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 O6 : rot 129:sc= 0.573 USER MOD Set 1.2: A 101 2TB O5 : rot -179:sc= 0.747 USER MOD Set 1.3: A 102 TOC N2 :NH3+ 151:sc= 3.13 (180deg=0.295) USER MOD Set 2.1: A 100 TOA O2 : rot 150:sc= 2.19 USER MOD Set 2.2: A 101 2TB N1 :NH3+ -177:sc= -1.35! (180deg=-1.73!) USER MOD Single : A 4 A O2' : rot -67:sc= 0.565 USER MOD Single : A 4 A O5' : rot 180:sc= 0 USER MOD Single : A 5 C O2' : rot -17:sc= 0.311 USER MOD Single : A 6 U O2' : rot -21:sc= 0.279 USER MOD Single : A 7 U O2' : rot -16:sc= 0.414 USER MOD Single : A 8 G O2' : rot -10:sc= 0.544 USER MOD Single : A 9 G O2' : rot -33:sc= 0.191 USER MOD Single : A 10 U O2' : rot -16:sc= 0.314 USER MOD Single : A 11 U O2' : rot 149:sc= -7.36! USER MOD Single : A 12 U O2' : rot -66:sc= 0.449 USER MOD Single : A 13 A O2' : rot 90:sc= -4.91! USER MOD Single : A 14 G O2' : rot -170:sc= 1.05 USER MOD Single : A 15 G O2' : rot -43:sc= 0.555 USER MOD Single : A 16 U O2' : rot -18:sc= 0.163 USER MOD Single : A 17 A O2' : rot -13:sc= 0.424 USER MOD Single : A 18 A O2' : rot -17:sc= 0.261 USER MOD Single : A 19 U O2' : rot -25:sc= 0.266 USER MOD Single : A 20 G O2' : rot -18:sc= 0.277 USER MOD Single : A 21 A O2' : rot -68:sc= 0.67 USER MOD Single : A 22 G O2' : rot -21:sc= 0.282 USER MOD Single : A 23 U O2' : rot -28:sc= 0.111 USER MOD Single : A 23 U O3' : rot 180:sc= 0.108 USER MOD Single : A 100 TOA N3 :NH3+ 137:sc= 2.34 (180deg=-1.29!) USER MOD Single : A 100 TOA O4 : rot 170:sc= 0.49 USER MOD Single : A 101 2TB N3 :NH3+ -170:sc= 0.753 (180deg=0.692) USER MOD Single : A 102 TOC N6 :NH3+ 146:sc= 0.835 (180deg=0.368!) USER MOD Single : A 102 TOC O4 : rot 42:sc= 1.86 USER MOD ----------------------------------------------------------------- ATOM 1 O5' A A 4 5.135 10.160 -9.068 1.00 1.17 O ATOM 2 C5' A A 4 5.793 10.139 -7.798 1.00 1.13 C ATOM 3 C4' A A 4 4.801 10.289 -6.647 1.00 1.04 C ATOM 4 O4' A A 4 4.062 11.502 -6.810 1.00 1.02 O ATOM 5 C3' A A 4 3.720 9.228 -6.589 1.00 1.02 C ATOM 6 O3' A A 4 4.246 8.132 -5.825 1.00 1.11 O ATOM 7 C2' A A 4 2.647 9.910 -5.751 1.00 1.00 C ATOM 8 O2' A A 4 2.953 9.808 -4.357 1.00 1.10 O ATOM 9 C1' A A 4 2.751 11.365 -6.229 1.00 0.97 C ATOM 10 N9 A A 4 1.742 11.699 -7.256 1.00 0.90 N ATOM 11 C8 A A 4 1.890 11.752 -8.620 1.00 0.96 C ATOM 12 N7 A A 4 0.802 12.102 -9.251 1.00 0.93 N ATOM 13 C5 A A 4 -0.126 12.294 -8.233 1.00 0.83 C ATOM 14 C6 A A 4 -1.478 12.676 -8.235 1.00 0.79 C ATOM 15 N6 A A 4 -2.168 12.953 -9.338 1.00 0.84 N ATOM 16 N1 A A 4 -2.101 12.768 -7.051 1.00 0.72 N ATOM 17 C2 A A 4 -1.424 12.500 -5.942 1.00 0.72 C ATOM 18 N3 A A 4 -0.160 12.133 -5.805 1.00 0.76 N ATOM 19 C4 A A 4 0.437 12.050 -7.013 1.00 0.81 C ATOM 0 H5' A A 4 6.526 10.945 -7.754 1.00 1.13 H new ATOM 0 H5'' A A 4 6.341 9.203 -7.687 1.00 1.13 H new ATOM 0 H4' A A 4 5.425 10.235 -5.755 1.00 1.04 H new ATOM 0 H3' A A 4 3.372 8.871 -7.558 1.00 1.02 H new ATOM 0 H2' A A 4 1.653 9.478 -5.864 1.00 1.00 H new ATOM 0 HO2' A A 4 2.893 8.871 -4.077 1.00 1.10 H new ATOM 0 HO5' A A 4 5.799 10.064 -9.782 1.00 1.17 H new ATOM 0 H1' A A 4 2.580 12.036 -5.387 1.00 0.97 H new ATOM 0 H8 A A 4 2.818 11.526 -9.123 1.00 0.96 H new ATOM 0 H61 A A 4 -3.149 13.225 -9.271 1.00 0.84 H new ATOM 0 H62 A A 4 -1.716 12.893 -10.251 1.00 0.84 H new ATOM 0 H2 A A 4 -1.983 12.595 -5.022 1.00 0.72 H new ATOM 32 P C A 5 3.455 6.731 -5.722 1.00 1.11 P ATOM 33 OP1 C A 5 4.434 5.670 -5.398 1.00 1.30 O ATOM 34 OP2 C A 5 2.589 6.597 -6.917 1.00 1.11 O ATOM 35 O5' C A 5 2.508 6.953 -4.436 1.00 1.02 O ATOM 36 C5' C A 5 1.196 6.379 -4.388 1.00 0.93 C ATOM 37 C4' C A 5 0.261 7.181 -3.488 1.00 0.88 C ATOM 38 O4' C A 5 0.245 8.550 -3.925 1.00 0.85 O ATOM 39 C3' C A 5 -1.200 6.753 -3.545 1.00 0.85 C ATOM 40 O3' C A 5 -1.419 5.816 -2.484 1.00 0.95 O ATOM 41 C2' C A 5 -1.926 8.033 -3.179 1.00 0.81 C ATOM 42 O2' C A 5 -1.846 8.276 -1.772 1.00 0.88 O ATOM 43 C1' C A 5 -1.102 9.054 -3.956 1.00 0.77 C ATOM 44 N1 C A 5 -1.531 9.181 -5.367 1.00 0.69 N ATOM 45 C2 C A 5 -2.748 9.796 -5.620 1.00 0.60 C ATOM 46 O2 C A 5 -3.458 10.183 -4.696 1.00 0.59 O ATOM 47 N3 C A 5 -3.144 9.954 -6.908 1.00 0.58 N ATOM 48 C4 C A 5 -2.378 9.524 -7.915 1.00 0.63 C ATOM 49 N4 C A 5 -2.821 9.724 -9.150 1.00 0.65 N ATOM 50 C5 C A 5 -1.126 8.886 -7.669 1.00 0.73 C ATOM 51 C6 C A 5 -0.742 8.734 -6.390 1.00 0.76 C ATOM 0 H5' C A 5 1.261 5.354 -4.024 1.00 0.93 H new ATOM 0 H5'' C A 5 0.782 6.334 -5.395 1.00 0.93 H new ATOM 0 H4' C A 5 0.647 7.023 -2.481 1.00 0.88 H new ATOM 0 H3' C A 5 -1.505 6.314 -4.495 1.00 0.85 H new ATOM 0 H2' C A 5 -2.991 8.038 -3.410 1.00 0.81 H new ATOM 0 HO2' C A 5 -1.590 7.450 -1.311 1.00 0.88 H new ATOM 0 H1' C A 5 -1.214 10.042 -3.510 1.00 0.77 H new ATOM 0 H41 C A 5 -2.267 9.411 -9.947 1.00 0.65 H new ATOM 0 H42 C A 5 -3.715 10.190 -9.302 1.00 0.65 H new ATOM 0 H5 C A 5 -0.508 8.537 -8.483 1.00 0.73 H new ATOM 0 H6 C A 5 0.200 8.254 -6.168 1.00 0.76 H new ATOM 63 P U A 6 -1.590 4.244 -2.794 1.00 0.87 P ATOM 64 OP1 U A 6 -0.449 3.526 -2.186 1.00 1.20 O ATOM 65 OP2 U A 6 -1.876 4.085 -4.241 1.00 0.87 O ATOM 66 O5' U A 6 -2.924 3.862 -1.971 1.00 0.69 O ATOM 67 C5' U A 6 -4.204 3.815 -2.617 1.00 0.60 C ATOM 68 C4' U A 6 -5.053 5.041 -2.291 1.00 0.47 C ATOM 69 O4' U A 6 -4.426 6.216 -2.828 1.00 0.46 O ATOM 70 C3' U A 6 -6.433 5.043 -2.927 1.00 0.46 C ATOM 71 O3' U A 6 -7.338 4.428 -2.001 1.00 0.51 O ATOM 72 C2' U A 6 -6.760 6.523 -2.971 1.00 0.45 C ATOM 73 O2' U A 6 -7.120 6.999 -1.670 1.00 0.52 O ATOM 74 C1' U A 6 -5.413 7.095 -3.407 1.00 0.42 C ATOM 75 N1 U A 6 -5.240 7.106 -4.877 1.00 0.40 N ATOM 76 C2 U A 6 -6.154 7.826 -5.629 1.00 0.38 C ATOM 77 O2 U A 6 -7.103 8.418 -5.130 1.00 0.41 O ATOM 78 N3 U A 6 -5.945 7.834 -6.988 1.00 0.38 N ATOM 79 C4 U A 6 -4.923 7.199 -7.658 1.00 0.41 C ATOM 80 O4 U A 6 -4.841 7.298 -8.877 1.00 0.46 O ATOM 81 C5 U A 6 -4.012 6.464 -6.813 1.00 0.45 C ATOM 82 C6 U A 6 -4.197 6.443 -5.471 1.00 0.43 C ATOM 0 H5' U A 6 -4.734 2.914 -2.307 1.00 0.60 H new ATOM 0 H5'' U A 6 -4.064 3.747 -3.696 1.00 0.60 H new ATOM 0 H4' U A 6 -5.144 5.023 -1.205 1.00 0.47 H new ATOM 0 H3' U A 6 -6.490 4.536 -3.890 1.00 0.46 H new ATOM 0 H2' U A 6 -7.597 6.789 -3.616 1.00 0.45 H new ATOM 0 HO2' U A 6 -7.397 6.244 -1.111 1.00 0.52 H new ATOM 0 H1' U A 6 -5.327 8.132 -3.082 1.00 0.42 H new ATOM 0 H3 U A 6 -6.610 8.361 -7.554 1.00 0.38 H new ATOM 0 H5 U A 6 -3.182 5.930 -7.251 1.00 0.45 H new ATOM 0 H6 U A 6 -3.505 5.890 -4.853 1.00 0.43 H new ATOM 93 P U A 7 -7.798 2.895 -2.191 1.00 0.44 P ATOM 94 OP1 U A 7 -7.488 2.158 -0.948 1.00 0.64 O ATOM 95 OP2 U A 7 -7.269 2.406 -3.492 1.00 0.45 O ATOM 96 O5' U A 7 -9.398 3.020 -2.321 1.00 0.50 O ATOM 97 C5' U A 7 -10.063 2.646 -3.533 1.00 0.41 C ATOM 98 C4' U A 7 -11.106 3.677 -3.956 1.00 0.42 C ATOM 99 O4' U A 7 -10.472 4.959 -4.102 1.00 0.53 O ATOM 100 C3' U A 7 -11.751 3.390 -5.310 1.00 0.41 C ATOM 101 O3' U A 7 -13.059 2.857 -5.046 1.00 0.41 O ATOM 102 C2' U A 7 -11.941 4.771 -5.922 1.00 0.46 C ATOM 103 O2' U A 7 -13.136 5.387 -5.431 1.00 0.50 O ATOM 104 C1' U A 7 -10.707 5.503 -5.406 1.00 0.49 C ATOM 105 N1 U A 7 -9.497 5.288 -6.231 1.00 0.46 N ATOM 106 C2 U A 7 -9.536 5.680 -7.558 1.00 0.46 C ATOM 107 O2 U A 7 -10.533 6.166 -8.083 1.00 0.47 O ATOM 108 N3 U A 7 -8.379 5.484 -8.274 1.00 0.46 N ATOM 109 C4 U A 7 -7.206 4.942 -7.799 1.00 0.47 C ATOM 110 O4 U A 7 -6.253 4.787 -8.554 1.00 0.50 O ATOM 111 C5 U A 7 -7.239 4.561 -6.410 1.00 0.48 C ATOM 112 C6 U A 7 -8.367 4.742 -5.683 1.00 0.48 C ATOM 0 H5' U A 7 -10.545 1.678 -3.398 1.00 0.41 H new ATOM 0 H5'' U A 7 -9.327 2.528 -4.328 1.00 0.41 H new ATOM 0 H4' U A 7 -11.871 3.646 -3.181 1.00 0.42 H new ATOM 0 H3' U A 7 -11.175 2.710 -5.938 1.00 0.41 H new ATOM 0 H2' U A 7 -12.040 4.768 -7.007 1.00 0.46 H new ATOM 0 HO2' U A 7 -13.708 4.708 -5.016 1.00 0.50 H new ATOM 0 H1' U A 7 -10.891 6.577 -5.422 1.00 0.49 H new ATOM 0 H3 U A 7 -8.391 5.768 -9.254 1.00 0.46 H new ATOM 0 H5 U A 7 -6.363 4.130 -5.948 1.00 0.48 H new ATOM 0 H6 U A 7 -8.376 4.448 -4.644 1.00 0.48 H new ATOM 123 P G A 8 -13.275 1.293 -4.715 1.00 0.41 P ATOM 124 OP1 G A 8 -14.492 1.150 -3.890 1.00 0.50 O ATOM 125 OP2 G A 8 -11.988 0.727 -4.252 1.00 0.48 O ATOM 126 O5' G A 8 -13.577 0.672 -6.177 1.00 0.36 O ATOM 127 C5' G A 8 -14.826 0.905 -6.845 1.00 0.35 C ATOM 128 C4' G A 8 -15.037 2.383 -7.171 1.00 0.36 C ATOM 129 O4' G A 8 -13.829 2.931 -7.668 1.00 0.35 O ATOM 130 C3' G A 8 -16.014 2.651 -8.297 1.00 0.37 C ATOM 131 O3' G A 8 -17.320 2.765 -7.717 1.00 0.43 O ATOM 132 C2' G A 8 -15.607 4.035 -8.804 1.00 0.40 C ATOM 133 O2' G A 8 -16.349 5.052 -8.124 1.00 0.48 O ATOM 134 C1' G A 8 -14.116 4.117 -8.423 1.00 0.38 C ATOM 135 N9 G A 8 -13.203 4.129 -9.581 1.00 0.35 N ATOM 136 C8 G A 8 -11.849 3.945 -9.574 1.00 0.34 C ATOM 137 N7 G A 8 -11.307 3.963 -10.757 1.00 0.33 N ATOM 138 C5 G A 8 -12.384 4.178 -11.613 1.00 0.33 C ATOM 139 C6 G A 8 -12.416 4.291 -13.029 1.00 0.35 C ATOM 140 O6 G A 8 -11.487 4.186 -13.819 1.00 0.35 O ATOM 141 N1 G A 8 -13.698 4.508 -13.494 1.00 0.38 N ATOM 142 C2 G A 8 -14.815 4.601 -12.706 1.00 0.40 C ATOM 143 N2 G A 8 -15.971 4.803 -13.320 1.00 0.46 N ATOM 144 N3 G A 8 -14.803 4.494 -11.379 1.00 0.38 N ATOM 145 C4 G A 8 -13.553 4.284 -10.902 1.00 0.35 C ATOM 0 H5' G A 8 -15.644 0.553 -6.217 1.00 0.35 H new ATOM 0 H5'' G A 8 -14.858 0.323 -7.766 1.00 0.35 H new ATOM 0 H4' G A 8 -15.403 2.810 -6.238 1.00 0.36 H new ATOM 0 H3' G A 8 -16.014 1.884 -9.072 1.00 0.37 H new ATOM 0 H2' G A 8 -15.792 4.178 -9.869 1.00 0.40 H new ATOM 0 HO2' G A 8 -17.064 4.638 -7.596 1.00 0.48 H new ATOM 0 H1' G A 8 -13.957 5.049 -7.881 1.00 0.38 H new ATOM 0 H8 G A 8 -11.280 3.798 -8.668 1.00 0.34 H new ATOM 0 H1 G A 8 -13.823 4.607 -14.501 1.00 0.38 H new ATOM 0 H21 G A 8 -16.831 4.879 -12.776 1.00 0.46 H new ATOM 0 H22 G A 8 -16.002 4.882 -14.336 1.00 0.46 H new ATOM 157 P G A 9 -18.335 1.510 -7.733 1.00 0.45 P ATOM 158 OP1 G A 9 -19.669 1.991 -7.309 1.00 0.53 O ATOM 159 OP2 G A 9 -17.690 0.386 -7.014 1.00 0.47 O ATOM 160 O5' G A 9 -18.407 1.132 -9.300 1.00 0.44 O ATOM 161 C5' G A 9 -17.626 0.054 -9.836 1.00 0.40 C ATOM 162 C4' G A 9 -17.531 0.129 -11.358 1.00 0.41 C ATOM 163 O4' G A 9 -16.870 1.346 -11.746 1.00 0.41 O ATOM 164 C3' G A 9 -16.674 -0.948 -12.000 1.00 0.39 C ATOM 165 O3' G A 9 -17.508 -2.088 -12.240 1.00 0.46 O ATOM 166 C2' G A 9 -16.351 -0.309 -13.337 1.00 0.38 C ATOM 167 O2' G A 9 -17.500 -0.294 -14.191 1.00 0.45 O ATOM 168 C1' G A 9 -15.998 1.100 -12.869 1.00 0.37 C ATOM 169 N9 G A 9 -14.603 1.202 -12.410 1.00 0.32 N ATOM 170 C8 G A 9 -14.141 1.294 -11.129 1.00 0.31 C ATOM 171 N7 G A 9 -12.846 1.345 -11.038 1.00 0.30 N ATOM 172 C5 G A 9 -12.417 1.286 -12.357 1.00 0.29 C ATOM 173 C6 G A 9 -11.103 1.303 -12.886 1.00 0.30 C ATOM 174 O6 G A 9 -10.043 1.370 -12.278 1.00 0.32 O ATOM 175 N1 G A 9 -11.105 1.224 -14.264 1.00 0.32 N ATOM 176 C2 G A 9 -12.231 1.139 -15.044 1.00 0.32 C ATOM 177 N2 G A 9 -12.049 1.065 -16.354 1.00 0.36 N ATOM 178 N3 G A 9 -13.473 1.123 -14.562 1.00 0.32 N ATOM 179 C4 G A 9 -13.488 1.198 -13.211 1.00 0.30 C ATOM 0 H5' G A 9 -18.071 -0.898 -9.545 1.00 0.40 H new ATOM 0 H5'' G A 9 -16.624 0.082 -9.407 1.00 0.40 H new ATOM 0 H4' G A 9 -18.566 0.034 -11.686 1.00 0.41 H new ATOM 0 H3' G A 9 -15.807 -1.259 -11.418 1.00 0.39 H new ATOM 0 H2' G A 9 -15.580 -0.813 -13.919 1.00 0.38 H new ATOM 0 HO2' G A 9 -18.047 -1.088 -14.017 1.00 0.45 H new ATOM 0 H1' G A 9 -16.115 1.812 -13.686 1.00 0.37 H new ATOM 0 H8 G A 9 -14.793 1.322 -10.269 1.00 0.31 H new ATOM 0 H1 G A 9 -10.202 1.229 -14.738 1.00 0.32 H new ATOM 0 H21 G A 9 -12.853 1.000 -16.978 1.00 0.36 H new ATOM 0 H22 G A 9 -11.104 1.073 -16.739 1.00 0.36 H new ATOM 191 P U A 10 -16.860 -3.556 -12.360 1.00 0.46 P ATOM 192 OP1 U A 10 -17.945 -4.555 -12.256 1.00 0.58 O ATOM 193 OP2 U A 10 -15.700 -3.623 -11.424 1.00 0.44 O ATOM 194 O5' U A 10 -16.299 -3.568 -13.871 1.00 0.41 O ATOM 195 C5' U A 10 -15.165 -4.366 -14.223 1.00 0.39 C ATOM 196 C4' U A 10 -14.588 -3.976 -15.583 1.00 0.33 C ATOM 197 O4' U A 10 -14.293 -2.572 -15.591 1.00 0.30 O ATOM 198 C3' U A 10 -13.265 -4.658 -15.911 1.00 0.31 C ATOM 199 O3' U A 10 -13.557 -5.757 -16.784 1.00 0.41 O ATOM 200 C2' U A 10 -12.531 -3.611 -16.728 1.00 0.29 C ATOM 201 O2' U A 10 -13.018 -3.580 -18.073 1.00 0.40 O ATOM 202 C1' U A 10 -12.933 -2.348 -15.977 1.00 0.26 C ATOM 203 N1 U A 10 -12.146 -2.106 -14.760 1.00 0.19 N ATOM 204 C2 U A 10 -10.766 -2.087 -14.858 1.00 0.18 C ATOM 205 O2 U A 10 -10.171 -2.245 -15.918 1.00 0.22 O ATOM 206 N3 U A 10 -10.086 -1.858 -13.686 1.00 0.19 N ATOM 207 C4 U A 10 -10.654 -1.646 -12.449 1.00 0.21 C ATOM 208 O4 U A 10 -9.939 -1.450 -11.470 1.00 0.27 O ATOM 209 C5 U A 10 -12.099 -1.680 -12.437 1.00 0.22 C ATOM 210 C6 U A 10 -12.779 -1.903 -13.572 1.00 0.21 C ATOM 0 H5' U A 10 -15.453 -5.417 -14.240 1.00 0.39 H new ATOM 0 H5'' U A 10 -14.395 -4.259 -13.459 1.00 0.39 H new ATOM 0 H4' U A 10 -15.343 -4.275 -16.309 1.00 0.33 H new ATOM 0 H3' U A 10 -12.714 -5.006 -15.037 1.00 0.31 H new ATOM 0 H2' U A 10 -11.456 -3.770 -16.818 1.00 0.29 H new ATOM 0 HO2' U A 10 -13.525 -4.399 -18.256 1.00 0.40 H new ATOM 0 H1' U A 10 -12.774 -1.480 -16.617 1.00 0.26 H new ATOM 0 H3 U A 10 -9.067 -1.844 -13.737 1.00 0.19 H new ATOM 0 H5 U A 10 -12.633 -1.525 -11.511 1.00 0.22 H new ATOM 0 H6 U A 10 -13.858 -1.922 -13.542 1.00 0.21 H new ATOM 221 P U A 11 -12.900 -7.204 -16.523 1.00 0.45 P ATOM 222 OP1 U A 11 -13.271 -8.092 -17.647 1.00 0.60 O ATOM 223 OP2 U A 11 -13.207 -7.603 -15.130 1.00 0.57 O ATOM 224 O5' U A 11 -11.322 -6.891 -16.620 1.00 0.34 O ATOM 225 C5' U A 11 -10.731 -6.452 -17.850 1.00 0.29 C ATOM 226 C4' U A 11 -9.225 -6.256 -17.710 1.00 0.25 C ATOM 227 O4' U A 11 -8.970 -5.245 -16.720 1.00 0.25 O ATOM 228 C3' U A 11 -8.472 -7.494 -17.224 1.00 0.29 C ATOM 229 O3' U A 11 -7.134 -7.422 -17.740 1.00 0.35 O ATOM 230 C2' U A 11 -8.402 -7.290 -15.723 1.00 0.28 C ATOM 231 O2' U A 11 -7.279 -7.968 -15.164 1.00 0.37 O ATOM 232 C1' U A 11 -8.224 -5.786 -15.622 1.00 0.22 C ATOM 233 N1 U A 11 -8.784 -5.276 -14.359 1.00 0.18 N ATOM 234 C2 U A 11 -7.916 -5.094 -13.299 1.00 0.18 C ATOM 235 O2 U A 11 -6.703 -5.261 -13.394 1.00 0.23 O ATOM 236 N3 U A 11 -8.488 -4.715 -12.108 1.00 0.18 N ATOM 237 C4 U A 11 -9.830 -4.505 -11.882 1.00 0.19 C ATOM 238 O4 U A 11 -10.220 -4.182 -10.761 1.00 0.22 O ATOM 239 C5 U A 11 -10.674 -4.707 -13.036 1.00 0.20 C ATOM 240 C6 U A 11 -10.130 -5.076 -14.220 1.00 0.19 C ATOM 0 H5' U A 11 -11.193 -5.516 -18.163 1.00 0.29 H new ATOM 0 H5'' U A 11 -10.932 -7.184 -18.633 1.00 0.29 H new ATOM 0 H4' U A 11 -8.878 -5.999 -18.711 1.00 0.25 H new ATOM 0 H3' U A 11 -8.932 -8.437 -17.520 1.00 0.29 H new ATOM 0 H2' U A 11 -9.269 -7.675 -15.186 1.00 0.28 H new ATOM 0 HO2' U A 11 -6.958 -7.477 -14.379 1.00 0.37 H new ATOM 0 H1' U A 11 -7.170 -5.509 -15.648 1.00 0.22 H new ATOM 0 H3 U A 11 -7.859 -4.576 -11.317 1.00 0.18 H new ATOM 0 H5 U A 11 -11.741 -4.564 -12.955 1.00 0.20 H new ATOM 0 H6 U A 11 -10.775 -5.216 -15.075 1.00 0.19 H new ATOM 251 P U A 12 -6.373 -8.750 -18.256 1.00 0.46 P ATOM 252 OP1 U A 12 -5.461 -8.362 -19.355 1.00 0.57 O ATOM 253 OP2 U A 12 -7.387 -9.807 -18.481 1.00 0.52 O ATOM 254 O5' U A 12 -5.477 -9.170 -16.982 1.00 0.46 O ATOM 255 C5' U A 12 -5.972 -10.075 -15.981 1.00 0.44 C ATOM 256 C4' U A 12 -4.990 -10.208 -14.819 1.00 0.43 C ATOM 257 O4' U A 12 -4.761 -8.922 -14.226 1.00 0.37 O ATOM 258 C3' U A 12 -5.470 -11.032 -13.637 1.00 0.45 C ATOM 259 O3' U A 12 -5.219 -12.416 -13.919 1.00 0.56 O ATOM 260 C2' U A 12 -4.498 -10.576 -12.573 1.00 0.42 C ATOM 261 O2' U A 12 -3.178 -11.060 -12.830 1.00 0.49 O ATOM 262 C1' U A 12 -4.567 -9.073 -12.802 1.00 0.36 C ATOM 263 N1 U A 12 -5.699 -8.450 -12.088 1.00 0.30 N ATOM 264 C2 U A 12 -5.482 -8.025 -10.794 1.00 0.30 C ATOM 265 O2 U A 12 -4.402 -8.127 -10.236 1.00 0.34 O ATOM 266 N3 U A 12 -6.554 -7.456 -10.158 1.00 0.26 N ATOM 267 C4 U A 12 -7.811 -7.271 -10.689 1.00 0.23 C ATOM 268 O4 U A 12 -8.674 -6.704 -10.026 1.00 0.24 O ATOM 269 C5 U A 12 -7.966 -7.745 -12.044 1.00 0.24 C ATOM 270 C6 U A 12 -6.920 -8.308 -12.687 1.00 0.27 C ATOM 0 H5' U A 12 -6.146 -11.054 -16.427 1.00 0.44 H new ATOM 0 H5'' U A 12 -6.933 -9.719 -15.609 1.00 0.44 H new ATOM 0 H4' U A 12 -4.127 -10.684 -15.284 1.00 0.43 H new ATOM 0 H3' U A 12 -6.525 -10.920 -13.385 1.00 0.45 H new ATOM 0 H2' U A 12 -4.728 -10.915 -11.563 1.00 0.42 H new ATOM 0 HO2' U A 12 -3.166 -12.036 -12.748 1.00 0.49 H new ATOM 0 H1' U A 12 -3.665 -8.587 -12.432 1.00 0.36 H new ATOM 0 H3 U A 12 -6.407 -7.139 -9.200 1.00 0.26 H new ATOM 0 H5 U A 12 -8.919 -7.649 -12.544 1.00 0.24 H new ATOM 0 H6 U A 12 -7.052 -8.655 -13.701 1.00 0.27 H new ATOM 281 P A A 13 -6.404 -13.506 -13.807 1.00 0.62 P ATOM 282 OP1 A A 13 -6.354 -14.369 -15.008 1.00 0.78 O ATOM 283 OP2 A A 13 -7.659 -12.797 -13.460 1.00 0.69 O ATOM 284 O5' A A 13 -5.953 -14.389 -12.534 1.00 0.62 O ATOM 285 C5' A A 13 -6.888 -14.747 -11.503 1.00 0.61 C ATOM 286 C4' A A 13 -6.409 -14.278 -10.130 1.00 0.55 C ATOM 287 O4' A A 13 -5.084 -14.779 -9.913 1.00 0.60 O ATOM 288 C3' A A 13 -6.276 -12.769 -9.991 1.00 0.45 C ATOM 289 O3' A A 13 -7.480 -12.286 -9.370 1.00 0.40 O ATOM 290 C2' A A 13 -5.157 -12.605 -8.977 1.00 0.47 C ATOM 291 O2' A A 13 -5.656 -12.680 -7.640 1.00 0.48 O ATOM 292 C1' A A 13 -4.260 -13.798 -9.265 1.00 0.55 C ATOM 293 N9 A A 13 -3.128 -13.459 -10.143 1.00 0.57 N ATOM 294 C8 A A 13 -3.093 -13.404 -11.508 1.00 0.58 C ATOM 295 N7 A A 13 -1.921 -13.088 -11.989 1.00 0.60 N ATOM 296 C5 A A 13 -1.132 -12.918 -10.857 1.00 0.62 C ATOM 297 C6 A A 13 0.217 -12.571 -10.678 1.00 0.69 C ATOM 298 N6 A A 13 1.051 -12.311 -11.679 1.00 0.74 N ATOM 299 N1 A A 13 0.681 -12.491 -9.421 1.00 0.74 N ATOM 300 C2 A A 13 -0.145 -12.737 -8.413 1.00 0.71 C ATOM 301 N3 A A 13 -1.427 -13.069 -8.448 1.00 0.65 N ATOM 302 C4 A A 13 -1.858 -13.142 -9.724 1.00 0.61 C ATOM 0 H5' A A 13 -7.024 -15.828 -11.493 1.00 0.61 H new ATOM 0 H5'' A A 13 -7.860 -14.305 -11.722 1.00 0.61 H new ATOM 0 H4' A A 13 -7.159 -14.638 -9.426 1.00 0.55 H new ATOM 0 H3' A A 13 -6.100 -12.255 -10.936 1.00 0.45 H new ATOM 0 H2' A A 13 -4.652 -11.642 -9.057 1.00 0.47 H new ATOM 0 HO2' A A 13 -5.636 -13.611 -7.335 1.00 0.48 H new ATOM 0 H1' A A 13 -3.830 -14.159 -8.331 1.00 0.55 H new ATOM 0 H8 A A 13 -3.953 -13.603 -12.130 1.00 0.58 H new ATOM 0 H61 A A 13 2.021 -12.064 -11.483 1.00 0.74 H new ATOM 0 H62 A A 13 0.721 -12.358 -12.643 1.00 0.74 H new ATOM 0 H2 A A 13 0.288 -12.655 -7.427 1.00 0.71 H new ATOM 314 P G A 14 -7.825 -10.709 -9.349 1.00 0.34 P ATOM 315 OP1 G A 14 -9.087 -10.504 -8.593 1.00 0.36 O ATOM 316 OP2 G A 14 -7.714 -10.198 -10.730 1.00 0.36 O ATOM 317 O5' G A 14 -6.621 -10.068 -8.483 1.00 0.33 O ATOM 318 C5' G A 14 -6.530 -10.294 -7.067 1.00 0.35 C ATOM 319 C4' G A 14 -5.156 -9.912 -6.510 1.00 0.38 C ATOM 320 O4' G A 14 -4.132 -10.531 -7.278 1.00 0.43 O ATOM 321 C3' G A 14 -4.808 -8.443 -6.613 1.00 0.37 C ATOM 322 O3' G A 14 -5.290 -7.826 -5.410 1.00 0.37 O ATOM 323 C2' G A 14 -3.281 -8.438 -6.537 1.00 0.43 C ATOM 324 O2' G A 14 -2.847 -8.320 -5.179 1.00 0.51 O ATOM 325 C1' G A 14 -2.898 -9.817 -7.096 1.00 0.46 C ATOM 326 N9 G A 14 -2.196 -9.738 -8.392 1.00 0.48 N ATOM 327 C8 G A 14 -2.690 -9.983 -9.644 1.00 0.46 C ATOM 328 N7 G A 14 -1.808 -9.853 -10.596 1.00 0.50 N ATOM 329 C5 G A 14 -0.646 -9.490 -9.924 1.00 0.55 C ATOM 330 C6 G A 14 0.652 -9.208 -10.432 1.00 0.62 C ATOM 331 O6 G A 14 1.042 -9.234 -11.596 1.00 0.65 O ATOM 332 N1 G A 14 1.532 -8.881 -9.419 1.00 0.68 N ATOM 333 C2 G A 14 1.215 -8.833 -8.087 1.00 0.66 C ATOM 334 N2 G A 14 2.187 -8.503 -7.249 1.00 0.73 N ATOM 335 N3 G A 14 0.007 -9.095 -7.594 1.00 0.60 N ATOM 336 C4 G A 14 -0.874 -9.416 -8.572 1.00 0.54 C ATOM 0 H5' G A 14 -6.727 -11.345 -6.855 1.00 0.35 H new ATOM 0 H5'' G A 14 -7.301 -9.716 -6.558 1.00 0.35 H new ATOM 0 H4' G A 14 -5.213 -10.219 -5.466 1.00 0.38 H new ATOM 0 H3' G A 14 -5.208 -7.946 -7.497 1.00 0.37 H new ATOM 0 H2' G A 14 -2.829 -7.608 -7.080 1.00 0.43 H new ATOM 0 HO2' G A 14 -1.881 -8.155 -5.157 1.00 0.51 H new ATOM 0 H1' G A 14 -2.215 -10.308 -6.403 1.00 0.46 H new ATOM 0 H8 G A 14 -3.718 -10.259 -9.828 1.00 0.46 H new ATOM 0 H1 G A 14 2.492 -8.658 -9.683 1.00 0.68 H new ATOM 0 H21 G A 14 2.002 -8.453 -6.247 1.00 0.73 H new ATOM 0 H22 G A 14 3.120 -8.299 -7.606 1.00 0.73 H new ATOM 348 P G A 15 -6.404 -6.672 -5.444 1.00 0.38 P ATOM 349 OP1 G A 15 -7.611 -7.167 -4.745 1.00 0.52 O ATOM 350 OP2 G A 15 -6.526 -6.181 -6.843 1.00 0.36 O ATOM 351 O5' G A 15 -5.736 -5.511 -4.546 1.00 0.41 O ATOM 352 C5' G A 15 -5.247 -4.305 -5.145 1.00 0.41 C ATOM 353 C4' G A 15 -4.066 -4.572 -6.078 1.00 0.37 C ATOM 354 O4' G A 15 -3.972 -3.498 -7.031 1.00 0.38 O ATOM 355 C3' G A 15 -2.695 -4.617 -5.407 1.00 0.44 C ATOM 356 O3' G A 15 -1.833 -5.363 -6.281 1.00 0.42 O ATOM 357 C2' G A 15 -2.266 -3.154 -5.455 1.00 0.50 C ATOM 358 O2' G A 15 -0.845 -3.017 -5.362 1.00 0.58 O ATOM 359 C1' G A 15 -2.749 -2.766 -6.846 1.00 0.44 C ATOM 360 N9 G A 15 -3.031 -1.321 -6.955 1.00 0.50 N ATOM 361 C8 G A 15 -2.375 -0.374 -7.699 1.00 0.63 C ATOM 362 N7 G A 15 -2.855 0.831 -7.555 1.00 0.68 N ATOM 363 C5 G A 15 -3.902 0.670 -6.653 1.00 0.57 C ATOM 364 C6 G A 15 -4.802 1.632 -6.111 1.00 0.58 C ATOM 365 O6 G A 15 -4.875 2.832 -6.352 1.00 0.68 O ATOM 366 N1 G A 15 -5.701 1.050 -5.239 1.00 0.52 N ATOM 367 C2 G A 15 -5.746 -0.283 -4.929 1.00 0.46 C ATOM 368 N2 G A 15 -6.704 -0.673 -4.105 1.00 0.51 N ATOM 369 N3 G A 15 -4.916 -1.195 -5.425 1.00 0.43 N ATOM 370 C4 G A 15 -4.019 -0.646 -6.280 1.00 0.47 C ATOM 0 H5' G A 15 -4.942 -3.609 -4.364 1.00 0.41 H new ATOM 0 H5'' G A 15 -6.050 -3.825 -5.704 1.00 0.41 H new ATOM 0 H4' G A 15 -4.276 -5.553 -6.504 1.00 0.37 H new ATOM 0 H3' G A 15 -2.680 -5.052 -4.407 1.00 0.44 H new ATOM 0 H2' G A 15 -2.660 -2.547 -4.640 1.00 0.50 H new ATOM 0 HO2' G A 15 -0.502 -3.628 -4.677 1.00 0.58 H new ATOM 0 H1' G A 15 -1.988 -2.992 -7.593 1.00 0.44 H new ATOM 0 H8 G A 15 -1.540 -0.604 -8.344 1.00 0.63 H new ATOM 0 H1 G A 15 -6.384 1.660 -4.791 1.00 0.52 H new ATOM 0 H21 G A 15 -6.782 -1.655 -3.842 1.00 0.51 H new ATOM 0 H22 G A 15 -7.365 0.009 -3.733 1.00 0.51 H new ATOM 382 P U A 16 -0.420 -5.965 -5.774 1.00 0.48 P ATOM 383 OP1 U A 16 -0.606 -7.399 -5.470 1.00 0.59 O ATOM 384 OP2 U A 16 0.137 -5.068 -4.737 1.00 0.62 O ATOM 385 O5' U A 16 0.494 -5.844 -7.096 1.00 0.44 O ATOM 386 C5' U A 16 0.207 -4.850 -8.089 1.00 0.44 C ATOM 387 C4' U A 16 0.411 -5.383 -9.502 1.00 0.45 C ATOM 388 O4' U A 16 -0.472 -6.494 -9.733 1.00 0.43 O ATOM 389 C3' U A 16 0.071 -4.403 -10.614 1.00 0.47 C ATOM 390 O3' U A 16 1.271 -3.691 -10.942 1.00 0.57 O ATOM 391 C2' U A 16 -0.241 -5.343 -11.765 1.00 0.49 C ATOM 392 O2' U A 16 0.957 -5.930 -12.289 1.00 0.58 O ATOM 393 C1' U A 16 -1.080 -6.386 -11.034 1.00 0.43 C ATOM 394 N1 U A 16 -2.485 -5.964 -10.863 1.00 0.35 N ATOM 395 C2 U A 16 -3.254 -5.801 -12.001 1.00 0.33 C ATOM 396 O2 U A 16 -2.831 -6.040 -13.126 1.00 0.36 O ATOM 397 N3 U A 16 -4.541 -5.356 -11.801 1.00 0.30 N ATOM 398 C4 U A 16 -5.121 -5.065 -10.587 1.00 0.29 C ATOM 399 O4 U A 16 -6.287 -4.674 -10.540 1.00 0.30 O ATOM 400 C5 U A 16 -4.262 -5.266 -9.445 1.00 0.30 C ATOM 401 C6 U A 16 -2.992 -5.705 -9.619 1.00 0.34 C ATOM 0 H5' U A 16 0.849 -3.984 -7.932 1.00 0.44 H new ATOM 0 H5'' U A 16 -0.822 -4.509 -7.975 1.00 0.44 H new ATOM 0 H4' U A 16 1.473 -5.625 -9.541 1.00 0.45 H new ATOM 0 H3' U A 16 -0.721 -3.693 -10.377 1.00 0.47 H new ATOM 0 H2' U A 16 -0.725 -4.876 -12.623 1.00 0.49 H new ATOM 0 HO2' U A 16 1.731 -5.400 -12.007 1.00 0.58 H new ATOM 0 H1' U A 16 -1.102 -7.319 -11.597 1.00 0.43 H new ATOM 0 H3 U A 16 -5.120 -5.230 -12.631 1.00 0.30 H new ATOM 0 H5 U A 16 -4.632 -5.066 -8.450 1.00 0.30 H new ATOM 0 H6 U A 16 -2.364 -5.854 -8.753 1.00 0.34 H new ATOM 412 P A A 17 1.219 -2.132 -11.349 1.00 0.59 P ATOM 413 OP1 A A 17 2.606 -1.657 -11.551 1.00 0.74 O ATOM 414 OP2 A A 17 0.332 -1.433 -10.390 1.00 0.63 O ATOM 415 O5' A A 17 0.479 -2.161 -12.781 1.00 0.54 O ATOM 416 C5' A A 17 1.022 -2.909 -13.879 1.00 0.55 C ATOM 417 C4' A A 17 -0.055 -3.268 -14.897 1.00 0.45 C ATOM 418 O4' A A 17 -1.127 -3.930 -14.223 1.00 0.43 O ATOM 419 C3' A A 17 -0.728 -2.082 -15.563 1.00 0.44 C ATOM 420 O3' A A 17 0.002 -1.794 -16.767 1.00 0.49 O ATOM 421 C2' A A 17 -2.074 -2.651 -15.988 1.00 0.39 C ATOM 422 O2' A A 17 -1.955 -3.336 -17.239 1.00 0.41 O ATOM 423 C1' A A 17 -2.381 -3.641 -14.862 1.00 0.38 C ATOM 424 N9 A A 17 -3.323 -3.112 -13.854 1.00 0.34 N ATOM 425 C8 A A 17 -3.081 -2.759 -12.548 1.00 0.35 C ATOM 426 N7 A A 17 -4.153 -2.371 -11.905 1.00 0.32 N ATOM 427 C5 A A 17 -5.166 -2.481 -12.857 1.00 0.27 C ATOM 428 C6 A A 17 -6.547 -2.223 -12.813 1.00 0.25 C ATOM 429 N6 A A 17 -7.183 -1.804 -11.725 1.00 0.27 N ATOM 430 N1 A A 17 -7.260 -2.432 -13.927 1.00 0.24 N ATOM 431 C2 A A 17 -6.640 -2.874 -15.017 1.00 0.25 C ATOM 432 N3 A A 17 -5.358 -3.153 -15.187 1.00 0.28 N ATOM 433 C4 A A 17 -4.670 -2.929 -14.046 1.00 0.28 C ATOM 0 H5' A A 17 1.489 -3.820 -13.505 1.00 0.55 H new ATOM 0 H5'' A A 17 1.805 -2.327 -14.366 1.00 0.55 H new ATOM 0 H4' A A 17 0.467 -3.861 -15.648 1.00 0.45 H new ATOM 0 H3' A A 17 -0.790 -1.195 -14.933 1.00 0.44 H new ATOM 0 H2' A A 17 -2.846 -1.895 -16.130 1.00 0.39 H new ATOM 0 HO2' A A 17 -1.093 -3.118 -17.650 1.00 0.41 H new ATOM 0 H1' A A 17 -2.859 -4.522 -15.291 1.00 0.38 H new ATOM 0 H8 A A 17 -2.101 -2.798 -12.096 1.00 0.35 H new ATOM 0 H61 A A 17 -8.188 -1.634 -11.756 1.00 0.27 H new ATOM 0 H62 A A 17 -6.666 -1.652 -10.859 1.00 0.27 H new ATOM 0 H2 A A 17 -7.269 -3.026 -15.882 1.00 0.25 H new ATOM 445 P A A 18 0.765 -0.388 -16.957 1.00 0.54 P ATOM 446 OP1 A A 18 0.614 0.038 -18.367 1.00 0.80 O ATOM 447 OP2 A A 18 2.117 -0.513 -16.368 1.00 0.80 O ATOM 448 O5' A A 18 -0.100 0.602 -16.021 1.00 0.55 O ATOM 449 C5' A A 18 -0.938 1.636 -16.563 1.00 0.53 C ATOM 450 C4' A A 18 -1.894 1.130 -17.649 1.00 0.49 C ATOM 451 O4' A A 18 -2.473 -0.123 -17.253 1.00 0.46 O ATOM 452 C3' A A 18 -3.095 2.035 -17.875 1.00 0.46 C ATOM 453 O3' A A 18 -2.770 2.951 -18.930 1.00 0.53 O ATOM 454 C2' A A 18 -4.137 1.074 -18.406 1.00 0.42 C ATOM 455 O2' A A 18 -3.869 0.734 -19.770 1.00 0.50 O ATOM 456 C1' A A 18 -3.893 -0.117 -17.489 1.00 0.40 C ATOM 457 N9 A A 18 -4.573 0.013 -16.190 1.00 0.34 N ATOM 458 C8 A A 18 -4.020 -0.050 -14.941 1.00 0.34 C ATOM 459 N7 A A 18 -4.877 0.136 -13.978 1.00 0.31 N ATOM 460 C5 A A 18 -6.082 0.328 -14.644 1.00 0.27 C ATOM 461 C6 A A 18 -7.384 0.574 -14.189 1.00 0.28 C ATOM 462 N6 A A 18 -7.697 0.664 -12.904 1.00 0.32 N ATOM 463 N1 A A 18 -8.354 0.715 -15.104 1.00 0.29 N ATOM 464 C2 A A 18 -8.041 0.617 -16.392 1.00 0.30 C ATOM 465 N3 A A 18 -6.859 0.392 -16.947 1.00 0.31 N ATOM 466 C4 A A 18 -5.911 0.255 -15.994 1.00 0.29 C ATOM 0 H5' A A 18 -0.310 2.423 -16.979 1.00 0.53 H new ATOM 0 H5'' A A 18 -1.519 2.084 -15.757 1.00 0.53 H new ATOM 0 H4' A A 18 -1.281 1.073 -18.549 1.00 0.49 H new ATOM 0 H3' A A 18 -3.404 2.593 -16.991 1.00 0.46 H new ATOM 0 H2' A A 18 -5.159 1.454 -18.406 1.00 0.42 H new ATOM 0 HO2' A A 18 -3.245 1.386 -20.153 1.00 0.50 H new ATOM 0 H1' A A 18 -4.275 -1.025 -17.955 1.00 0.40 H new ATOM 0 H8 A A 18 -2.970 -0.237 -14.769 1.00 0.34 H new ATOM 0 H61 A A 18 -8.661 0.845 -12.625 1.00 0.32 H new ATOM 0 H62 A A 18 -6.973 0.553 -12.194 1.00 0.32 H new ATOM 0 H2 A A 18 -8.864 0.737 -17.081 1.00 0.30 H new ATOM 478 P U A 19 -2.259 4.439 -18.585 1.00 0.59 P ATOM 479 OP1 U A 19 -2.836 5.371 -19.581 1.00 0.67 O ATOM 480 OP2 U A 19 -0.792 4.390 -18.386 1.00 0.66 O ATOM 481 O5' U A 19 -2.953 4.724 -17.154 1.00 0.55 O ATOM 482 C5' U A 19 -4.069 5.616 -17.021 1.00 0.52 C ATOM 483 C4' U A 19 -5.290 5.147 -17.812 1.00 0.47 C ATOM 484 O4' U A 19 -5.658 3.820 -17.396 1.00 0.41 O ATOM 485 C3' U A 19 -6.547 5.971 -17.572 1.00 0.43 C ATOM 486 O3' U A 19 -6.591 7.001 -18.568 1.00 0.50 O ATOM 487 C2' U A 19 -7.646 4.976 -17.892 1.00 0.42 C ATOM 488 O2' U A 19 -7.770 4.791 -19.305 1.00 0.50 O ATOM 489 C1' U A 19 -7.087 3.725 -17.226 1.00 0.39 C ATOM 490 N1 U A 19 -7.390 3.669 -15.781 1.00 0.37 N ATOM 491 C2 U A 19 -8.717 3.659 -15.395 1.00 0.39 C ATOM 492 O2 U A 19 -9.644 3.630 -16.199 1.00 0.44 O ATOM 493 N3 U A 19 -8.949 3.647 -14.039 1.00 0.40 N ATOM 494 C4 U A 19 -7.991 3.636 -13.049 1.00 0.40 C ATOM 495 O4 U A 19 -8.326 3.619 -11.866 1.00 0.44 O ATOM 496 C5 U A 19 -6.631 3.641 -13.530 1.00 0.38 C ATOM 497 C6 U A 19 -6.383 3.656 -14.862 1.00 0.37 C ATOM 0 H5' U A 19 -3.779 6.610 -17.362 1.00 0.52 H new ATOM 0 H5'' U A 19 -4.335 5.706 -15.968 1.00 0.52 H new ATOM 0 H4' U A 19 -4.984 5.227 -18.855 1.00 0.47 H new ATOM 0 H3' U A 19 -6.613 6.418 -16.580 1.00 0.43 H new ATOM 0 H2' U A 19 -8.641 5.268 -17.556 1.00 0.42 H new ATOM 0 HO2' U A 19 -7.434 5.586 -19.770 1.00 0.50 H new ATOM 0 H1' U A 19 -7.527 2.832 -17.671 1.00 0.39 H new ATOM 0 H3 U A 19 -9.924 3.646 -13.738 1.00 0.40 H new ATOM 0 H5 U A 19 -5.810 3.633 -12.828 1.00 0.38 H new ATOM 0 H6 U A 19 -5.359 3.658 -15.205 1.00 0.37 H new ATOM 508 P G A 20 -6.762 8.547 -18.142 1.00 0.51 P ATOM 509 OP1 G A 20 -6.701 9.374 -19.368 1.00 0.63 O ATOM 510 OP2 G A 20 -5.838 8.823 -17.019 1.00 0.57 O ATOM 511 O5' G A 20 -8.272 8.594 -17.574 1.00 0.47 O ATOM 512 C5' G A 20 -9.392 8.657 -18.468 1.00 0.50 C ATOM 513 C4' G A 20 -10.711 8.379 -17.749 1.00 0.46 C ATOM 514 O4' G A 20 -10.654 7.088 -17.127 1.00 0.45 O ATOM 515 C3' G A 20 -11.031 9.311 -16.592 1.00 0.40 C ATOM 516 O3' G A 20 -11.735 10.444 -17.119 1.00 0.44 O ATOM 517 C2' G A 20 -12.028 8.482 -15.804 1.00 0.42 C ATOM 518 O2' G A 20 -13.301 8.461 -16.459 1.00 0.50 O ATOM 519 C1' G A 20 -11.361 7.110 -15.870 1.00 0.44 C ATOM 520 N9 G A 20 -10.399 6.904 -14.773 1.00 0.41 N ATOM 521 C8 G A 20 -9.061 6.622 -14.850 1.00 0.41 C ATOM 522 N7 G A 20 -8.487 6.481 -13.688 1.00 0.42 N ATOM 523 C5 G A 20 -9.520 6.686 -12.779 1.00 0.44 C ATOM 524 C6 G A 20 -9.504 6.659 -11.360 1.00 0.48 C ATOM 525 O6 G A 20 -8.560 6.425 -10.613 1.00 0.52 O ATOM 526 N1 G A 20 -10.753 6.920 -10.829 1.00 0.50 N ATOM 527 C2 G A 20 -11.882 7.172 -11.564 1.00 0.49 C ATOM 528 N2 G A 20 -13.000 7.400 -10.890 1.00 0.54 N ATOM 529 N3 G A 20 -11.915 7.199 -12.894 1.00 0.46 N ATOM 530 C4 G A 20 -10.696 6.948 -13.433 1.00 0.43 C ATOM 0 H5' G A 20 -9.257 7.933 -19.271 1.00 0.50 H new ATOM 0 H5'' G A 20 -9.432 9.643 -18.931 1.00 0.50 H new ATOM 0 H4' G A 20 -11.460 8.493 -18.533 1.00 0.46 H new ATOM 0 H3' G A 20 -10.163 9.653 -16.028 1.00 0.40 H new ATOM 0 H2' G A 20 -12.230 8.844 -14.796 1.00 0.42 H new ATOM 0 HO2' G A 20 -13.350 9.199 -17.102 1.00 0.50 H new ATOM 0 H1' G A 20 -12.109 6.322 -15.781 1.00 0.44 H new ATOM 0 H8 G A 20 -8.531 6.525 -15.786 1.00 0.41 H new ATOM 0 H1 G A 20 -10.841 6.925 -9.813 1.00 0.50 H new ATOM 0 H21 G A 20 -13.867 7.593 -11.391 1.00 0.54 H new ATOM 0 H22 G A 20 -12.993 7.383 -9.870 1.00 0.54 H new ATOM 542 P A A 21 -11.668 11.869 -16.369 1.00 0.45 P ATOM 543 OP1 A A 21 -12.759 12.720 -16.896 1.00 0.58 O ATOM 544 OP2 A A 21 -10.270 12.352 -16.415 1.00 0.57 O ATOM 545 O5' A A 21 -12.017 11.482 -14.840 1.00 0.40 O ATOM 546 C5' A A 21 -13.374 11.459 -14.375 1.00 0.40 C ATOM 547 C4' A A 21 -13.448 11.446 -12.850 1.00 0.32 C ATOM 548 O4' A A 21 -12.860 10.240 -12.350 1.00 0.34 O ATOM 549 C3' A A 21 -12.657 12.548 -12.167 1.00 0.31 C ATOM 550 O3' A A 21 -13.538 13.673 -12.024 1.00 0.40 O ATOM 551 C2' A A 21 -12.417 11.964 -10.781 1.00 0.32 C ATOM 552 O2' A A 21 -13.575 12.127 -9.956 1.00 0.41 O ATOM 553 C1' A A 21 -12.180 10.487 -11.105 1.00 0.29 C ATOM 554 N9 A A 21 -10.749 10.166 -11.280 1.00 0.28 N ATOM 555 C8 A A 21 -10.015 10.134 -12.439 1.00 0.32 C ATOM 556 N7 A A 21 -8.768 9.797 -12.259 1.00 0.35 N ATOM 557 C5 A A 21 -8.673 9.594 -10.885 1.00 0.32 C ATOM 558 C6 A A 21 -7.609 9.216 -10.050 1.00 0.37 C ATOM 559 N6 A A 21 -6.381 8.962 -10.494 1.00 0.44 N ATOM 560 N1 A A 21 -7.852 9.106 -8.734 1.00 0.36 N ATOM 561 C2 A A 21 -9.077 9.354 -8.283 1.00 0.33 C ATOM 562 N3 A A 21 -10.158 9.713 -8.961 1.00 0.30 N ATOM 563 C4 A A 21 -9.876 9.816 -10.278 1.00 0.28 C ATOM 0 H5' A A 21 -13.880 10.579 -14.771 1.00 0.40 H new ATOM 0 H5'' A A 21 -13.905 12.331 -14.758 1.00 0.40 H new ATOM 0 H4' A A 21 -14.510 11.563 -12.633 1.00 0.32 H new ATOM 0 H3' A A 21 -11.749 12.851 -12.688 1.00 0.31 H new ATOM 0 H2' A A 21 -11.601 12.434 -10.233 1.00 0.32 H new ATOM 0 HO2' A A 21 -13.702 13.078 -9.754 1.00 0.41 H new ATOM 0 H1' A A 21 -12.545 9.872 -10.282 1.00 0.29 H new ATOM 0 H8 A A 21 -10.431 10.366 -13.408 1.00 0.32 H new ATOM 0 H61 A A 21 -5.648 8.691 -9.839 1.00 0.44 H new ATOM 0 H62 A A 21 -6.173 9.038 -11.490 1.00 0.44 H new ATOM 0 H2 A A 21 -9.210 9.248 -7.216 1.00 0.33 H new ATOM 575 P G A 22 -12.995 15.094 -11.490 1.00 0.53 P ATOM 576 OP1 G A 22 -14.023 16.118 -11.778 1.00 0.72 O ATOM 577 OP2 G A 22 -11.612 15.279 -11.984 1.00 0.59 O ATOM 578 O5' G A 22 -12.939 14.872 -9.893 1.00 0.52 O ATOM 579 C5' G A 22 -11.861 15.410 -9.118 1.00 0.58 C ATOM 580 C4' G A 22 -11.736 14.714 -7.767 1.00 0.56 C ATOM 581 O4' G A 22 -11.459 13.320 -7.977 1.00 0.51 O ATOM 582 C3' G A 22 -10.580 15.198 -6.904 1.00 0.63 C ATOM 583 O3' G A 22 -11.088 16.231 -6.048 1.00 0.76 O ATOM 584 C2' G A 22 -10.296 13.983 -6.039 1.00 0.59 C ATOM 585 O2' G A 22 -11.281 13.854 -5.009 1.00 0.67 O ATOM 586 C1' G A 22 -10.437 12.866 -7.070 1.00 0.49 C ATOM 587 N9 G A 22 -9.195 12.636 -7.834 1.00 0.46 N ATOM 588 C8 G A 22 -8.965 12.830 -9.172 1.00 0.48 C ATOM 589 N7 G A 22 -7.758 12.515 -9.548 1.00 0.51 N ATOM 590 C5 G A 22 -7.145 12.084 -8.379 1.00 0.48 C ATOM 591 C6 G A 22 -5.822 11.615 -8.162 1.00 0.52 C ATOM 592 O6 G A 22 -4.917 11.478 -8.977 1.00 0.60 O ATOM 593 N1 G A 22 -5.609 11.285 -6.839 1.00 0.50 N ATOM 594 C2 G A 22 -6.543 11.387 -5.840 1.00 0.47 C ATOM 595 N2 G A 22 -6.163 11.022 -4.623 1.00 0.51 N ATOM 596 N3 G A 22 -7.787 11.824 -6.025 1.00 0.46 N ATOM 597 C4 G A 22 -8.017 12.155 -7.319 1.00 0.45 C ATOM 0 H5' G A 22 -12.020 16.477 -8.964 1.00 0.58 H new ATOM 0 H5'' G A 22 -10.927 15.304 -9.670 1.00 0.58 H new ATOM 0 H4' G A 22 -12.679 14.926 -7.263 1.00 0.56 H new ATOM 0 H3' G A 22 -9.719 15.568 -7.461 1.00 0.63 H new ATOM 0 H2' G A 22 -9.338 14.004 -5.519 1.00 0.59 H new ATOM 0 HO2' G A 22 -11.714 14.721 -4.860 1.00 0.67 H new ATOM 0 H1' G A 22 -10.673 11.926 -6.572 1.00 0.49 H new ATOM 0 H8 G A 22 -9.715 13.209 -9.851 1.00 0.48 H new ATOM 0 H1 G A 22 -4.684 10.938 -6.584 1.00 0.50 H new ATOM 0 H21 G A 22 -6.820 11.079 -3.845 1.00 0.51 H new ATOM 0 H22 G A 22 -5.214 10.684 -4.465 1.00 0.51 H new ATOM 609 P U A 23 -10.284 17.615 -5.854 1.00 0.89 P ATOM 610 OP1 U A 23 -11.164 18.569 -5.142 1.00 1.05 O ATOM 611 OP2 U A 23 -9.686 17.991 -7.154 1.00 0.92 O ATOM 612 O5' U A 23 -9.089 17.190 -4.858 1.00 0.88 O ATOM 613 C5' U A 23 -9.345 16.940 -3.470 1.00 0.95 C ATOM 614 C4' U A 23 -8.188 16.198 -2.810 1.00 0.88 C ATOM 615 O4' U A 23 -7.989 14.940 -3.467 1.00 0.77 O ATOM 616 C3' U A 23 -6.834 16.884 -2.928 1.00 0.88 C ATOM 617 O3' U A 23 -6.680 17.895 -1.926 1.00 1.00 O ATOM 618 C2' U A 23 -5.910 15.706 -2.665 1.00 0.81 C ATOM 619 O2' U A 23 -5.919 15.355 -1.277 1.00 0.86 O ATOM 620 C1' U A 23 -6.587 14.620 -3.504 1.00 0.72 C ATOM 621 N1 U A 23 -6.133 14.617 -4.911 1.00 0.67 N ATOM 622 C2 U A 23 -4.896 14.064 -5.181 1.00 0.67 C ATOM 623 O2 U A 23 -4.177 13.587 -4.310 1.00 0.71 O ATOM 624 N3 U A 23 -4.508 14.071 -6.500 1.00 0.68 N ATOM 625 C4 U A 23 -5.229 14.571 -7.559 1.00 0.70 C ATOM 626 O4 U A 23 -4.767 14.506 -8.694 1.00 0.76 O ATOM 627 C5 U A 23 -6.510 15.134 -7.203 1.00 0.69 C ATOM 628 C6 U A 23 -6.913 15.139 -5.909 1.00 0.68 C ATOM 0 H5' U A 23 -10.259 16.355 -3.368 1.00 0.95 H new ATOM 0 H5'' U A 23 -9.513 17.886 -2.954 1.00 0.95 H new ATOM 0 H4' U A 23 -8.480 16.134 -1.762 1.00 0.88 H new ATOM 0 H3' U A 23 -6.661 17.400 -3.872 1.00 0.88 H new ATOM 0 H2' U A 23 -4.863 15.884 -2.911 1.00 0.81 H new ATOM 0 HO2' U A 23 -6.119 16.150 -0.740 1.00 0.86 H new ATOM 0 HO3' U A 23 -5.802 18.320 -2.022 1.00 1.00 H new ATOM 0 H1' U A 23 -6.348 13.635 -3.104 1.00 0.72 H new ATOM 0 H3 U A 23 -3.597 13.666 -6.714 1.00 0.68 H new ATOM 0 H5 U A 23 -7.147 15.551 -7.968 1.00 0.69 H new ATOM 0 H6 U A 23 -7.873 15.565 -5.658 1.00 0.68 H new TER 640 U A 23 HETATM 641 C1 TOA A 100 -8.654 0.234 -7.527 1.00 0.32 C HETATM 642 C2 TOA A 100 -8.135 1.623 -7.889 1.00 0.36 C HETATM 643 C3 TOA A 100 -7.496 1.560 -9.278 1.00 0.37 C HETATM 644 C4 TOA A 100 -6.393 0.501 -9.307 1.00 0.38 C HETATM 645 C5 TOA A 100 -6.958 -0.839 -8.827 1.00 0.35 C HETATM 646 C6 TOA A 100 -5.912 -1.931 -8.707 1.00 0.41 C HETATM 647 O2 TOA A 100 -9.210 2.559 -7.892 1.00 0.38 O HETATM 648 N3 TOA A 100 -6.932 2.798 -9.901 1.00 0.45 N HETATM 649 O4 TOA A 100 -5.904 0.375 -10.637 1.00 0.40 O HETATM 650 O5 TOA A 100 -7.566 -0.675 -7.530 1.00 0.35 O HETATM 651 O6 TOA A 100 -6.448 -3.101 -8.103 1.00 0.45 O HETATM 0 HN33 TOA A 100 -6.036 2.582 -10.337 1.00 0.45 H new HETATM 0 HN32 TOA A 100 -7.578 3.148 -10.608 1.00 0.45 H new HETATM 0 HN31 TOA A 100 -6.797 3.510 -9.183 1.00 0.45 H new HETATM 0 HO6 TOA A 100 -6.236 -3.881 -8.657 1.00 0.45 H new HETATM 0 HO4 TOA A 100 -5.095 -0.179 -10.637 1.00 0.40 H new HETATM 0 HO2 TOA A 100 -8.871 3.447 -7.652 1.00 0.38 H new HETATM 0 H62 TOA A 100 -5.525 -2.176 -9.696 1.00 0.41 H new HETATM 0 H61 TOA A 100 -5.071 -1.568 -8.116 1.00 0.41 H new HETATM 0 H5 TOA A 100 -7.682 -1.144 -9.583 1.00 0.35 H new HETATM 0 H4 TOA A 100 -5.577 0.797 -8.648 1.00 0.38 H new HETATM 0 H3 TOA A 100 -8.372 1.333 -9.886 1.00 0.37 H new HETATM 0 H2 TOA A 100 -7.396 1.945 -7.155 1.00 0.36 H new HETATM 665 C1 TOC A 102 -10.988 -5.181 -6.813 1.00 0.25 C HETATM 666 C2 TOC A 102 -9.691 -5.986 -6.958 1.00 0.26 C HETATM 667 C3 TOC A 102 -9.955 -7.316 -7.663 1.00 0.27 C HETATM 668 C4 TOC A 102 -11.066 -8.055 -6.940 1.00 0.31 C HETATM 669 C5 TOC A 102 -12.313 -7.186 -6.906 1.00 0.30 C HETATM 670 C6 TOC A 102 -13.450 -7.872 -6.173 1.00 0.38 C HETATM 671 N2 TOC A 102 -8.691 -5.193 -7.741 1.00 0.27 N HETATM 672 N6 TOC A 102 -13.708 -9.191 -6.851 1.00 0.43 N HETATM 673 O4 TOC A 102 -11.349 -9.280 -7.604 1.00 0.36 O HETATM 674 O5 TOC A 102 -12.023 -5.958 -6.216 1.00 0.29 O HETATM 0 HN63 TOC A 102 -13.996 -9.880 -6.156 1.00 0.43 H new HETATM 0 HN62 TOC A 102 -14.448 -9.079 -7.544 1.00 0.43 H new HETATM 0 HN61 TOC A 102 -12.856 -9.509 -7.312 1.00 0.43 H new HETATM 0 HN23 TOC A 102 -7.748 -5.453 -7.451 1.00 0.27 H new HETATM 0 HN22 TOC A 102 -8.806 -5.387 -8.736 1.00 0.27 H new HETATM 0 HN21 TOC A 102 -8.837 -4.198 -7.570 1.00 0.27 H new HETATM 0 HO4 TOC A 102 -10.509 -9.711 -7.867 1.00 0.36 H new HETATM 0 H62 TOC A 102 -13.191 -8.026 -5.125 1.00 0.38 H new HETATM 0 H61 TOC A 102 -14.346 -7.251 -6.192 1.00 0.38 H new HETATM 0 H5 TOC A 102 -12.612 -7.000 -7.938 1.00 0.30 H new HETATM 0 H4 TOC A 102 -10.748 -8.273 -5.920 1.00 0.31 H new HETATM 0 H32 TOC A 102 -10.235 -7.141 -8.702 1.00 0.27 H new HETATM 0 H31 TOC A 102 -9.048 -7.921 -7.675 1.00 0.27 H new HETATM 0 H2 TOC A 102 -9.298 -6.192 -5.962 1.00 0.26 H new HETATM 690 C1 2TB A 101 -11.957 -0.483 -8.882 1.00 0.26 C HETATM 691 C2 2TB A 101 -13.142 -1.458 -8.840 1.00 0.26 C HETATM 692 C3 2TB A 101 -12.699 -2.893 -9.092 1.00 0.23 C HETATM 693 C4 2TB A 101 -11.707 -3.256 -7.998 1.00 0.24 C HETATM 694 C5 2TB A 101 -10.443 -2.408 -8.154 1.00 0.24 C HETATM 695 C6 2TB A 101 -10.756 -0.903 -8.019 1.00 0.26 C HETATM 696 N1 2TB A 101 -12.372 0.919 -8.520 1.00 0.33 N HETATM 697 N3 2TB A 101 -13.879 -3.826 -9.145 1.00 0.29 N HETATM 698 O5 2TB A 101 -9.497 -2.802 -7.167 1.00 0.30 O HETATM 699 O4 2TB A 101 -11.370 -4.654 -8.054 1.00 0.24 O HETATM 700 O6 2TB A 101 -9.621 -0.135 -8.468 1.00 0.27 O HETATM 0 HN33 2TB A 101 -13.550 -4.791 -9.147 1.00 0.29 H new HETATM 0 HN32 2TB A 101 -14.472 -3.672 -8.330 1.00 0.29 H new HETATM 0 HN31 2TB A 101 -14.416 -3.648 -9.994 1.00 0.29 H new HETATM 0 HN13 2TB A 101 -11.571 1.544 -8.607 1.00 0.33 H new HETATM 0 HN12 2TB A 101 -13.114 1.227 -9.148 1.00 0.33 H new HETATM 0 HN11 2TB A 101 -12.713 0.936 -7.559 1.00 0.33 H new HETATM 0 HO5 2TB A 101 -8.688 -2.256 -7.253 1.00 0.30 H new HETATM 0 H6 2TB A 101 -10.984 -0.718 -6.969 1.00 0.26 H new HETATM 0 H5 2TB A 101 -10.032 -2.571 -9.150 1.00 0.24 H new HETATM 0 H4 2TB A 101 -12.166 -3.055 -7.030 1.00 0.24 H new HETATM 0 H3 2TB A 101 -12.216 -2.989 -10.064 1.00 0.23 H new HETATM 0 H22 2TB A 101 -13.632 -1.394 -7.869 1.00 0.26 H new HETATM 0 H21 2TB A 101 -13.879 -1.168 -9.589 1.00 0.26 H new HETATM 0 H1 2TB A 101 -11.624 -0.511 -9.919 1.00 0.26 H new