USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 153 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 -12:sc= 0.472 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -23:sc= 0.396 USER MOD Single : A 3 C O2' : rot -10:sc= 0.0873 USER MOD Single : A 4 C O2' : rot -14:sc= -1.05 USER MOD Single : A 5 U O2' : rot -14:sc= 0.354 USER MOD Single : A 6 G O2' : rot -131:sc= -6.41! USER MOD Single : A 7 A O2' : rot 161:sc= -6.52! USER MOD Single : A 8 U O2' : rot 141:sc= 0.709 USER MOD Single : A 9 A O2' : rot -81:sc= 0.583 USER MOD Single : A 10 G O2' : rot -71:sc= 1.04 USER MOD Single : A 11 G O2' : rot -18:sc= 0.395 USER MOD Single : A 12 G O2' : rot -7:sc= 0.288 USER MOD Single : A 13 U O2' : rot -14:sc= -1.35! USER MOD Single : A 14 C O2' : rot -22:sc= 0.212 USER MOD Single : A 14 C O3' : rot 180:sc= 0.21 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -5.912 -1.140 9.534 1.00 0.00 O ATOM 2 C5' G A 1 -4.674 -1.165 8.820 1.00 0.00 C ATOM 3 C4' G A 1 -3.921 -2.474 9.048 1.00 0.00 C ATOM 4 O4' G A 1 -4.175 -3.356 7.956 1.00 0.00 O ATOM 5 C3' G A 1 -2.411 -2.345 9.077 1.00 0.00 C ATOM 6 O3' G A 1 -2.032 -2.175 10.448 1.00 0.00 O ATOM 7 C2' G A 1 -1.925 -3.721 8.639 1.00 0.00 C ATOM 8 O2' G A 1 -1.821 -4.601 9.763 1.00 0.00 O ATOM 9 C1' G A 1 -3.036 -4.192 7.696 1.00 0.00 C ATOM 10 N9 G A 1 -2.662 -4.053 6.273 1.00 0.00 N ATOM 11 C8 G A 1 -2.399 -2.909 5.563 1.00 0.00 C ATOM 12 N7 G A 1 -2.096 -3.126 4.315 1.00 0.00 N ATOM 13 C5 G A 1 -2.162 -4.509 4.186 1.00 0.00 C ATOM 14 C6 G A 1 -1.931 -5.332 3.049 1.00 0.00 C ATOM 15 O6 G A 1 -1.618 -4.989 1.911 1.00 0.00 O ATOM 16 N1 G A 1 -2.102 -6.674 3.345 1.00 0.00 N ATOM 17 C2 G A 1 -2.452 -7.172 4.580 1.00 0.00 C ATOM 18 N2 G A 1 -2.571 -8.494 4.689 1.00 0.00 N ATOM 19 N3 G A 1 -2.673 -6.408 5.655 1.00 0.00 N ATOM 20 C4 G A 1 -2.509 -5.089 5.382 1.00 0.00 C ATOM 0 H5' G A 1 -4.053 -0.327 9.137 1.00 0.00 H new ATOM 0 H5'' G A 1 -4.865 -1.035 7.755 1.00 0.00 H new ATOM 0 H4' G A 1 -4.273 -2.825 10.018 1.00 0.00 H new ATOM 0 H3' G A 1 -2.024 -1.529 8.467 1.00 0.00 H new ATOM 0 H2' G A 1 -0.939 -3.701 8.175 1.00 0.00 H new ATOM 0 HO2' G A 1 -1.900 -4.084 10.592 1.00 0.00 H new ATOM 0 HO5' G A 1 -6.368 -0.289 9.368 1.00 0.00 H new ATOM 0 H1' G A 1 -3.235 -5.249 7.874 1.00 0.00 H new ATOM 0 H8 G A 1 -2.439 -1.921 5.998 1.00 0.00 H new ATOM 0 H1 G A 1 -1.958 -7.345 2.590 1.00 0.00 H new ATOM 0 H21 G A 1 -2.828 -8.911 5.584 1.00 0.00 H new ATOM 0 H22 G A 1 -2.405 -9.090 3.878 1.00 0.00 H new ATOM 33 P G A 2 -0.626 -1.493 10.838 1.00 0.00 P ATOM 34 OP1 G A 2 -0.532 -1.440 12.313 1.00 0.00 O ATOM 35 OP2 G A 2 -0.480 -0.250 10.046 1.00 0.00 O ATOM 36 O5' G A 2 0.451 -2.567 10.303 1.00 0.00 O ATOM 37 C5' G A 2 1.337 -2.243 9.227 1.00 0.00 C ATOM 38 C4' G A 2 2.553 -3.164 9.198 1.00 0.00 C ATOM 39 O4' G A 2 2.114 -4.527 9.142 1.00 0.00 O ATOM 40 C3' G A 2 3.440 -3.000 7.975 1.00 0.00 C ATOM 41 O3' G A 2 4.488 -2.096 8.336 1.00 0.00 O ATOM 42 C2' G A 2 4.065 -4.376 7.807 1.00 0.00 C ATOM 43 O2' G A 2 5.188 -4.532 8.681 1.00 0.00 O ATOM 44 C1' G A 2 2.922 -5.295 8.236 1.00 0.00 C ATOM 45 N9 G A 2 2.076 -5.714 7.098 1.00 0.00 N ATOM 46 C8 G A 2 0.711 -5.659 6.988 1.00 0.00 C ATOM 47 N7 G A 2 0.258 -6.089 5.845 1.00 0.00 N ATOM 48 C5 G A 2 1.401 -6.456 5.148 1.00 0.00 C ATOM 49 C6 G A 2 1.530 -6.998 3.843 1.00 0.00 C ATOM 50 O6 G A 2 0.643 -7.253 3.033 1.00 0.00 O ATOM 51 N1 G A 2 2.855 -7.229 3.515 1.00 0.00 N ATOM 52 C2 G A 2 3.928 -6.975 4.338 1.00 0.00 C ATOM 53 N2 G A 2 5.138 -7.263 3.859 1.00 0.00 N ATOM 54 N3 G A 2 3.818 -6.467 5.569 1.00 0.00 N ATOM 55 C4 G A 2 2.525 -6.234 5.905 1.00 0.00 C ATOM 0 H5' G A 2 1.667 -1.209 9.326 1.00 0.00 H new ATOM 0 H5'' G A 2 0.802 -2.318 8.280 1.00 0.00 H new ATOM 0 H4' G A 2 3.117 -2.904 10.094 1.00 0.00 H new ATOM 0 H3' G A 2 2.916 -2.643 7.088 1.00 0.00 H new ATOM 0 H2' G A 2 4.441 -4.571 6.803 1.00 0.00 H new ATOM 0 HO2' G A 2 5.546 -3.650 8.914 1.00 0.00 H new ATOM 0 H1' G A 2 3.333 -6.201 8.682 1.00 0.00 H new ATOM 0 H8 G A 2 0.070 -5.293 7.776 1.00 0.00 H new ATOM 0 H1 G A 2 3.051 -7.617 2.592 1.00 0.00 H new ATOM 0 H21 G A 2 5.966 -7.093 4.430 1.00 0.00 H new ATOM 0 H22 G A 2 5.236 -7.653 2.922 1.00 0.00 H new ATOM 67 P C A 3 4.758 -0.762 7.472 1.00 0.00 P ATOM 68 OP1 C A 3 5.562 0.168 8.297 1.00 0.00 O ATOM 69 OP2 C A 3 3.473 -0.314 6.894 1.00 0.00 O ATOM 70 O5' C A 3 5.688 -1.303 6.274 1.00 0.00 O ATOM 71 C5' C A 3 6.883 -2.040 6.553 1.00 0.00 C ATOM 72 C4' C A 3 7.400 -2.762 5.313 1.00 0.00 C ATOM 73 O4' C A 3 6.618 -3.941 5.095 1.00 0.00 O ATOM 74 C3' C A 3 7.269 -1.978 4.018 1.00 0.00 C ATOM 75 O3' C A 3 8.512 -1.299 3.812 1.00 0.00 O ATOM 76 C2' C A 3 7.165 -3.066 2.960 1.00 0.00 C ATOM 77 O2' C A 3 8.463 -3.555 2.606 1.00 0.00 O ATOM 78 C1' C A 3 6.369 -4.145 3.693 1.00 0.00 C ATOM 79 N1 C A 3 4.912 -4.040 3.443 1.00 0.00 N ATOM 80 C2 C A 3 4.407 -4.664 2.311 1.00 0.00 C ATOM 81 O2 C A 3 5.158 -5.271 1.548 1.00 0.00 O ATOM 82 N3 C A 3 3.070 -4.590 2.065 1.00 0.00 N ATOM 83 C4 C A 3 2.258 -3.927 2.898 1.00 0.00 C ATOM 84 N4 C A 3 0.957 -3.896 2.609 1.00 0.00 N ATOM 85 C5 C A 3 2.770 -3.281 4.064 1.00 0.00 C ATOM 86 C6 C A 3 4.092 -3.360 4.299 1.00 0.00 C ATOM 0 H5' C A 3 6.688 -2.766 7.342 1.00 0.00 H new ATOM 0 H5'' C A 3 7.650 -1.362 6.926 1.00 0.00 H new ATOM 0 H4' C A 3 8.455 -2.942 5.521 1.00 0.00 H new ATOM 0 H3' C A 3 6.440 -1.270 4.006 1.00 0.00 H new ATOM 0 H2' C A 3 6.709 -2.732 2.028 1.00 0.00 H new ATOM 0 HO2' C A 3 9.149 -2.974 2.996 1.00 0.00 H new ATOM 0 H1' C A 3 6.679 -5.130 3.343 1.00 0.00 H new ATOM 0 H41 C A 3 0.310 -3.400 3.222 1.00 0.00 H new ATOM 0 H42 C A 3 0.609 -4.368 1.775 1.00 0.00 H new ATOM 0 H5 C A 3 2.116 -2.746 4.736 1.00 0.00 H new ATOM 0 H6 C A 3 4.509 -2.881 5.173 1.00 0.00 H new ATOM 98 P C A 4 8.545 0.175 3.163 1.00 0.00 P ATOM 99 OP1 C A 4 9.926 0.697 3.271 1.00 0.00 O ATOM 100 OP2 C A 4 7.416 0.953 3.720 1.00 0.00 O ATOM 101 O5' C A 4 8.236 -0.119 1.610 1.00 0.00 O ATOM 102 C5' C A 4 9.181 -0.824 0.797 1.00 0.00 C ATOM 103 C4' C A 4 8.704 -0.931 -0.648 1.00 0.00 C ATOM 104 O4' C A 4 7.777 -2.019 -0.758 1.00 0.00 O ATOM 105 C3' C A 4 7.920 0.267 -1.155 1.00 0.00 C ATOM 106 O3' C A 4 8.854 1.168 -1.756 1.00 0.00 O ATOM 107 C2' C A 4 7.081 -0.335 -2.268 1.00 0.00 C ATOM 108 O2' C A 4 7.863 -0.530 -3.449 1.00 0.00 O ATOM 109 C1' C A 4 6.697 -1.676 -1.650 1.00 0.00 C ATOM 110 N1 C A 4 5.455 -1.568 -0.855 1.00 0.00 N ATOM 111 C2 C A 4 4.261 -1.931 -1.461 1.00 0.00 C ATOM 112 O2 C A 4 4.250 -2.353 -2.617 1.00 0.00 O ATOM 113 N3 C A 4 3.108 -1.808 -0.747 1.00 0.00 N ATOM 114 C4 C A 4 3.126 -1.346 0.510 1.00 0.00 C ATOM 115 N4 C A 4 1.966 -1.250 1.155 1.00 0.00 N ATOM 116 C5 C A 4 4.356 -0.971 1.136 1.00 0.00 C ATOM 117 C6 C A 4 5.484 -1.098 0.426 1.00 0.00 C ATOM 0 H5' C A 4 9.339 -1.823 1.204 1.00 0.00 H new ATOM 0 H5'' C A 4 10.142 -0.311 0.827 1.00 0.00 H new ATOM 0 H4' C A 4 9.621 -1.039 -1.227 1.00 0.00 H new ATOM 0 H3' C A 4 7.344 0.786 -0.389 1.00 0.00 H new ATOM 0 H2' C A 4 6.237 0.281 -2.579 1.00 0.00 H new ATOM 0 HO2' C A 4 8.708 -0.041 -3.366 1.00 0.00 H new ATOM 0 H1' C A 4 6.530 -2.418 -2.431 1.00 0.00 H new ATOM 0 H41 C A 4 1.943 -0.902 2.114 1.00 0.00 H new ATOM 0 H42 C A 4 1.100 -1.524 0.691 1.00 0.00 H new ATOM 0 H5 C A 4 4.374 -0.597 2.149 1.00 0.00 H new ATOM 0 H6 C A 4 6.429 -0.825 0.873 1.00 0.00 H new ATOM 129 P U A 5 8.542 2.747 -1.822 1.00 0.00 P ATOM 130 OP1 U A 5 9.647 3.409 -2.551 1.00 0.00 O ATOM 131 OP2 U A 5 8.176 3.205 -0.463 1.00 0.00 O ATOM 132 O5' U A 5 7.222 2.806 -2.745 1.00 0.00 O ATOM 133 C5' U A 5 7.294 2.509 -4.143 1.00 0.00 C ATOM 134 C4' U A 5 5.968 2.758 -4.837 1.00 0.00 C ATOM 135 O4' U A 5 5.036 1.765 -4.420 1.00 0.00 O ATOM 136 C3' U A 5 5.305 4.077 -4.482 1.00 0.00 C ATOM 137 O3' U A 5 5.695 5.024 -5.483 1.00 0.00 O ATOM 138 C2' U A 5 3.828 3.789 -4.681 1.00 0.00 C ATOM 139 O2' U A 5 3.463 3.933 -6.057 1.00 0.00 O ATOM 140 C1' U A 5 3.727 2.325 -4.253 1.00 0.00 C ATOM 141 N1 U A 5 3.322 2.174 -2.837 1.00 0.00 N ATOM 142 C2 U A 5 1.967 2.150 -2.555 1.00 0.00 C ATOM 143 O2 U A 5 1.105 2.267 -3.426 1.00 0.00 O ATOM 144 N3 U A 5 1.630 1.989 -1.226 1.00 0.00 N ATOM 145 C4 U A 5 2.512 1.850 -0.171 1.00 0.00 C ATOM 146 O4 U A 5 2.088 1.704 0.971 1.00 0.00 O ATOM 147 C5 U A 5 3.907 1.890 -0.546 1.00 0.00 C ATOM 148 C6 U A 5 4.259 2.048 -1.843 1.00 0.00 C ATOM 0 H5' U A 5 7.587 1.468 -4.280 1.00 0.00 H new ATOM 0 H5'' U A 5 8.068 3.121 -4.606 1.00 0.00 H new ATOM 0 H4' U A 5 6.203 2.750 -5.901 1.00 0.00 H new ATOM 0 H3' U A 5 5.552 4.448 -3.487 1.00 0.00 H new ATOM 0 H2' U A 5 3.172 4.461 -4.127 1.00 0.00 H new ATOM 0 HO2' U A 5 4.180 4.396 -6.539 1.00 0.00 H new ATOM 0 H1' U A 5 2.968 1.825 -4.855 1.00 0.00 H new ATOM 0 H3 U A 5 0.635 1.971 -1.001 1.00 0.00 H new ATOM 0 H5 U A 5 4.671 1.793 0.211 1.00 0.00 H new ATOM 0 H6 U A 5 5.307 2.076 -2.103 1.00 0.00 H new ATOM 159 P G A 6 6.167 6.508 -5.071 1.00 0.00 P ATOM 160 OP1 G A 6 6.646 7.197 -6.290 1.00 0.00 O ATOM 161 OP2 G A 6 7.051 6.403 -3.888 1.00 0.00 O ATOM 162 O5' G A 6 4.787 7.199 -4.610 1.00 0.00 O ATOM 163 C5' G A 6 3.695 7.335 -5.525 1.00 0.00 C ATOM 164 C4' G A 6 2.352 7.280 -4.805 1.00 0.00 C ATOM 165 O4' G A 6 2.344 6.168 -3.921 1.00 0.00 O ATOM 166 C3' G A 6 2.062 8.462 -3.893 1.00 0.00 C ATOM 167 O3' G A 6 1.244 9.375 -4.631 1.00 0.00 O ATOM 168 C2' G A 6 1.198 7.877 -2.763 1.00 0.00 C ATOM 169 O2' G A 6 -0.165 8.231 -2.926 1.00 0.00 O ATOM 170 C1' G A 6 1.345 6.365 -2.922 1.00 0.00 C ATOM 171 N9 G A 6 1.778 5.730 -1.663 1.00 0.00 N ATOM 172 C8 G A 6 3.043 5.370 -1.275 1.00 0.00 C ATOM 173 N7 G A 6 3.100 4.874 -0.071 1.00 0.00 N ATOM 174 C5 G A 6 1.782 4.907 0.370 1.00 0.00 C ATOM 175 C6 G A 6 1.226 4.495 1.612 1.00 0.00 C ATOM 176 O6 G A 6 1.802 4.015 2.584 1.00 0.00 O ATOM 177 N1 G A 6 -0.144 4.698 1.651 1.00 0.00 N ATOM 178 C2 G A 6 -0.893 5.232 0.624 1.00 0.00 C ATOM 179 N2 G A 6 -2.204 5.357 0.832 1.00 0.00 N ATOM 180 N3 G A 6 -0.379 5.621 -0.545 1.00 0.00 N ATOM 181 C4 G A 6 0.962 5.429 -0.599 1.00 0.00 C ATOM 0 H5' G A 6 3.742 6.541 -6.270 1.00 0.00 H new ATOM 0 H5'' G A 6 3.783 8.280 -6.061 1.00 0.00 H new ATOM 0 H4' G A 6 1.617 7.247 -5.610 1.00 0.00 H new ATOM 0 H3' G A 6 2.962 8.958 -3.530 1.00 0.00 H new ATOM 0 H2' G A 6 1.509 8.246 -1.786 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.514 8.587 -2.082 1.00 0.00 H new ATOM 0 H1' G A 6 0.390 5.917 -3.196 1.00 0.00 H new ATOM 0 H8 G A 6 3.911 5.487 -1.908 1.00 0.00 H new ATOM 0 H1 G A 6 -0.636 4.432 2.504 1.00 0.00 H new ATOM 0 H21 G A 6 -2.801 5.747 0.103 1.00 0.00 H new ATOM 0 H22 G A 6 -2.610 5.063 1.720 1.00 0.00 H new ATOM 193 P A A 7 1.011 10.886 -4.107 1.00 0.00 P ATOM 194 OP1 A A 7 1.151 11.802 -5.261 1.00 0.00 O ATOM 195 OP2 A A 7 1.838 11.095 -2.897 1.00 0.00 O ATOM 196 O5' A A 7 -0.537 10.869 -3.663 1.00 0.00 O ATOM 197 C5' A A 7 -1.418 9.875 -4.189 1.00 0.00 C ATOM 198 C4' A A 7 -2.678 9.717 -3.367 1.00 0.00 C ATOM 199 O4' A A 7 -2.364 8.955 -2.188 1.00 0.00 O ATOM 200 C3' A A 7 -3.260 11.004 -2.826 1.00 0.00 C ATOM 201 O3' A A 7 -4.577 10.612 -2.427 1.00 0.00 O ATOM 202 C2' A A 7 -2.395 11.209 -1.590 1.00 0.00 C ATOM 203 O2' A A 7 -2.974 12.133 -0.686 1.00 0.00 O ATOM 204 C1' A A 7 -2.383 9.796 -1.027 1.00 0.00 C ATOM 205 N9 A A 7 -1.190 9.504 -0.206 1.00 0.00 N ATOM 206 C8 A A 7 0.122 9.829 -0.448 1.00 0.00 C ATOM 207 N7 A A 7 0.944 9.401 0.468 1.00 0.00 N ATOM 208 C5 A A 7 0.120 8.749 1.379 1.00 0.00 C ATOM 209 C6 A A 7 0.379 8.075 2.581 1.00 0.00 C ATOM 210 N6 A A 7 1.599 7.930 3.099 1.00 0.00 N ATOM 211 N1 A A 7 -0.664 7.543 3.238 1.00 0.00 N ATOM 212 C2 A A 7 -1.883 7.677 2.727 1.00 0.00 C ATOM 213 N3 A A 7 -2.256 8.283 1.611 1.00 0.00 N ATOM 214 C4 A A 7 -1.184 8.805 0.978 1.00 0.00 C ATOM 0 H5' A A 7 -0.896 8.919 -4.233 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.687 10.139 -5.212 1.00 0.00 H new ATOM 0 H4' A A 7 -3.395 9.259 -4.049 1.00 0.00 H new ATOM 0 H3' A A 7 -3.289 11.880 -3.474 1.00 0.00 H new ATOM 0 H2' A A 7 -1.409 11.628 -1.790 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.573 12.018 0.201 1.00 0.00 H new ATOM 0 H1' A A 7 -3.239 9.644 -0.370 1.00 0.00 H new ATOM 0 H8 A A 7 0.442 10.387 -1.316 1.00 0.00 H new ATOM 0 H61 A A 7 1.723 7.428 3.978 1.00 0.00 H new ATOM 0 H62 A A 7 2.408 8.321 2.616 1.00 0.00 H new ATOM 0 H2 A A 7 -2.680 7.229 3.302 1.00 0.00 H new ATOM 226 P U A 8 -5.726 11.598 -1.881 1.00 0.00 P ATOM 227 OP1 U A 8 -6.708 11.813 -2.967 1.00 0.00 O ATOM 228 OP2 U A 8 -5.120 12.757 -1.194 1.00 0.00 O ATOM 229 O5' U A 8 -6.395 10.632 -0.780 1.00 0.00 O ATOM 230 C5' U A 8 -6.286 9.208 -0.953 1.00 0.00 C ATOM 231 C4' U A 8 -5.771 8.498 0.300 1.00 0.00 C ATOM 232 O4' U A 8 -4.695 9.249 0.879 1.00 0.00 O ATOM 233 C3' U A 8 -6.798 8.358 1.415 1.00 0.00 C ATOM 234 O3' U A 8 -6.429 7.213 2.197 1.00 0.00 O ATOM 235 C2' U A 8 -6.528 9.589 2.253 1.00 0.00 C ATOM 236 O2' U A 8 -7.020 9.432 3.587 1.00 0.00 O ATOM 237 C1' U A 8 -5.019 9.617 2.223 1.00 0.00 C ATOM 238 N1 U A 8 -4.477 10.956 2.493 1.00 0.00 N ATOM 239 C2 U A 8 -4.401 11.371 3.812 1.00 0.00 C ATOM 240 O2 U A 8 -4.744 10.658 4.753 1.00 0.00 O ATOM 241 N3 U A 8 -3.910 12.644 4.016 1.00 0.00 N ATOM 242 C4 U A 8 -3.496 13.524 3.036 1.00 0.00 C ATOM 243 O4 U A 8 -3.077 14.637 3.344 1.00 0.00 O ATOM 244 C5 U A 8 -3.605 13.016 1.687 1.00 0.00 C ATOM 245 C6 U A 8 -4.084 11.766 1.464 1.00 0.00 C ATOM 0 H5' U A 8 -5.615 8.998 -1.786 1.00 0.00 H new ATOM 0 H5'' U A 8 -7.262 8.803 -1.220 1.00 0.00 H new ATOM 0 H4' U A 8 -5.482 7.507 -0.051 1.00 0.00 H new ATOM 0 H3' U A 8 -7.829 8.258 1.075 1.00 0.00 H new ATOM 0 H2' U A 8 -7.008 10.499 1.892 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.385 9.829 4.219 1.00 0.00 H new ATOM 0 H1' U A 8 -4.600 8.959 2.985 1.00 0.00 H new ATOM 0 H3 U A 8 -3.847 12.965 4.982 1.00 0.00 H new ATOM 0 H5 U A 8 -3.304 13.634 0.854 1.00 0.00 H new ATOM 0 H6 U A 8 -4.156 11.402 0.450 1.00 0.00 H new ATOM 256 P A A 9 -7.550 6.292 2.901 1.00 0.00 P ATOM 257 OP1 A A 9 -8.006 6.976 4.133 1.00 0.00 O ATOM 258 OP2 A A 9 -7.030 4.908 2.977 1.00 0.00 O ATOM 259 O5' A A 9 -8.754 6.325 1.832 1.00 0.00 O ATOM 260 C5' A A 9 -9.138 5.147 1.114 1.00 0.00 C ATOM 261 C4' A A 9 -9.650 5.492 -0.284 1.00 0.00 C ATOM 262 O4' A A 9 -9.034 6.721 -0.712 1.00 0.00 O ATOM 263 C3' A A 9 -9.290 4.482 -1.375 1.00 0.00 C ATOM 264 O3' A A 9 -10.441 3.659 -1.609 1.00 0.00 O ATOM 265 C2' A A 9 -9.102 5.364 -2.602 1.00 0.00 C ATOM 266 O2' A A 9 -10.364 5.760 -3.149 1.00 0.00 O ATOM 267 C1' A A 9 -8.391 6.548 -1.981 1.00 0.00 C ATOM 268 N9 A A 9 -6.955 6.283 -1.769 1.00 0.00 N ATOM 269 C8 A A 9 -6.333 5.762 -0.666 1.00 0.00 C ATOM 270 N7 A A 9 -5.043 5.633 -0.805 1.00 0.00 N ATOM 271 C5 A A 9 -4.798 6.107 -2.088 1.00 0.00 C ATOM 272 C6 A A 9 -3.623 6.242 -2.843 1.00 0.00 C ATOM 273 N6 A A 9 -2.414 5.900 -2.398 1.00 0.00 N ATOM 274 N1 A A 9 -3.732 6.748 -4.081 1.00 0.00 N ATOM 275 C2 A A 9 -4.931 7.096 -4.530 1.00 0.00 C ATOM 276 N3 A A 9 -6.103 7.020 -3.924 1.00 0.00 N ATOM 277 C4 A A 9 -5.956 6.506 -2.685 1.00 0.00 C ATOM 0 H5' A A 9 -9.914 4.618 1.667 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.286 4.472 1.035 1.00 0.00 H new ATOM 0 H4' A A 9 -10.734 5.527 -0.180 1.00 0.00 H new ATOM 0 H3' A A 9 -8.430 3.856 -1.135 1.00 0.00 H new ATOM 0 H2' A A 9 -8.572 4.889 -3.428 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.724 5.034 -3.699 1.00 0.00 H new ATOM 0 H1' A A 9 -8.448 7.425 -2.626 1.00 0.00 H new ATOM 0 H8 A A 9 -6.861 5.484 0.234 1.00 0.00 H new ATOM 0 H61 A A 9 -1.597 6.023 -2.996 1.00 0.00 H new ATOM 0 H62 A A 9 -2.306 5.516 -1.459 1.00 0.00 H new ATOM 0 H2 A A 9 -4.952 7.498 -5.532 1.00 0.00 H new ATOM 289 P G A 10 -10.387 2.464 -2.694 1.00 0.00 P ATOM 290 OP1 G A 10 -11.759 1.936 -2.870 1.00 0.00 O ATOM 291 OP2 G A 10 -9.285 1.547 -2.326 1.00 0.00 O ATOM 292 O5' G A 10 -9.968 3.245 -4.041 1.00 0.00 O ATOM 293 C5' G A 10 -10.208 2.684 -5.336 1.00 0.00 C ATOM 294 C4' G A 10 -8.936 2.126 -5.974 1.00 0.00 C ATOM 295 O4' G A 10 -7.860 3.050 -5.781 1.00 0.00 O ATOM 296 C3' G A 10 -8.413 0.835 -5.376 1.00 0.00 C ATOM 297 O3' G A 10 -9.032 -0.247 -6.079 1.00 0.00 O ATOM 298 C2' G A 10 -6.946 0.866 -5.780 1.00 0.00 C ATOM 299 O2' G A 10 -6.784 0.460 -7.142 1.00 0.00 O ATOM 300 C1' G A 10 -6.612 2.348 -5.620 1.00 0.00 C ATOM 301 N9 G A 10 -6.064 2.644 -4.285 1.00 0.00 N ATOM 302 C8 G A 10 -6.744 2.855 -3.115 1.00 0.00 C ATOM 303 N7 G A 10 -5.969 3.050 -2.086 1.00 0.00 N ATOM 304 C5 G A 10 -4.684 2.964 -2.610 1.00 0.00 C ATOM 305 C6 G A 10 -3.424 3.094 -1.964 1.00 0.00 C ATOM 306 O6 G A 10 -3.197 3.305 -0.776 1.00 0.00 O ATOM 307 N1 G A 10 -2.374 2.941 -2.855 1.00 0.00 N ATOM 308 C2 G A 10 -2.512 2.695 -4.201 1.00 0.00 C ATOM 309 N2 G A 10 -1.392 2.575 -4.914 1.00 0.00 N ATOM 310 N3 G A 10 -3.690 2.570 -4.819 1.00 0.00 N ATOM 311 C4 G A 10 -4.730 2.718 -3.961 1.00 0.00 C ATOM 0 H5' G A 10 -10.633 3.448 -5.987 1.00 0.00 H new ATOM 0 H5'' G A 10 -10.949 1.889 -5.253 1.00 0.00 H new ATOM 0 H4' G A 10 -9.226 1.952 -7.010 1.00 0.00 H new ATOM 0 H3' G A 10 -8.586 0.727 -4.305 1.00 0.00 H new ATOM 0 H2' G A 10 -6.312 0.198 -5.196 1.00 0.00 H new ATOM 0 HO2' G A 10 -6.950 -0.503 -7.218 1.00 0.00 H new ATOM 0 H1' G A 10 -5.859 2.646 -6.349 1.00 0.00 H new ATOM 0 H8 G A 10 -7.822 2.859 -3.051 1.00 0.00 H new ATOM 0 H1 G A 10 -1.427 3.017 -2.484 1.00 0.00 H new ATOM 0 H21 G A 10 -1.443 2.392 -5.916 1.00 0.00 H new ATOM 0 H22 G A 10 -0.485 2.666 -4.457 1.00 0.00 H new ATOM 323 P G A 11 -8.747 -1.777 -5.656 1.00 0.00 P ATOM 324 OP1 G A 11 -9.740 -2.637 -6.336 1.00 0.00 O ATOM 325 OP2 G A 11 -8.610 -1.833 -4.182 1.00 0.00 O ATOM 326 O5' G A 11 -7.302 -2.059 -6.314 1.00 0.00 O ATOM 327 C5' G A 11 -6.157 -2.330 -5.495 1.00 0.00 C ATOM 328 C4' G A 11 -4.872 -1.832 -6.154 1.00 0.00 C ATOM 329 O4' G A 11 -4.466 -0.610 -5.528 1.00 0.00 O ATOM 330 C3' G A 11 -3.676 -2.752 -5.999 1.00 0.00 C ATOM 331 O3' G A 11 -3.635 -3.578 -7.167 1.00 0.00 O ATOM 332 C2' G A 11 -2.489 -1.803 -6.075 1.00 0.00 C ATOM 333 O2' G A 11 -2.149 -1.523 -7.435 1.00 0.00 O ATOM 334 C1' G A 11 -3.036 -0.546 -5.394 1.00 0.00 C ATOM 335 N9 G A 11 -2.697 -0.483 -3.957 1.00 0.00 N ATOM 336 C8 G A 11 -3.536 -0.302 -2.886 1.00 0.00 C ATOM 337 N7 G A 11 -2.923 -0.272 -1.737 1.00 0.00 N ATOM 338 C5 G A 11 -1.584 -0.447 -2.065 1.00 0.00 C ATOM 339 C6 G A 11 -0.440 -0.501 -1.223 1.00 0.00 C ATOM 340 O6 G A 11 -0.390 -0.399 0.000 1.00 0.00 O ATOM 341 N1 G A 11 0.722 -0.692 -1.951 1.00 0.00 N ATOM 342 C2 G A 11 0.785 -0.816 -3.321 1.00 0.00 C ATOM 343 N2 G A 11 1.991 -0.998 -3.857 1.00 0.00 N ATOM 344 N3 G A 11 -0.283 -0.767 -4.122 1.00 0.00 N ATOM 345 C4 G A 11 -1.431 -0.580 -3.424 1.00 0.00 C ATOM 0 H5' G A 11 -6.083 -3.402 -5.313 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.280 -1.850 -4.524 1.00 0.00 H new ATOM 0 H4' G A 11 -5.123 -1.746 -7.211 1.00 0.00 H new ATOM 0 H3' G A 11 -3.695 -3.361 -5.095 1.00 0.00 H new ATOM 0 H2' G A 11 -1.583 -2.199 -5.615 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.549 -2.202 -8.018 1.00 0.00 H new ATOM 0 H1' G A 11 -2.598 0.337 -5.860 1.00 0.00 H new ATOM 0 H8 G A 11 -4.606 -0.194 -2.987 1.00 0.00 H new ATOM 0 H1 G A 11 1.599 -0.745 -1.433 1.00 0.00 H new ATOM 0 H21 G A 11 2.091 -1.095 -4.867 1.00 0.00 H new ATOM 0 H22 G A 11 2.815 -1.040 -3.257 1.00 0.00 H new ATOM 357 P G A 12 -3.560 -5.184 -7.047 1.00 0.00 P ATOM 358 OP1 G A 12 -4.457 -5.767 -8.069 1.00 0.00 O ATOM 359 OP2 G A 12 -3.727 -5.554 -5.623 1.00 0.00 O ATOM 360 O5' G A 12 -2.039 -5.493 -7.474 1.00 0.00 O ATOM 361 C5' G A 12 -1.447 -6.766 -7.204 1.00 0.00 C ATOM 362 C4' G A 12 0.056 -6.645 -6.962 1.00 0.00 C ATOM 363 O4' G A 12 0.360 -5.302 -6.564 1.00 0.00 O ATOM 364 C3' G A 12 0.587 -7.506 -5.825 1.00 0.00 C ATOM 365 O3' G A 12 1.075 -8.719 -6.408 1.00 0.00 O ATOM 366 C2' G A 12 1.793 -6.723 -5.329 1.00 0.00 C ATOM 367 O2' G A 12 2.936 -6.974 -6.152 1.00 0.00 O ATOM 368 C1' G A 12 1.321 -5.281 -5.496 1.00 0.00 C ATOM 369 N9 G A 12 0.658 -4.764 -4.281 1.00 0.00 N ATOM 370 C8 G A 12 -0.634 -4.324 -4.130 1.00 0.00 C ATOM 371 N7 G A 12 -0.918 -3.936 -2.920 1.00 0.00 N ATOM 372 C5 G A 12 0.265 -4.131 -2.217 1.00 0.00 C ATOM 373 C6 G A 12 0.561 -3.886 -0.849 1.00 0.00 C ATOM 374 O6 G A 12 -0.178 -3.436 0.023 1.00 0.00 O ATOM 375 N1 G A 12 1.871 -4.219 -0.544 1.00 0.00 N ATOM 376 C2 G A 12 2.786 -4.725 -1.440 1.00 0.00 C ATOM 377 N2 G A 12 4.009 -4.981 -0.976 1.00 0.00 N ATOM 378 N3 G A 12 2.517 -4.960 -2.725 1.00 0.00 N ATOM 379 C4 G A 12 1.239 -4.639 -3.041 1.00 0.00 C ATOM 0 H5' G A 12 -1.628 -7.438 -8.043 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.922 -7.211 -6.330 1.00 0.00 H new ATOM 0 H4' G A 12 0.514 -6.961 -7.899 1.00 0.00 H new ATOM 0 H3' G A 12 -0.148 -7.724 -5.050 1.00 0.00 H new ATOM 0 H2' G A 12 2.097 -6.979 -4.314 1.00 0.00 H new ATOM 0 HO2' G A 12 2.726 -7.681 -6.797 1.00 0.00 H new ATOM 0 H1' G A 12 2.177 -4.636 -5.695 1.00 0.00 H new ATOM 0 H8 G A 12 -1.348 -4.302 -4.940 1.00 0.00 H new ATOM 0 H1 G A 12 2.181 -4.079 0.418 1.00 0.00 H new ATOM 0 H21 G A 12 4.723 -5.357 -1.600 1.00 0.00 H new ATOM 0 H22 G A 12 4.231 -4.801 0.003 1.00 0.00 H new ATOM 391 P U A 13 0.828 -10.137 -5.685 1.00 0.00 P ATOM 392 OP1 U A 13 1.099 -11.210 -6.667 1.00 0.00 O ATOM 393 OP2 U A 13 -0.478 -10.083 -4.991 1.00 0.00 O ATOM 394 O5' U A 13 1.989 -10.169 -4.568 1.00 0.00 O ATOM 395 C5' U A 13 3.368 -10.111 -4.947 1.00 0.00 C ATOM 396 C4' U A 13 4.245 -9.614 -3.801 1.00 0.00 C ATOM 397 O4' U A 13 3.783 -8.327 -3.380 1.00 0.00 O ATOM 398 C3' U A 13 4.188 -10.461 -2.542 1.00 0.00 C ATOM 399 O3' U A 13 5.262 -11.404 -2.619 1.00 0.00 O ATOM 400 C2' U A 13 4.534 -9.470 -1.443 1.00 0.00 C ATOM 401 O2' U A 13 5.949 -9.293 -1.344 1.00 0.00 O ATOM 402 C1' U A 13 3.871 -8.189 -1.950 1.00 0.00 C ATOM 403 N1 U A 13 2.512 -8.000 -1.394 1.00 0.00 N ATOM 404 C2 U A 13 2.413 -7.528 -0.096 1.00 0.00 C ATOM 405 O2 U A 13 3.397 -7.286 0.598 1.00 0.00 O ATOM 406 N3 U A 13 1.132 -7.350 0.386 1.00 0.00 N ATOM 407 C4 U A 13 -0.041 -7.601 -0.300 1.00 0.00 C ATOM 408 O4 U A 13 -1.125 -7.401 0.243 1.00 0.00 O ATOM 409 C5 U A 13 0.142 -8.092 -1.646 1.00 0.00 C ATOM 410 C6 U A 13 1.392 -8.274 -2.140 1.00 0.00 C ATOM 0 H5' U A 13 3.482 -9.450 -5.806 1.00 0.00 H new ATOM 0 H5'' U A 13 3.702 -11.100 -5.259 1.00 0.00 H new ATOM 0 H4' U A 13 5.257 -9.631 -4.204 1.00 0.00 H new ATOM 0 H3' U A 13 3.239 -10.976 -2.393 1.00 0.00 H new ATOM 0 H2' U A 13 4.204 -9.781 -0.452 1.00 0.00 H new ATOM 0 HO2' U A 13 6.403 -10.000 -1.849 1.00 0.00 H new ATOM 0 H1' U A 13 4.457 -7.323 -1.642 1.00 0.00 H new ATOM 0 H3 U A 13 1.043 -7.000 1.340 1.00 0.00 H new ATOM 0 H5 U A 13 -0.718 -8.315 -2.260 1.00 0.00 H new ATOM 0 H6 U A 13 1.510 -8.645 -3.148 1.00 0.00 H new ATOM 421 P C A 14 5.238 -12.749 -1.732 1.00 0.00 P ATOM 422 OP1 C A 14 6.548 -13.423 -1.881 1.00 0.00 O ATOM 423 OP2 C A 14 3.992 -13.485 -2.041 1.00 0.00 O ATOM 424 O5' C A 14 5.129 -12.180 -0.229 1.00 0.00 O ATOM 425 C5' C A 14 6.290 -11.711 0.464 1.00 0.00 C ATOM 426 C4' C A 14 6.039 -11.596 1.965 1.00 0.00 C ATOM 427 O4' C A 14 5.197 -10.469 2.215 1.00 0.00 O ATOM 428 C3' C A 14 5.286 -12.767 2.577 1.00 0.00 C ATOM 429 O3' C A 14 6.194 -13.811 2.942 1.00 0.00 O ATOM 430 C2' C A 14 4.671 -12.131 3.819 1.00 0.00 C ATOM 431 O2' C A 14 5.621 -12.097 4.888 1.00 0.00 O ATOM 432 C1' C A 14 4.349 -10.713 3.346 1.00 0.00 C ATOM 433 N1 C A 14 2.936 -10.574 2.928 1.00 0.00 N ATOM 434 C2 C A 14 2.024 -10.130 3.877 1.00 0.00 C ATOM 435 O2 C A 14 2.394 -9.858 5.018 1.00 0.00 O ATOM 436 N3 C A 14 0.716 -10.004 3.515 1.00 0.00 N ATOM 437 C4 C A 14 0.321 -10.300 2.271 1.00 0.00 C ATOM 438 N4 C A 14 -0.970 -10.151 1.977 1.00 0.00 N ATOM 439 C5 C A 14 1.255 -10.758 1.290 1.00 0.00 C ATOM 440 C6 C A 14 2.543 -10.880 1.658 1.00 0.00 C ATOM 0 H5' C A 14 6.583 -10.739 0.068 1.00 0.00 H new ATOM 0 H5'' C A 14 7.122 -12.392 0.285 1.00 0.00 H new ATOM 0 H4' C A 14 7.035 -11.535 2.404 1.00 0.00 H new ATOM 0 H3' C A 14 4.558 -13.226 1.908 1.00 0.00 H new ATOM 0 H2' C A 14 3.804 -12.671 4.200 1.00 0.00 H new ATOM 0 HO2' C A 14 6.315 -12.770 4.730 1.00 0.00 H new ATOM 0 HO3' C A 14 5.694 -14.556 3.336 1.00 0.00 H new ATOM 0 H1' C A 14 4.512 -10.005 4.159 1.00 0.00 H new ATOM 0 H41 C A 14 -1.308 -10.367 1.039 1.00 0.00 H new ATOM 0 H42 C A 14 -1.621 -9.821 2.690 1.00 0.00 H new ATOM 0 H5 C A 14 0.937 -10.998 0.286 1.00 0.00 H new ATOM 0 H6 C A 14 3.274 -11.224 0.941 1.00 0.00 H new TER 453 C A 14