USER MOD reduce.3.24.130724 H: found=0, std=0, add=164, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 164 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot -17:sc= 0.273 USER MOD Single : A 1 G O5' : rot 180:sc= -0.322 USER MOD Single : A 2 G O2' : rot -5:sc= -1.09 USER MOD Single : A 3 C O2' : rot 8:sc= 0.0583 USER MOD Single : A 4 U O2' : rot -2:sc= -7.14! USER MOD Single : A 5 C O2' : rot -5:sc= -7.32! USER MOD Single : A 6 U O2' : rot 131:sc= 1.24 USER MOD Single : A 7 C O2' : rot -57:sc= 0.713 USER MOD Single : A 8 A O2' : rot 22:sc= 0.441 USER MOD Single : A 9 G O2' : rot -15:sc= 0.581 USER MOD Single : A 10 U O2' : rot -47:sc= 0.372 USER MOD Single : A 11 G O2' : rot -24:sc= 0.293 USER MOD Single : A 12 A O2' : rot -20:sc= 0.3 USER MOD Single : A 13 G O2' : rot -8:sc= -1.98! USER MOD Single : A 14 C O2' : rot 3:sc= -6.6! USER MOD Single : A 15 C O2' : rot -18:sc= 0.177 USER MOD Single : A 15 C O3' : rot 180:sc= 0.178 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -8.207 2.533 5.598 1.00 0.00 O ATOM 2 C5' G A 1 -9.382 2.522 6.412 1.00 0.00 C ATOM 3 C4' G A 1 -10.458 3.449 5.857 1.00 0.00 C ATOM 4 O4' G A 1 -10.303 4.783 6.363 1.00 0.00 O ATOM 5 C3' G A 1 -10.352 3.564 4.344 1.00 0.00 C ATOM 6 O3' G A 1 -11.263 2.630 3.757 1.00 0.00 O ATOM 7 C2' G A 1 -10.865 4.971 4.078 1.00 0.00 C ATOM 8 O2' G A 1 -12.297 5.007 4.027 1.00 0.00 O ATOM 9 C1' G A 1 -10.338 5.726 5.279 1.00 0.00 C ATOM 10 N9 G A 1 -8.998 6.290 5.009 1.00 0.00 N ATOM 11 C8 G A 1 -7.840 6.155 5.705 1.00 0.00 C ATOM 12 N7 G A 1 -6.800 6.777 5.262 1.00 0.00 N ATOM 13 C5 G A 1 -7.309 7.413 4.127 1.00 0.00 C ATOM 14 C6 G A 1 -6.657 8.261 3.191 1.00 0.00 C ATOM 15 O6 G A 1 -5.483 8.623 3.180 1.00 0.00 O ATOM 16 N1 G A 1 -7.529 8.689 2.199 1.00 0.00 N ATOM 17 C2 G A 1 -8.864 8.348 2.111 1.00 0.00 C ATOM 18 N2 G A 1 -9.535 8.862 1.080 1.00 0.00 N ATOM 19 N3 G A 1 -9.485 7.550 2.987 1.00 0.00 N ATOM 20 C4 G A 1 -8.655 7.120 3.965 1.00 0.00 C ATOM 0 H5' G A 1 -9.125 2.828 7.426 1.00 0.00 H new ATOM 0 H5'' G A 1 -9.773 1.506 6.474 1.00 0.00 H new ATOM 0 H4' G A 1 -11.414 3.019 6.158 1.00 0.00 H new ATOM 0 H3' G A 1 -9.353 3.376 3.952 1.00 0.00 H new ATOM 0 H2' G A 1 -10.543 5.382 3.121 1.00 0.00 H new ATOM 0 HO2' G A 1 -12.643 4.098 3.910 1.00 0.00 H new ATOM 0 HO5' G A 1 -7.537 1.930 5.982 1.00 0.00 H new ATOM 0 H1' G A 1 -10.977 6.575 5.523 1.00 0.00 H new ATOM 0 H8 G A 1 -7.791 5.549 6.597 1.00 0.00 H new ATOM 0 H1 G A 1 -7.153 9.305 1.478 1.00 0.00 H new ATOM 0 H21 G A 1 -10.525 8.648 0.958 1.00 0.00 H new ATOM 0 H22 G A 1 -9.058 9.469 0.413 1.00 0.00 H new ATOM 33 P G A 2 -10.730 1.508 2.733 1.00 0.00 P ATOM 34 OP1 G A 2 -11.690 0.381 2.739 1.00 0.00 O ATOM 35 OP2 G A 2 -9.299 1.260 3.019 1.00 0.00 O ATOM 36 O5' G A 2 -10.837 2.252 1.311 1.00 0.00 O ATOM 37 C5' G A 2 -12.031 2.154 0.531 1.00 0.00 C ATOM 38 C4' G A 2 -12.044 3.175 -0.601 1.00 0.00 C ATOM 39 O4' G A 2 -11.707 4.485 -0.123 1.00 0.00 O ATOM 40 C3' G A 2 -11.004 2.831 -1.659 1.00 0.00 C ATOM 41 O3' G A 2 -11.654 2.126 -2.720 1.00 0.00 O ATOM 42 C2' G A 2 -10.579 4.190 -2.179 1.00 0.00 C ATOM 43 O2' G A 2 -11.459 4.657 -3.208 1.00 0.00 O ATOM 44 C1' G A 2 -10.673 5.059 -0.936 1.00 0.00 C ATOM 45 N9 G A 2 -9.386 5.111 -0.210 1.00 0.00 N ATOM 46 C8 G A 2 -9.060 4.641 1.024 1.00 0.00 C ATOM 47 N7 G A 2 -7.851 4.832 1.435 1.00 0.00 N ATOM 48 C5 G A 2 -7.285 5.515 0.353 1.00 0.00 C ATOM 49 C6 G A 2 -5.964 6.015 0.181 1.00 0.00 C ATOM 50 O6 G A 2 -5.017 5.950 0.962 1.00 0.00 O ATOM 51 N1 G A 2 -5.810 6.638 -1.051 1.00 0.00 N ATOM 52 C2 G A 2 -6.802 6.768 -2.005 1.00 0.00 C ATOM 53 N2 G A 2 -6.461 7.401 -3.127 1.00 0.00 N ATOM 54 N3 G A 2 -8.045 6.301 -1.850 1.00 0.00 N ATOM 55 C4 G A 2 -8.218 5.690 -0.657 1.00 0.00 C ATOM 0 H5' G A 2 -12.899 2.308 1.172 1.00 0.00 H new ATOM 0 H5'' G A 2 -12.115 1.149 0.117 1.00 0.00 H new ATOM 0 H4' G A 2 -13.052 3.156 -1.016 1.00 0.00 H new ATOM 0 H3' G A 2 -10.179 2.225 -1.283 1.00 0.00 H new ATOM 0 H2' G A 2 -9.590 4.189 -2.637 1.00 0.00 H new ATOM 0 HO2' G A 2 -12.117 3.962 -3.416 1.00 0.00 H new ATOM 0 H1' G A 2 -10.906 6.091 -1.200 1.00 0.00 H new ATOM 0 H8 G A 2 -9.785 4.127 1.637 1.00 0.00 H new ATOM 0 H1 G A 2 -4.894 7.030 -1.269 1.00 0.00 H new ATOM 0 H21 G A 2 -7.149 7.529 -3.869 1.00 0.00 H new ATOM 0 H22 G A 2 -5.512 7.757 -3.243 1.00 0.00 H new ATOM 67 P C A 3 -10.940 0.858 -3.408 1.00 0.00 P ATOM 68 OP1 C A 3 -11.920 0.203 -4.304 1.00 0.00 O ATOM 69 OP2 C A 3 -10.271 0.072 -2.347 1.00 0.00 O ATOM 70 O5' C A 3 -9.803 1.545 -4.318 1.00 0.00 O ATOM 71 C5' C A 3 -10.151 2.557 -5.268 1.00 0.00 C ATOM 72 C4' C A 3 -8.915 3.177 -5.915 1.00 0.00 C ATOM 73 O4' C A 3 -8.280 4.116 -5.051 1.00 0.00 O ATOM 74 C3' C A 3 -7.854 2.134 -6.199 1.00 0.00 C ATOM 75 O3' C A 3 -8.102 1.563 -7.487 1.00 0.00 O ATOM 76 C2' C A 3 -6.584 2.966 -6.276 1.00 0.00 C ATOM 77 O2' C A 3 -6.361 3.458 -7.603 1.00 0.00 O ATOM 78 C1' C A 3 -6.864 4.111 -5.296 1.00 0.00 C ATOM 79 N1 C A 3 -6.109 3.919 -4.045 1.00 0.00 N ATOM 80 C2 C A 3 -4.768 4.266 -4.050 1.00 0.00 C ATOM 81 O2 C A 3 -4.263 4.756 -5.057 1.00 0.00 O ATOM 82 N3 C A 3 -4.042 4.050 -2.918 1.00 0.00 N ATOM 83 C4 C A 3 -4.611 3.518 -1.828 1.00 0.00 C ATOM 84 N4 C A 3 -3.869 3.313 -0.739 1.00 0.00 N ATOM 85 C5 C A 3 -5.997 3.163 -1.821 1.00 0.00 C ATOM 86 C6 C A 3 -6.705 3.381 -2.943 1.00 0.00 C ATOM 0 H5' C A 3 -10.731 3.336 -4.773 1.00 0.00 H new ATOM 0 H5'' C A 3 -10.788 2.127 -6.040 1.00 0.00 H new ATOM 0 H4' C A 3 -9.279 3.649 -6.827 1.00 0.00 H new ATOM 0 H3' C A 3 -7.817 1.329 -5.465 1.00 0.00 H new ATOM 0 H2' C A 3 -5.685 2.400 -6.030 1.00 0.00 H new ATOM 0 HO2' C A 3 -7.141 3.258 -8.161 1.00 0.00 H new ATOM 0 H1' C A 3 -6.546 5.067 -5.712 1.00 0.00 H new ATOM 0 H41 C A 3 -4.291 2.909 0.097 1.00 0.00 H new ATOM 0 H42 C A 3 -2.880 3.561 -0.742 1.00 0.00 H new ATOM 0 H5 C A 3 -6.459 2.734 -0.944 1.00 0.00 H new ATOM 0 H6 C A 3 -7.755 3.128 -2.972 1.00 0.00 H new ATOM 98 P U A 4 -7.636 0.055 -7.813 1.00 0.00 P ATOM 99 OP1 U A 4 -8.251 -0.353 -9.096 1.00 0.00 O ATOM 100 OP2 U A 4 -7.844 -0.767 -6.600 1.00 0.00 O ATOM 101 O5' U A 4 -6.051 0.216 -8.046 1.00 0.00 O ATOM 102 C5' U A 4 -5.554 0.955 -9.165 1.00 0.00 C ATOM 103 C4' U A 4 -4.167 1.528 -8.892 1.00 0.00 C ATOM 104 O4' U A 4 -4.052 2.002 -7.553 1.00 0.00 O ATOM 105 C3' U A 4 -3.091 0.467 -9.019 1.00 0.00 C ATOM 106 O3' U A 4 -2.648 0.424 -10.378 1.00 0.00 O ATOM 107 C2' U A 4 -1.960 1.023 -8.166 1.00 0.00 C ATOM 108 O2' U A 4 -1.068 1.830 -8.945 1.00 0.00 O ATOM 109 C1' U A 4 -2.691 1.863 -7.114 1.00 0.00 C ATOM 110 N1 U A 4 -2.619 1.215 -5.791 1.00 0.00 N ATOM 111 C2 U A 4 -1.505 1.481 -5.022 1.00 0.00 C ATOM 112 O2 U A 4 -0.612 2.234 -5.403 1.00 0.00 O ATOM 113 N3 U A 4 -1.450 0.853 -3.793 1.00 0.00 N ATOM 114 C4 U A 4 -2.402 -0.010 -3.274 1.00 0.00 C ATOM 115 O4 U A 4 -2.251 -0.518 -2.166 1.00 0.00 O ATOM 116 C5 U A 4 -3.534 -0.230 -4.145 1.00 0.00 C ATOM 117 C6 U A 4 -3.609 0.377 -5.355 1.00 0.00 C ATOM 0 H5' U A 4 -6.243 1.766 -9.400 1.00 0.00 H new ATOM 0 H5'' U A 4 -5.514 0.307 -10.040 1.00 0.00 H new ATOM 0 H4' U A 4 -4.039 2.328 -9.621 1.00 0.00 H new ATOM 0 H3' U A 4 -3.422 -0.529 -8.724 1.00 0.00 H new ATOM 0 H2' U A 4 -1.335 0.243 -7.730 1.00 0.00 H new ATOM 0 HO2' U A 4 -1.361 1.832 -9.880 1.00 0.00 H new ATOM 0 H1' U A 4 -2.227 2.844 -7.009 1.00 0.00 H new ATOM 0 H3 U A 4 -0.632 1.042 -3.213 1.00 0.00 H new ATOM 0 H5 U A 4 -4.331 -0.887 -3.828 1.00 0.00 H new ATOM 0 H6 U A 4 -4.466 0.196 -5.987 1.00 0.00 H new ATOM 128 P C A 5 -1.577 -0.681 -10.852 1.00 0.00 P ATOM 129 OP1 C A 5 -0.998 -0.242 -12.141 1.00 0.00 O ATOM 130 OP2 C A 5 -2.211 -2.014 -10.744 1.00 0.00 O ATOM 131 O5' C A 5 -0.432 -0.575 -9.723 1.00 0.00 O ATOM 132 C5' C A 5 0.656 0.341 -9.879 1.00 0.00 C ATOM 133 C4' C A 5 1.866 -0.073 -9.045 1.00 0.00 C ATOM 134 O4' C A 5 1.646 0.153 -7.657 1.00 0.00 O ATOM 135 C3' C A 5 2.132 -1.561 -9.156 1.00 0.00 C ATOM 136 O3' C A 5 3.002 -1.795 -10.266 1.00 0.00 O ATOM 137 C2' C A 5 2.897 -1.869 -7.878 1.00 0.00 C ATOM 138 O2' C A 5 4.311 -1.755 -8.076 1.00 0.00 O ATOM 139 C1' C A 5 2.388 -0.812 -6.894 1.00 0.00 C ATOM 140 N1 C A 5 1.548 -1.431 -5.852 1.00 0.00 N ATOM 141 C2 C A 5 2.111 -1.589 -4.597 1.00 0.00 C ATOM 142 O2 C A 5 3.257 -1.198 -4.386 1.00 0.00 O ATOM 143 N3 C A 5 1.367 -2.180 -3.625 1.00 0.00 N ATOM 144 C4 C A 5 0.119 -2.601 -3.871 1.00 0.00 C ATOM 145 N4 C A 5 -0.580 -3.177 -2.893 1.00 0.00 N ATOM 146 C5 C A 5 -0.468 -2.439 -5.168 1.00 0.00 C ATOM 147 C6 C A 5 0.278 -1.852 -6.123 1.00 0.00 C ATOM 0 H5' C A 5 0.336 1.340 -9.584 1.00 0.00 H new ATOM 0 H5'' C A 5 0.939 0.394 -10.930 1.00 0.00 H new ATOM 0 H4' C A 5 2.696 0.521 -9.428 1.00 0.00 H new ATOM 0 H3' C A 5 1.228 -2.155 -9.288 1.00 0.00 H new ATOM 0 H2' C A 5 2.738 -2.888 -7.526 1.00 0.00 H new ATOM 0 HO2' C A 5 4.496 -1.587 -9.024 1.00 0.00 H new ATOM 0 H1' C A 5 3.219 -0.329 -6.379 1.00 0.00 H new ATOM 0 H41 C A 5 -1.531 -3.501 -3.069 1.00 0.00 H new ATOM 0 H42 C A 5 -0.164 -3.293 -1.969 1.00 0.00 H new ATOM 0 H5 C A 5 -1.474 -2.776 -5.372 1.00 0.00 H new ATOM 0 H6 C A 5 -0.132 -1.713 -7.112 1.00 0.00 H new ATOM 159 P U A 6 3.196 -3.285 -10.847 1.00 0.00 P ATOM 160 OP1 U A 6 4.410 -3.298 -11.697 1.00 0.00 O ATOM 161 OP2 U A 6 1.902 -3.736 -11.406 1.00 0.00 O ATOM 162 O5' U A 6 3.502 -4.148 -9.521 1.00 0.00 O ATOM 163 C5' U A 6 4.757 -4.021 -8.849 1.00 0.00 C ATOM 164 C4' U A 6 4.752 -4.725 -7.494 1.00 0.00 C ATOM 165 O4' U A 6 3.512 -4.559 -6.817 1.00 0.00 O ATOM 166 C3' U A 6 4.902 -6.225 -7.648 1.00 0.00 C ATOM 167 O3' U A 6 6.297 -6.541 -7.657 1.00 0.00 O ATOM 168 C2' U A 6 4.297 -6.766 -6.360 1.00 0.00 C ATOM 169 O2' U A 6 5.299 -6.960 -5.356 1.00 0.00 O ATOM 170 C1' U A 6 3.298 -5.681 -5.946 1.00 0.00 C ATOM 171 N1 U A 6 1.918 -6.185 -6.050 1.00 0.00 N ATOM 172 C2 U A 6 1.431 -6.928 -4.990 1.00 0.00 C ATOM 173 O2 U A 6 2.102 -7.149 -3.983 1.00 0.00 O ATOM 174 N3 U A 6 0.143 -7.409 -5.126 1.00 0.00 N ATOM 175 C4 U A 6 -0.690 -7.215 -6.216 1.00 0.00 C ATOM 176 O4 U A 6 -1.822 -7.694 -6.233 1.00 0.00 O ATOM 177 C5 U A 6 -0.100 -6.427 -7.274 1.00 0.00 C ATOM 178 C6 U A 6 1.160 -5.945 -7.163 1.00 0.00 C ATOM 0 H5' U A 6 4.988 -2.965 -8.708 1.00 0.00 H new ATOM 0 H5'' U A 6 5.547 -4.440 -9.473 1.00 0.00 H new ATOM 0 H4' U A 6 5.580 -4.281 -6.942 1.00 0.00 H new ATOM 0 H3' U A 6 4.442 -6.622 -8.553 1.00 0.00 H new ATOM 0 H2' U A 6 3.829 -7.742 -6.492 1.00 0.00 H new ATOM 0 HO2' U A 6 5.004 -6.551 -4.516 1.00 0.00 H new ATOM 0 H1' U A 6 3.447 -5.386 -4.907 1.00 0.00 H new ATOM 0 H3 U A 6 -0.230 -7.958 -4.351 1.00 0.00 H new ATOM 0 H5 U A 6 -0.673 -6.220 -8.166 1.00 0.00 H new ATOM 0 H6 U A 6 1.575 -5.359 -7.970 1.00 0.00 H new ATOM 189 P C A 7 6.802 -8.004 -8.102 1.00 0.00 P ATOM 190 OP1 C A 7 7.856 -7.838 -9.127 1.00 0.00 O ATOM 191 OP2 C A 7 5.612 -8.836 -8.395 1.00 0.00 O ATOM 192 O5' C A 7 7.490 -8.563 -6.759 1.00 0.00 O ATOM 193 C5' C A 7 8.853 -8.995 -6.769 1.00 0.00 C ATOM 194 C4' C A 7 9.579 -8.602 -5.486 1.00 0.00 C ATOM 195 O4' C A 7 10.456 -7.491 -5.710 1.00 0.00 O ATOM 196 C3' C A 7 8.591 -8.165 -4.411 1.00 0.00 C ATOM 197 O3' C A 7 9.114 -8.553 -3.137 1.00 0.00 O ATOM 198 C2' C A 7 8.609 -6.647 -4.489 1.00 0.00 C ATOM 199 O2' C A 7 8.337 -6.052 -3.216 1.00 0.00 O ATOM 200 C1' C A 7 10.030 -6.353 -4.949 1.00 0.00 C ATOM 201 N1 C A 7 10.075 -5.128 -5.767 1.00 0.00 N ATOM 202 C2 C A 7 9.669 -3.945 -5.168 1.00 0.00 C ATOM 203 O2 C A 7 9.294 -3.945 -3.998 1.00 0.00 O ATOM 204 N3 C A 7 9.700 -2.804 -5.909 1.00 0.00 N ATOM 205 C4 C A 7 10.112 -2.823 -7.184 1.00 0.00 C ATOM 206 N4 C A 7 10.130 -1.687 -7.882 1.00 0.00 N ATOM 207 C5 C A 7 10.532 -4.042 -7.805 1.00 0.00 C ATOM 208 C6 C A 7 10.498 -5.165 -7.063 1.00 0.00 C ATOM 0 H5' C A 7 9.367 -8.559 -7.626 1.00 0.00 H new ATOM 0 H5'' C A 7 8.891 -10.077 -6.892 1.00 0.00 H new ATOM 0 H4' C A 7 10.139 -9.481 -5.167 1.00 0.00 H new ATOM 0 H3' C A 7 7.597 -8.592 -4.541 1.00 0.00 H new ATOM 0 H2' C A 7 7.847 -6.241 -5.154 1.00 0.00 H new ATOM 0 HO2' C A 7 7.469 -6.367 -2.887 1.00 0.00 H new ATOM 0 H1' C A 7 10.689 -6.184 -4.097 1.00 0.00 H new ATOM 0 H41 C A 7 10.442 -1.690 -8.853 1.00 0.00 H new ATOM 0 H42 C A 7 9.832 -0.815 -7.445 1.00 0.00 H new ATOM 0 H5 C A 7 10.864 -4.061 -8.832 1.00 0.00 H new ATOM 0 H6 C A 7 10.808 -6.103 -7.498 1.00 0.00 H new ATOM 220 P A A 8 8.422 -9.741 -2.299 1.00 0.00 P ATOM 221 OP1 A A 8 8.277 -9.293 -0.895 1.00 0.00 O ATOM 222 OP2 A A 8 9.139 -11.000 -2.600 1.00 0.00 O ATOM 223 O5' A A 8 6.954 -9.827 -2.955 1.00 0.00 O ATOM 224 C5' A A 8 6.388 -11.092 -3.310 1.00 0.00 C ATOM 225 C4' A A 8 4.969 -11.244 -2.751 1.00 0.00 C ATOM 226 O4' A A 8 4.033 -10.478 -3.516 1.00 0.00 O ATOM 227 C3' A A 8 4.493 -12.697 -2.790 1.00 0.00 C ATOM 228 O3' A A 8 3.810 -12.958 -1.562 1.00 0.00 O ATOM 229 C2' A A 8 3.465 -12.759 -3.918 1.00 0.00 C ATOM 230 O2' A A 8 2.365 -13.604 -3.562 1.00 0.00 O ATOM 231 C1' A A 8 3.013 -11.314 -4.082 1.00 0.00 C ATOM 232 N9 A A 8 2.802 -10.985 -5.505 1.00 0.00 N ATOM 233 C8 A A 8 3.608 -10.319 -6.370 1.00 0.00 C ATOM 234 N7 A A 8 3.170 -10.128 -7.568 1.00 0.00 N ATOM 235 C5 A A 8 1.914 -10.740 -7.509 1.00 0.00 C ATOM 236 C6 A A 8 0.897 -10.905 -8.454 1.00 0.00 C ATOM 237 N6 A A 8 0.982 -10.447 -9.703 1.00 0.00 N ATOM 238 N1 A A 8 -0.211 -11.558 -8.063 1.00 0.00 N ATOM 239 C2 A A 8 -0.317 -12.024 -6.818 1.00 0.00 C ATOM 240 N3 A A 8 0.582 -11.923 -5.843 1.00 0.00 N ATOM 241 C4 A A 8 1.683 -11.264 -6.258 1.00 0.00 C ATOM 0 H5' A A 8 7.019 -11.895 -2.929 1.00 0.00 H new ATOM 0 H5'' A A 8 6.366 -11.191 -4.395 1.00 0.00 H new ATOM 0 H4' A A 8 5.013 -10.892 -1.720 1.00 0.00 H new ATOM 0 H3' A A 8 5.310 -13.404 -2.932 1.00 0.00 H new ATOM 0 H2' A A 8 3.875 -13.177 -4.838 1.00 0.00 H new ATOM 0 HO2' A A 8 2.316 -13.684 -2.586 1.00 0.00 H new ATOM 0 H1' A A 8 2.062 -11.156 -3.573 1.00 0.00 H new ATOM 0 H8 A A 8 4.581 -9.962 -6.066 1.00 0.00 H new ATOM 0 H61 A A 8 0.211 -10.594 -10.354 1.00 0.00 H new ATOM 0 H62 A A 8 1.819 -9.949 -10.008 1.00 0.00 H new ATOM 0 H2 A A 8 -1.234 -12.540 -6.575 1.00 0.00 H new ATOM 253 P G A 9 4.631 -13.035 -0.181 1.00 0.00 P ATOM 254 OP1 G A 9 5.910 -13.732 -0.442 1.00 0.00 O ATOM 255 OP2 G A 9 3.720 -13.531 0.874 1.00 0.00 O ATOM 256 O5' G A 9 4.953 -11.485 0.113 1.00 0.00 O ATOM 257 C5' G A 9 4.184 -10.749 1.069 1.00 0.00 C ATOM 258 C4' G A 9 5.046 -10.317 2.260 1.00 0.00 C ATOM 259 O4' G A 9 6.385 -10.064 1.825 1.00 0.00 O ATOM 260 C3' G A 9 4.529 -9.023 2.905 1.00 0.00 C ATOM 261 O3' G A 9 4.071 -9.345 4.221 1.00 0.00 O ATOM 262 C2' G A 9 5.772 -8.141 3.080 1.00 0.00 C ATOM 263 O2' G A 9 6.272 -8.219 4.419 1.00 0.00 O ATOM 264 C1' G A 9 6.772 -8.713 2.092 1.00 0.00 C ATOM 265 N9 G A 9 6.811 -7.895 0.865 1.00 0.00 N ATOM 266 C8 G A 9 7.760 -7.020 0.456 1.00 0.00 C ATOM 267 N7 G A 9 7.558 -6.387 -0.648 1.00 0.00 N ATOM 268 C5 G A 9 6.317 -6.892 -1.043 1.00 0.00 C ATOM 269 C6 G A 9 5.538 -6.588 -2.191 1.00 0.00 C ATOM 270 O6 G A 9 5.794 -5.800 -3.099 1.00 0.00 O ATOM 271 N1 G A 9 4.356 -7.313 -2.210 1.00 0.00 N ATOM 272 C2 G A 9 3.963 -8.220 -1.249 1.00 0.00 C ATOM 273 N2 G A 9 2.788 -8.814 -1.452 1.00 0.00 N ATOM 274 N3 G A 9 4.689 -8.514 -0.162 1.00 0.00 N ATOM 275 C4 G A 9 5.849 -7.818 -0.121 1.00 0.00 C ATOM 0 H5' G A 9 3.354 -11.362 1.421 1.00 0.00 H new ATOM 0 H5'' G A 9 3.751 -9.870 0.592 1.00 0.00 H new ATOM 0 H4' G A 9 5.005 -11.128 2.987 1.00 0.00 H new ATOM 0 H3' G A 9 3.740 -8.552 2.319 1.00 0.00 H new ATOM 0 H2' G A 9 5.564 -7.086 2.901 1.00 0.00 H new ATOM 0 HO2' G A 9 5.591 -8.619 5.000 1.00 0.00 H new ATOM 0 H1' G A 9 7.782 -8.698 2.503 1.00 0.00 H new ATOM 0 H8 G A 9 8.657 -6.858 1.036 1.00 0.00 H new ATOM 0 H1 G A 9 3.727 -7.163 -2.999 1.00 0.00 H new ATOM 0 H21 G A 9 2.438 -9.496 -0.779 1.00 0.00 H new ATOM 0 H22 G A 9 2.238 -8.587 -2.281 1.00 0.00 H new ATOM 287 P U A 10 2.519 -9.172 4.620 1.00 0.00 P ATOM 288 OP1 U A 10 2.192 -10.181 5.652 1.00 0.00 O ATOM 289 OP2 U A 10 1.723 -9.107 3.373 1.00 0.00 O ATOM 290 O5' U A 10 2.488 -7.718 5.312 1.00 0.00 O ATOM 291 C5' U A 10 1.421 -7.360 6.197 1.00 0.00 C ATOM 292 C4' U A 10 0.734 -6.069 5.759 1.00 0.00 C ATOM 293 O4' U A 10 -0.692 -6.189 5.839 1.00 0.00 O ATOM 294 C3' U A 10 1.114 -4.906 6.669 1.00 0.00 C ATOM 295 O3' U A 10 1.073 -3.703 5.899 1.00 0.00 O ATOM 296 C2' U A 10 -0.023 -4.860 7.680 1.00 0.00 C ATOM 297 O2' U A 10 -0.213 -3.537 8.193 1.00 0.00 O ATOM 298 C1' U A 10 -1.213 -5.308 6.845 1.00 0.00 C ATOM 299 N1 U A 10 -2.213 -6.000 7.676 1.00 0.00 N ATOM 300 C2 U A 10 -3.206 -5.232 8.254 1.00 0.00 C ATOM 301 O2 U A 10 -3.269 -4.014 8.095 1.00 0.00 O ATOM 302 N3 U A 10 -4.132 -5.916 9.023 1.00 0.00 N ATOM 303 C4 U A 10 -4.147 -7.279 9.260 1.00 0.00 C ATOM 304 O4 U A 10 -5.021 -7.784 9.963 1.00 0.00 O ATOM 305 C5 U A 10 -3.072 -8.001 8.617 1.00 0.00 C ATOM 306 C6 U A 10 -2.155 -7.353 7.860 1.00 0.00 C ATOM 0 H5' U A 10 1.811 -7.240 7.208 1.00 0.00 H new ATOM 0 H5'' U A 10 0.690 -8.168 6.231 1.00 0.00 H new ATOM 0 H4' U A 10 1.057 -5.887 4.734 1.00 0.00 H new ATOM 0 H3' U A 10 2.100 -5.011 7.122 1.00 0.00 H new ATOM 0 H2' U A 10 0.150 -5.478 8.561 1.00 0.00 H new ATOM 0 HO2' U A 10 0.653 -3.160 8.453 1.00 0.00 H new ATOM 0 H1' U A 10 -1.719 -4.452 6.398 1.00 0.00 H new ATOM 0 H3 U A 10 -4.872 -5.363 9.455 1.00 0.00 H new ATOM 0 H5 U A 10 -2.999 -9.071 8.742 1.00 0.00 H new ATOM 0 H6 U A 10 -1.362 -7.917 7.392 1.00 0.00 H new ATOM 317 P G A 11 1.875 -2.395 6.387 1.00 0.00 P ATOM 318 OP1 G A 11 2.267 -2.595 7.800 1.00 0.00 O ATOM 319 OP2 G A 11 1.096 -1.198 5.998 1.00 0.00 O ATOM 320 O5' G A 11 3.206 -2.446 5.486 1.00 0.00 O ATOM 321 C5' G A 11 4.332 -3.217 5.908 1.00 0.00 C ATOM 322 C4' G A 11 5.515 -3.045 4.962 1.00 0.00 C ATOM 323 O4' G A 11 5.700 -4.216 4.153 1.00 0.00 O ATOM 324 C3' G A 11 5.279 -1.888 3.993 1.00 0.00 C ATOM 325 O3' G A 11 6.026 -0.755 4.449 1.00 0.00 O ATOM 326 C2' G A 11 5.895 -2.386 2.699 1.00 0.00 C ATOM 327 O2' G A 11 7.305 -2.140 2.655 1.00 0.00 O ATOM 328 C1' G A 11 5.588 -3.870 2.768 1.00 0.00 C ATOM 329 N9 G A 11 4.232 -4.150 2.260 1.00 0.00 N ATOM 330 C8 G A 11 3.204 -4.807 2.851 1.00 0.00 C ATOM 331 N7 G A 11 2.099 -4.908 2.189 1.00 0.00 N ATOM 332 C5 G A 11 2.415 -4.239 1.003 1.00 0.00 C ATOM 333 C6 G A 11 1.616 -3.999 -0.147 1.00 0.00 C ATOM 334 O6 G A 11 0.451 -4.336 -0.350 1.00 0.00 O ATOM 335 N1 G A 11 2.315 -3.289 -1.115 1.00 0.00 N ATOM 336 C2 G A 11 3.623 -2.861 -0.996 1.00 0.00 C ATOM 337 N2 G A 11 4.122 -2.192 -2.035 1.00 0.00 N ATOM 338 N3 G A 11 4.381 -3.082 0.083 1.00 0.00 N ATOM 339 C4 G A 11 3.720 -3.771 1.038 1.00 0.00 C ATOM 0 H5' G A 11 4.055 -4.270 5.958 1.00 0.00 H new ATOM 0 H5'' G A 11 4.623 -2.916 6.914 1.00 0.00 H new ATOM 0 H4' G A 11 6.386 -2.859 5.590 1.00 0.00 H new ATOM 0 H3' G A 11 4.231 -1.603 3.896 1.00 0.00 H new ATOM 0 H2' G A 11 5.508 -1.894 1.807 1.00 0.00 H new ATOM 0 HO2' G A 11 7.526 -1.393 3.250 1.00 0.00 H new ATOM 0 H1' G A 11 6.271 -4.454 2.151 1.00 0.00 H new ATOM 0 H8 G A 11 3.305 -5.231 3.839 1.00 0.00 H new ATOM 0 H1 G A 11 1.824 -3.066 -1.981 1.00 0.00 H new ATOM 0 H21 G A 11 5.082 -1.850 -2.008 1.00 0.00 H new ATOM 0 H22 G A 11 3.543 -2.022 -2.858 1.00 0.00 H new ATOM 351 P A A 12 5.266 0.579 4.941 1.00 0.00 P ATOM 352 OP1 A A 12 6.071 1.200 6.017 1.00 0.00 O ATOM 353 OP2 A A 12 3.846 0.240 5.183 1.00 0.00 O ATOM 354 O5' A A 12 5.344 1.529 3.643 1.00 0.00 O ATOM 355 C5' A A 12 6.479 2.371 3.431 1.00 0.00 C ATOM 356 C4' A A 12 6.743 2.596 1.945 1.00 0.00 C ATOM 357 O4' A A 12 6.521 1.396 1.198 1.00 0.00 O ATOM 358 C3' A A 12 5.786 3.617 1.352 1.00 0.00 C ATOM 359 O3' A A 12 6.382 4.916 1.446 1.00 0.00 O ATOM 360 C2' A A 12 5.753 3.214 -0.113 1.00 0.00 C ATOM 361 O2' A A 12 6.867 3.752 -0.832 1.00 0.00 O ATOM 362 C1' A A 12 5.827 1.699 -0.025 1.00 0.00 C ATOM 363 N9 A A 12 4.470 1.122 -0.038 1.00 0.00 N ATOM 364 C8 A A 12 3.871 0.283 0.841 1.00 0.00 C ATOM 365 N7 A A 12 2.668 -0.104 0.571 1.00 0.00 N ATOM 366 C5 A A 12 2.426 0.556 -0.638 1.00 0.00 C ATOM 367 C6 A A 12 1.320 0.588 -1.496 1.00 0.00 C ATOM 368 N6 A A 12 0.198 -0.093 -1.264 1.00 0.00 N ATOM 369 N1 A A 12 1.419 1.345 -2.605 1.00 0.00 N ATOM 370 C2 A A 12 2.536 2.030 -2.859 1.00 0.00 C ATOM 371 N3 A A 12 3.639 2.069 -2.117 1.00 0.00 N ATOM 372 C4 A A 12 3.516 1.304 -1.013 1.00 0.00 C ATOM 0 H5' A A 12 7.358 1.921 3.893 1.00 0.00 H new ATOM 0 H5'' A A 12 6.317 3.331 3.922 1.00 0.00 H new ATOM 0 H4' A A 12 7.777 2.935 1.879 1.00 0.00 H new ATOM 0 H3' A A 12 4.810 3.646 1.836 1.00 0.00 H new ATOM 0 H2' A A 12 4.878 3.581 -0.649 1.00 0.00 H new ATOM 0 HO2' A A 12 7.241 4.510 -0.336 1.00 0.00 H new ATOM 0 H1' A A 12 6.355 1.270 -0.876 1.00 0.00 H new ATOM 0 H8 A A 12 4.380 -0.050 1.734 1.00 0.00 H new ATOM 0 H61 A A 12 -0.579 -0.035 -1.922 1.00 0.00 H new ATOM 0 H62 A A 12 0.117 -0.672 -0.428 1.00 0.00 H new ATOM 0 H2 A A 12 2.545 2.616 -3.766 1.00 0.00 H new ATOM 384 P G A 13 5.475 6.205 1.783 1.00 0.00 P ATOM 385 OP1 G A 13 6.360 7.265 2.313 1.00 0.00 O ATOM 386 OP2 G A 13 4.308 5.755 2.575 1.00 0.00 O ATOM 387 O5' G A 13 4.950 6.665 0.331 1.00 0.00 O ATOM 388 C5' G A 13 5.675 7.638 -0.427 1.00 0.00 C ATOM 389 C4' G A 13 5.111 7.796 -1.839 1.00 0.00 C ATOM 390 O4' G A 13 4.815 6.523 -2.432 1.00 0.00 O ATOM 391 C3' G A 13 3.798 8.566 -1.829 1.00 0.00 C ATOM 392 O3' G A 13 4.075 9.944 -2.089 1.00 0.00 O ATOM 393 C2' G A 13 3.068 7.986 -3.025 1.00 0.00 C ATOM 394 O2' G A 13 3.503 8.585 -4.253 1.00 0.00 O ATOM 395 C1' G A 13 3.472 6.526 -2.941 1.00 0.00 C ATOM 396 N9 G A 13 2.561 5.793 -2.044 1.00 0.00 N ATOM 397 C8 G A 13 2.789 5.292 -0.805 1.00 0.00 C ATOM 398 N7 G A 13 1.806 4.711 -0.205 1.00 0.00 N ATOM 399 C5 G A 13 0.784 4.828 -1.151 1.00 0.00 C ATOM 400 C6 G A 13 -0.565 4.384 -1.094 1.00 0.00 C ATOM 401 O6 G A 13 -1.133 3.787 -0.182 1.00 0.00 O ATOM 402 N1 G A 13 -1.256 4.705 -2.257 1.00 0.00 N ATOM 403 C2 G A 13 -0.722 5.371 -3.343 1.00 0.00 C ATOM 404 N2 G A 13 -1.546 5.589 -4.366 1.00 0.00 N ATOM 405 N3 G A 13 0.546 5.792 -3.403 1.00 0.00 N ATOM 406 C4 G A 13 1.240 5.490 -2.282 1.00 0.00 C ATOM 0 H5' G A 13 6.723 7.345 -0.485 1.00 0.00 H new ATOM 0 H5'' G A 13 5.640 8.598 0.087 1.00 0.00 H new ATOM 0 H4' G A 13 5.877 8.326 -2.405 1.00 0.00 H new ATOM 0 H3' G A 13 3.246 8.493 -0.892 1.00 0.00 H new ATOM 0 H2' G A 13 1.991 8.152 -3.012 1.00 0.00 H new ATOM 0 HO2' G A 13 4.090 9.345 -4.056 1.00 0.00 H new ATOM 0 H1' G A 13 3.418 6.031 -3.911 1.00 0.00 H new ATOM 0 H8 G A 13 3.759 5.376 -0.337 1.00 0.00 H new ATOM 0 H1 G A 13 -2.236 4.426 -2.313 1.00 0.00 H new ATOM 0 H21 G A 13 -1.210 6.076 -5.197 1.00 0.00 H new ATOM 0 H22 G A 13 -2.513 5.269 -4.319 1.00 0.00 H new ATOM 418 P C A 14 3.229 11.102 -1.354 1.00 0.00 P ATOM 419 OP1 C A 14 3.921 12.392 -1.574 1.00 0.00 O ATOM 420 OP2 C A 14 2.923 10.653 0.023 1.00 0.00 O ATOM 421 O5' C A 14 1.856 11.118 -2.195 1.00 0.00 O ATOM 422 C5' C A 14 1.883 11.159 -3.624 1.00 0.00 C ATOM 423 C4' C A 14 0.480 11.084 -4.217 1.00 0.00 C ATOM 424 O4' C A 14 0.022 9.732 -4.300 1.00 0.00 O ATOM 425 C3' C A 14 -0.528 11.800 -3.338 1.00 0.00 C ATOM 426 O3' C A 14 -0.636 13.156 -3.780 1.00 0.00 O ATOM 427 C2' C A 14 -1.829 11.087 -3.661 1.00 0.00 C ATOM 428 O2' C A 14 -2.471 11.661 -4.805 1.00 0.00 O ATOM 429 C1' C A 14 -1.367 9.658 -3.940 1.00 0.00 C ATOM 430 N1 C A 14 -1.563 8.803 -2.753 1.00 0.00 N ATOM 431 C2 C A 14 -2.787 8.165 -2.625 1.00 0.00 C ATOM 432 O2 C A 14 -3.652 8.316 -3.483 1.00 0.00 O ATOM 433 N3 C A 14 -2.994 7.379 -1.533 1.00 0.00 N ATOM 434 C4 C A 14 -2.040 7.225 -0.606 1.00 0.00 C ATOM 435 N4 C A 14 -2.273 6.447 0.450 1.00 0.00 N ATOM 436 C5 C A 14 -0.776 7.881 -0.734 1.00 0.00 C ATOM 437 C6 C A 14 -0.581 8.657 -1.818 1.00 0.00 C ATOM 0 H5' C A 14 2.482 10.330 -4.001 1.00 0.00 H new ATOM 0 H5'' C A 14 2.368 12.078 -3.953 1.00 0.00 H new ATOM 0 H4' C A 14 0.550 11.544 -5.203 1.00 0.00 H new ATOM 0 H3' C A 14 -0.270 11.794 -2.279 1.00 0.00 H new ATOM 0 H2' C A 14 -2.568 11.155 -2.862 1.00 0.00 H new ATOM 0 HO2' C A 14 -1.907 12.372 -5.174 1.00 0.00 H new ATOM 0 H1' C A 14 -1.949 9.212 -4.746 1.00 0.00 H new ATOM 0 H41 C A 14 -1.553 6.324 1.161 1.00 0.00 H new ATOM 0 H42 C A 14 -3.172 5.975 0.547 1.00 0.00 H new ATOM 0 H5 C A 14 -0.005 7.759 0.012 1.00 0.00 H new ATOM 0 H6 C A 14 0.362 9.168 -1.948 1.00 0.00 H new ATOM 449 P C A 15 -1.584 14.197 -2.999 1.00 0.00 P ATOM 450 OP1 C A 15 -1.643 15.449 -3.787 1.00 0.00 O ATOM 451 OP2 C A 15 -1.160 14.237 -1.582 1.00 0.00 O ATOM 452 O5' C A 15 -3.027 13.486 -3.073 1.00 0.00 O ATOM 453 C5' C A 15 -3.861 13.654 -4.223 1.00 0.00 C ATOM 454 C4' C A 15 -5.338 13.514 -3.870 1.00 0.00 C ATOM 455 O4' C A 15 -5.646 12.179 -3.454 1.00 0.00 O ATOM 456 C3' C A 15 -5.708 14.420 -2.703 1.00 0.00 C ATOM 457 O3' C A 15 -6.145 15.708 -3.153 1.00 0.00 O ATOM 458 C2' C A 15 -6.834 13.653 -2.036 1.00 0.00 C ATOM 459 O2' C A 15 -8.095 13.931 -2.654 1.00 0.00 O ATOM 460 C1' C A 15 -6.419 12.204 -2.248 1.00 0.00 C ATOM 461 N1 C A 15 -5.632 11.708 -1.105 1.00 0.00 N ATOM 462 C2 C A 15 -6.295 10.944 -0.160 1.00 0.00 C ATOM 463 O2 C A 15 -7.493 10.707 -0.292 1.00 0.00 O ATOM 464 N3 C A 15 -5.588 10.471 0.902 1.00 0.00 N ATOM 465 C4 C A 15 -4.281 10.738 1.031 1.00 0.00 C ATOM 466 N4 C A 15 -3.618 10.259 2.083 1.00 0.00 N ATOM 467 C5 C A 15 -3.592 11.528 0.057 1.00 0.00 C ATOM 468 C6 C A 15 -4.302 11.991 -0.989 1.00 0.00 C ATOM 0 H5' C A 15 -3.595 12.914 -4.978 1.00 0.00 H new ATOM 0 H5'' C A 15 -3.683 14.635 -4.662 1.00 0.00 H new ATOM 0 H4' C A 15 -5.894 13.782 -4.769 1.00 0.00 H new ATOM 0 H3' C A 15 -4.871 14.630 -2.037 1.00 0.00 H new ATOM 0 H2' C A 15 -6.973 13.915 -0.987 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.029 14.758 -3.175 1.00 0.00 H new ATOM 0 HO3' C A 15 -6.376 16.264 -2.380 1.00 0.00 H new ATOM 0 H1' C A 15 -7.290 11.554 -2.328 1.00 0.00 H new ATOM 0 H41 C A 15 -2.623 10.456 2.192 1.00 0.00 H new ATOM 0 H42 C A 15 -4.105 9.696 2.780 1.00 0.00 H new ATOM 0 H5 C A 15 -2.539 11.745 0.157 1.00 0.00 H new ATOM 0 H6 C A 15 -3.815 12.592 -1.743 1.00 0.00 H new TER 481 C A 15