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 -14:sc= 0.381 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 G O2' : rot -11:sc= -0.686 USER MOD Single : A 3 C O2' : rot -16:sc= 0.24 USER MOD Single : A 4 C O2' : rot -14:sc= -0.837 USER MOD Single : A 5 U O2' : rot -11:sc= 0.318 USER MOD Single : A 6 G O2' : rot -128:sc= -6.49! USER MOD Single : A 7 A O2' : rot 145:sc= -6.64! USER MOD Single : A 8 U O2' : rot 141:sc= 0.706 USER MOD Single : A 9 A O2' : rot -80:sc= 0.646 USER MOD Single : A 10 G O2' : rot -72:sc= 0.865 USER MOD Single : A 11 G O2' : rot -14:sc= 0.365 USER MOD Single : A 12 G O2' : rot -4:sc= -0.425 USER MOD Single : A 13 U O2' : rot -6:sc= -1.41! USER MOD Single : A 14 C O2' : rot -25:sc= 0.209 USER MOD Single : A 14 C O3' : rot 180:sc= 0.198 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -4.104 -1.405 10.359 1.00 0.00 O ATOM 2 C5' G A 1 -4.537 -2.676 9.864 1.00 0.00 C ATOM 3 C4' G A 1 -3.554 -3.785 10.229 1.00 0.00 C ATOM 4 O4' G A 1 -3.911 -4.979 9.524 1.00 0.00 O ATOM 5 C3' G A 1 -2.116 -3.519 9.821 1.00 0.00 C ATOM 6 O3' G A 1 -1.459 -2.948 10.957 1.00 0.00 O ATOM 7 C2' G A 1 -1.544 -4.915 9.622 1.00 0.00 C ATOM 8 O2' G A 1 -1.145 -5.485 10.873 1.00 0.00 O ATOM 9 C1' G A 1 -2.743 -5.670 9.050 1.00 0.00 C ATOM 10 N9 G A 1 -2.762 -5.665 7.573 1.00 0.00 N ATOM 11 C8 G A 1 -3.287 -4.721 6.725 1.00 0.00 C ATOM 12 N7 G A 1 -3.158 -5.019 5.465 1.00 0.00 N ATOM 13 C5 G A 1 -2.499 -6.243 5.472 1.00 0.00 C ATOM 14 C6 G A 1 -2.084 -7.061 4.387 1.00 0.00 C ATOM 15 O6 G A 1 -2.225 -6.857 3.183 1.00 0.00 O ATOM 16 N1 G A 1 -1.454 -8.212 4.826 1.00 0.00 N ATOM 17 C2 G A 1 -1.244 -8.543 6.147 1.00 0.00 C ATOM 18 N2 G A 1 -0.616 -9.694 6.390 1.00 0.00 N ATOM 19 N3 G A 1 -1.630 -7.782 7.175 1.00 0.00 N ATOM 20 C4 G A 1 -2.250 -6.650 6.761 1.00 0.00 C ATOM 0 H5' G A 1 -4.646 -2.627 8.781 1.00 0.00 H new ATOM 0 H5'' G A 1 -5.520 -2.911 10.273 1.00 0.00 H new ATOM 0 H4' G A 1 -3.612 -3.859 11.315 1.00 0.00 H new ATOM 0 H3' G A 1 -2.011 -2.871 8.951 1.00 0.00 H new ATOM 0 H2' G A 1 -0.657 -4.940 8.988 1.00 0.00 H new ATOM 0 HO2' G A 1 -1.110 -4.783 11.556 1.00 0.00 H new ATOM 0 HO5' G A 1 -4.755 -0.717 10.107 1.00 0.00 H new ATOM 0 H1' G A 1 -2.700 -6.713 9.365 1.00 0.00 H new ATOM 0 H8 G A 1 -3.763 -3.815 7.072 1.00 0.00 H new ATOM 0 H1 G A 1 -1.119 -8.865 4.118 1.00 0.00 H new ATOM 0 H21 G A 1 -0.437 -9.984 7.351 1.00 0.00 H new ATOM 0 H22 G A 1 -0.315 -10.284 5.615 1.00 0.00 H new ATOM 33 P G A 2 -0.703 -1.529 10.848 1.00 0.00 P ATOM 34 OP1 G A 2 -0.800 -0.851 12.159 1.00 0.00 O ATOM 35 OP2 G A 2 -1.179 -0.840 9.625 1.00 0.00 O ATOM 36 O5' G A 2 0.831 -1.967 10.620 1.00 0.00 O ATOM 37 C5' G A 2 1.516 -1.635 9.411 1.00 0.00 C ATOM 38 C4' G A 2 2.745 -2.514 9.203 1.00 0.00 C ATOM 39 O4' G A 2 2.328 -3.876 9.052 1.00 0.00 O ATOM 40 C3' G A 2 3.531 -2.221 7.936 1.00 0.00 C ATOM 41 O3' G A 2 4.568 -1.299 8.286 1.00 0.00 O ATOM 42 C2' G A 2 4.191 -3.555 7.627 1.00 0.00 C ATOM 43 O2' G A 2 5.364 -3.738 8.425 1.00 0.00 O ATOM 44 C1' G A 2 3.102 -4.542 8.040 1.00 0.00 C ATOM 45 N9 G A 2 2.209 -4.891 6.916 1.00 0.00 N ATOM 46 C8 G A 2 0.897 -4.538 6.724 1.00 0.00 C ATOM 47 N7 G A 2 0.384 -5.005 5.622 1.00 0.00 N ATOM 48 C5 G A 2 1.427 -5.716 5.040 1.00 0.00 C ATOM 49 C6 G A 2 1.461 -6.443 3.822 1.00 0.00 C ATOM 50 O6 G A 2 0.561 -6.600 3.003 1.00 0.00 O ATOM 51 N1 G A 2 2.705 -7.011 3.602 1.00 0.00 N ATOM 52 C2 G A 2 3.786 -6.899 4.445 1.00 0.00 C ATOM 53 N2 G A 2 4.908 -7.511 4.072 1.00 0.00 N ATOM 54 N3 G A 2 3.765 -6.218 5.594 1.00 0.00 N ATOM 55 C4 G A 2 2.553 -5.654 5.825 1.00 0.00 C ATOM 0 H5' G A 2 1.817 -0.588 9.439 1.00 0.00 H new ATOM 0 H5'' G A 2 0.838 -1.750 8.565 1.00 0.00 H new ATOM 0 H4' G A 2 3.373 -2.317 10.072 1.00 0.00 H new ATOM 0 H3' G A 2 2.931 -1.823 7.118 1.00 0.00 H new ATOM 0 H2' G A 2 4.519 -3.658 6.593 1.00 0.00 H new ATOM 0 HO2' G A 2 5.591 -2.895 8.870 1.00 0.00 H new ATOM 0 H1' G A 2 3.558 -5.469 8.387 1.00 0.00 H new ATOM 0 H8 G A 2 0.341 -3.929 7.422 1.00 0.00 H new ATOM 0 H1 G A 2 2.829 -7.555 2.748 1.00 0.00 H new ATOM 0 H21 G A 2 5.738 -7.458 4.662 1.00 0.00 H new ATOM 0 H22 G A 2 4.937 -8.033 3.196 1.00 0.00 H new ATOM 67 P C A 3 5.049 -0.171 7.242 1.00 0.00 P ATOM 68 OP1 C A 3 6.076 0.665 7.904 1.00 0.00 O ATOM 69 OP2 C A 3 3.846 0.463 6.657 1.00 0.00 O ATOM 70 O5' C A 3 5.769 -1.040 6.094 1.00 0.00 O ATOM 71 C5' C A 3 6.945 -1.802 6.384 1.00 0.00 C ATOM 72 C4' C A 3 7.388 -2.632 5.184 1.00 0.00 C ATOM 73 O4' C A 3 6.502 -3.745 5.026 1.00 0.00 O ATOM 74 C3' C A 3 7.319 -1.910 3.850 1.00 0.00 C ATOM 75 O3' C A 3 8.606 -1.331 3.618 1.00 0.00 O ATOM 76 C2' C A 3 7.143 -3.044 2.853 1.00 0.00 C ATOM 77 O2' C A 3 8.401 -3.652 2.546 1.00 0.00 O ATOM 78 C1' C A 3 6.255 -4.015 3.634 1.00 0.00 C ATOM 79 N1 C A 3 4.816 -3.816 3.351 1.00 0.00 N ATOM 80 C2 C A 3 4.244 -4.591 2.351 1.00 0.00 C ATOM 81 O2 C A 3 4.927 -5.400 1.727 1.00 0.00 O ATOM 82 N3 C A 3 2.919 -4.435 2.081 1.00 0.00 N ATOM 83 C4 C A 3 2.181 -3.551 2.765 1.00 0.00 C ATOM 84 N4 C A 3 0.889 -3.450 2.459 1.00 0.00 N ATOM 85 C5 C A 3 2.763 -2.747 3.793 1.00 0.00 C ATOM 86 C6 C A 3 4.072 -2.909 4.053 1.00 0.00 C ATOM 0 H5' C A 3 6.753 -2.460 7.231 1.00 0.00 H new ATOM 0 H5'' C A 3 7.751 -1.130 6.679 1.00 0.00 H new ATOM 0 H4' C A 3 8.423 -2.895 5.403 1.00 0.00 H new ATOM 0 H3' C A 3 6.543 -1.146 3.793 1.00 0.00 H new ATOM 0 H2' C A 3 6.726 -2.729 1.896 1.00 0.00 H new ATOM 0 HO2' C A 3 9.128 -3.064 2.838 1.00 0.00 H new ATOM 0 H1' C A 3 6.491 -5.040 3.349 1.00 0.00 H new ATOM 0 H41 C A 3 0.297 -2.787 2.959 1.00 0.00 H new ATOM 0 H42 C A 3 0.492 -4.035 1.724 1.00 0.00 H new ATOM 0 H5 C A 3 2.170 -2.032 4.344 1.00 0.00 H new ATOM 0 H6 C A 3 4.541 -2.316 4.825 1.00 0.00 H new ATOM 98 P C A 4 8.741 0.143 2.984 1.00 0.00 P ATOM 99 OP1 C A 4 10.162 0.552 3.061 1.00 0.00 O ATOM 100 OP2 C A 4 7.693 1.003 3.579 1.00 0.00 O ATOM 101 O5' C A 4 8.371 -0.106 1.437 1.00 0.00 O ATOM 102 C5' C A 4 9.198 -0.933 0.612 1.00 0.00 C ATOM 103 C4' C A 4 8.674 -1.006 -0.818 1.00 0.00 C ATOM 104 O4' C A 4 7.702 -2.054 -0.914 1.00 0.00 O ATOM 105 C3' C A 4 7.920 0.226 -1.289 1.00 0.00 C ATOM 106 O3' C A 4 8.871 1.105 -1.896 1.00 0.00 O ATOM 107 C2' C A 4 7.039 -0.332 -2.393 1.00 0.00 C ATOM 108 O2' C A 4 7.791 -0.542 -3.590 1.00 0.00 O ATOM 109 C1' C A 4 6.618 -1.664 -1.779 1.00 0.00 C ATOM 110 N1 C A 4 5.395 -1.520 -0.965 1.00 0.00 N ATOM 111 C2 C A 4 4.180 -1.846 -1.550 1.00 0.00 C ATOM 112 O2 C A 4 4.138 -2.267 -2.706 1.00 0.00 O ATOM 113 N3 C A 4 3.043 -1.684 -0.820 1.00 0.00 N ATOM 114 C4 C A 4 3.096 -1.222 0.435 1.00 0.00 C ATOM 115 N4 C A 4 1.947 -1.083 1.096 1.00 0.00 N ATOM 116 C5 C A 4 4.346 -0.888 1.043 1.00 0.00 C ATOM 117 C6 C A 4 5.459 -1.052 0.316 1.00 0.00 C ATOM 0 H5' C A 4 9.245 -1.937 1.034 1.00 0.00 H new ATOM 0 H5'' C A 4 10.215 -0.541 0.607 1.00 0.00 H new ATOM 0 H4' C A 4 9.570 -1.143 -1.423 1.00 0.00 H new ATOM 0 H3' C A 4 7.378 0.752 -0.504 1.00 0.00 H new ATOM 0 H2' C A 4 6.213 0.317 -2.683 1.00 0.00 H new ATOM 0 HO2' C A 4 8.654 -0.083 -3.519 1.00 0.00 H new ATOM 0 H1' C A 4 6.409 -2.394 -2.561 1.00 0.00 H new ATOM 0 H41 C A 4 1.949 -0.734 2.054 1.00 0.00 H new ATOM 0 H42 C A 4 1.066 -1.326 0.643 1.00 0.00 H new ATOM 0 H5 C A 4 4.391 -0.516 2.056 1.00 0.00 H new ATOM 0 H6 C A 4 6.419 -0.811 0.748 1.00 0.00 H new ATOM 129 P U A 5 8.639 2.699 -1.879 1.00 0.00 P ATOM 130 OP1 U A 5 9.770 3.340 -2.586 1.00 0.00 O ATOM 131 OP2 U A 5 8.309 3.104 -0.494 1.00 0.00 O ATOM 132 O5' U A 5 7.316 2.870 -2.782 1.00 0.00 O ATOM 133 C5' U A 5 7.346 2.583 -4.184 1.00 0.00 C ATOM 134 C4' U A 5 6.014 2.883 -4.846 1.00 0.00 C ATOM 135 O4' U A 5 5.068 1.893 -4.449 1.00 0.00 O ATOM 136 C3' U A 5 5.383 4.200 -4.433 1.00 0.00 C ATOM 137 O3' U A 5 5.787 5.180 -5.394 1.00 0.00 O ATOM 138 C2' U A 5 3.900 3.948 -4.635 1.00 0.00 C ATOM 139 O2' U A 5 3.535 4.134 -6.006 1.00 0.00 O ATOM 140 C1' U A 5 3.775 2.477 -4.243 1.00 0.00 C ATOM 141 N1 U A 5 3.392 2.299 -2.825 1.00 0.00 N ATOM 142 C2 U A 5 2.042 2.278 -2.519 1.00 0.00 C ATOM 143 O2 U A 5 1.166 2.412 -3.372 1.00 0.00 O ATOM 144 N3 U A 5 1.726 2.100 -1.187 1.00 0.00 N ATOM 145 C4 U A 5 2.627 1.943 -0.151 1.00 0.00 C ATOM 146 O4 U A 5 2.221 1.785 0.998 1.00 0.00 O ATOM 147 C5 U A 5 4.015 1.980 -0.547 1.00 0.00 C ATOM 148 C6 U A 5 4.345 2.154 -1.849 1.00 0.00 C ATOM 0 H5' U A 5 7.600 1.534 -4.335 1.00 0.00 H new ATOM 0 H5'' U A 5 8.130 3.172 -4.660 1.00 0.00 H new ATOM 0 H4' U A 5 6.232 2.909 -5.914 1.00 0.00 H new ATOM 0 H3' U A 5 5.644 4.526 -3.426 1.00 0.00 H new ATOM 0 H2' U A 5 3.257 4.618 -4.064 1.00 0.00 H new ATOM 0 HO2' U A 5 4.276 4.557 -6.487 1.00 0.00 H new ATOM 0 H1' U A 5 2.995 2.009 -4.843 1.00 0.00 H new ATOM 0 H3 U A 5 0.735 2.083 -0.945 1.00 0.00 H new ATOM 0 H5 U A 5 4.791 1.869 0.196 1.00 0.00 H new ATOM 0 H6 U A 5 5.388 2.179 -2.127 1.00 0.00 H new ATOM 159 P G A 6 6.236 6.656 -4.928 1.00 0.00 P ATOM 160 OP1 G A 6 6.742 7.384 -6.114 1.00 0.00 O ATOM 161 OP2 G A 6 7.088 6.523 -3.725 1.00 0.00 O ATOM 162 O5' G A 6 4.838 7.321 -4.484 1.00 0.00 O ATOM 163 C5' G A 6 3.768 7.466 -5.421 1.00 0.00 C ATOM 164 C4' G A 6 2.408 7.383 -4.735 1.00 0.00 C ATOM 165 O4' G A 6 2.391 6.260 -3.866 1.00 0.00 O ATOM 166 C3' G A 6 2.083 8.549 -3.814 1.00 0.00 C ATOM 167 O3' G A 6 1.282 9.469 -4.565 1.00 0.00 O ATOM 168 C2' G A 6 1.189 7.940 -2.724 1.00 0.00 C ATOM 169 O2' G A 6 -0.174 8.277 -2.929 1.00 0.00 O ATOM 170 C1' G A 6 1.362 6.433 -2.893 1.00 0.00 C ATOM 171 N9 G A 6 1.772 5.791 -1.628 1.00 0.00 N ATOM 172 C8 G A 6 3.030 5.441 -1.212 1.00 0.00 C ATOM 173 N7 G A 6 3.063 4.938 -0.010 1.00 0.00 N ATOM 174 C5 G A 6 1.734 4.953 0.399 1.00 0.00 C ATOM 175 C6 G A 6 1.150 4.526 1.623 1.00 0.00 C ATOM 176 O6 G A 6 1.708 4.046 2.607 1.00 0.00 O ATOM 177 N1 G A 6 -0.222 4.716 1.629 1.00 0.00 N ATOM 178 C2 G A 6 -0.949 5.248 0.588 1.00 0.00 C ATOM 179 N2 G A 6 -2.267 5.359 0.765 1.00 0.00 N ATOM 180 N3 G A 6 -0.412 5.652 -0.564 1.00 0.00 N ATOM 181 C4 G A 6 0.931 5.474 -0.587 1.00 0.00 C ATOM 0 H5' G A 6 3.841 6.688 -6.181 1.00 0.00 H new ATOM 0 H5'' G A 6 3.860 8.423 -5.934 1.00 0.00 H new ATOM 0 H4' G A 6 1.694 7.351 -5.558 1.00 0.00 H new ATOM 0 H3' G A 6 2.967 9.045 -3.414 1.00 0.00 H new ATOM 0 H2' G A 6 1.461 8.303 -1.733 1.00 0.00 H new ATOM 0 HO2' G A 6 -0.544 8.660 -2.106 1.00 0.00 H new ATOM 0 H1' G A 6 0.421 5.975 -3.196 1.00 0.00 H new ATOM 0 H8 G A 6 3.911 5.570 -1.823 1.00 0.00 H new ATOM 0 H1 G A 6 -0.732 4.441 2.468 1.00 0.00 H new ATOM 0 H21 G A 6 -2.850 5.747 0.024 1.00 0.00 H new ATOM 0 H22 G A 6 -2.691 5.056 1.642 1.00 0.00 H new ATOM 193 P A A 7 1.034 10.974 -4.030 1.00 0.00 P ATOM 194 OP1 A A 7 1.240 11.905 -5.161 1.00 0.00 O ATOM 195 OP2 A A 7 1.797 11.158 -2.776 1.00 0.00 O ATOM 196 O5' A A 7 -0.536 10.960 -3.668 1.00 0.00 O ATOM 197 C5' A A 7 -1.386 9.948 -4.209 1.00 0.00 C ATOM 198 C4' A A 7 -2.666 9.777 -3.422 1.00 0.00 C ATOM 199 O4' A A 7 -2.378 9.005 -2.243 1.00 0.00 O ATOM 200 C3' A A 7 -3.267 11.055 -2.885 1.00 0.00 C ATOM 201 O3' A A 7 -4.590 10.655 -2.516 1.00 0.00 O ATOM 202 C2' A A 7 -2.430 11.257 -1.629 1.00 0.00 C ATOM 203 O2' A A 7 -3.036 12.169 -0.732 1.00 0.00 O ATOM 204 C1' A A 7 -2.422 9.839 -1.076 1.00 0.00 C ATOM 205 N9 A A 7 -1.243 9.546 -0.236 1.00 0.00 N ATOM 206 C8 A A 7 0.070 9.884 -0.447 1.00 0.00 C ATOM 207 N7 A A 7 0.879 9.451 0.479 1.00 0.00 N ATOM 208 C5 A A 7 0.043 8.780 1.363 1.00 0.00 C ATOM 209 C6 A A 7 0.284 8.091 2.562 1.00 0.00 C ATOM 210 N6 A A 7 1.495 7.951 3.100 1.00 0.00 N ATOM 211 N1 A A 7 -0.768 7.542 3.190 1.00 0.00 N ATOM 212 C2 A A 7 -1.976 7.673 2.658 1.00 0.00 C ATOM 213 N3 A A 7 -2.334 8.291 1.543 1.00 0.00 N ATOM 214 C4 A A 7 -1.254 8.831 0.939 1.00 0.00 C ATOM 0 H5' A A 7 -0.848 9.000 -4.229 1.00 0.00 H new ATOM 0 H5'' A A 7 -1.630 10.198 -5.241 1.00 0.00 H new ATOM 0 H4' A A 7 -3.364 9.323 -4.126 1.00 0.00 H new ATOM 0 H3' A A 7 -3.287 11.934 -3.529 1.00 0.00 H new ATOM 0 H2' A A 7 -1.442 11.684 -1.804 1.00 0.00 H new ATOM 0 HO2' A A 7 -2.853 11.891 0.190 1.00 0.00 H new ATOM 0 H1' A A 7 -3.290 9.679 -0.436 1.00 0.00 H new ATOM 0 H8 A A 7 0.402 10.456 -1.301 1.00 0.00 H new ATOM 0 H61 A A 7 1.608 7.439 3.975 1.00 0.00 H new ATOM 0 H62 A A 7 2.309 8.356 2.637 1.00 0.00 H new ATOM 0 H2 A A 7 -2.780 7.211 3.212 1.00 0.00 H new ATOM 226 P U A 8 -5.755 11.633 -1.992 1.00 0.00 P ATOM 227 OP1 U A 8 -6.718 11.841 -3.097 1.00 0.00 O ATOM 228 OP2 U A 8 -5.168 12.796 -1.295 1.00 0.00 O ATOM 229 O5' U A 8 -6.438 10.662 -0.904 1.00 0.00 O ATOM 230 C5' U A 8 -6.321 9.238 -1.078 1.00 0.00 C ATOM 231 C4' U A 8 -5.827 8.527 0.182 1.00 0.00 C ATOM 232 O4' U A 8 -4.766 9.280 0.784 1.00 0.00 O ATOM 233 C3' U A 8 -6.878 8.381 1.277 1.00 0.00 C ATOM 234 O3' U A 8 -6.522 7.231 2.059 1.00 0.00 O ATOM 235 C2' U A 8 -6.624 9.607 2.128 1.00 0.00 C ATOM 236 O2' U A 8 -7.137 9.441 3.451 1.00 0.00 O ATOM 237 C1' U A 8 -5.115 9.639 2.124 1.00 0.00 C ATOM 238 N1 U A 8 -4.579 10.979 2.412 1.00 0.00 N ATOM 239 C2 U A 8 -4.526 11.383 3.737 1.00 0.00 C ATOM 240 O2 U A 8 -4.882 10.661 4.666 1.00 0.00 O ATOM 241 N3 U A 8 -4.040 12.657 3.957 1.00 0.00 N ATOM 242 C4 U A 8 -3.612 13.544 2.990 1.00 0.00 C ATOM 243 O4 U A 8 -3.200 14.656 3.314 1.00 0.00 O ATOM 244 C5 U A 8 -3.699 13.047 1.637 1.00 0.00 C ATOM 245 C6 U A 8 -4.172 11.797 1.396 1.00 0.00 C ATOM 0 H5' U A 8 -5.634 9.032 -1.899 1.00 0.00 H new ATOM 0 H5'' U A 8 -7.291 8.830 -1.363 1.00 0.00 H new ATOM 0 H4' U A 8 -5.526 7.538 -0.165 1.00 0.00 H new ATOM 0 H3' U A 8 -7.902 8.284 0.917 1.00 0.00 H new ATOM 0 H2' U A 8 -7.100 10.518 1.764 1.00 0.00 H new ATOM 0 HO2' U A 8 -6.513 9.835 4.096 1.00 0.00 H new ATOM 0 H1' U A 8 -4.709 8.977 2.889 1.00 0.00 H new ATOM 0 H3 U A 8 -3.993 12.972 4.926 1.00 0.00 H new ATOM 0 H5 U A 8 -3.387 13.672 0.813 1.00 0.00 H new ATOM 0 H6 U A 8 -4.228 11.441 0.378 1.00 0.00 H new ATOM 256 P A A 9 -7.659 6.308 2.737 1.00 0.00 P ATOM 257 OP1 A A 9 -8.143 6.989 3.959 1.00 0.00 O ATOM 258 OP2 A A 9 -7.139 4.925 2.823 1.00 0.00 O ATOM 259 O5' A A 9 -8.840 6.341 1.641 1.00 0.00 O ATOM 260 C5' A A 9 -9.204 5.164 0.911 1.00 0.00 C ATOM 261 C4' A A 9 -9.690 5.512 -0.495 1.00 0.00 C ATOM 262 O4' A A 9 -9.070 6.745 -0.907 1.00 0.00 O ATOM 263 C3' A A 9 -9.307 4.507 -1.583 1.00 0.00 C ATOM 264 O3' A A 9 -10.454 3.686 -1.843 1.00 0.00 O ATOM 265 C2' A A 9 -9.091 5.392 -2.803 1.00 0.00 C ATOM 266 O2' A A 9 -10.338 5.786 -3.380 1.00 0.00 O ATOM 267 C1' A A 9 -8.398 6.577 -2.162 1.00 0.00 C ATOM 268 N9 A A 9 -6.966 6.317 -1.917 1.00 0.00 N ATOM 269 C8 A A 9 -6.367 5.794 -0.801 1.00 0.00 C ATOM 270 N7 A A 9 -5.072 5.670 -0.909 1.00 0.00 N ATOM 271 C5 A A 9 -4.800 6.151 -2.185 1.00 0.00 C ATOM 272 C6 A A 9 -3.608 6.295 -2.912 1.00 0.00 C ATOM 273 N6 A A 9 -2.410 5.959 -2.440 1.00 0.00 N ATOM 274 N1 A A 9 -3.690 6.806 -4.149 1.00 0.00 N ATOM 275 C2 A A 9 -4.880 7.150 -4.625 1.00 0.00 C ATOM 276 N3 A A 9 -6.067 7.065 -4.048 1.00 0.00 N ATOM 277 C4 A A 9 -5.947 6.548 -2.808 1.00 0.00 C ATOM 0 H5' A A 9 -9.988 4.629 1.447 1.00 0.00 H new ATOM 0 H5'' A A 9 -8.347 4.494 0.846 1.00 0.00 H new ATOM 0 H4' A A 9 -10.776 5.543 -0.411 1.00 0.00 H new ATOM 0 H3' A A 9 -8.452 3.880 -1.328 1.00 0.00 H new ATOM 0 H2' A A 9 -8.539 4.920 -3.616 1.00 0.00 H new ATOM 0 HO2' A A 9 -10.685 5.058 -3.937 1.00 0.00 H new ATOM 0 H1' A A 9 -8.444 7.454 -2.807 1.00 0.00 H new ATOM 0 H8 A A 9 -6.915 5.511 0.085 1.00 0.00 H new ATOM 0 H61 A A 9 -1.580 6.088 -3.018 1.00 0.00 H new ATOM 0 H62 A A 9 -2.322 5.573 -1.500 1.00 0.00 H new ATOM 0 H2 A A 9 -4.879 7.557 -5.625 1.00 0.00 H new ATOM 289 P G A 10 -10.384 2.495 -2.933 1.00 0.00 P ATOM 290 OP1 G A 10 -11.751 1.963 -3.124 1.00 0.00 O ATOM 291 OP2 G A 10 -9.282 1.582 -2.555 1.00 0.00 O ATOM 292 O5' G A 10 -9.955 3.283 -4.272 1.00 0.00 O ATOM 293 C5' G A 10 -10.174 2.724 -5.571 1.00 0.00 C ATOM 294 C4' G A 10 -8.891 2.178 -6.195 1.00 0.00 C ATOM 295 O4' G A 10 -7.823 3.110 -5.986 1.00 0.00 O ATOM 296 C3' G A 10 -8.364 0.891 -5.594 1.00 0.00 C ATOM 297 O3' G A 10 -8.968 -0.196 -6.306 1.00 0.00 O ATOM 298 C2' G A 10 -6.893 0.932 -5.981 1.00 0.00 C ATOM 299 O2' G A 10 -6.714 0.535 -7.344 1.00 0.00 O ATOM 300 C1' G A 10 -6.573 2.417 -5.810 1.00 0.00 C ATOM 301 N9 G A 10 -6.048 2.708 -4.465 1.00 0.00 N ATOM 302 C8 G A 10 -6.747 2.909 -3.305 1.00 0.00 C ATOM 303 N7 G A 10 -5.990 3.098 -2.261 1.00 0.00 N ATOM 304 C5 G A 10 -4.697 3.023 -2.766 1.00 0.00 C ATOM 305 C6 G A 10 -3.449 3.151 -2.099 1.00 0.00 C ATOM 306 O6 G A 10 -3.241 3.354 -0.904 1.00 0.00 O ATOM 307 N1 G A 10 -2.383 3.009 -2.972 1.00 0.00 N ATOM 308 C2 G A 10 -2.498 2.771 -4.322 1.00 0.00 C ATOM 309 N2 G A 10 -1.365 2.663 -5.016 1.00 0.00 N ATOM 310 N3 G A 10 -3.665 2.648 -4.961 1.00 0.00 N ATOM 311 C4 G A 10 -4.718 2.784 -4.119 1.00 0.00 C ATOM 0 H5' G A 10 -10.597 3.487 -6.225 1.00 0.00 H new ATOM 0 H5'' G A 10 -10.909 1.923 -5.499 1.00 0.00 H new ATOM 0 H4' G A 10 -9.168 2.005 -7.235 1.00 0.00 H new ATOM 0 H3' G A 10 -8.548 0.781 -4.525 1.00 0.00 H new ATOM 0 H2' G A 10 -6.261 0.265 -5.395 1.00 0.00 H new ATOM 0 HO2' G A 10 -6.858 -0.431 -7.425 1.00 0.00 H new ATOM 0 H1' G A 10 -5.812 2.726 -6.527 1.00 0.00 H new ATOM 0 H8 G A 10 -7.826 2.911 -3.259 1.00 0.00 H new ATOM 0 H1 G A 10 -1.442 3.087 -2.585 1.00 0.00 H new ATOM 0 H21 G A 10 -1.397 2.487 -6.020 1.00 0.00 H new ATOM 0 H22 G A 10 -0.466 2.757 -4.543 1.00 0.00 H new ATOM 323 P G A 11 -8.702 -1.722 -5.862 1.00 0.00 P ATOM 324 OP1 G A 11 -9.681 -2.584 -6.560 1.00 0.00 O ATOM 325 OP2 G A 11 -8.604 -1.766 -4.385 1.00 0.00 O ATOM 326 O5' G A 11 -7.242 -2.016 -6.480 1.00 0.00 O ATOM 327 C5' G A 11 -6.113 -2.246 -5.629 1.00 0.00 C ATOM 328 C4' G A 11 -4.818 -1.768 -6.282 1.00 0.00 C ATOM 329 O4' G A 11 -4.421 -0.525 -5.690 1.00 0.00 O ATOM 330 C3' G A 11 -3.623 -2.680 -6.076 1.00 0.00 C ATOM 331 O3' G A 11 -3.565 -3.553 -7.208 1.00 0.00 O ATOM 332 C2' G A 11 -2.438 -1.729 -6.175 1.00 0.00 C ATOM 333 O2' G A 11 -2.100 -1.481 -7.542 1.00 0.00 O ATOM 334 C1' G A 11 -2.995 -0.463 -5.523 1.00 0.00 C ATOM 335 N9 G A 11 -2.688 -0.386 -4.079 1.00 0.00 N ATOM 336 C8 G A 11 -3.552 -0.213 -3.028 1.00 0.00 C ATOM 337 N7 G A 11 -2.962 -0.168 -1.866 1.00 0.00 N ATOM 338 C5 G A 11 -1.615 -0.325 -2.167 1.00 0.00 C ATOM 339 C6 G A 11 -0.486 -0.359 -1.302 1.00 0.00 C ATOM 340 O6 G A 11 -0.462 -0.252 -0.079 1.00 0.00 O ATOM 341 N1 G A 11 0.693 -0.534 -2.008 1.00 0.00 N ATOM 342 C2 G A 11 0.784 -0.663 -3.374 1.00 0.00 C ATOM 343 N2 G A 11 2.003 -0.828 -3.885 1.00 0.00 N ATOM 344 N3 G A 11 -0.267 -0.633 -4.196 1.00 0.00 N ATOM 345 C4 G A 11 -1.433 -0.460 -3.522 1.00 0.00 C ATOM 0 H5' G A 11 -6.037 -3.309 -5.402 1.00 0.00 H new ATOM 0 H5'' G A 11 -6.258 -1.727 -4.681 1.00 0.00 H new ATOM 0 H4' G A 11 -5.054 -1.717 -7.345 1.00 0.00 H new ATOM 0 H3' G A 11 -3.652 -3.254 -5.150 1.00 0.00 H new ATOM 0 H2' G A 11 -1.528 -2.107 -5.709 1.00 0.00 H new ATOM 0 HO2' G A 11 -2.542 -2.143 -8.114 1.00 0.00 H new ATOM 0 H1' G A 11 -2.545 0.414 -5.988 1.00 0.00 H new ATOM 0 H8 G A 11 -4.621 -0.122 -3.151 1.00 0.00 H new ATOM 0 H1 G A 11 1.561 -0.570 -1.473 1.00 0.00 H new ATOM 0 H21 G A 11 2.124 -0.929 -4.893 1.00 0.00 H new ATOM 0 H22 G A 11 2.815 -0.854 -3.268 1.00 0.00 H new ATOM 357 P G A 12 -3.236 -5.120 -7.030 1.00 0.00 P ATOM 358 OP1 G A 12 -4.002 -5.872 -8.049 1.00 0.00 O ATOM 359 OP2 G A 12 -3.374 -5.466 -5.598 1.00 0.00 O ATOM 360 O5' G A 12 -1.674 -5.193 -7.416 1.00 0.00 O ATOM 361 C5' G A 12 -1.033 -6.453 -7.643 1.00 0.00 C ATOM 362 C4' G A 12 0.445 -6.413 -7.262 1.00 0.00 C ATOM 363 O4' G A 12 0.779 -5.102 -6.792 1.00 0.00 O ATOM 364 C3' G A 12 0.828 -7.331 -6.111 1.00 0.00 C ATOM 365 O3' G A 12 1.283 -8.561 -6.684 1.00 0.00 O ATOM 366 C2' G A 12 2.036 -6.638 -5.502 1.00 0.00 C ATOM 367 O2' G A 12 3.220 -6.930 -6.250 1.00 0.00 O ATOM 368 C1' G A 12 1.657 -5.166 -5.656 1.00 0.00 C ATOM 369 N9 G A 12 0.935 -4.649 -4.474 1.00 0.00 N ATOM 370 C8 G A 12 -0.349 -4.173 -4.394 1.00 0.00 C ATOM 371 N7 G A 12 -0.696 -3.792 -3.198 1.00 0.00 N ATOM 372 C5 G A 12 0.437 -4.033 -2.428 1.00 0.00 C ATOM 373 C6 G A 12 0.658 -3.815 -1.042 1.00 0.00 C ATOM 374 O6 G A 12 -0.121 -3.359 -0.208 1.00 0.00 O ATOM 375 N1 G A 12 1.937 -4.191 -0.664 1.00 0.00 N ATOM 376 C2 G A 12 2.890 -4.713 -1.510 1.00 0.00 C ATOM 377 N2 G A 12 4.073 -5.016 -0.976 1.00 0.00 N ATOM 378 N3 G A 12 2.693 -4.921 -2.813 1.00 0.00 N ATOM 379 C4 G A 12 1.445 -4.558 -3.200 1.00 0.00 C ATOM 0 H5' G A 12 -1.130 -6.727 -8.694 1.00 0.00 H new ATOM 0 H5'' G A 12 -1.537 -7.227 -7.064 1.00 0.00 H new ATOM 0 H4' G A 12 0.968 -6.723 -8.167 1.00 0.00 H new ATOM 0 H3' G A 12 0.021 -7.518 -5.402 1.00 0.00 H new ATOM 0 H2' G A 12 2.251 -6.942 -4.477 1.00 0.00 H new ATOM 0 HO2' G A 12 3.008 -7.571 -6.960 1.00 0.00 H new ATOM 0 H1' G A 12 2.558 -4.564 -5.772 1.00 0.00 H new ATOM 0 H8 G A 12 -1.012 -4.119 -5.245 1.00 0.00 H new ATOM 0 H1 G A 12 2.192 -4.072 0.316 1.00 0.00 H new ATOM 0 H21 G A 12 4.812 -5.405 -1.561 1.00 0.00 H new ATOM 0 H22 G A 12 4.239 -4.858 0.018 1.00 0.00 H new ATOM 391 P U A 13 1.051 -9.959 -5.917 1.00 0.00 P ATOM 392 OP1 U A 13 1.486 -11.055 -6.811 1.00 0.00 O ATOM 393 OP2 U A 13 -0.319 -9.962 -5.360 1.00 0.00 O ATOM 394 O5' U A 13 2.092 -9.864 -4.691 1.00 0.00 O ATOM 395 C5' U A 13 3.502 -9.861 -4.931 1.00 0.00 C ATOM 396 C4' U A 13 4.291 -9.629 -3.645 1.00 0.00 C ATOM 397 O4' U A 13 4.001 -8.320 -3.144 1.00 0.00 O ATOM 398 C3' U A 13 3.925 -10.553 -2.498 1.00 0.00 C ATOM 399 O3' U A 13 4.813 -11.675 -2.559 1.00 0.00 O ATOM 400 C2' U A 13 4.306 -9.740 -1.270 1.00 0.00 C ATOM 401 O2' U A 13 5.710 -9.836 -1.013 1.00 0.00 O ATOM 402 C1' U A 13 3.939 -8.322 -1.706 1.00 0.00 C ATOM 403 N1 U A 13 2.575 -7.939 -1.279 1.00 0.00 N ATOM 404 C2 U A 13 2.418 -7.480 0.018 1.00 0.00 C ATOM 405 O2 U A 13 3.355 -7.404 0.811 1.00 0.00 O ATOM 406 N3 U A 13 1.138 -7.117 0.381 1.00 0.00 N ATOM 407 C4 U A 13 0.016 -7.170 -0.424 1.00 0.00 C ATOM 408 O4 U A 13 -1.074 -6.813 0.017 1.00 0.00 O ATOM 409 C5 U A 13 0.257 -7.662 -1.761 1.00 0.00 C ATOM 410 C6 U A 13 1.508 -8.024 -2.138 1.00 0.00 C ATOM 0 H5' U A 13 3.747 -9.083 -5.654 1.00 0.00 H new ATOM 0 H5'' U A 13 3.798 -10.812 -5.374 1.00 0.00 H new ATOM 0 H4' U A 13 5.330 -9.795 -3.930 1.00 0.00 H new ATOM 0 H3' U A 13 2.888 -10.889 -2.506 1.00 0.00 H new ATOM 0 H2' U A 13 3.814 -10.067 -0.354 1.00 0.00 H new ATOM 0 HO2' U A 13 6.112 -10.483 -1.630 1.00 0.00 H new ATOM 0 H1' U A 13 4.623 -7.606 -1.250 1.00 0.00 H new ATOM 0 H3 U A 13 1.007 -6.777 1.334 1.00 0.00 H new ATOM 0 H5 U A 13 -0.561 -7.742 -2.462 1.00 0.00 H new ATOM 0 H6 U A 13 1.669 -8.389 -3.142 1.00 0.00 H new ATOM 421 P C A 14 4.415 -13.075 -1.867 1.00 0.00 P ATOM 422 OP1 C A 14 5.527 -14.028 -2.080 1.00 0.00 O ATOM 423 OP2 C A 14 3.045 -13.433 -2.298 1.00 0.00 O ATOM 424 O5' C A 14 4.367 -12.692 -0.302 1.00 0.00 O ATOM 425 C5' C A 14 5.576 -12.493 0.438 1.00 0.00 C ATOM 426 C4' C A 14 5.295 -12.266 1.921 1.00 0.00 C ATOM 427 O4' C A 14 4.698 -10.981 2.095 1.00 0.00 O ATOM 428 C3' C A 14 4.291 -13.229 2.534 1.00 0.00 C ATOM 429 O3' C A 14 4.940 -14.429 2.964 1.00 0.00 O ATOM 430 C2' C A 14 3.789 -12.432 3.733 1.00 0.00 C ATOM 431 O2' C A 14 4.696 -12.553 4.832 1.00 0.00 O ATOM 432 C1' C A 14 3.783 -10.998 3.201 1.00 0.00 C ATOM 433 N1 C A 14 2.446 -10.580 2.726 1.00 0.00 N ATOM 434 C2 C A 14 1.643 -9.865 3.605 1.00 0.00 C ATOM 435 O2 C A 14 2.045 -9.594 4.736 1.00 0.00 O ATOM 436 N3 C A 14 0.408 -9.474 3.189 1.00 0.00 N ATOM 437 C4 C A 14 -0.027 -9.773 1.958 1.00 0.00 C ATOM 438 N4 C A 14 -1.246 -9.361 1.613 1.00 0.00 N ATOM 439 C5 C A 14 0.794 -10.509 1.047 1.00 0.00 C ATOM 440 C6 C A 14 2.013 -10.891 1.468 1.00 0.00 C ATOM 0 H5' C A 14 6.114 -11.636 0.033 1.00 0.00 H new ATOM 0 H5'' C A 14 6.224 -13.361 0.318 1.00 0.00 H new ATOM 0 H4' C A 14 6.264 -12.394 2.404 1.00 0.00 H new ATOM 0 H3' C A 14 3.505 -13.547 1.849 1.00 0.00 H new ATOM 0 H2' C A 14 2.819 -12.766 4.103 1.00 0.00 H new ATOM 0 HO2' C A 14 5.203 -13.388 4.748 1.00 0.00 H new ATOM 0 HO3' C A 14 4.279 -15.036 3.357 1.00 0.00 H new ATOM 0 H1' C A 14 4.064 -10.309 3.998 1.00 0.00 H new ATOM 0 H41 C A 14 -1.611 -9.570 0.684 1.00 0.00 H new ATOM 0 H42 C A 14 -1.814 -8.836 2.278 1.00 0.00 H new ATOM 0 H5 C A 14 0.446 -10.750 0.053 1.00 0.00 H new ATOM 0 H6 C A 14 2.656 -11.450 0.804 1.00 0.00 H new TER 453 C A 14