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 117:sc= 1.13 USER MOD Set 1.2: A 101 2TB O5 : rot -173:sc= 0.846 USER MOD Set 1.3: A 102 TOC N2 :NH3+ 141:sc= 3.18 (180deg=0.2) USER MOD Set 2.1: A 100 TOA O2 : rot 156:sc= 0.867 USER MOD Set 2.2: A 101 2TB N1 :NH3+ -126:sc= -0.349! (180deg=-2.12!) USER MOD Single : A 4 A O2' : rot -137:sc= 0.19 USER MOD Single : A 4 A O5' : rot 180:sc= -0.646 USER MOD Single : A 5 C O2' : rot -119:sc= 0.228 USER MOD Single : A 6 U O2' : rot -20:sc= 0.208 USER MOD Single : A 7 U O2' : rot -30:sc= 0.2 USER MOD Single : A 8 G O2' : rot -13:sc= 0.437 USER MOD Single : A 9 G O2' : rot -32:sc= 0.145 USER MOD Single : A 10 U O2' : rot -17:sc= 0.352 USER MOD Single : A 11 U O2' : rot -14:sc= 0.458 USER MOD Single : A 12 U O2' : rot -80:sc= 1.47 USER MOD Single : A 13 A O2' : rot -84:sc= 1.27 USER MOD Single : A 14 G O2' : rot -116:sc= 1.24 USER MOD Single : A 15 G O2' : rot -41:sc= 0.517 USER MOD Single : A 16 U O2' : rot -23:sc= 0.349 USER MOD Single : A 17 A O2' : rot -34:sc= 0.352 USER MOD Single : A 18 A O2' : rot -26:sc= 0.266 USER MOD Single : A 19 U O2' : rot -16:sc= 0.401 USER MOD Single : A 20 G O2' : rot -19:sc= 0.234 USER MOD Single : A 21 A O2' : rot -71:sc= 0.57 USER MOD Single : A 22 G O2' : rot -21:sc= 0.287 USER MOD Single : A 23 U O2' : rot -26:sc= 0.0987 USER MOD Single : A 23 U O3' : rot 180:sc= 0.12 USER MOD Single : A 100 TOA N3 :NH3+ -123:sc= 2.5 (180deg=-1.11!) USER MOD Single : A 100 TOA O4 : rot 160:sc= 0.323 USER MOD Single : A 101 2TB N3 :NH3+ -173:sc= 1.26 (180deg=1.19) USER MOD Single : A 102 TOC N6 :NH3+ 164:sc= 0.926 (180deg=0.39) USER MOD Single : A 102 TOC O4 : rot 36:sc= 1.68! USER MOD ----------------------------------------------------------------- ATOM 1 O5' A A 4 3.948 10.948 -10.186 1.00 1.12 O ATOM 2 C5' A A 4 4.846 10.581 -9.132 1.00 1.18 C ATOM 3 C4' A A 4 4.138 10.526 -7.782 1.00 1.03 C ATOM 4 O4' A A 4 3.565 11.811 -7.494 1.00 0.95 O ATOM 5 C3' A A 4 2.955 9.574 -7.720 1.00 0.89 C ATOM 6 O3' A A 4 3.449 8.304 -7.272 1.00 0.98 O ATOM 7 C2' A A 4 2.120 10.169 -6.599 1.00 0.78 C ATOM 8 O2' A A 4 2.652 9.830 -5.315 1.00 0.92 O ATOM 9 C1' A A 4 2.272 11.662 -6.880 1.00 0.79 C ATOM 10 N9 A A 4 1.239 12.161 -7.808 1.00 0.66 N ATOM 11 C8 A A 4 1.290 12.269 -9.175 1.00 0.69 C ATOM 12 N7 A A 4 0.193 12.739 -9.704 1.00 0.61 N ATOM 13 C5 A A 4 -0.637 12.957 -8.607 1.00 0.49 C ATOM 14 C6 A A 4 -1.946 13.450 -8.484 1.00 0.42 C ATOM 15 N6 A A 4 -2.693 13.832 -9.517 1.00 0.47 N ATOM 16 N1 A A 4 -2.467 13.537 -7.251 1.00 0.41 N ATOM 17 C2 A A 4 -1.733 13.159 -6.211 1.00 0.48 C ATOM 18 N3 A A 4 -0.499 12.682 -6.194 1.00 0.55 N ATOM 19 C4 A A 4 -0.007 12.608 -7.448 1.00 0.53 C ATOM 0 H5' A A 4 5.665 11.299 -9.085 1.00 1.18 H new ATOM 0 H5'' A A 4 5.287 9.609 -9.352 1.00 1.18 H new ATOM 0 H4' A A 4 4.909 10.197 -7.086 1.00 1.03 H new ATOM 0 H3' A A 4 2.420 9.450 -8.662 1.00 0.89 H new ATOM 0 H2' A A 4 1.089 9.816 -6.574 1.00 0.78 H new ATOM 0 HO2' A A 4 1.920 9.582 -4.713 1.00 0.92 H new ATOM 0 HO5' A A 4 4.435 10.975 -11.036 1.00 1.12 H new ATOM 0 H1' A A 4 2.167 12.230 -5.956 1.00 0.79 H new ATOM 0 H8 A A 4 2.156 11.991 -9.758 1.00 0.69 H new ATOM 0 H61 A A 4 -3.638 14.182 -9.361 1.00 0.47 H new ATOM 0 H62 A A 4 -2.320 13.775 -10.465 1.00 0.47 H new ATOM 0 H2 A A 4 -2.209 13.254 -5.246 1.00 0.48 H new ATOM 32 P C A 5 2.546 6.975 -7.403 1.00 0.98 P ATOM 33 OP1 C A 5 3.366 5.814 -6.989 1.00 1.15 O ATOM 34 OP2 C A 5 1.901 6.983 -8.735 1.00 0.96 O ATOM 35 O5' C A 5 1.400 7.209 -6.292 1.00 0.86 O ATOM 36 C5' C A 5 1.674 7.014 -4.898 1.00 0.93 C ATOM 37 C4' C A 5 0.501 7.451 -4.026 1.00 0.82 C ATOM 38 O4' C A 5 0.206 8.833 -4.284 1.00 0.75 O ATOM 39 C3' C A 5 -0.814 6.743 -4.317 1.00 0.70 C ATOM 40 O3' C A 5 -0.874 5.573 -3.490 1.00 0.76 O ATOM 41 C2' C A 5 -1.826 7.743 -3.785 1.00 0.65 C ATOM 42 O2' C A 5 -1.886 7.713 -2.356 1.00 0.78 O ATOM 43 C1' C A 5 -1.220 9.050 -4.283 1.00 0.65 C ATOM 44 N1 C A 5 -1.665 9.380 -5.657 1.00 0.55 N ATOM 45 C2 C A 5 -2.775 10.201 -5.799 1.00 0.50 C ATOM 46 O2 C A 5 -3.372 10.624 -4.812 1.00 0.54 O ATOM 47 N3 C A 5 -3.201 10.515 -7.051 1.00 0.45 N ATOM 48 C4 C A 5 -2.564 10.040 -8.126 1.00 0.45 C ATOM 49 N4 C A 5 -3.029 10.388 -9.321 1.00 0.44 N ATOM 50 C5 C A 5 -1.422 9.193 -7.992 1.00 0.52 C ATOM 51 C6 C A 5 -1.008 8.890 -6.748 1.00 0.57 C ATOM 0 H5' C A 5 2.564 7.578 -4.620 1.00 0.93 H new ATOM 0 H5'' C A 5 1.892 5.962 -4.714 1.00 0.93 H new ATOM 0 H4' C A 5 0.825 7.224 -3.010 1.00 0.82 H new ATOM 0 H3' C A 5 -0.959 6.456 -5.359 1.00 0.70 H new ATOM 0 H2' C A 5 -2.852 7.564 -4.108 1.00 0.65 H new ATOM 0 HO2' C A 5 -2.792 7.470 -2.072 1.00 0.78 H new ATOM 0 H1' C A 5 -1.527 9.880 -3.647 1.00 0.65 H new ATOM 0 H41 C A 5 -2.571 10.046 -10.166 1.00 0.44 H new ATOM 0 H42 C A 5 -3.844 10.997 -9.393 1.00 0.44 H new ATOM 0 H5 C A 5 -0.908 8.808 -8.860 1.00 0.52 H new ATOM 0 H6 C A 5 -0.147 8.252 -6.612 1.00 0.57 H new ATOM 63 P U A 6 -1.809 4.322 -3.901 1.00 0.71 P ATOM 64 OP1 U A 6 -1.424 3.160 -3.070 1.00 0.87 O ATOM 65 OP2 U A 6 -1.809 4.207 -5.376 1.00 0.74 O ATOM 66 O5' U A 6 -3.278 4.806 -3.441 1.00 0.60 O ATOM 67 C5' U A 6 -3.671 4.754 -2.064 1.00 0.61 C ATOM 68 C4' U A 6 -4.978 5.504 -1.814 1.00 0.50 C ATOM 69 O4' U A 6 -4.839 6.869 -2.251 1.00 0.52 O ATOM 70 C3' U A 6 -6.178 5.005 -2.606 1.00 0.38 C ATOM 71 O3' U A 6 -6.812 3.965 -1.849 1.00 0.36 O ATOM 72 C2' U A 6 -7.078 6.225 -2.566 1.00 0.38 C ATOM 73 O2' U A 6 -7.617 6.419 -1.254 1.00 0.42 O ATOM 74 C1' U A 6 -6.055 7.306 -2.897 1.00 0.45 C ATOM 75 N1 U A 6 -5.815 7.423 -4.354 1.00 0.43 N ATOM 76 C2 U A 6 -6.675 8.222 -5.084 1.00 0.40 C ATOM 77 O2 U A 6 -7.618 8.817 -4.576 1.00 0.41 O ATOM 78 N3 U A 6 -6.415 8.314 -6.433 1.00 0.39 N ATOM 79 C4 U A 6 -5.388 7.694 -7.107 1.00 0.42 C ATOM 80 O4 U A 6 -5.260 7.867 -8.313 1.00 0.44 O ATOM 81 C5 U A 6 -4.533 6.875 -6.284 1.00 0.46 C ATOM 82 C6 U A 6 -4.772 6.767 -4.955 1.00 0.46 C ATOM 0 H5' U A 6 -2.883 5.183 -1.445 1.00 0.61 H new ATOM 0 H5'' U A 6 -3.786 3.714 -1.759 1.00 0.61 H new ATOM 0 H4' U A 6 -5.155 5.365 -0.748 1.00 0.50 H new ATOM 0 H3' U A 6 -5.949 4.627 -3.603 1.00 0.38 H new ATOM 0 H2' U A 6 -7.946 6.186 -3.224 1.00 0.38 H new ATOM 0 HO2' U A 6 -7.557 5.582 -0.749 1.00 0.42 H new ATOM 0 H1' U A 6 -6.404 8.283 -2.562 1.00 0.45 H new ATOM 0 H3 U A 6 -7.044 8.897 -6.985 1.00 0.39 H new ATOM 0 H5 U A 6 -3.702 6.347 -6.727 1.00 0.46 H new ATOM 0 H6 U A 6 -4.124 6.148 -4.353 1.00 0.46 H new ATOM 93 P U A 7 -7.470 2.696 -2.593 1.00 0.38 P ATOM 94 OP1 U A 7 -8.014 1.779 -1.569 1.00 0.50 O ATOM 95 OP2 U A 7 -6.503 2.192 -3.597 1.00 0.47 O ATOM 96 O5' U A 7 -8.704 3.350 -3.398 1.00 0.43 O ATOM 97 C5' U A 7 -9.905 3.743 -2.722 1.00 0.40 C ATOM 98 C4' U A 7 -10.815 4.567 -3.629 1.00 0.34 C ATOM 99 O4' U A 7 -10.131 5.768 -4.034 1.00 0.40 O ATOM 100 C3' U A 7 -11.177 3.905 -4.949 1.00 0.31 C ATOM 101 O3' U A 7 -12.374 3.147 -4.755 1.00 0.34 O ATOM 102 C2' U A 7 -11.517 5.108 -5.804 1.00 0.36 C ATOM 103 O2' U A 7 -12.757 5.693 -5.401 1.00 0.43 O ATOM 104 C1' U A 7 -10.342 6.005 -5.441 1.00 0.38 C ATOM 105 N1 U A 7 -9.114 5.646 -6.176 1.00 0.35 N ATOM 106 C2 U A 7 -9.030 6.013 -7.505 1.00 0.39 C ATOM 107 O2 U A 7 -9.931 6.605 -8.090 1.00 0.46 O ATOM 108 N3 U A 7 -7.873 5.654 -8.155 1.00 0.37 N ATOM 109 C4 U A 7 -6.810 4.972 -7.605 1.00 0.34 C ATOM 110 O4 U A 7 -5.838 4.689 -8.298 1.00 0.36 O ATOM 111 C5 U A 7 -6.973 4.628 -6.215 1.00 0.34 C ATOM 112 C6 U A 7 -8.102 4.969 -5.560 1.00 0.34 C ATOM 0 H5' U A 7 -9.651 4.324 -1.835 1.00 0.40 H new ATOM 0 H5'' U A 7 -10.438 2.856 -2.380 1.00 0.40 H new ATOM 0 H4' U A 7 -11.713 4.719 -3.030 1.00 0.34 H new ATOM 0 H3' U A 7 -10.408 3.251 -5.360 1.00 0.31 H new ATOM 0 H2' U A 7 -11.643 4.908 -6.868 1.00 0.36 H new ATOM 0 HO2' U A 7 -13.340 4.999 -5.028 1.00 0.43 H new ATOM 0 H1' U A 7 -10.557 7.044 -5.690 1.00 0.38 H new ATOM 0 H3 U A 7 -7.794 5.918 -9.137 1.00 0.37 H new ATOM 0 H5 U A 7 -6.189 4.096 -5.696 1.00 0.34 H new ATOM 0 H6 U A 7 -8.208 4.699 -4.520 1.00 0.34 H new ATOM 123 P G A 8 -12.346 1.547 -4.913 1.00 0.36 P ATOM 124 OP1 G A 8 -11.794 0.962 -3.675 1.00 0.55 O ATOM 125 OP2 G A 8 -11.717 1.228 -6.223 1.00 0.42 O ATOM 126 O5' G A 8 -13.907 1.165 -5.011 1.00 0.40 O ATOM 127 C5' G A 8 -14.555 1.007 -6.280 1.00 0.37 C ATOM 128 C4' G A 8 -14.885 2.352 -6.924 1.00 0.38 C ATOM 129 O4' G A 8 -13.687 3.003 -7.335 1.00 0.37 O ATOM 130 C3' G A 8 -15.654 2.273 -8.222 1.00 0.37 C ATOM 131 O3' G A 8 -17.045 2.157 -7.895 1.00 0.42 O ATOM 132 C2' G A 8 -15.430 3.662 -8.818 1.00 0.40 C ATOM 133 O2' G A 8 -16.404 4.581 -8.317 1.00 0.50 O ATOM 134 C1' G A 8 -14.024 4.028 -8.292 1.00 0.39 C ATOM 135 N9 G A 8 -12.996 4.042 -9.353 1.00 0.36 N ATOM 136 C8 G A 8 -11.641 3.860 -9.236 1.00 0.36 C ATOM 137 N7 G A 8 -11.005 3.898 -10.371 1.00 0.35 N ATOM 138 C5 G A 8 -12.008 4.126 -11.310 1.00 0.34 C ATOM 139 C6 G A 8 -11.926 4.263 -12.722 1.00 0.35 C ATOM 140 O6 G A 8 -10.937 4.166 -13.435 1.00 0.35 O ATOM 141 N1 G A 8 -13.164 4.486 -13.287 1.00 0.39 N ATOM 142 C2 G A 8 -14.343 4.565 -12.593 1.00 0.42 C ATOM 143 N2 G A 8 -15.444 4.778 -13.296 1.00 0.49 N ATOM 144 N3 G A 8 -14.438 4.434 -11.271 1.00 0.40 N ATOM 145 C4 G A 8 -13.231 4.218 -10.697 1.00 0.36 C ATOM 0 H5' G A 8 -15.472 0.432 -6.150 1.00 0.37 H new ATOM 0 H5'' G A 8 -13.911 0.434 -6.947 1.00 0.37 H new ATOM 0 H4' G A 8 -15.467 2.857 -6.153 1.00 0.38 H new ATOM 0 H3' G A 8 -15.360 1.450 -8.874 1.00 0.37 H new ATOM 0 H2' G A 8 -15.513 3.692 -9.904 1.00 0.40 H new ATOM 0 HO2' G A 8 -17.125 4.085 -7.875 1.00 0.50 H new ATOM 0 H1' G A 8 -14.045 5.032 -7.869 1.00 0.39 H new ATOM 0 H8 G A 8 -11.147 3.700 -8.289 1.00 0.36 H new ATOM 0 H1 G A 8 -13.205 4.601 -14.300 1.00 0.39 H new ATOM 0 H21 G A 8 -16.346 4.844 -12.824 1.00 0.49 H new ATOM 0 H22 G A 8 -15.391 4.876 -14.310 1.00 0.49 H new ATOM 157 P G A 9 -17.826 0.761 -8.099 1.00 0.44 P ATOM 158 OP1 G A 9 -19.213 0.926 -7.614 1.00 0.51 O ATOM 159 OP2 G A 9 -16.973 -0.327 -7.557 1.00 0.46 O ATOM 160 O5' G A 9 -17.863 0.609 -9.705 1.00 0.40 O ATOM 161 C5' G A 9 -16.962 -0.277 -10.380 1.00 0.37 C ATOM 162 C4' G A 9 -16.997 -0.079 -11.891 1.00 0.34 C ATOM 163 O4' G A 9 -16.533 1.247 -12.215 1.00 0.35 O ATOM 164 C3' G A 9 -16.058 -0.986 -12.674 1.00 0.34 C ATOM 165 O3' G A 9 -16.780 -2.173 -13.021 1.00 0.38 O ATOM 166 C2' G A 9 -15.842 -0.174 -13.937 1.00 0.34 C ATOM 167 O2' G A 9 -17.023 -0.150 -14.744 1.00 0.37 O ATOM 168 C1' G A 9 -15.585 1.184 -13.298 1.00 0.33 C ATOM 169 N9 G A 9 -14.231 1.285 -12.733 1.00 0.29 N ATOM 170 C8 G A 9 -13.876 1.391 -11.420 1.00 0.28 C ATOM 171 N7 G A 9 -12.589 1.391 -11.221 1.00 0.28 N ATOM 172 C5 G A 9 -12.054 1.287 -12.498 1.00 0.27 C ATOM 173 C6 G A 9 -10.699 1.241 -12.918 1.00 0.27 C ATOM 174 O6 G A 9 -9.686 1.269 -12.227 1.00 0.28 O ATOM 175 N1 G A 9 -10.594 1.133 -14.290 1.00 0.28 N ATOM 176 C2 G A 9 -11.653 1.077 -15.158 1.00 0.31 C ATOM 177 N2 G A 9 -11.369 0.976 -16.448 1.00 0.35 N ATOM 178 N3 G A 9 -12.931 1.118 -14.780 1.00 0.31 N ATOM 179 C4 G A 9 -13.054 1.223 -13.437 1.00 0.28 C ATOM 0 H5' G A 9 -17.221 -1.309 -10.143 1.00 0.37 H new ATOM 0 H5'' G A 9 -15.948 -0.111 -10.015 1.00 0.37 H new ATOM 0 H4' G A 9 -18.032 -0.288 -12.162 1.00 0.34 H new ATOM 0 H3' G A 9 -15.144 -1.268 -12.151 1.00 0.34 H new ATOM 0 H2' G A 9 -15.063 -0.538 -14.607 1.00 0.34 H new ATOM 0 HO2' G A 9 -17.514 -0.991 -14.631 1.00 0.37 H new ATOM 0 H1' G A 9 -15.681 1.983 -14.033 1.00 0.33 H new ATOM 0 H8 G A 9 -14.596 1.468 -10.619 1.00 0.28 H new ATOM 0 H1 G A 9 -9.656 1.092 -14.689 1.00 0.28 H new ATOM 0 H21 G A 9 -12.122 0.931 -17.134 1.00 0.35 H new ATOM 0 H22 G A 9 -10.397 0.943 -16.755 1.00 0.35 H new ATOM 191 P U A 10 -16.072 -3.613 -12.900 1.00 0.36 P ATOM 192 OP1 U A 10 -17.092 -4.660 -13.112 1.00 0.41 O ATOM 193 OP2 U A 10 -15.251 -3.616 -11.655 1.00 0.34 O ATOM 194 O5' U A 10 -15.067 -3.613 -14.159 1.00 0.40 O ATOM 195 C5' U A 10 -15.570 -3.491 -15.498 1.00 0.42 C ATOM 196 C4' U A 10 -14.453 -3.221 -16.502 1.00 0.41 C ATOM 197 O4' U A 10 -13.768 -2.018 -16.130 1.00 0.40 O ATOM 198 C3' U A 10 -13.365 -4.281 -16.543 1.00 0.39 C ATOM 199 O3' U A 10 -13.725 -5.199 -17.586 1.00 0.46 O ATOM 200 C2' U A 10 -12.149 -3.502 -17.022 1.00 0.38 C ATOM 201 O2' U A 10 -12.178 -3.341 -18.443 1.00 0.44 O ATOM 202 C1' U A 10 -12.350 -2.156 -16.321 1.00 0.36 C ATOM 203 N1 U A 10 -11.688 -2.069 -15.012 1.00 0.30 N ATOM 204 C2 U A 10 -10.307 -2.157 -14.977 1.00 0.27 C ATOM 205 O2 U A 10 -9.625 -2.324 -15.980 1.00 0.32 O ATOM 206 N3 U A 10 -9.729 -2.025 -13.738 1.00 0.23 N ATOM 207 C4 U A 10 -10.397 -1.817 -12.551 1.00 0.23 C ATOM 208 O4 U A 10 -9.766 -1.711 -11.504 1.00 0.26 O ATOM 209 C5 U A 10 -11.836 -1.739 -12.676 1.00 0.26 C ATOM 210 C6 U A 10 -12.420 -1.866 -13.882 1.00 0.29 C ATOM 0 H5' U A 10 -16.299 -2.682 -15.540 1.00 0.42 H new ATOM 0 H5'' U A 10 -16.093 -4.406 -15.774 1.00 0.42 H new ATOM 0 H4' U A 10 -14.955 -3.183 -17.469 1.00 0.41 H new ATOM 0 H3' U A 10 -13.210 -4.809 -15.602 1.00 0.39 H new ATOM 0 H2' U A 10 -11.196 -3.983 -16.801 1.00 0.38 H new ATOM 0 HO2' U A 10 -12.812 -3.979 -18.832 1.00 0.44 H new ATOM 0 H1' U A 10 -11.911 -1.370 -16.935 1.00 0.36 H new ATOM 0 H3 U A 10 -8.712 -2.087 -13.692 1.00 0.23 H new ATOM 0 H5 U A 10 -12.444 -1.578 -11.798 1.00 0.26 H new ATOM 0 H6 U A 10 -13.496 -1.805 -13.955 1.00 0.29 H new ATOM 221 P U A 11 -13.293 -6.748 -17.517 1.00 0.46 P ATOM 222 OP1 U A 11 -13.999 -7.474 -18.597 1.00 0.64 O ATOM 223 OP2 U A 11 -13.422 -7.203 -16.114 1.00 0.55 O ATOM 224 O5' U A 11 -11.726 -6.693 -17.889 1.00 0.41 O ATOM 225 C5' U A 11 -10.789 -7.526 -17.198 1.00 0.46 C ATOM 226 C4' U A 11 -9.370 -6.972 -17.268 1.00 0.33 C ATOM 227 O4' U A 11 -9.361 -5.638 -16.743 1.00 0.36 O ATOM 228 C3' U A 11 -8.365 -7.737 -16.418 1.00 0.32 C ATOM 229 O3' U A 11 -7.667 -8.631 -17.297 1.00 0.39 O ATOM 230 C2' U A 11 -7.367 -6.672 -15.992 1.00 0.29 C ATOM 231 O2' U A 11 -6.371 -6.482 -17.001 1.00 0.36 O ATOM 232 C1' U A 11 -8.244 -5.431 -15.864 1.00 0.29 C ATOM 233 N1 U A 11 -8.754 -5.222 -14.491 1.00 0.23 N ATOM 234 C2 U A 11 -7.831 -5.064 -13.474 1.00 0.22 C ATOM 235 O2 U A 11 -6.620 -5.142 -13.653 1.00 0.27 O ATOM 236 N3 U A 11 -8.348 -4.834 -12.221 1.00 0.24 N ATOM 237 C4 U A 11 -9.684 -4.755 -11.892 1.00 0.26 C ATOM 238 O4 U A 11 -10.015 -4.548 -10.727 1.00 0.33 O ATOM 239 C5 U A 11 -10.588 -4.933 -13.004 1.00 0.28 C ATOM 240 C6 U A 11 -10.098 -5.156 -14.248 1.00 0.26 C ATOM 0 H5' U A 11 -10.809 -8.527 -17.628 1.00 0.46 H new ATOM 0 H5'' U A 11 -11.090 -7.621 -16.155 1.00 0.46 H new ATOM 0 H4' U A 11 -9.084 -7.042 -18.318 1.00 0.33 H new ATOM 0 H3' U A 11 -8.816 -8.279 -15.586 1.00 0.32 H new ATOM 0 H2' U A 11 -6.825 -6.921 -15.080 1.00 0.29 H new ATOM 0 HO2' U A 11 -6.407 -7.224 -17.640 1.00 0.36 H new ATOM 0 H1' U A 11 -7.653 -4.550 -16.114 1.00 0.29 H new ATOM 0 H3 U A 11 -7.678 -4.710 -11.462 1.00 0.24 H new ATOM 0 H5 U A 11 -11.655 -4.888 -12.844 1.00 0.28 H new ATOM 0 H6 U A 11 -10.788 -5.285 -15.069 1.00 0.26 H new ATOM 251 P U A 12 -8.261 -10.085 -17.661 1.00 0.44 P ATOM 252 OP1 U A 12 -8.108 -10.295 -19.118 1.00 0.55 O ATOM 253 OP2 U A 12 -9.595 -10.218 -17.031 1.00 0.49 O ATOM 254 O5' U A 12 -7.244 -11.075 -16.899 1.00 0.46 O ATOM 255 C5' U A 12 -7.390 -11.348 -15.501 1.00 0.39 C ATOM 256 C4' U A 12 -6.061 -11.227 -14.761 1.00 0.37 C ATOM 257 O4' U A 12 -5.647 -9.847 -14.714 1.00 0.33 O ATOM 258 C3' U A 12 -6.105 -11.613 -13.294 1.00 0.33 C ATOM 259 O3' U A 12 -5.907 -13.030 -13.194 1.00 0.41 O ATOM 260 C2' U A 12 -4.864 -10.921 -12.782 1.00 0.34 C ATOM 261 O2' U A 12 -3.673 -11.540 -13.282 1.00 0.43 O ATOM 262 C1' U A 12 -5.077 -9.557 -13.416 1.00 0.30 C ATOM 263 N1 U A 12 -6.032 -8.758 -12.629 1.00 0.26 N ATOM 264 C2 U A 12 -5.605 -8.274 -11.408 1.00 0.28 C ATOM 265 O2 U A 12 -4.453 -8.387 -11.017 1.00 0.35 O ATOM 266 N3 U A 12 -6.551 -7.635 -10.647 1.00 0.29 N ATOM 267 C4 U A 12 -7.864 -7.434 -10.989 1.00 0.28 C ATOM 268 O4 U A 12 -8.609 -6.835 -10.220 1.00 0.34 O ATOM 269 C5 U A 12 -8.237 -7.961 -12.281 1.00 0.25 C ATOM 270 C6 U A 12 -7.321 -8.590 -13.047 1.00 0.24 C ATOM 0 H5' U A 12 -7.792 -12.352 -15.366 1.00 0.39 H new ATOM 0 H5'' U A 12 -8.112 -10.655 -15.068 1.00 0.39 H new ATOM 0 H4' U A 12 -5.403 -11.897 -15.314 1.00 0.37 H new ATOM 0 H3' U A 12 -7.028 -11.356 -12.773 1.00 0.33 H new ATOM 0 H2' U A 12 -4.736 -10.928 -11.700 1.00 0.34 H new ATOM 0 HO2' U A 12 -3.474 -12.341 -12.754 1.00 0.43 H new ATOM 0 H1' U A 12 -4.150 -8.986 -13.472 1.00 0.30 H new ATOM 0 H3 U A 12 -6.249 -7.275 -9.741 1.00 0.29 H new ATOM 0 H5 U A 12 -9.251 -7.851 -12.635 1.00 0.25 H new ATOM 0 H6 U A 12 -7.615 -8.970 -14.014 1.00 0.24 H new ATOM 281 P A A 13 -7.159 -14.021 -12.958 1.00 0.44 P ATOM 282 OP1 A A 13 -7.317 -14.865 -14.162 1.00 0.62 O ATOM 283 OP2 A A 13 -8.302 -13.214 -12.467 1.00 0.44 O ATOM 284 O5' A A 13 -6.643 -14.958 -11.749 1.00 0.49 O ATOM 285 C5' A A 13 -7.489 -15.254 -10.626 1.00 0.45 C ATOM 286 C4' A A 13 -6.991 -14.580 -9.348 1.00 0.43 C ATOM 287 O4' A A 13 -5.668 -15.050 -9.053 1.00 0.49 O ATOM 288 C3' A A 13 -6.845 -13.070 -9.444 1.00 0.40 C ATOM 289 O3' A A 13 -8.070 -12.493 -8.960 1.00 0.37 O ATOM 290 C2' A A 13 -5.758 -12.774 -8.421 1.00 0.43 C ATOM 291 O2' A A 13 -6.290 -12.749 -7.093 1.00 0.45 O ATOM 292 C1' A A 13 -4.829 -13.970 -8.608 1.00 0.48 C ATOM 293 N9 A A 13 -3.787 -13.733 -9.624 1.00 0.48 N ATOM 294 C8 A A 13 -3.911 -13.720 -10.988 1.00 0.49 C ATOM 295 N7 A A 13 -2.790 -13.495 -11.613 1.00 0.51 N ATOM 296 C5 A A 13 -1.861 -13.350 -10.588 1.00 0.52 C ATOM 297 C6 A A 13 -0.481 -13.093 -10.582 1.00 0.57 C ATOM 298 N6 A A 13 0.241 -12.920 -11.686 1.00 0.61 N ATOM 299 N1 A A 13 0.136 -13.010 -9.396 1.00 0.60 N ATOM 300 C2 A A 13 -0.577 -13.172 -8.287 1.00 0.59 C ATOM 301 N3 A A 13 -1.873 -13.415 -8.156 1.00 0.55 N ATOM 302 C4 A A 13 -2.459 -13.492 -9.370 1.00 0.51 C ATOM 0 H5' A A 13 -7.530 -16.333 -10.476 1.00 0.45 H new ATOM 0 H5'' A A 13 -8.505 -14.923 -10.839 1.00 0.45 H new ATOM 0 H4' A A 13 -7.741 -14.824 -8.596 1.00 0.43 H new ATOM 0 H3' A A 13 -6.627 -12.699 -10.445 1.00 0.40 H new ATOM 0 H2' A A 13 -5.277 -11.805 -8.555 1.00 0.43 H new ATOM 0 HO2' A A 13 -6.669 -11.864 -6.909 1.00 0.45 H new ATOM 0 H1' A A 13 -4.310 -14.177 -7.672 1.00 0.48 H new ATOM 0 H8 A A 13 -4.850 -13.881 -11.498 1.00 0.49 H new ATOM 0 H61 A A 13 1.242 -12.736 -11.617 1.00 0.61 H new ATOM 0 H62 A A 13 -0.206 -12.972 -12.601 1.00 0.61 H new ATOM 0 H2 A A 13 -0.023 -13.095 -7.363 1.00 0.59 H new ATOM 314 P G A 14 -8.267 -10.895 -8.896 1.00 0.36 P ATOM 315 OP1 G A 14 -9.698 -10.602 -8.644 1.00 0.37 O ATOM 316 OP2 G A 14 -7.592 -10.289 -10.065 1.00 0.38 O ATOM 317 O5' G A 14 -7.447 -10.478 -7.572 1.00 0.40 O ATOM 318 C5' G A 14 -6.705 -9.255 -7.529 1.00 0.41 C ATOM 319 C4' G A 14 -5.448 -9.384 -6.673 1.00 0.39 C ATOM 320 O4' G A 14 -4.635 -10.439 -7.193 1.00 0.40 O ATOM 321 C3' G A 14 -4.542 -8.167 -6.710 1.00 0.41 C ATOM 322 O3' G A 14 -4.888 -7.337 -5.591 1.00 0.43 O ATOM 323 C2' G A 14 -3.171 -8.747 -6.407 1.00 0.44 C ATOM 324 O2' G A 14 -2.983 -8.900 -4.997 1.00 0.49 O ATOM 325 C1' G A 14 -3.238 -10.112 -7.085 1.00 0.43 C ATOM 326 N9 G A 14 -2.644 -10.110 -8.433 1.00 0.41 N ATOM 327 C8 G A 14 -3.254 -10.360 -9.630 1.00 0.39 C ATOM 328 N7 G A 14 -2.445 -10.323 -10.651 1.00 0.40 N ATOM 329 C5 G A 14 -1.210 -10.022 -10.086 1.00 0.42 C ATOM 330 C6 G A 14 0.061 -9.847 -10.702 1.00 0.45 C ATOM 331 O6 G A 14 0.356 -9.940 -11.890 1.00 0.47 O ATOM 332 N1 G A 14 1.038 -9.552 -9.772 1.00 0.49 N ATOM 333 C2 G A 14 0.831 -9.437 -8.421 1.00 0.51 C ATOM 334 N2 G A 14 1.885 -9.145 -7.673 1.00 0.57 N ATOM 335 N3 G A 14 -0.349 -9.599 -7.830 1.00 0.48 N ATOM 336 C4 G A 14 -1.322 -9.888 -8.724 1.00 0.43 C ATOM 0 H5' G A 14 -7.336 -8.461 -7.130 1.00 0.41 H new ATOM 0 H5'' G A 14 -6.427 -8.963 -8.542 1.00 0.41 H new ATOM 0 H4' G A 14 -5.814 -9.543 -5.659 1.00 0.39 H new ATOM 0 H3' G A 14 -4.602 -7.605 -7.642 1.00 0.41 H new ATOM 0 H2' G A 14 -2.348 -8.121 -6.752 1.00 0.44 H new ATOM 0 HO2' G A 14 -2.256 -8.314 -4.698 1.00 0.49 H new ATOM 0 H1' G A 14 -2.673 -10.834 -6.496 1.00 0.43 H new ATOM 0 H8 G A 14 -4.310 -10.569 -9.721 1.00 0.39 H new ATOM 0 H1 G A 14 1.987 -9.408 -10.116 1.00 0.49 H new ATOM 0 H21 G A 14 1.783 -9.049 -6.663 1.00 0.57 H new ATOM 0 H22 G A 14 2.799 -9.016 -8.108 1.00 0.57 H new ATOM 348 P G A 15 -6.195 -6.401 -5.587 1.00 0.46 P ATOM 349 OP1 G A 15 -7.257 -7.075 -4.810 1.00 0.61 O ATOM 350 OP2 G A 15 -6.474 -5.977 -6.985 1.00 0.45 O ATOM 351 O5' G A 15 -5.689 -5.115 -4.754 1.00 0.45 O ATOM 352 C5' G A 15 -4.996 -4.038 -5.403 1.00 0.41 C ATOM 353 C4' G A 15 -3.866 -4.539 -6.303 1.00 0.37 C ATOM 354 O4' G A 15 -3.652 -3.596 -7.364 1.00 0.35 O ATOM 355 C3' G A 15 -2.505 -4.688 -5.631 1.00 0.40 C ATOM 356 O3' G A 15 -1.769 -5.629 -6.424 1.00 0.39 O ATOM 357 C2' G A 15 -1.887 -3.305 -5.828 1.00 0.41 C ATOM 358 O2' G A 15 -0.459 -3.357 -5.798 1.00 0.46 O ATOM 359 C1' G A 15 -2.375 -2.951 -7.228 1.00 0.38 C ATOM 360 N9 G A 15 -2.567 -1.498 -7.393 1.00 0.41 N ATOM 361 C8 G A 15 -1.956 -0.641 -8.271 1.00 0.49 C ATOM 362 N7 G A 15 -2.341 0.600 -8.147 1.00 0.52 N ATOM 363 C5 G A 15 -3.273 0.561 -7.112 1.00 0.46 C ATOM 364 C6 G A 15 -4.040 1.607 -6.522 1.00 0.49 C ATOM 365 O6 G A 15 -4.084 2.794 -6.830 1.00 0.56 O ATOM 366 N1 G A 15 -4.852 1.131 -5.511 1.00 0.48 N ATOM 367 C2 G A 15 -4.932 -0.176 -5.115 1.00 0.45 C ATOM 368 N2 G A 15 -5.793 -0.457 -4.153 1.00 0.52 N ATOM 369 N3 G A 15 -4.227 -1.163 -5.654 1.00 0.40 N ATOM 370 C4 G A 15 -3.417 -0.722 -6.646 1.00 0.40 C ATOM 0 H5' G A 15 -4.587 -3.365 -4.650 1.00 0.41 H new ATOM 0 H5'' G A 15 -5.703 -3.459 -5.998 1.00 0.41 H new ATOM 0 H4' G A 15 -4.202 -5.525 -6.625 1.00 0.37 H new ATOM 0 H3' G A 15 -2.529 -5.010 -4.590 1.00 0.40 H new ATOM 0 H2' G A 15 -2.164 -2.590 -5.053 1.00 0.41 H new ATOM 0 HO2' G A 15 -0.169 -3.963 -5.084 1.00 0.46 H new ATOM 0 H1' G A 15 -1.645 -3.269 -7.972 1.00 0.38 H new ATOM 0 H8 G A 15 -1.224 -0.963 -8.997 1.00 0.49 H new ATOM 0 H1 G A 15 -5.438 1.807 -5.021 1.00 0.48 H new ATOM 0 H21 G A 15 -5.892 -1.416 -3.821 1.00 0.52 H new ATOM 0 H22 G A 15 -6.359 0.286 -3.742 1.00 0.52 H new ATOM 382 P U A 16 -0.427 -6.348 -5.881 1.00 0.42 P ATOM 383 OP1 U A 16 -0.774 -7.708 -5.417 1.00 0.43 O ATOM 384 OP2 U A 16 0.276 -5.422 -4.964 1.00 0.49 O ATOM 385 O5' U A 16 0.434 -6.477 -7.236 1.00 0.41 O ATOM 386 C5' U A 16 0.283 -5.498 -8.274 1.00 0.39 C ATOM 387 C4' U A 16 0.423 -6.106 -9.666 1.00 0.36 C ATOM 388 O4' U A 16 -0.617 -7.069 -9.888 1.00 0.34 O ATOM 389 C3' U A 16 0.272 -5.112 -10.806 1.00 0.35 C ATOM 390 O3' U A 16 1.591 -4.680 -11.155 1.00 0.42 O ATOM 391 C2' U A 16 -0.232 -5.981 -11.940 1.00 0.36 C ATOM 392 O2' U A 16 0.838 -6.744 -12.506 1.00 0.43 O ATOM 393 C1' U A 16 -1.205 -6.883 -11.190 1.00 0.32 C ATOM 394 N1 U A 16 -2.538 -6.281 -11.012 1.00 0.28 N ATOM 395 C2 U A 16 -3.252 -5.938 -12.146 1.00 0.27 C ATOM 396 O2 U A 16 -2.811 -6.087 -13.279 1.00 0.30 O ATOM 397 N3 U A 16 -4.501 -5.406 -11.931 1.00 0.24 N ATOM 398 C4 U A 16 -5.091 -5.187 -10.707 1.00 0.24 C ATOM 399 O4 U A 16 -6.228 -4.724 -10.649 1.00 0.25 O ATOM 400 C5 U A 16 -4.287 -5.566 -9.572 1.00 0.27 C ATOM 401 C6 U A 16 -3.054 -6.095 -9.759 1.00 0.29 C ATOM 0 H5' U A 16 1.031 -4.716 -8.144 1.00 0.39 H new ATOM 0 H5'' U A 16 -0.694 -5.023 -8.184 1.00 0.39 H new ATOM 0 H4' U A 16 1.429 -6.525 -9.675 1.00 0.36 H new ATOM 0 H3' U A 16 -0.364 -4.256 -10.582 1.00 0.35 H new ATOM 0 H2' U A 16 -0.669 -5.435 -12.776 1.00 0.36 H new ATOM 0 HO2' U A 16 1.692 -6.304 -12.312 1.00 0.43 H new ATOM 0 H1' U A 16 -1.355 -7.804 -11.753 1.00 0.32 H new ATOM 0 H3 U A 16 -5.042 -5.149 -12.757 1.00 0.24 H new ATOM 0 H5 U A 16 -4.668 -5.428 -8.571 1.00 0.27 H new ATOM 0 H6 U A 16 -2.465 -6.376 -8.899 1.00 0.29 H new ATOM 412 P A A 17 2.062 -3.168 -10.884 1.00 0.44 P ATOM 413 OP1 A A 17 3.370 -3.208 -10.190 1.00 0.59 O ATOM 414 OP2 A A 17 0.930 -2.425 -10.283 1.00 0.47 O ATOM 415 O5' A A 17 2.301 -2.614 -12.377 1.00 0.46 O ATOM 416 C5' A A 17 1.390 -1.683 -12.966 1.00 0.42 C ATOM 417 C4' A A 17 0.591 -2.303 -14.112 1.00 0.35 C ATOM 418 O4' A A 17 -0.314 -3.291 -13.599 1.00 0.32 O ATOM 419 C3' A A 17 -0.316 -1.326 -14.826 1.00 0.31 C ATOM 420 O3' A A 17 0.433 -0.769 -15.913 1.00 0.34 O ATOM 421 C2' A A 17 -1.370 -2.230 -15.435 1.00 0.30 C ATOM 422 O2' A A 17 -0.868 -2.856 -16.620 1.00 0.35 O ATOM 423 C1' A A 17 -1.564 -3.255 -14.325 1.00 0.29 C ATOM 424 N9 A A 17 -2.649 -2.907 -13.384 1.00 0.26 N ATOM 425 C8 A A 17 -2.568 -2.701 -12.033 1.00 0.26 C ATOM 426 N7 A A 17 -3.720 -2.443 -11.470 1.00 0.25 N ATOM 427 C5 A A 17 -4.622 -2.485 -12.532 1.00 0.23 C ATOM 428 C6 A A 17 -6.015 -2.299 -12.610 1.00 0.23 C ATOM 429 N6 A A 17 -6.784 -2.046 -11.557 1.00 0.25 N ATOM 430 N1 A A 17 -6.596 -2.407 -13.812 1.00 0.24 N ATOM 431 C2 A A 17 -5.841 -2.687 -14.870 1.00 0.25 C ATOM 432 N3 A A 17 -4.532 -2.885 -14.930 1.00 0.25 N ATOM 433 C4 A A 17 -3.980 -2.766 -13.703 1.00 0.24 C ATOM 0 H5' A A 17 1.944 -0.820 -13.337 1.00 0.42 H new ATOM 0 H5'' A A 17 0.703 -1.317 -12.203 1.00 0.42 H new ATOM 0 H4' A A 17 1.349 -2.692 -14.792 1.00 0.35 H new ATOM 0 H3' A A 17 -0.712 -0.535 -14.189 1.00 0.31 H new ATOM 0 H2' A A 17 -2.284 -1.718 -15.736 1.00 0.30 H new ATOM 0 HO2' A A 17 -0.263 -2.240 -17.084 1.00 0.35 H new ATOM 0 H1' A A 17 -1.843 -4.211 -14.769 1.00 0.29 H new ATOM 0 H8 A A 17 -1.639 -2.747 -11.483 1.00 0.26 H new ATOM 0 H61 A A 17 -7.789 -1.921 -11.678 1.00 0.25 H new ATOM 0 H62 A A 17 -6.369 -1.977 -10.628 1.00 0.25 H new ATOM 0 H2 A A 17 -6.367 -2.764 -15.810 1.00 0.25 H new ATOM 445 P A A 18 1.272 0.592 -15.736 1.00 0.39 P ATOM 446 OP1 A A 18 2.708 0.276 -15.906 1.00 0.50 O ATOM 447 OP2 A A 18 0.806 1.273 -14.505 1.00 0.46 O ATOM 448 O5' A A 18 0.791 1.455 -17.007 1.00 0.37 O ATOM 449 C5' A A 18 -0.463 2.148 -16.991 1.00 0.38 C ATOM 450 C4' A A 18 -1.534 1.423 -17.805 1.00 0.34 C ATOM 451 O4' A A 18 -1.928 0.215 -17.134 1.00 0.31 O ATOM 452 C3' A A 18 -2.841 2.175 -17.931 1.00 0.34 C ATOM 453 O3' A A 18 -2.745 3.053 -19.063 1.00 0.39 O ATOM 454 C2' A A 18 -3.803 1.066 -18.290 1.00 0.33 C ATOM 455 O2' A A 18 -3.611 0.637 -19.641 1.00 0.39 O ATOM 456 C1' A A 18 -3.350 -0.004 -17.302 1.00 0.29 C ATOM 457 N9 A A 18 -4.021 0.133 -15.997 1.00 0.25 N ATOM 458 C8 A A 18 -3.461 0.161 -14.752 1.00 0.24 C ATOM 459 N7 A A 18 -4.328 0.305 -13.789 1.00 0.22 N ATOM 460 C5 A A 18 -5.547 0.374 -14.454 1.00 0.21 C ATOM 461 C6 A A 18 -6.864 0.525 -14.004 1.00 0.22 C ATOM 462 N6 A A 18 -7.189 0.611 -12.721 1.00 0.23 N ATOM 463 N1 A A 18 -7.843 0.557 -14.920 1.00 0.24 N ATOM 464 C2 A A 18 -7.523 0.444 -16.204 1.00 0.27 C ATOM 465 N3 A A 18 -6.328 0.297 -16.754 1.00 0.27 N ATOM 466 C4 A A 18 -5.372 0.271 -15.801 1.00 0.23 C ATOM 0 H5' A A 18 -0.326 3.154 -17.389 1.00 0.38 H new ATOM 0 H5'' A A 18 -0.803 2.256 -15.961 1.00 0.38 H new ATOM 0 H4' A A 18 -1.069 1.284 -18.781 1.00 0.34 H new ATOM 0 H3' A A 18 -3.116 2.754 -17.049 1.00 0.34 H new ATOM 0 H2' A A 18 -4.859 1.331 -18.232 1.00 0.33 H new ATOM 0 HO2' A A 18 -3.228 1.371 -20.166 1.00 0.39 H new ATOM 0 H1' A A 18 -3.591 -1.000 -17.674 1.00 0.29 H new ATOM 0 H8 A A 18 -2.398 0.072 -14.581 1.00 0.24 H new ATOM 0 H61 A A 18 -8.166 0.720 -12.449 1.00 0.23 H new ATOM 0 H62 A A 18 -6.462 0.568 -12.007 1.00 0.23 H new ATOM 0 H2 A A 18 -8.352 0.477 -16.895 1.00 0.27 H new ATOM 478 P U A 19 -2.205 4.560 -18.888 1.00 0.46 P ATOM 479 OP1 U A 19 -2.874 5.412 -19.897 1.00 0.51 O ATOM 480 OP2 U A 19 -0.726 4.519 -18.822 1.00 0.53 O ATOM 481 O5' U A 19 -2.765 4.959 -17.427 1.00 0.44 O ATOM 482 C5' U A 19 -3.973 5.715 -17.272 1.00 0.44 C ATOM 483 C4' U A 19 -5.179 5.028 -17.914 1.00 0.40 C ATOM 484 O4' U A 19 -5.408 3.763 -17.276 1.00 0.36 O ATOM 485 C3' U A 19 -6.485 5.784 -17.740 1.00 0.39 C ATOM 486 O3' U A 19 -6.671 6.566 -18.930 1.00 0.48 O ATOM 487 C2' U A 19 -7.530 4.683 -17.761 1.00 0.37 C ATOM 488 O2' U A 19 -7.830 4.294 -19.105 1.00 0.44 O ATOM 489 C1' U A 19 -6.811 3.559 -17.023 1.00 0.34 C ATOM 490 N1 U A 19 -7.038 3.582 -15.563 1.00 0.30 N ATOM 491 C2 U A 19 -8.340 3.524 -15.104 1.00 0.33 C ATOM 492 O2 U A 19 -9.306 3.429 -15.855 1.00 0.38 O ATOM 493 N3 U A 19 -8.499 3.542 -13.738 1.00 0.33 N ATOM 494 C4 U A 19 -7.494 3.605 -12.800 1.00 0.32 C ATOM 495 O4 U A 19 -7.767 3.596 -11.601 1.00 0.37 O ATOM 496 C5 U A 19 -6.163 3.660 -13.352 1.00 0.30 C ATOM 497 C6 U A 19 -5.985 3.650 -14.697 1.00 0.29 C ATOM 0 H5' U A 19 -3.841 6.701 -17.717 1.00 0.44 H new ATOM 0 H5'' U A 19 -4.168 5.868 -16.211 1.00 0.44 H new ATOM 0 H4' U A 19 -4.930 4.957 -18.973 1.00 0.40 H new ATOM 0 H3' U A 19 -6.524 6.414 -16.851 1.00 0.39 H new ATOM 0 H2' U A 19 -8.484 4.968 -17.318 1.00 0.37 H new ATOM 0 HO2' U A 19 -7.499 4.977 -19.725 1.00 0.44 H new ATOM 0 H1' U A 19 -7.186 2.598 -17.376 1.00 0.34 H new ATOM 0 H3 U A 19 -9.455 3.505 -13.386 1.00 0.33 H new ATOM 0 H5 U A 19 -5.308 3.709 -12.695 1.00 0.30 H new ATOM 0 H6 U A 19 -4.982 3.697 -15.094 1.00 0.29 H new ATOM 508 P G A 20 -6.762 8.173 -18.867 1.00 0.43 P ATOM 509 OP1 G A 20 -6.380 8.708 -20.193 1.00 0.54 O ATOM 510 OP2 G A 20 -6.048 8.633 -17.654 1.00 0.44 O ATOM 511 O5' G A 20 -8.339 8.426 -18.657 1.00 0.44 O ATOM 512 C5' G A 20 -8.828 9.048 -17.464 1.00 0.37 C ATOM 513 C4' G A 20 -10.291 8.703 -17.201 1.00 0.34 C ATOM 514 O4' G A 20 -10.412 7.288 -16.957 1.00 0.34 O ATOM 515 C3' G A 20 -10.868 9.349 -15.946 1.00 0.32 C ATOM 516 O3' G A 20 -11.570 10.531 -16.350 1.00 0.40 O ATOM 517 C2' G A 20 -11.902 8.332 -15.503 1.00 0.37 C ATOM 518 O2' G A 20 -13.053 8.364 -16.355 1.00 0.44 O ATOM 519 C1' G A 20 -11.099 7.062 -15.717 1.00 0.35 C ATOM 520 N9 G A 20 -10.098 6.845 -14.658 1.00 0.32 N ATOM 521 C8 G A 20 -8.768 6.562 -14.794 1.00 0.31 C ATOM 522 N7 G A 20 -8.141 6.420 -13.660 1.00 0.33 N ATOM 523 C5 G A 20 -9.132 6.628 -12.705 1.00 0.33 C ATOM 524 C6 G A 20 -9.051 6.602 -11.289 1.00 0.37 C ATOM 525 O6 G A 20 -8.074 6.371 -10.584 1.00 0.41 O ATOM 526 N1 G A 20 -10.275 6.863 -10.704 1.00 0.38 N ATOM 527 C2 G A 20 -11.436 7.117 -11.386 1.00 0.39 C ATOM 528 N2 G A 20 -12.519 7.356 -10.662 1.00 0.44 N ATOM 529 N3 G A 20 -11.530 7.143 -12.714 1.00 0.37 N ATOM 530 C4 G A 20 -10.337 6.891 -13.307 1.00 0.33 C ATOM 0 H5' G A 20 -8.719 10.129 -17.548 1.00 0.37 H new ATOM 0 H5'' G A 20 -8.222 8.732 -16.615 1.00 0.37 H new ATOM 0 H4' G A 20 -10.824 9.060 -18.082 1.00 0.34 H new ATOM 0 H3' G A 20 -10.127 9.601 -15.187 1.00 0.32 H new ATOM 0 H2' G A 20 -12.300 8.473 -14.498 1.00 0.37 H new ATOM 0 HO2' G A 20 -13.071 9.210 -16.849 1.00 0.44 H new ATOM 0 H1' G A 20 -11.749 6.187 -15.713 1.00 0.35 H new ATOM 0 H8 G A 20 -8.281 6.465 -15.753 1.00 0.31 H new ATOM 0 H1 G A 20 -10.318 6.867 -9.685 1.00 0.38 H new ATOM 0 H21 G A 20 -13.408 7.551 -11.123 1.00 0.44 H new ATOM 0 H22 G A 20 -12.464 7.345 -9.644 1.00 0.44 H new ATOM 542 P A A 21 -11.720 11.780 -15.343 1.00 0.60 P ATOM 543 OP1 A A 21 -12.718 12.714 -15.911 1.00 0.72 O ATOM 544 OP2 A A 21 -10.363 12.266 -15.006 1.00 0.80 O ATOM 545 O5' A A 21 -12.352 11.096 -14.026 1.00 0.70 O ATOM 546 C5' A A 21 -13.748 11.216 -13.724 1.00 0.64 C ATOM 547 C4' A A 21 -13.986 11.333 -12.221 1.00 0.47 C ATOM 548 O4' A A 21 -13.520 10.138 -11.574 1.00 0.46 O ATOM 549 C3' A A 21 -13.214 12.461 -11.548 1.00 0.39 C ATOM 550 O3' A A 21 -14.097 13.592 -11.483 1.00 0.47 O ATOM 551 C2' A A 21 -13.028 11.940 -10.132 1.00 0.38 C ATOM 552 O2' A A 21 -14.219 12.123 -9.360 1.00 0.47 O ATOM 553 C1' A A 21 -12.767 10.460 -10.394 1.00 0.39 C ATOM 554 N9 A A 21 -11.343 10.169 -10.648 1.00 0.36 N ATOM 555 C8 A A 21 -10.687 10.072 -11.851 1.00 0.38 C ATOM 556 N7 A A 21 -9.418 9.794 -11.732 1.00 0.38 N ATOM 557 C5 A A 21 -9.226 9.699 -10.358 1.00 0.36 C ATOM 558 C6 A A 21 -8.097 9.423 -9.572 1.00 0.39 C ATOM 559 N6 A A 21 -6.892 9.175 -10.077 1.00 0.42 N ATOM 560 N1 A A 21 -8.250 9.404 -8.238 1.00 0.43 N ATOM 561 C2 A A 21 -9.452 9.644 -7.725 1.00 0.44 C ATOM 562 N3 A A 21 -10.586 9.914 -8.352 1.00 0.41 N ATOM 563 C4 A A 21 -10.393 9.925 -9.687 1.00 0.36 C ATOM 0 H5' A A 21 -14.281 10.348 -14.112 1.00 0.64 H new ATOM 0 H5'' A A 21 -14.156 12.092 -14.228 1.00 0.64 H new ATOM 0 H4' A A 21 -15.056 11.515 -12.121 1.00 0.47 H new ATOM 0 H3' A A 21 -12.284 12.736 -12.046 1.00 0.39 H new ATOM 0 H2' A A 21 -12.242 12.441 -9.567 1.00 0.38 H new ATOM 0 HO2' A A 21 -14.339 13.076 -9.164 1.00 0.47 H new ATOM 0 H1' A A 21 -13.054 9.876 -9.519 1.00 0.39 H new ATOM 0 H8 A A 21 -11.175 10.212 -12.804 1.00 0.38 H new ATOM 0 H61 A A 21 -6.108 8.981 -9.454 1.00 0.42 H new ATOM 0 H62 A A 21 -6.752 9.179 -11.087 1.00 0.42 H new ATOM 0 H2 A A 21 -9.512 9.615 -6.647 1.00 0.44 H new ATOM 575 P G A 22 -13.567 15.032 -10.988 1.00 0.60 P ATOM 576 OP1 G A 22 -14.630 16.028 -11.247 1.00 0.76 O ATOM 577 OP2 G A 22 -12.210 15.242 -11.541 1.00 0.65 O ATOM 578 O5' G A 22 -13.441 14.833 -9.393 1.00 0.59 O ATOM 579 C5' G A 22 -12.347 15.412 -8.669 1.00 0.67 C ATOM 580 C4' G A 22 -12.148 14.744 -7.312 1.00 0.68 C ATOM 581 O4' G A 22 -11.839 13.353 -7.507 1.00 0.60 O ATOM 582 C3' G A 22 -10.971 15.281 -6.507 1.00 0.77 C ATOM 583 O3' G A 22 -11.482 16.297 -5.630 1.00 0.97 O ATOM 584 C2' G A 22 -10.591 14.085 -5.653 1.00 0.74 C ATOM 585 O2' G A 22 -11.520 13.914 -4.578 1.00 0.90 O ATOM 586 C1' G A 22 -10.730 12.962 -6.677 1.00 0.60 C ATOM 587 N9 G A 22 -9.533 12.814 -7.530 1.00 0.47 N ATOM 588 C8 G A 22 -9.415 13.040 -8.877 1.00 0.43 C ATOM 589 N7 G A 22 -8.220 12.812 -9.345 1.00 0.37 N ATOM 590 C5 G A 22 -7.496 12.407 -8.230 1.00 0.36 C ATOM 591 C6 G A 22 -6.133 12.024 -8.119 1.00 0.34 C ATOM 592 O6 G A 22 -5.281 11.960 -8.999 1.00 0.36 O ATOM 593 N1 G A 22 -5.802 11.689 -6.821 1.00 0.38 N ATOM 594 C2 G A 22 -6.665 11.713 -5.756 1.00 0.46 C ATOM 595 N2 G A 22 -6.178 11.344 -4.580 1.00 0.55 N ATOM 596 N3 G A 22 -7.946 12.071 -5.842 1.00 0.49 N ATOM 597 C4 G A 22 -8.290 12.405 -7.110 1.00 0.43 C ATOM 0 H5' G A 22 -12.529 16.477 -8.526 1.00 0.67 H new ATOM 0 H5'' G A 22 -11.433 15.320 -9.257 1.00 0.67 H new ATOM 0 H4' G A 22 -13.076 14.936 -6.774 1.00 0.68 H new ATOM 0 H3' G A 22 -10.155 15.684 -7.107 1.00 0.77 H new ATOM 0 H2' G A 22 -9.613 14.152 -5.177 1.00 0.74 H new ATOM 0 HO2' G A 22 -11.984 14.760 -4.409 1.00 0.90 H new ATOM 0 H1' G A 22 -10.868 12.008 -6.169 1.00 0.60 H new ATOM 0 H8 G A 22 -10.236 13.376 -9.493 1.00 0.43 H new ATOM 0 H1 G A 22 -4.840 11.401 -6.640 1.00 0.38 H new ATOM 0 H21 G A 22 -6.779 11.344 -3.756 1.00 0.55 H new ATOM 0 H22 G A 22 -5.202 11.060 -4.499 1.00 0.55 H new ATOM 609 P U A 23 -10.729 17.714 -5.482 1.00 1.15 P ATOM 610 OP1 U A 23 -11.617 18.636 -4.740 1.00 1.41 O ATOM 611 OP2 U A 23 -10.205 18.103 -6.811 1.00 1.11 O ATOM 612 O5' U A 23 -9.476 17.347 -4.537 1.00 1.11 O ATOM 613 C5' U A 23 -9.660 17.099 -3.138 1.00 1.22 C ATOM 614 C4' U A 23 -8.458 16.384 -2.530 1.00 1.11 C ATOM 615 O4' U A 23 -8.256 15.133 -3.206 1.00 0.96 O ATOM 616 C3' U A 23 -7.129 17.110 -2.693 1.00 1.03 C ATOM 617 O3' U A 23 -6.948 18.092 -1.669 1.00 1.18 O ATOM 618 C2' U A 23 -6.163 15.950 -2.511 1.00 0.91 C ATOM 619 O2' U A 23 -6.101 15.551 -1.135 1.00 1.03 O ATOM 620 C1' U A 23 -6.850 14.876 -3.355 1.00 0.83 C ATOM 621 N1 U A 23 -6.492 14.958 -4.787 1.00 0.69 N ATOM 622 C2 U A 23 -5.246 14.492 -5.160 1.00 0.58 C ATOM 623 O2 U A 23 -4.446 14.022 -4.359 1.00 0.63 O ATOM 624 N3 U A 23 -4.947 14.576 -6.499 1.00 0.50 N ATOM 625 C4 U A 23 -5.765 15.075 -7.487 1.00 0.51 C ATOM 626 O4 U A 23 -5.373 15.087 -8.649 1.00 0.50 O ATOM 627 C5 U A 23 -7.051 15.544 -7.026 1.00 0.62 C ATOM 628 C6 U A 23 -7.366 15.471 -5.710 1.00 0.71 C ATOM 0 H5' U A 23 -10.556 16.496 -2.990 1.00 1.22 H new ATOM 0 H5'' U A 23 -9.823 18.044 -2.619 1.00 1.22 H new ATOM 0 H4' U A 23 -8.702 16.303 -1.471 1.00 1.11 H new ATOM 0 H3' U A 23 -7.019 17.659 -3.628 1.00 1.03 H new ATOM 0 H2' U A 23 -5.133 16.165 -2.796 1.00 0.91 H new ATOM 0 HO2' U A 23 -6.326 16.314 -0.563 1.00 1.03 H new ATOM 0 HO3' U A 23 -6.087 18.542 -1.796 1.00 1.18 H new ATOM 0 H1' U A 23 -6.546 13.883 -3.023 1.00 0.83 H new ATOM 0 H3 U A 23 -4.030 14.236 -6.788 1.00 0.50 H new ATOM 0 H5 U A 23 -7.761 15.953 -7.730 1.00 0.62 H new ATOM 0 H6 U A 23 -8.331 15.826 -5.380 1.00 0.71 H new TER 640 U A 23 HETATM 641 C1 TOA A 100 -8.579 0.170 -7.501 1.00 0.28 C HETATM 642 C2 TOA A 100 -7.933 1.522 -7.796 1.00 0.29 C HETATM 643 C3 TOA A 100 -7.149 1.429 -9.107 1.00 0.28 C HETATM 644 C4 TOA A 100 -6.134 0.282 -9.043 1.00 0.27 C HETATM 645 C5 TOA A 100 -6.844 -1.013 -8.640 1.00 0.26 C HETATM 646 C6 TOA A 100 -5.909 -2.190 -8.428 1.00 0.29 C HETATM 647 O2 TOA A 100 -8.932 2.533 -7.900 1.00 0.32 O HETATM 648 N3 TOA A 100 -6.426 2.641 -9.608 1.00 0.35 N HETATM 649 O4 TOA A 100 -5.524 0.129 -10.319 1.00 0.29 O HETATM 650 O5 TOA A 100 -7.564 -0.812 -7.407 1.00 0.28 O HETATM 651 O6 TOA A 100 -6.635 -3.406 -8.283 1.00 0.31 O HETATM 0 HN33 TOA A 100 -6.753 2.869 -10.547 1.00 0.35 H new HETATM 0 HN32 TOA A 100 -6.608 3.428 -8.985 1.00 0.35 H new HETATM 0 HN31 TOA A 100 -5.424 2.453 -9.634 1.00 0.35 H new HETATM 0 HO6 TOA A 100 -6.411 -4.011 -9.021 1.00 0.31 H new HETATM 0 HO4 TOA A 100 -4.678 -0.356 -10.221 1.00 0.29 H new HETATM 0 HO2 TOA A 100 -8.534 3.407 -7.704 1.00 0.32 H new HETATM 0 H62 TOA A 100 -5.225 -2.271 -9.273 1.00 0.29 H new HETATM 0 H61 TOA A 100 -5.300 -2.019 -7.540 1.00 0.29 H new HETATM 0 H5 TOA A 100 -7.505 -1.252 -9.473 1.00 0.26 H new HETATM 0 H4 TOA A 100 -5.368 0.507 -8.301 1.00 0.27 H new HETATM 0 H3 TOA A 100 -7.954 1.274 -9.825 1.00 0.28 H new HETATM 0 H2 TOA A 100 -7.257 1.784 -6.982 1.00 0.29 H new HETATM 665 C1 TOC A 102 -11.066 -5.154 -7.046 1.00 0.25 C HETATM 666 C2 TOC A 102 -9.832 -6.043 -7.230 1.00 0.25 C HETATM 667 C3 TOC A 102 -10.206 -7.319 -7.984 1.00 0.24 C HETATM 668 C4 TOC A 102 -11.360 -8.003 -7.269 1.00 0.29 C HETATM 669 C5 TOC A 102 -12.538 -7.047 -7.163 1.00 0.29 C HETATM 670 C6 TOC A 102 -13.700 -7.677 -6.416 1.00 0.41 C HETATM 671 N2 TOC A 102 -8.782 -5.290 -7.985 1.00 0.27 N HETATM 672 N6 TOC A 102 -14.067 -8.957 -7.120 1.00 0.46 N HETATM 673 O4 TOC A 102 -11.753 -9.171 -7.975 1.00 0.33 O HETATM 674 O5 TOC A 102 -12.138 -5.870 -6.442 1.00 0.29 O HETATM 0 HN63 TOC A 102 -14.650 -9.527 -6.507 1.00 0.46 H new HETATM 0 HN62 TOC A 102 -14.582 -8.741 -7.974 1.00 0.46 H new HETATM 0 HN61 TOC A 102 -13.218 -9.471 -7.356 1.00 0.46 H new HETATM 0 HN23 TOC A 102 -7.864 -5.505 -7.597 1.00 0.27 H new HETATM 0 HN22 TOC A 102 -8.808 -5.563 -8.968 1.00 0.27 H new HETATM 0 HN21 TOC A 102 -8.958 -4.288 -7.906 1.00 0.27 H new HETATM 0 HO4 TOC A 102 -10.963 -9.598 -8.367 1.00 0.33 H new HETATM 0 H62 TOC A 102 -13.424 -7.877 -5.381 1.00 0.41 H new HETATM 0 H61 TOC A 102 -14.552 -6.997 -6.393 1.00 0.41 H new HETATM 0 H5 TOC A 102 -12.854 -6.801 -8.177 1.00 0.29 H new HETATM 0 H4 TOC A 102 -11.034 -8.288 -6.269 1.00 0.29 H new HETATM 0 H32 TOC A 102 -10.488 -7.080 -9.009 1.00 0.24 H new HETATM 0 H31 TOC A 102 -9.348 -7.989 -8.038 1.00 0.24 H new HETATM 0 H2 TOC A 102 -9.443 -6.321 -6.250 1.00 0.25 H new HETATM 690 C1 2TB A 101 -11.803 -0.402 -9.106 1.00 0.27 C HETATM 691 C2 2TB A 101 -13.043 -1.307 -9.097 1.00 0.27 C HETATM 692 C3 2TB A 101 -12.682 -2.773 -9.304 1.00 0.25 C HETATM 693 C4 2TB A 101 -11.709 -3.182 -8.207 1.00 0.23 C HETATM 694 C5 2TB A 101 -10.409 -2.391 -8.356 1.00 0.25 C HETATM 695 C6 2TB A 101 -10.669 -0.882 -8.186 1.00 0.27 C HETATM 696 N1 2TB A 101 -12.145 1.023 -8.740 1.00 0.33 N HETATM 697 N3 2TB A 101 -13.908 -3.632 -9.308 1.00 0.31 N HETATM 698 O5 2TB A 101 -9.478 -2.845 -7.384 1.00 0.30 O HETATM 699 O4 2TB A 101 -11.436 -4.593 -8.275 1.00 0.22 O HETATM 700 O6 2TB A 101 -9.482 -0.134 -8.529 1.00 0.28 O HETATM 0 HN33 2TB A 101 -13.635 -4.615 -9.331 1.00 0.31 H new HETATM 0 HN32 2TB A 101 -14.454 -3.451 -8.465 1.00 0.31 H new HETATM 0 HN31 2TB A 101 -14.472 -3.417 -10.130 1.00 0.31 H new HETATM 0 HN13 2TB A 101 -11.803 1.652 -9.466 1.00 0.33 H new HETATM 0 HN12 2TB A 101 -13.157 1.119 -8.656 1.00 0.33 H new HETATM 0 HN11 2TB A 101 -11.706 1.261 -7.851 1.00 0.33 H new HETATM 0 HO5 2TB A 101 -8.686 -2.268 -7.396 1.00 0.30 H new HETATM 0 H6 2TB A 101 -10.947 -0.718 -7.145 1.00 0.27 H new HETATM 0 H5 2TB A 101 -10.002 -2.551 -9.355 1.00 0.25 H new HETATM 0 H4 2TB A 101 -12.158 -2.964 -7.238 1.00 0.23 H new HETATM 0 H3 2TB A 101 -12.208 -2.909 -10.276 1.00 0.25 H new HETATM 0 H22 2TB A 101 -13.568 -1.193 -8.148 1.00 0.27 H new HETATM 0 H21 2TB A 101 -13.730 -0.989 -9.881 1.00 0.27 H new HETATM 0 H1 2TB A 101 -11.443 -0.453 -10.134 1.00 0.27 H new