1.00 0.48 O ATOM 582 C3' G A 22 -10.712 15.453 -6.698 1.00 0.61 C ATOM 583 O3' G A 22 -11.129 16.574 -5.905 1.00 0.74 O ATOM 584 C2' G A 22 -10.459 14.285 -5.758 1.00 0.54 C ATOM 585 O2' G A 22 -11.370 14.313 -4.655 1.00 0.62 O ATOM 586 C1' G A 22 -10.749 13.107 -6.684 1.00 0.43 C ATOM 587 N9 G A 22 -9.591 12.749 -7.529 1.00 0.36 N ATOM 588 C8 G A 22 -9.462 12.871 -8.889 1.00 0.36 C ATOM 589 N7 G A 22 -8.309 12.473 -9.345 1.00 0.38 N ATOM 590 C5 G A 22 -7.624 12.057 -8.208 1.00 0.39 C ATOM 591 C6 G A 22 -6.315 11.523 -8.079 1.00 0.46 C ATOM 592 O6 G A 22 -5.488 11.310 -8.956 1.00 0.54 O ATOM 593 N1 G A 22 -6.009 11.232 -6.765 1.00 0.49 N ATOM 594 C2 G A 22 -6.849 11.426 -5.699 1.00 0.45 C ATOM 595 N2 G A 22 -6.393 11.073 -4.505 1.00 0.51 N ATOM 596 N3 G A 22 -8.080 11.928 -5.802 1.00 0.40 N ATOM 597 C4 G A 22 -8.401 12.220 -7.087 1.00 0.36 C ATOM 0 H5' G A 22 -12.028 16.635 -8.870 1.00 0.61 H new ATOM 0 H5'' G A 22 -11.110 15.262 -9.455 1.00 0.61 H new ATOM 0 H4' G A 22 -12.838 15.349 -6.997 1.00 0.58 H new ATOM 0 H3' G A 22 -9.850 15.724 -7.308 1.00 0.61 H new ATOM 0 H2' G A 22 -9.468 14.269 -5.305 1.00 0.54 H new ATOM 0 HO2' G A 22 -11.615 15.241 -4.457 1.00 0.62 H new ATOM 0 H1' G A 22 -10.994 12.221 -6.098 1.00 0.43 H new ATOM 0 H8 G A 22 -10.244 13.261 -9.523 1.00 0.36 H new ATOM 0 H1 G A 22 -5.086 10.842 -6.572 1.00 0.49 H new ATOM 0 H21 G A 22 -6.978 11.196 -3.679 1.00 0.51 H new ATOM 0 H22 G A 22 -5.457 10.678 -4.413 1.00 0.51 H new ATOM 609 P U A 23 -10.053 17.547 -5.203 1.00 0.82 P ATOM 610 OP1 U A 23 -10.654 18.892 -5.079 1.00 1.00 O ATOM 611 OP2 U A 23 -8.753 17.380 -5.894 1.00 0.81 O ATOM 612 O5' U A 23 -9.922 16.916 -3.725 1.00 0.86 O ATOM 613 C5' U A 23 -8.738 17.120 -2.944 1.00 0.90 C ATOM 614 C4' U A 23 -8.252 15.818 -2.318 1.00 0.83 C ATOM 615 O4' U A 23 -7.976 14.871 -3.366 1.00 0.76 O ATOM 616 C3' U A 23 -6.938 15.926 -1.544 1.00 0.90 C ATOM 617 O3' U A 23 -6.819 14.856 -0.600 1.00 0.89 O ATOM 618 C2' U A 23 -5.929 15.758 -2.670 1.00 0.88 C ATOM 619 O2' U A 23 -4.645 15.382 -2.156 1.00 0.95 O ATOM 620 C1' U A 23 -6.568 14.611 -3.436 1.00 0.78 C ATOM 621 N1 U A 23 -6.153 14.565 -4.852 1.00 0.74 N ATOM 622 C2 U A 23 -4.943 13.968 -5.143 1.00 0.78 C ATOM 623 O2 U A 23 -4.209 13.507 -4.276 1.00 0.83 O ATOM 624 N3 U A 23 -4.597 13.925 -6.472 1.00 0.79 N ATOM 625 C4 U A 23 -5.335 14.418 -7.523 1.00 0.75 C ATOM 626 O4 U A 23 -4.912 14.304 -8.670 1.00 0.78 O ATOM 627 C5 U A 23 -6.587 15.030 -7.145 1.00 0.72 C ATOM 628 C6 U A 23 -6.948 15.081 -5.840 1.00 0.72 C ATOM 0 H5' U A 23 -8.939 17.849 -2.159 1.00 0.90 H new ATOM 0 H5'' U A 23 -7.953 17.538 -3.574 1.00 0.90 H new ATOM 0 H4' U A 23 -9.047 15.528 -1.631 1.00 0.83 H new ATOM 0 H3' U A 23 -6.826 16.842 -0.964 1.00 0.90 H new ATOM 0 H2' U A 23 -5.743 16.656 -3.259 1.00 0.88 H new ATOM 0 HO2' U A 23 -4.240 14.711 -2.745 1.00 0.95 H new ATOM 0 HO3' U A 23 -5.937 14.438 -0.689 1.00 0.89 H new ATOM 0 H1' U A 23 -6.271 13.654 -3.006 1.00 0.78 H new ATOM 0 H3 U A 23 -3.706 13.485 -6.702 1.00 0.79 H new ATOM 0 H5 U A 23 -7.235 15.447 -7.902 1.00 0.72 H new ATOM 0 H6 U A 23 -7.888 15.541 -5.572 1.00 0.72 H new TER 640 U A 23 HETATM 641 C1 TOA A 100 -8.198 0.406 -7.782 1.00 0.33 C HETATM 642 C2 TOA A 100 -7.615 1.758 -8.181 1.00 0.37 C HETATM 643 C3 TOA A 100 -6.967 1.631 -9.560 1.00 0.39 C HETATM 644 C4 TOA A 100 -5.929 0.501 -9.574 1.00 0.41 C HETATM 645 C5 TOA A 100 -6.555 -0.792 -9.040 1.00 0.37 C HETATM 646 C6 TOA A 100 -5.574 -1.941 -8.874 1.00 0.42 C HETATM 647 O2 TOA A 100 -8.646 2.741 -8.220 1.00 0.38 O HETATM 648 N3 TOA A 100 -6.315 2.851 -10.133 1.00 0.43 N HETATM 649 O4 TOA A 100 -5.477 0.305 -10.908 1.00 0.46 O HETATM 650 O5 TOA A 100 -7.156 -0.551 -7.752 1.00 0.36 O HETATM 651 O6 TOA A 100 -6.228 -3.095 -8.356 1.00 0.43 O HETATM 0 HN33 TOA A 100 -6.808 3.135 -10.980 1.00 0.43 H new HETATM 0 HN32 TOA A 100 -6.350 3.608 -9.450 1.00 0.43 H new HETATM 0 HN31 TOA A 100 -5.343 2.643 -10.360 1.00 0.43 H new HETATM 0 HO6 TOA A 100 -5.822 -3.345 -7.500 1.00 0.43 H new HETATM 0 HO4 TOA A 100 -4.704 -0.297 -10.906 1.00 0.46 H new HETATM 0 HO2 TOA A 100 -8.250 3.634 -8.138 1.00 0.38 H new HETATM 0 H62 TOA A 100 -5.118 -2.177 -9.835 1.00 0.42 H new HETATM 0 H61 TOA A 100 -4.768 -1.643 -8.203 1.00 0.42 H new HETATM 0 H5 TOA A 100 -7.287 -1.085 -9.792 1.00 0.37 H new HETATM 0 H4 TOA A 100 -5.087 0.770 -8.937 1.00 0.41 H new HETATM 0 H3 TOA A 100 -7.827 1.429 -10.198 1.00 0.39 H new HETATM 0 H2 TOA A 100 -6.868 2.064 -7.449 1.00 0.37 H new HETATM 665 C1 TOC A 102 -10.721 -4.750 -6.739 1.00 0.25 C HETATM 666 C2 TOC A 102 -9.521 -5.658 -7.028 1.00 0.26 C HETATM 667 C3 TOC A 102 -9.977 -7.020 -7.552 1.00 0.30 C HETATM 668 C4 TOC A 102 -10.990 -7.608 -6.583 1.00 0.36 C HETATM 669 C5 TOC A 102 -12.161 -6.651 -6.443 1.00 0.34 C HETATM 670 C6 TOC A 102 -13.213 -7.187 -5.489 1.00 0.43 C HETATM 671 N2 TOC A 102 -8.637 -5.007 -8.047 1.00 0.26 N HETATM 672 N6 TOC A 102 -13.666 -8.527 -6.001 1.00 0.48 N HETATM 673 O4 TOC A 102 -11.447 -8.869 -7.051 1.00 0.45 O HETATM 674 O5 TOC A 102 -11.690 -5.397 -5.921 1.00 0.30 O HETATM 0 HN63 TOC A 102 -14.118 -9.044 -5.247 1.00 0.48 H new HETATM 0 HN62 TOC A 102 -14.328 -8.393 -6.766 1.00 0.48 H new HETATM 0 HN61 TOC A 102 -12.860 -9.053 -6.338 1.00 0.48 H new HETATM 0 HN23 TOC A 102 -7.682 -5.346 -7.935 1.00 0.26 H new HETATM 0 HN22 TOC A 102 -8.971 -5.235 -8.983 1.00 0.26 H new HETATM 0 HN21 TOC A 102 -8.655 -3.995 -7.917 1.00 0.26 H new HETATM 0 HO4 TOC A 102 -10.745 -9.540 -6.922 1.00 0.45 H new HETATM 0 H62 TOC A 102 -12.803 -7.282 -4.484 1.00 0.43 H new HETATM 0 H61 TOC A 102 -14.056 -6.499 -5.425 1.00 0.43 H new HETATM 0 H5 TOC A 102 -12.606 -6.529 -7.430 1.00 0.34 H new HETATM 0 H4 TOC A 102 -10.517 -7.752 -5.612 1.00 0.36 H new HETATM 0 H32 TOC A 102 -10.421 -6.913 -8.542 1.00 0.30 H new HETATM 0 H31 TOC A 102 -9.123 -7.689 -7.656 1.00 0.30 H new HETATM 0 H2 TOC A 102 -8.973 -5.810 -6.098 1.00 0.26 H new HETATM 690 C1 2TB A 101 -11.557 -0.159 -9.082 1.00 0.26 C HETATM 691 C2 2TB A 101 -12.825 -1.000 -8.882 1.00 0.25 C HETATM 692 C3 2TB A 101 -12.547 -2.497 -8.987 1.00 0.22 C HETATM 693 C4 2TB A 101 -11.483 -2.862 -7.961 1.00 0.23 C HETATM 694 C5 2TB A 101 -10.177 -2.140 -8.302 1.00 0.24 C HETATM 695 C6 2TB A 101 -10.367 -0.615 -8.223 1.00 0.26 C HETATM 696 N1 2TB A 101 -11.834 1.290 -8.801 1.00 0.34 N HETATM 697 N3 2TB A 101 -13.801 -3.293 -8.782 1.00 0.29 N HETATM 698 O5 2TB A 101 -9.159 -2.557 -7.401 1.00 0.29 O HETATM 699 O4 2TB A 101 -11.268 -4.285 -7.942 1.00 0.22 O HETATM 700 O6 2TB A 101 -9.184 0.050 -8.713 1.00 0.30 O HETATM 0 HN33 2TB A 101 -13.569 -4.285 -8.724 1.00 0.29 H new HETATM 0 HN32 2TB A 101 -14.253 -2.999 -7.916 1.00 0.29 H new HETATM 0 HN31 2TB A 101 -14.435 -3.138 -9.566 1.00 0.29 H new HETATM 0 HN13 2TB A 101 -10.956 1.809 -8.792 1.00 0.34 H new HETATM 0 HN12 2TB A 101 -12.444 1.667 -9.527 1.00 0.34 H new HETATM 0 HN11 2TB A 101 -12.291 1.380 -7.893 1.00 0.34 H new HETATM 0 HO5 2TB A 101 -8.354 -2.016 -7.544 1.00 0.29 H new HETATM 0 H6 2TB A 101 -10.553 -0.359 -7.180 1.00 0.26 H new HETATM 0 H5 2TB A 101 -9.884 -2.394 -9.321 1.00 0.24 H new HETATM 0 H4 2TB A 101 -11.823 -2.552 -6.973 1.00 0.23 H new HETATM 0 H3 2TB A 101 -12.184 -2.736 -9.987 1.00 0.22 H new HETATM 0 H22 2TB A 101 -13.254 -0.780 -7.905 1.00 0.25 H new HETATM 0 H21 2TB A 101 -13.568 -0.717 -9.628 1.00 0.25 H new HETATM 0 H1 2TB A 101 -11.276 -0.302 -10.125 1.00 0.26 H new