USER MOD reduce.3.24.130724 H: found=0, std=0, add=155, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 155 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 13 G O2' : rot -11:sc= -4.18! USER MOD Single : A 13 G O5' : rot 34:sc= -0.975! USER MOD Single : A 14 G O2' : rot -17:sc= -0.0761 USER MOD Single : A 15 C O2' : rot -14:sc= -0.499 USER MOD Single : A 16 A O2' : rot -2:sc= -5.36! USER MOD Single : A 17 C O2' : rot -3:sc= -3.42! USER MOD Single : A 18 U O2' : rot 176:sc= -6.43! USER MOD Single : A 19 G O2' : rot -22:sc= 0.189 USER MOD Single : A 19 G O3' : rot 180:sc= 0.175 USER MOD Single : B 59 C O2' : rot -14:sc= -2.66! USER MOD Single : B 59 C O5' : rot 32:sc= -2.64! USER MOD Single : B 60 A O2' : rot -18:sc= 0.226 USER MOD Single : B 61 G O2' : rot -136:sc= -1.59 USER MOD Single : B 62 U O2' : rot -20:sc= -1.48! USER MOD Single : B 63 G O2' : rot -4:sc= -0.267 USER MOD Single : B 64 U O2' : rot -6:sc= 0.0674 USER MOD Single : B 65 C O2' : rot -25:sc= 0.158 USER MOD Single : B 65 C O3' : rot 180:sc= 0.179 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 4.905 -6.650 -5.330 1.00 0.00 O ATOM 2 C5' G A 13 5.259 -7.385 -6.504 1.00 0.00 C ATOM 3 C4' G A 13 4.102 -8.250 -6.994 1.00 0.00 C ATOM 4 O4' G A 13 3.881 -9.369 -6.119 1.00 0.00 O ATOM 5 C3' G A 13 2.795 -7.462 -7.002 1.00 0.00 C ATOM 6 O3' G A 13 2.540 -7.006 -8.331 1.00 0.00 O ATOM 7 C2' G A 13 1.763 -8.513 -6.648 1.00 0.00 C ATOM 8 O2' G A 13 1.378 -9.285 -7.793 1.00 0.00 O ATOM 9 C1' G A 13 2.529 -9.348 -5.642 1.00 0.00 C ATOM 10 N9 G A 13 2.448 -8.745 -4.300 1.00 0.00 N ATOM 11 C8 G A 13 3.124 -7.688 -3.787 1.00 0.00 C ATOM 12 N7 G A 13 2.852 -7.334 -2.576 1.00 0.00 N ATOM 13 C5 G A 13 1.870 -8.263 -2.223 1.00 0.00 C ATOM 14 C6 G A 13 1.153 -8.411 -1.005 1.00 0.00 C ATOM 15 O6 G A 13 1.245 -7.739 0.022 1.00 0.00 O ATOM 16 N1 G A 13 0.257 -9.470 -1.070 1.00 0.00 N ATOM 17 C2 G A 13 0.069 -10.290 -2.164 1.00 0.00 C ATOM 18 N2 G A 13 -0.839 -11.255 -2.028 1.00 0.00 N ATOM 19 N3 G A 13 0.739 -10.158 -3.313 1.00 0.00 N ATOM 20 C4 G A 13 1.618 -9.132 -3.275 1.00 0.00 C ATOM 0 H5' G A 13 6.122 -8.016 -6.293 1.00 0.00 H new ATOM 0 H5'' G A 13 5.556 -6.693 -7.292 1.00 0.00 H new ATOM 0 H4' G A 13 4.375 -8.581 -7.996 1.00 0.00 H new ATOM 0 H3' G A 13 2.798 -6.601 -6.333 1.00 0.00 H new ATOM 0 H2' G A 13 0.824 -8.108 -6.271 1.00 0.00 H new ATOM 0 HO2' G A 13 1.724 -8.860 -8.605 1.00 0.00 H new ATOM 0 HO5' G A 13 4.293 -7.184 -4.782 1.00 0.00 H new ATOM 0 H1' G A 13 2.122 -10.355 -5.551 1.00 0.00 H new ATOM 0 H8 G A 13 3.864 -7.161 -4.371 1.00 0.00 H new ATOM 0 H1 G A 13 -0.308 -9.657 -0.242 1.00 0.00 H new ATOM 0 H21 G A 13 -1.024 -11.894 -2.801 1.00 0.00 H new ATOM 0 H22 G A 13 -1.349 -11.355 -1.151 1.00 0.00 H new ATOM 33 P G A 14 1.548 -5.762 -8.578 1.00 0.00 P ATOM 34 OP1 G A 14 1.428 -5.548 -10.037 1.00 0.00 O ATOM 35 OP2 G A 14 1.976 -4.648 -7.702 1.00 0.00 O ATOM 36 O5' G A 14 0.141 -6.323 -8.032 1.00 0.00 O ATOM 37 C5' G A 14 -0.505 -7.409 -8.698 1.00 0.00 C ATOM 38 C4' G A 14 -1.932 -7.617 -8.196 1.00 0.00 C ATOM 39 O4' G A 14 -1.977 -8.364 -6.968 1.00 0.00 O ATOM 40 C3' G A 14 -2.603 -6.300 -7.856 1.00 0.00 C ATOM 41 O3' G A 14 -3.167 -5.724 -9.036 1.00 0.00 O ATOM 42 C2' G A 14 -3.721 -6.777 -6.958 1.00 0.00 C ATOM 43 O2' G A 14 -4.769 -7.402 -7.709 1.00 0.00 O ATOM 44 C1' G A 14 -2.973 -7.782 -6.100 1.00 0.00 C ATOM 45 N9 G A 14 -2.353 -7.130 -4.937 1.00 0.00 N ATOM 46 C8 G A 14 -1.142 -6.535 -4.807 1.00 0.00 C ATOM 47 N7 G A 14 -0.824 -6.081 -3.642 1.00 0.00 N ATOM 48 C5 G A 14 -1.960 -6.405 -2.893 1.00 0.00 C ATOM 49 C6 G A 14 -2.242 -6.173 -1.524 1.00 0.00 C ATOM 50 O6 G A 14 -1.529 -5.631 -0.685 1.00 0.00 O ATOM 51 N1 G A 14 -3.500 -6.657 -1.173 1.00 0.00 N ATOM 52 C2 G A 14 -4.376 -7.285 -2.030 1.00 0.00 C ATOM 53 N2 G A 14 -5.540 -7.667 -1.505 1.00 0.00 N ATOM 54 N3 G A 14 -4.116 -7.509 -3.319 1.00 0.00 N ATOM 55 C4 G A 14 -2.898 -7.046 -3.682 1.00 0.00 C ATOM 0 H5' G A 14 0.070 -8.322 -8.545 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.522 -7.218 -9.771 1.00 0.00 H new ATOM 0 H4' G A 14 -2.432 -8.143 -9.009 1.00 0.00 H new ATOM 0 H3' G A 14 -1.940 -5.552 -7.420 1.00 0.00 H new ATOM 0 H2' G A 14 -4.226 -5.988 -6.400 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.682 -7.161 -8.655 1.00 0.00 H new ATOM 0 H1' G A 14 -3.642 -8.541 -5.694 1.00 0.00 H new ATOM 0 H8 G A 14 -0.469 -6.444 -5.647 1.00 0.00 H new ATOM 0 H1 G A 14 -3.796 -6.537 -0.204 1.00 0.00 H new ATOM 0 H21 G A 14 -6.232 -8.138 -2.088 1.00 0.00 H new ATOM 0 H22 G A 14 -5.738 -7.489 -0.520 1.00 0.00 H new ATOM 67 P C A 15 -3.341 -4.126 -9.126 1.00 0.00 P ATOM 68 OP1 C A 15 -4.060 -3.802 -10.378 1.00 0.00 O ATOM 69 OP2 C A 15 -2.033 -3.496 -8.836 1.00 0.00 O ATOM 70 O5' C A 15 -4.326 -3.840 -7.887 1.00 0.00 O ATOM 71 C5' C A 15 -5.683 -4.271 -7.945 1.00 0.00 C ATOM 72 C4' C A 15 -6.345 -4.255 -6.572 1.00 0.00 C ATOM 73 O4' C A 15 -5.637 -5.069 -5.634 1.00 0.00 O ATOM 74 C3' C A 15 -6.331 -2.886 -5.928 1.00 0.00 C ATOM 75 O3' C A 15 -7.398 -2.094 -6.451 1.00 0.00 O ATOM 76 C2' C A 15 -6.655 -3.256 -4.498 1.00 0.00 C ATOM 77 O2' C A 15 -8.049 -3.545 -4.333 1.00 0.00 O ATOM 78 C1' C A 15 -5.798 -4.504 -4.316 1.00 0.00 C ATOM 79 N1 C A 15 -4.501 -4.152 -3.701 1.00 0.00 N ATOM 80 C2 C A 15 -4.496 -3.924 -2.335 1.00 0.00 C ATOM 81 O2 C A 15 -5.545 -3.977 -1.700 1.00 0.00 O ATOM 82 N3 C A 15 -3.312 -3.628 -1.734 1.00 0.00 N ATOM 83 C4 C A 15 -2.180 -3.558 -2.443 1.00 0.00 C ATOM 84 N4 C A 15 -1.040 -3.273 -1.818 1.00 0.00 N ATOM 85 C5 C A 15 -2.180 -3.789 -3.854 1.00 0.00 C ATOM 86 C6 C A 15 -3.355 -4.076 -4.440 1.00 0.00 C ATOM 0 H5' C A 15 -5.726 -5.279 -8.357 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.240 -3.625 -8.624 1.00 0.00 H new ATOM 0 H4' C A 15 -7.358 -4.606 -6.767 1.00 0.00 H new ATOM 0 H3' C A 15 -5.410 -2.322 -6.074 1.00 0.00 H new ATOM 0 H2' C A 15 -6.455 -2.466 -3.774 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.543 -3.235 -5.121 1.00 0.00 H new ATOM 0 H1' C A 15 -6.262 -5.227 -3.646 1.00 0.00 H new ATOM 0 H41 C A 15 -0.169 -3.216 -2.346 1.00 0.00 H new ATOM 0 H42 C A 15 -1.037 -3.111 -0.811 1.00 0.00 H new ATOM 0 H5 C A 15 -1.267 -3.735 -4.429 1.00 0.00 H new ATOM 0 H6 C A 15 -3.393 -4.248 -5.505 1.00 0.00 H new ATOM 98 P A A 16 -7.327 -0.487 -6.355 1.00 0.00 P ATOM 99 OP1 A A 16 -8.579 0.066 -6.917 1.00 0.00 O ATOM 100 OP2 A A 16 -6.019 -0.050 -6.896 1.00 0.00 O ATOM 101 O5' A A 16 -7.328 -0.223 -4.764 1.00 0.00 O ATOM 102 C5' A A 16 -8.523 -0.412 -4.004 1.00 0.00 C ATOM 103 C4' A A 16 -8.303 -0.188 -2.507 1.00 0.00 C ATOM 104 O4' A A 16 -7.356 -1.109 -1.956 1.00 0.00 O ATOM 105 C3' A A 16 -7.709 1.175 -2.214 1.00 0.00 C ATOM 106 O3' A A 16 -8.757 2.141 -2.129 1.00 0.00 O ATOM 107 C2' A A 16 -7.142 0.965 -0.826 1.00 0.00 C ATOM 108 O2' A A 16 -8.159 1.061 0.178 1.00 0.00 O ATOM 109 C1' A A 16 -6.592 -0.446 -0.926 1.00 0.00 C ATOM 110 N9 A A 16 -5.155 -0.425 -1.247 1.00 0.00 N ATOM 111 C8 A A 16 -4.519 -0.699 -2.403 1.00 0.00 C ATOM 112 N7 A A 16 -3.230 -0.707 -2.395 1.00 0.00 N ATOM 113 C5 A A 16 -2.964 -0.387 -1.065 1.00 0.00 C ATOM 114 C6 A A 16 -1.777 -0.221 -0.354 1.00 0.00 C ATOM 115 N6 A A 16 -0.573 -0.412 -0.902 1.00 0.00 N ATOM 116 N1 A A 16 -1.882 0.106 0.948 1.00 0.00 N ATOM 117 C2 A A 16 -3.091 0.253 1.507 1.00 0.00 C ATOM 118 N3 A A 16 -4.267 0.114 0.925 1.00 0.00 N ATOM 119 C4 A A 16 -4.133 -0.207 -0.365 1.00 0.00 C ATOM 0 H5' A A 16 -8.898 -1.423 -4.166 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.291 0.274 -4.362 1.00 0.00 H new ATOM 0 H4' A A 16 -9.295 -0.307 -2.071 1.00 0.00 H new ATOM 0 H3' A A 16 -6.993 1.520 -2.960 1.00 0.00 H new ATOM 0 H2' A A 16 -6.400 1.709 -0.536 1.00 0.00 H new ATOM 0 HO2' A A 16 -9.016 1.280 -0.244 1.00 0.00 H new ATOM 0 H1' A A 16 -6.684 -0.977 0.022 1.00 0.00 H new ATOM 0 H8 A A 16 -5.072 -0.905 -3.308 1.00 0.00 H new ATOM 0 H61 A A 16 0.269 -0.279 -0.342 1.00 0.00 H new ATOM 0 H62 A A 16 -0.496 -0.691 -1.880 1.00 0.00 H new ATOM 0 H2 A A 16 -3.104 0.515 2.555 1.00 0.00 H new ATOM 131 P C A 17 -8.409 3.709 -2.235 1.00 0.00 P ATOM 132 OP1 C A 17 -9.661 4.474 -2.044 1.00 0.00 O ATOM 133 OP2 C A 17 -7.589 3.923 -3.449 1.00 0.00 O ATOM 134 O5' C A 17 -7.472 3.941 -0.945 1.00 0.00 O ATOM 135 C5' C A 17 -7.985 3.700 0.368 1.00 0.00 C ATOM 136 C4' C A 17 -6.911 3.850 1.444 1.00 0.00 C ATOM 137 O4' C A 17 -5.890 2.861 1.347 1.00 0.00 O ATOM 138 C3' C A 17 -6.177 5.165 1.326 1.00 0.00 C ATOM 139 O3' C A 17 -6.937 6.173 1.996 1.00 0.00 O ATOM 140 C2' C A 17 -4.921 4.891 2.128 1.00 0.00 C ATOM 141 O2' C A 17 -5.140 5.092 3.529 1.00 0.00 O ATOM 142 C1' C A 17 -4.648 3.423 1.811 1.00 0.00 C ATOM 143 N1 C A 17 -3.610 3.290 0.784 1.00 0.00 N ATOM 144 C2 C A 17 -2.294 3.262 1.200 1.00 0.00 C ATOM 145 O2 C A 17 -2.028 3.371 2.395 1.00 0.00 O ATOM 146 N3 C A 17 -1.324 3.114 0.254 1.00 0.00 N ATOM 147 C4 C A 17 -1.648 3.000 -1.043 1.00 0.00 C ATOM 148 N4 C A 17 -0.685 2.842 -1.951 1.00 0.00 N ATOM 149 C5 C A 17 -3.013 3.036 -1.460 1.00 0.00 C ATOM 150 C6 C A 17 -3.945 3.180 -0.524 1.00 0.00 C ATOM 0 H5' C A 17 -8.404 2.695 0.413 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.800 4.395 0.571 1.00 0.00 H new ATOM 0 H4' C A 17 -7.461 3.764 2.381 1.00 0.00 H new ATOM 0 H3' C A 17 -5.998 5.494 0.302 1.00 0.00 H new ATOM 0 H2' C A 17 -4.091 5.553 1.879 1.00 0.00 H new ATOM 0 HO2' C A 17 -6.053 5.418 3.674 1.00 0.00 H new ATOM 0 H1' C A 17 -4.286 2.901 2.696 1.00 0.00 H new ATOM 0 H41 C A 17 -0.925 2.755 -2.939 1.00 0.00 H new ATOM 0 H42 C A 17 0.291 2.808 -1.658 1.00 0.00 H new ATOM 0 H5 C A 17 -3.280 2.949 -2.503 1.00 0.00 H new ATOM 0 H6 C A 17 -4.986 3.210 -0.810 1.00 0.00 H new ATOM 162 P U A 18 -6.838 7.711 1.537 1.00 0.00 P ATOM 163 OP1 U A 18 -7.675 8.523 2.448 1.00 0.00 O ATOM 164 OP2 U A 18 -7.061 7.774 0.075 1.00 0.00 O ATOM 165 O5' U A 18 -5.294 8.059 1.827 1.00 0.00 O ATOM 166 C5' U A 18 -4.755 7.943 3.146 1.00 0.00 C ATOM 167 C4' U A 18 -3.262 8.242 3.161 1.00 0.00 C ATOM 168 O4' U A 18 -2.510 7.168 2.602 1.00 0.00 O ATOM 169 C3' U A 18 -2.956 9.455 2.302 1.00 0.00 C ATOM 170 O3' U A 18 -2.729 10.575 3.161 1.00 0.00 O ATOM 171 C2' U A 18 -1.654 9.142 1.589 1.00 0.00 C ATOM 172 O2' U A 18 -0.592 9.984 2.041 1.00 0.00 O ATOM 173 C1' U A 18 -1.370 7.684 1.903 1.00 0.00 C ATOM 174 N1 U A 18 -1.129 6.950 0.654 1.00 0.00 N ATOM 175 C2 U A 18 0.183 6.768 0.267 1.00 0.00 C ATOM 176 O2 U A 18 1.125 7.185 0.936 1.00 0.00 O ATOM 177 N3 U A 18 0.376 6.094 -0.923 1.00 0.00 N ATOM 178 C4 U A 18 -0.619 5.588 -1.745 1.00 0.00 C ATOM 179 O4 U A 18 -0.328 5.003 -2.786 1.00 0.00 O ATOM 180 C5 U A 18 -1.965 5.825 -1.257 1.00 0.00 C ATOM 181 C6 U A 18 -2.172 6.490 -0.095 1.00 0.00 C ATOM 0 H5' U A 18 -4.930 6.936 3.526 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.273 8.631 3.815 1.00 0.00 H new ATOM 0 H4' U A 18 -2.991 8.404 4.204 1.00 0.00 H new ATOM 0 H3' U A 18 -3.767 9.676 1.609 1.00 0.00 H new ATOM 0 H2' U A 18 -1.732 9.320 0.516 1.00 0.00 H new ATOM 0 HO2' U A 18 0.245 9.717 1.607 1.00 0.00 H new ATOM 0 H1' U A 18 -0.480 7.575 2.523 1.00 0.00 H new ATOM 0 H3 U A 18 1.340 5.956 -1.225 1.00 0.00 H new ATOM 0 H5 U A 18 -2.810 5.468 -1.826 1.00 0.00 H new ATOM 0 H6 U A 18 -3.183 6.659 0.245 1.00 0.00 H new ATOM 192 P G A 19 -2.591 12.060 2.551 1.00 0.00 P ATOM 193 OP1 G A 19 -2.866 13.035 3.629 1.00 0.00 O ATOM 194 OP2 G A 19 -3.355 12.117 1.285 1.00 0.00 O ATOM 195 O5' G A 19 -1.017 12.120 2.199 1.00 0.00 O ATOM 196 C5' G A 19 -0.057 12.160 3.261 1.00 0.00 C ATOM 197 C4' G A 19 1.371 11.883 2.783 1.00 0.00 C ATOM 198 O4' G A 19 1.520 10.563 2.274 1.00 0.00 O ATOM 199 C3' G A 19 1.776 12.771 1.627 1.00 0.00 C ATOM 200 O3' G A 19 2.122 14.090 2.065 1.00 0.00 O ATOM 201 C2' G A 19 2.988 12.015 1.094 1.00 0.00 C ATOM 202 O2' G A 19 4.180 12.373 1.800 1.00 0.00 O ATOM 203 C1' G A 19 2.610 10.554 1.337 1.00 0.00 C ATOM 204 N9 G A 19 2.227 9.907 0.070 1.00 0.00 N ATOM 205 C8 G A 19 0.999 9.645 -0.421 1.00 0.00 C ATOM 206 N7 G A 19 0.919 9.042 -1.557 1.00 0.00 N ATOM 207 C5 G A 19 2.266 8.878 -1.884 1.00 0.00 C ATOM 208 C6 G A 19 2.857 8.279 -3.025 1.00 0.00 C ATOM 209 O6 G A 19 2.298 7.761 -3.990 1.00 0.00 O ATOM 210 N1 G A 19 4.241 8.323 -2.963 1.00 0.00 N ATOM 211 C2 G A 19 4.977 8.878 -1.934 1.00 0.00 C ATOM 212 N2 G A 19 6.302 8.844 -2.071 1.00 0.00 N ATOM 213 N3 G A 19 4.428 9.442 -0.853 1.00 0.00 N ATOM 214 C4 G A 19 3.076 9.409 -0.891 1.00 0.00 C ATOM 0 H5' G A 19 -0.330 11.426 4.019 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.092 13.139 3.739 1.00 0.00 H new ATOM 0 H4' G A 19 1.983 12.058 3.668 1.00 0.00 H new ATOM 0 H3' G A 19 0.990 12.937 0.890 1.00 0.00 H new ATOM 0 H2' G A 19 3.206 12.234 0.049 1.00 0.00 H new ATOM 0 HO2' G A 19 4.058 13.248 2.225 1.00 0.00 H new ATOM 0 HO3' G A 19 2.380 14.634 1.292 1.00 0.00 H new ATOM 0 H1' G A 19 3.449 9.985 1.737 1.00 0.00 H new ATOM 0 H8 G A 19 0.110 9.932 0.121 1.00 0.00 H new ATOM 0 H1 G A 19 4.758 7.912 -3.740 1.00 0.00 H new ATOM 0 H21 G A 19 6.900 9.238 -1.345 1.00 0.00 H new ATOM 0 H22 G A 19 6.718 8.424 -2.902 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.643 4.685 -8.138 1.00 0.00 O ATOM 229 C5' C B 59 10.064 4.559 -8.129 1.00 0.00 C ATOM 230 C4' C B 59 10.714 5.404 -7.028 1.00 0.00 C ATOM 231 O4' C B 59 10.308 6.784 -7.114 1.00 0.00 O ATOM 232 C3' C B 59 10.278 4.946 -5.637 1.00 0.00 C ATOM 233 O3' C B 59 11.269 4.062 -5.109 1.00 0.00 O ATOM 234 C2' C B 59 10.316 6.235 -4.842 1.00 0.00 C ATOM 235 O2' C B 59 11.654 6.590 -4.471 1.00 0.00 O ATOM 236 C1' C B 59 9.743 7.199 -5.856 1.00 0.00 C ATOM 237 N1 C B 59 8.273 7.102 -5.879 1.00 0.00 N ATOM 238 C2 C B 59 7.562 7.688 -4.845 1.00 0.00 C ATOM 239 O2 C B 59 8.153 8.296 -3.956 1.00 0.00 O ATOM 240 N3 C B 59 6.204 7.560 -4.847 1.00 0.00 N ATOM 241 C4 C B 59 5.580 6.883 -5.824 1.00 0.00 C ATOM 242 N4 C B 59 4.251 6.778 -5.804 1.00 0.00 N ATOM 243 C5 C B 59 6.323 6.279 -6.885 1.00 0.00 C ATOM 244 C6 C B 59 7.650 6.419 -6.870 1.00 0.00 C ATOM 0 H5' C B 59 10.460 4.862 -9.098 1.00 0.00 H new ATOM 0 H5'' C B 59 10.333 3.512 -7.988 1.00 0.00 H new ATOM 0 H4' C B 59 11.788 5.289 -7.171 1.00 0.00 H new ATOM 0 H3' C B 59 9.315 4.436 -5.622 1.00 0.00 H new ATOM 0 H2' C B 59 9.780 6.200 -3.894 1.00 0.00 H new ATOM 0 HO2' C B 59 12.247 5.822 -4.609 1.00 0.00 H new ATOM 0 HO5' C B 59 8.392 5.584 -7.840 1.00 0.00 H new ATOM 0 H1' C B 59 9.980 8.238 -5.627 1.00 0.00 H new ATOM 0 H41 C B 59 3.769 6.265 -6.542 1.00 0.00 H new ATOM 0 H42 C B 59 3.717 7.210 -5.050 1.00 0.00 H new ATOM 0 H5 C B 59 5.828 5.729 -7.671 1.00 0.00 H new ATOM 0 H6 C B 59 8.238 5.980 -7.662 1.00 0.00 H new ATOM 257 P A B 60 10.861 2.950 -4.019 1.00 0.00 P ATOM 258 OP1 A B 60 12.089 2.238 -3.602 1.00 0.00 O ATOM 259 OP2 A B 60 9.708 2.187 -4.544 1.00 0.00 O ATOM 260 O5' A B 60 10.352 3.847 -2.781 1.00 0.00 O ATOM 261 C5' A B 60 11.236 4.774 -2.147 1.00 0.00 C ATOM 262 C4' A B 60 10.533 5.570 -1.051 1.00 0.00 C ATOM 263 O4' A B 60 9.604 6.525 -1.585 1.00 0.00 O ATOM 264 C3' A B 60 9.692 4.669 -0.167 1.00 0.00 C ATOM 265 O3' A B 60 10.521 4.130 0.869 1.00 0.00 O ATOM 266 C2' A B 60 8.725 5.665 0.436 1.00 0.00 C ATOM 267 O2' A B 60 9.334 6.414 1.495 1.00 0.00 O ATOM 268 C1' A B 60 8.417 6.548 -0.766 1.00 0.00 C ATOM 269 N9 A B 60 7.242 6.046 -1.509 1.00 0.00 N ATOM 270 C8 A B 60 7.173 5.284 -2.633 1.00 0.00 C ATOM 271 N7 A B 60 5.999 4.973 -3.069 1.00 0.00 N ATOM 272 C5 A B 60 5.172 5.601 -2.132 1.00 0.00 C ATOM 273 C6 A B 60 3.782 5.681 -1.995 1.00 0.00 C ATOM 274 N6 A B 60 2.931 5.090 -2.838 1.00 0.00 N ATOM 275 N1 A B 60 3.302 6.388 -0.954 1.00 0.00 N ATOM 276 C2 A B 60 4.140 6.982 -0.098 1.00 0.00 C ATOM 277 N3 A B 60 5.467 6.967 -0.134 1.00 0.00 N ATOM 278 C4 A B 60 5.923 6.255 -1.182 1.00 0.00 C ATOM 0 H5' A B 60 11.639 5.460 -2.892 1.00 0.00 H new ATOM 0 H5'' A B 60 12.082 4.235 -1.719 1.00 0.00 H new ATOM 0 H4' A B 60 11.337 6.059 -0.501 1.00 0.00 H new ATOM 0 H3' A B 60 9.220 3.832 -0.682 1.00 0.00 H new ATOM 0 H2' A B 60 7.846 5.212 0.894 1.00 0.00 H new ATOM 0 HO2' A B 60 10.140 5.949 1.803 1.00 0.00 H new ATOM 0 H1' A B 60 8.167 7.564 -0.461 1.00 0.00 H new ATOM 0 H8 A B 60 8.066 4.952 -3.141 1.00 0.00 H new ATOM 0 H61 A B 60 1.925 5.179 -2.693 1.00 0.00 H new ATOM 0 H62 A B 60 3.287 4.549 -3.626 1.00 0.00 H new ATOM 0 H2 A B 60 3.687 7.535 0.712 1.00 0.00 H new ATOM 290 P G B 61 10.357 2.590 1.320 1.00 0.00 P ATOM 291 OP1 G B 61 11.520 2.227 2.159 1.00 0.00 O ATOM 292 OP2 G B 61 10.034 1.788 0.119 1.00 0.00 O ATOM 293 O5' G B 61 9.053 2.634 2.260 1.00 0.00 O ATOM 294 C5' G B 61 9.128 3.190 3.573 1.00 0.00 C ATOM 295 C4' G B 61 7.742 3.416 4.167 1.00 0.00 C ATOM 296 O4' G B 61 6.972 4.298 3.347 1.00 0.00 O ATOM 297 C3' G B 61 6.938 2.127 4.232 1.00 0.00 C ATOM 298 O3' G B 61 7.118 1.528 5.517 1.00 0.00 O ATOM 299 C2' G B 61 5.500 2.595 4.133 1.00 0.00 C ATOM 300 O2' G B 61 4.929 2.822 5.426 1.00 0.00 O ATOM 301 C1' G B 61 5.597 3.883 3.330 1.00 0.00 C ATOM 302 N9 G B 61 5.112 3.644 1.961 1.00 0.00 N ATOM 303 C8 G B 61 5.795 3.383 0.819 1.00 0.00 C ATOM 304 N7 G B 61 5.106 3.175 -0.254 1.00 0.00 N ATOM 305 C5 G B 61 3.798 3.309 0.221 1.00 0.00 C ATOM 306 C6 G B 61 2.561 3.192 -0.466 1.00 0.00 C ATOM 307 O6 G B 61 2.368 2.946 -1.655 1.00 0.00 O ATOM 308 N1 G B 61 1.486 3.397 0.390 1.00 0.00 N ATOM 309 C2 G B 61 1.583 3.679 1.736 1.00 0.00 C ATOM 310 N2 G B 61 0.436 3.830 2.391 1.00 0.00 N ATOM 311 N3 G B 61 2.738 3.792 2.386 1.00 0.00 N ATOM 312 C4 G B 61 3.798 3.596 1.576 1.00 0.00 C ATOM 0 H5' G B 61 9.668 4.136 3.538 1.00 0.00 H new ATOM 0 H5'' G B 61 9.697 2.522 4.220 1.00 0.00 H new ATOM 0 H4' G B 61 7.913 3.826 5.162 1.00 0.00 H new ATOM 0 H3' G B 61 7.224 1.410 3.463 1.00 0.00 H new ATOM 0 H2' G B 61 4.849 1.856 3.666 1.00 0.00 H new ATOM 0 HO2' G B 61 4.023 2.449 5.454 1.00 0.00 H new ATOM 0 H1' G B 61 4.979 4.672 3.758 1.00 0.00 H new ATOM 0 H8 G B 61 6.874 3.350 0.807 1.00 0.00 H new ATOM 0 H1 G B 61 0.550 3.334 -0.010 1.00 0.00 H new ATOM 0 H21 G B 61 0.443 4.040 3.389 1.00 0.00 H new ATOM 0 H22 G B 61 -0.450 3.736 1.895 1.00 0.00 H new ATOM 324 P U B 62 6.590 0.030 5.797 1.00 0.00 P ATOM 325 OP1 U B 62 7.300 -0.501 6.982 1.00 0.00 O ATOM 326 OP2 U B 62 6.612 -0.719 4.522 1.00 0.00 O ATOM 327 O5' U B 62 5.052 0.298 6.203 1.00 0.00 O ATOM 328 C5' U B 62 4.759 0.987 7.422 1.00 0.00 C ATOM 329 C4' U B 62 3.312 1.476 7.495 1.00 0.00 C ATOM 330 O4' U B 62 2.980 2.310 6.378 1.00 0.00 O ATOM 331 C3' U B 62 2.292 0.353 7.432 1.00 0.00 C ATOM 332 O3' U B 62 2.087 -0.192 8.736 1.00 0.00 O ATOM 333 C2' U B 62 1.056 1.129 7.040 1.00 0.00 C ATOM 334 O2' U B 62 0.543 1.896 8.136 1.00 0.00 O ATOM 335 C1' U B 62 1.633 2.017 5.957 1.00 0.00 C ATOM 336 N1 U B 62 1.623 1.311 4.670 1.00 0.00 N ATOM 337 C2 U B 62 0.428 1.241 3.978 1.00 0.00 C ATOM 338 O2 U B 62 -0.616 1.705 4.426 1.00 0.00 O ATOM 339 N3 U B 62 0.475 0.597 2.754 1.00 0.00 N ATOM 340 C4 U B 62 1.601 0.031 2.176 1.00 0.00 C ATOM 341 O4 U B 62 1.538 -0.500 1.070 1.00 0.00 O ATOM 342 C5 U B 62 2.799 0.152 2.982 1.00 0.00 C ATOM 343 C6 U B 62 2.768 0.770 4.181 1.00 0.00 C ATOM 0 H5' U B 62 5.431 1.839 7.522 1.00 0.00 H new ATOM 0 H5'' U B 62 4.956 0.324 8.265 1.00 0.00 H new ATOM 0 H4' U B 62 3.265 2.000 8.449 1.00 0.00 H new ATOM 0 H3' U B 62 2.566 -0.472 6.774 1.00 0.00 H new ATOM 0 H2' U B 62 0.210 0.517 6.729 1.00 0.00 H new ATOM 0 HO2' U B 62 0.883 1.530 8.979 1.00 0.00 H new ATOM 0 H1' U B 62 1.055 2.931 5.819 1.00 0.00 H new ATOM 0 H3 U B 62 -0.398 0.533 2.230 1.00 0.00 H new ATOM 0 H5 U B 62 3.729 -0.258 2.618 1.00 0.00 H new ATOM 0 H6 U B 62 3.674 0.836 4.765 1.00 0.00 H new ATOM 354 P G B 63 1.534 -1.698 8.896 1.00 0.00 P ATOM 355 OP1 G B 63 1.317 -1.961 10.336 1.00 0.00 O ATOM 356 OP2 G B 63 2.404 -2.596 8.104 1.00 0.00 O ATOM 357 O5' G B 63 0.094 -1.623 8.173 1.00 0.00 O ATOM 358 C5' G B 63 -0.938 -0.782 8.696 1.00 0.00 C ATOM 359 C4' G B 63 -2.254 -0.944 7.935 1.00 0.00 C ATOM 360 O4' G B 63 -2.248 -0.247 6.686 1.00 0.00 O ATOM 361 C3' G B 63 -2.516 -2.391 7.564 1.00 0.00 C ATOM 362 O3' G B 63 -3.168 -3.025 8.665 1.00 0.00 O ATOM 363 C2' G B 63 -3.508 -2.234 6.425 1.00 0.00 C ATOM 364 O2' G B 63 -4.832 -1.981 6.905 1.00 0.00 O ATOM 365 C1' G B 63 -2.939 -1.036 5.694 1.00 0.00 C ATOM 366 N9 G B 63 -2.023 -1.469 4.625 1.00 0.00 N ATOM 367 C8 G B 63 -0.671 -1.506 4.612 1.00 0.00 C ATOM 368 N7 G B 63 -0.089 -1.864 3.521 1.00 0.00 N ATOM 369 C5 G B 63 -1.181 -2.112 2.688 1.00 0.00 C ATOM 370 C6 G B 63 -1.208 -2.543 1.340 1.00 0.00 C ATOM 371 O6 G B 63 -0.259 -2.788 0.601 1.00 0.00 O ATOM 372 N1 G B 63 -2.509 -2.673 0.876 1.00 0.00 N ATOM 373 C2 G B 63 -3.649 -2.424 1.614 1.00 0.00 C ATOM 374 N2 G B 63 -4.811 -2.636 0.996 1.00 0.00 N ATOM 375 N3 G B 63 -3.631 -2.012 2.885 1.00 0.00 N ATOM 376 C4 G B 63 -2.371 -1.876 3.358 1.00 0.00 C ATOM 0 H5' G B 63 -0.617 0.258 8.646 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.097 -1.016 9.748 1.00 0.00 H new ATOM 0 H4' G B 63 -3.011 -0.549 8.613 1.00 0.00 H new ATOM 0 H3' G B 63 -1.629 -2.972 7.313 1.00 0.00 H new ATOM 0 H2' G B 63 -3.615 -3.124 5.805 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.838 -2.021 7.884 1.00 0.00 H new ATOM 0 H1' G B 63 -3.724 -0.453 5.213 1.00 0.00 H new ATOM 0 H8 G B 63 -0.098 -1.244 5.489 1.00 0.00 H new ATOM 0 H1 G B 63 -2.634 -2.977 -0.089 1.00 0.00 H new ATOM 0 H21 G B 63 -5.688 -2.470 1.489 1.00 0.00 H new ATOM 0 H22 G B 63 -4.823 -2.964 0.030 1.00 0.00 H new ATOM 388 P U B 64 -2.798 -4.537 9.065 1.00 0.00 P ATOM 389 OP1 U B 64 -3.357 -4.814 10.407 1.00 0.00 O ATOM 390 OP2 U B 64 -1.355 -4.747 8.807 1.00 0.00 O ATOM 391 O5' U B 64 -3.632 -5.383 7.985 1.00 0.00 O ATOM 392 C5' U B 64 -5.040 -5.183 7.850 1.00 0.00 C ATOM 393 C4' U B 64 -5.587 -5.890 6.618 1.00 0.00 C ATOM 394 O4' U B 64 -5.378 -5.128 5.425 1.00 0.00 O ATOM 395 C3' U B 64 -4.865 -7.199 6.376 1.00 0.00 C ATOM 396 O3' U B 64 -5.520 -8.229 7.120 1.00 0.00 O ATOM 397 C2' U B 64 -5.114 -7.426 4.901 1.00 0.00 C ATOM 398 O2' U B 64 -6.398 -8.021 4.671 1.00 0.00 O ATOM 399 C1' U B 64 -5.048 -6.015 4.341 1.00 0.00 C ATOM 400 N1 U B 64 -3.717 -5.709 3.783 1.00 0.00 N ATOM 401 C2 U B 64 -3.550 -5.897 2.423 1.00 0.00 C ATOM 402 O2 U B 64 -4.451 -6.334 1.709 1.00 0.00 O ATOM 403 N3 U B 64 -2.309 -5.570 1.908 1.00 0.00 N ATOM 404 C4 U B 64 -1.232 -5.081 2.630 1.00 0.00 C ATOM 405 O4 U B 64 -0.170 -4.818 2.070 1.00 0.00 O ATOM 406 C5 U B 64 -1.495 -4.919 4.045 1.00 0.00 C ATOM 407 C6 U B 64 -2.702 -5.230 4.569 1.00 0.00 C ATOM 0 H5' U B 64 -5.252 -4.116 7.783 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.548 -5.554 8.740 1.00 0.00 H new ATOM 0 H4' U B 64 -6.649 -6.033 6.817 1.00 0.00 H new ATOM 0 H3' U B 64 -3.812 -7.193 6.658 1.00 0.00 H new ATOM 0 H2' U B 64 -4.403 -8.112 4.440 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.814 -8.244 5.530 1.00 0.00 H new ATOM 0 H1' U B 64 -5.748 -5.898 3.514 1.00 0.00 H new ATOM 0 H3 U B 64 -2.174 -5.701 0.905 1.00 0.00 H new ATOM 0 H5 U B 64 -0.715 -4.544 4.691 1.00 0.00 H new ATOM 0 H6 U B 64 -2.869 -5.098 5.628 1.00 0.00 H new ATOM 418 P C B 65 -4.656 -9.376 7.847 1.00 0.00 P ATOM 419 OP1 C B 65 -5.543 -10.103 8.782 1.00 0.00 O ATOM 420 OP2 C B 65 -3.401 -8.768 8.342 1.00 0.00 O ATOM 421 O5' C B 65 -4.293 -10.362 6.629 1.00 0.00 O ATOM 422 C5' C B 65 -5.334 -11.003 5.891 1.00 0.00 C ATOM 423 C4' C B 65 -4.798 -11.731 4.662 1.00 0.00 C ATOM 424 O4' C B 65 -4.584 -10.837 3.574 1.00 0.00 O ATOM 425 C3' C B 65 -3.452 -12.376 4.935 1.00 0.00 C ATOM 426 O3' C B 65 -3.598 -13.663 5.544 1.00 0.00 O ATOM 427 C2' C B 65 -2.871 -12.482 3.536 1.00 0.00 C ATOM 428 O2' C B 65 -3.324 -13.666 2.869 1.00 0.00 O ATOM 429 C1' C B 65 -3.402 -11.221 2.859 1.00 0.00 C ATOM 430 N1 C B 65 -2.408 -10.144 2.904 1.00 0.00 N ATOM 431 C2 C B 65 -1.590 -9.976 1.803 1.00 0.00 C ATOM 432 O2 C B 65 -1.689 -10.734 0.842 1.00 0.00 O ATOM 433 N3 C B 65 -0.690 -8.954 1.820 1.00 0.00 N ATOM 434 C4 C B 65 -0.605 -8.134 2.875 1.00 0.00 C ATOM 435 N4 C B 65 0.307 -7.161 2.873 1.00 0.00 N ATOM 436 C5 C B 65 -1.461 -8.308 4.012 1.00 0.00 C ATOM 437 C6 C B 65 -2.332 -9.325 3.983 1.00 0.00 C ATOM 0 H5' C B 65 -6.069 -10.260 5.581 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.852 -11.713 6.536 1.00 0.00 H new ATOM 0 H4' C B 65 -5.553 -12.479 4.418 1.00 0.00 H new ATOM 0 H3' C B 65 -2.827 -11.816 5.631 1.00 0.00 H new ATOM 0 H2' C B 65 -1.783 -12.554 3.523 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.566 -14.344 3.534 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.713 -14.051 5.705 1.00 0.00 H new ATOM 0 H1' C B 65 -3.620 -11.411 1.808 1.00 0.00 H new ATOM 0 H41 C B 65 0.381 -6.530 3.671 1.00 0.00 H new ATOM 0 H42 C B 65 0.930 -7.048 2.073 1.00 0.00 H new ATOM 0 H5 C B 65 -1.405 -7.643 4.861 1.00 0.00 H new ATOM 0 H6 C B 65 -2.982 -9.495 4.829 1.00 0.00 H new TER 450 C B 65