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 -5:sc= -4.26! USER MOD Single : A 13 G O5' : rot 35:sc= -0.928! USER MOD Single : A 14 G O2' : rot -15:sc= 0.0201 USER MOD Single : A 15 C O2' : rot -6:sc= -0.758 USER MOD Single : A 16 A O2' : rot -1:sc= -5.09! USER MOD Single : A 17 C O2' : rot -1:sc= -3.09! USER MOD Single : A 18 U O2' : rot 173:sc= -7.14! USER MOD Single : A 19 G O2' : rot -20:sc= 0.191 USER MOD Single : A 19 G O3' : rot 180:sc= 0.185 USER MOD Single : B 59 C O2' : rot -12:sc= -1.95! USER MOD Single : B 59 C O5' : rot 37:sc= -3.41! USER MOD Single : B 60 A O2' : rot -16:sc= 0.2 USER MOD Single : B 61 G O2' : rot -150:sc= -2.08! USER MOD Single : B 62 U O2' : rot -17:sc= -1.83! USER MOD Single : B 63 G O2' : rot -5:sc= -0.269 USER MOD Single : B 64 U O2' : rot -7:sc= 0.147 USER MOD Single : B 65 C O2' : rot -15:sc= 0.154 USER MOD Single : B 65 C O3' : rot 180:sc= 0.166 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 4.971 -6.914 -5.155 1.00 0.00 O ATOM 2 C5' G A 13 5.343 -7.711 -6.283 1.00 0.00 C ATOM 3 C4' G A 13 4.167 -8.535 -6.799 1.00 0.00 C ATOM 4 O4' G A 13 3.885 -9.640 -5.927 1.00 0.00 O ATOM 5 C3' G A 13 2.891 -7.700 -6.844 1.00 0.00 C ATOM 6 O3' G A 13 2.681 -7.250 -8.183 1.00 0.00 O ATOM 7 C2' G A 13 1.812 -8.708 -6.503 1.00 0.00 C ATOM 8 O2' G A 13 1.420 -9.472 -7.649 1.00 0.00 O ATOM 9 C1' G A 13 2.525 -9.564 -5.477 1.00 0.00 C ATOM 10 N9 G A 13 2.441 -8.948 -4.141 1.00 0.00 N ATOM 11 C8 G A 13 3.130 -7.899 -3.629 1.00 0.00 C ATOM 12 N7 G A 13 2.850 -7.529 -2.425 1.00 0.00 N ATOM 13 C5 G A 13 1.846 -8.436 -2.075 1.00 0.00 C ATOM 14 C6 G A 13 1.112 -8.559 -0.866 1.00 0.00 C ATOM 15 O6 G A 13 1.203 -7.880 0.157 1.00 0.00 O ATOM 16 N1 G A 13 0.197 -9.602 -0.931 1.00 0.00 N ATOM 17 C2 G A 13 0.006 -10.428 -2.020 1.00 0.00 C ATOM 18 N2 G A 13 -0.923 -11.374 -1.886 1.00 0.00 N ATOM 19 N3 G A 13 0.693 -10.320 -3.161 1.00 0.00 N ATOM 20 C4 G A 13 1.590 -9.310 -3.122 1.00 0.00 C ATOM 0 H5' G A 13 6.161 -8.376 -6.006 1.00 0.00 H new ATOM 0 H5'' G A 13 5.713 -7.066 -7.079 1.00 0.00 H new ATOM 0 H4' G A 13 4.451 -8.880 -7.793 1.00 0.00 H new ATOM 0 H3' G A 13 2.913 -6.833 -6.184 1.00 0.00 H new ATOM 0 H2' G A 13 0.882 -8.264 -6.147 1.00 0.00 H new ATOM 0 HO2' G A 13 1.876 -9.126 -8.444 1.00 0.00 H new ATOM 0 HO5' G A 13 4.319 -7.403 -4.610 1.00 0.00 H new ATOM 0 H1' G A 13 2.078 -10.554 -5.387 1.00 0.00 H new ATOM 0 H8 G A 13 3.887 -7.391 -4.208 1.00 0.00 H new ATOM 0 H1 G A 13 -0.380 -9.771 -0.107 1.00 0.00 H new ATOM 0 H21 G A 13 -1.111 -12.016 -2.656 1.00 0.00 H new ATOM 0 H22 G A 13 -1.446 -11.456 -1.014 1.00 0.00 H new ATOM 33 P G A 14 1.732 -5.980 -8.468 1.00 0.00 P ATOM 34 OP1 G A 14 1.657 -5.777 -9.932 1.00 0.00 O ATOM 35 OP2 G A 14 2.168 -4.872 -7.591 1.00 0.00 O ATOM 36 O5' G A 14 0.294 -6.494 -7.956 1.00 0.00 O ATOM 37 C5' G A 14 -0.372 -7.562 -8.632 1.00 0.00 C ATOM 38 C4' G A 14 -1.819 -7.718 -8.170 1.00 0.00 C ATOM 39 O4' G A 14 -1.922 -8.447 -6.934 1.00 0.00 O ATOM 40 C3' G A 14 -2.458 -6.375 -7.870 1.00 0.00 C ATOM 41 O3' G A 14 -2.984 -5.808 -9.071 1.00 0.00 O ATOM 42 C2' G A 14 -3.610 -6.800 -6.985 1.00 0.00 C ATOM 43 O2' G A 14 -4.665 -7.400 -7.747 1.00 0.00 O ATOM 44 C1' G A 14 -2.916 -7.818 -6.097 1.00 0.00 C ATOM 45 N9 G A 14 -2.300 -7.174 -4.927 1.00 0.00 N ATOM 46 C8 G A 14 -1.074 -6.614 -4.777 1.00 0.00 C ATOM 47 N7 G A 14 -0.766 -6.160 -3.609 1.00 0.00 N ATOM 48 C5 G A 14 -1.925 -6.445 -2.880 1.00 0.00 C ATOM 49 C6 G A 14 -2.227 -6.194 -1.519 1.00 0.00 C ATOM 50 O6 G A 14 -1.514 -5.666 -0.670 1.00 0.00 O ATOM 51 N1 G A 14 -3.506 -6.637 -1.188 1.00 0.00 N ATOM 52 C2 G A 14 -4.384 -7.245 -2.058 1.00 0.00 C ATOM 53 N2 G A 14 -5.567 -7.589 -1.553 1.00 0.00 N ATOM 54 N3 G A 14 -4.105 -7.486 -3.340 1.00 0.00 N ATOM 55 C4 G A 14 -2.867 -7.063 -3.683 1.00 0.00 C ATOM 0 H5' G A 14 0.167 -8.493 -8.457 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.352 -7.379 -9.706 1.00 0.00 H new ATOM 0 H4' G A 14 -2.313 -8.240 -8.989 1.00 0.00 H new ATOM 0 H3' G A 14 -1.781 -5.639 -7.436 1.00 0.00 H new ATOM 0 H2' G A 14 -4.096 -5.985 -6.449 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.533 -7.205 -8.698 1.00 0.00 H new ATOM 0 H1' G A 14 -3.621 -8.547 -5.697 1.00 0.00 H new ATOM 0 H8 G A 14 -0.382 -6.550 -5.604 1.00 0.00 H new ATOM 0 H1 G A 14 -3.816 -6.500 -0.226 1.00 0.00 H new ATOM 0 H21 G A 14 -6.262 -8.043 -2.146 1.00 0.00 H new ATOM 0 H22 G A 14 -5.778 -7.398 -0.573 1.00 0.00 H new ATOM 67 P C A 15 -3.104 -4.207 -9.201 1.00 0.00 P ATOM 68 OP1 C A 15 -3.794 -3.891 -10.473 1.00 0.00 O ATOM 69 OP2 C A 15 -1.781 -3.613 -8.908 1.00 0.00 O ATOM 70 O5' C A 15 -4.098 -3.861 -7.985 1.00 0.00 O ATOM 71 C5' C A 15 -5.474 -4.225 -8.065 1.00 0.00 C ATOM 72 C4' C A 15 -6.159 -4.167 -6.702 1.00 0.00 C ATOM 73 O4' C A 15 -5.501 -5.001 -5.743 1.00 0.00 O ATOM 74 C3' C A 15 -6.097 -2.794 -6.069 1.00 0.00 C ATOM 75 O3' C A 15 -7.119 -1.960 -6.618 1.00 0.00 O ATOM 76 C2' C A 15 -6.467 -3.138 -4.643 1.00 0.00 C ATOM 77 O2' C A 15 -7.874 -3.365 -4.504 1.00 0.00 O ATOM 78 C1' C A 15 -5.669 -4.421 -4.434 1.00 0.00 C ATOM 79 N1 C A 15 -4.374 -4.119 -3.788 1.00 0.00 N ATOM 80 C2 C A 15 -4.394 -3.888 -2.422 1.00 0.00 C ATOM 81 O2 C A 15 -5.461 -3.908 -1.813 1.00 0.00 O ATOM 82 N3 C A 15 -3.218 -3.629 -1.794 1.00 0.00 N ATOM 83 C4 C A 15 -2.066 -3.598 -2.474 1.00 0.00 C ATOM 84 N4 C A 15 -0.933 -3.344 -1.822 1.00 0.00 N ATOM 85 C5 C A 15 -2.038 -3.832 -3.884 1.00 0.00 C ATOM 86 C6 C A 15 -3.208 -4.083 -4.498 1.00 0.00 C ATOM 0 H5' C A 15 -5.560 -5.233 -8.472 1.00 0.00 H new ATOM 0 H5'' C A 15 -5.986 -3.557 -8.757 1.00 0.00 H new ATOM 0 H4' C A 15 -7.183 -4.476 -6.913 1.00 0.00 H new ATOM 0 H3' C A 15 -5.149 -2.272 -6.202 1.00 0.00 H new ATOM 0 H2' C A 15 -6.248 -2.351 -3.921 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.324 -3.160 -5.350 1.00 0.00 H new ATOM 0 H1' C A 15 -6.180 -5.121 -3.772 1.00 0.00 H new ATOM 0 H41 C A 15 -0.048 -3.318 -2.329 1.00 0.00 H new ATOM 0 H42 C A 15 -0.950 -3.176 -0.816 1.00 0.00 H new ATOM 0 H5 C A 15 -1.110 -3.808 -4.437 1.00 0.00 H new ATOM 0 H6 C A 15 -3.226 -4.258 -5.564 1.00 0.00 H new ATOM 98 P A A 16 -7.003 -0.357 -6.487 1.00 0.00 P ATOM 99 OP1 A A 16 -8.216 0.245 -7.083 1.00 0.00 O ATOM 100 OP2 A A 16 -5.664 0.051 -6.967 1.00 0.00 O ATOM 101 O5' A A 16 -7.058 -0.123 -4.891 1.00 0.00 O ATOM 102 C5' A A 16 -8.288 -0.289 -4.181 1.00 0.00 C ATOM 103 C4' A A 16 -8.116 -0.114 -2.672 1.00 0.00 C ATOM 104 O4' A A 16 -7.191 -1.056 -2.117 1.00 0.00 O ATOM 105 C3' A A 16 -7.524 1.237 -2.318 1.00 0.00 C ATOM 106 O3' A A 16 -8.567 2.209 -2.245 1.00 0.00 O ATOM 107 C2' A A 16 -7.011 0.979 -0.917 1.00 0.00 C ATOM 108 O2' A A 16 -8.070 1.030 0.048 1.00 0.00 O ATOM 109 C1' A A 16 -6.448 -0.421 -1.052 1.00 0.00 C ATOM 110 N9 A A 16 -5.006 -0.377 -1.352 1.00 0.00 N ATOM 111 C8 A A 16 -4.352 -0.619 -2.505 1.00 0.00 C ATOM 112 N7 A A 16 -3.064 -0.618 -2.480 1.00 0.00 N ATOM 113 C5 A A 16 -2.818 -0.327 -1.140 1.00 0.00 C ATOM 114 C6 A A 16 -1.641 -0.169 -0.409 1.00 0.00 C ATOM 115 N6 A A 16 -0.430 -0.341 -0.947 1.00 0.00 N ATOM 116 N1 A A 16 -1.766 0.127 0.898 1.00 0.00 N ATOM 117 C2 A A 16 -2.982 0.252 1.445 1.00 0.00 C ATOM 118 N3 A A 16 -4.151 0.117 0.844 1.00 0.00 N ATOM 119 C4 A A 16 -3.998 -0.173 -0.452 1.00 0.00 C ATOM 0 H5' A A 16 -8.692 -1.280 -4.386 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.017 0.434 -4.547 1.00 0.00 H new ATOM 0 H4' A A 16 -9.122 -0.243 -2.273 1.00 0.00 H new ATOM 0 H3' A A 16 -6.779 1.599 -3.026 1.00 0.00 H new ATOM 0 H2' A A 16 -6.287 1.715 -0.567 1.00 0.00 H new ATOM 0 HO2' A A 16 -8.915 1.235 -0.404 1.00 0.00 H new ATOM 0 H1' A A 16 -6.549 -0.983 -0.123 1.00 0.00 H new ATOM 0 H8 A A 16 -4.891 -0.808 -3.422 1.00 0.00 H new ATOM 0 H61 A A 16 0.405 -0.215 -0.375 1.00 0.00 H new ATOM 0 H62 A A 16 -0.341 -0.598 -1.930 1.00 0.00 H new ATOM 0 H2 A A 16 -3.010 0.490 2.498 1.00 0.00 H new ATOM 131 P C A 17 -8.201 3.776 -2.292 1.00 0.00 P ATOM 132 OP1 C A 17 -9.452 4.549 -2.130 1.00 0.00 O ATOM 133 OP2 C A 17 -7.331 4.015 -3.464 1.00 0.00 O ATOM 134 O5' C A 17 -7.315 3.961 -0.958 1.00 0.00 O ATOM 135 C5' C A 17 -7.881 3.686 0.325 1.00 0.00 C ATOM 136 C4' C A 17 -6.851 3.804 1.446 1.00 0.00 C ATOM 137 O4' C A 17 -5.820 2.824 1.351 1.00 0.00 O ATOM 138 C3' C A 17 -6.127 5.130 1.401 1.00 0.00 C ATOM 139 O3' C A 17 -6.911 6.095 2.107 1.00 0.00 O ATOM 140 C2' C A 17 -4.878 4.838 2.207 1.00 0.00 C ATOM 141 O2' C A 17 -5.116 4.979 3.613 1.00 0.00 O ATOM 142 C1' C A 17 -4.585 3.387 1.834 1.00 0.00 C ATOM 143 N1 C A 17 -3.547 3.304 0.800 1.00 0.00 N ATOM 144 C2 C A 17 -2.230 3.276 1.211 1.00 0.00 C ATOM 145 O2 C A 17 -1.960 3.354 2.408 1.00 0.00 O ATOM 146 N3 C A 17 -1.262 3.164 0.259 1.00 0.00 N ATOM 147 C4 C A 17 -1.589 3.085 -1.041 1.00 0.00 C ATOM 148 N4 C A 17 -0.627 2.955 -1.954 1.00 0.00 N ATOM 149 C5 C A 17 -2.955 3.121 -1.453 1.00 0.00 C ATOM 150 C6 C A 17 -3.887 3.229 -0.510 1.00 0.00 C ATOM 0 H5' C A 17 -8.304 2.681 0.326 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.702 4.377 0.514 1.00 0.00 H new ATOM 0 H4' C A 17 -7.432 3.680 2.360 1.00 0.00 H new ATOM 0 H3' C A 17 -5.934 5.506 0.396 1.00 0.00 H new ATOM 0 H2' C A 17 -4.053 5.519 1.996 1.00 0.00 H new ATOM 0 HO2' C A 17 -6.045 5.254 3.762 1.00 0.00 H new ATOM 0 H1' C A 17 -4.213 2.839 2.700 1.00 0.00 H new ATOM 0 H41 C A 17 -0.868 2.894 -2.943 1.00 0.00 H new ATOM 0 H42 C A 17 0.350 2.916 -1.663 1.00 0.00 H new ATOM 0 H5 C A 17 -3.224 3.062 -2.497 1.00 0.00 H new ATOM 0 H6 C A 17 -4.929 3.257 -0.792 1.00 0.00 H new ATOM 162 P U A 18 -6.864 7.649 1.692 1.00 0.00 P ATOM 163 OP1 U A 18 -7.723 8.405 2.630 1.00 0.00 O ATOM 164 OP2 U A 18 -7.097 7.747 0.234 1.00 0.00 O ATOM 165 O5' U A 18 -5.331 8.038 1.985 1.00 0.00 O ATOM 166 C5' U A 18 -4.777 7.885 3.295 1.00 0.00 C ATOM 167 C4' U A 18 -3.288 8.205 3.307 1.00 0.00 C ATOM 168 O4' U A 18 -2.527 7.152 2.718 1.00 0.00 O ATOM 169 C3' U A 18 -3.006 9.441 2.472 1.00 0.00 C ATOM 170 O3' U A 18 -2.781 10.542 3.355 1.00 0.00 O ATOM 171 C2' U A 18 -1.712 9.160 1.735 1.00 0.00 C ATOM 172 O2' U A 18 -0.654 10.006 2.191 1.00 0.00 O ATOM 173 C1' U A 18 -1.405 7.697 2.011 1.00 0.00 C ATOM 174 N1 U A 18 -1.178 6.994 0.742 1.00 0.00 N ATOM 175 C2 U A 18 0.131 6.827 0.335 1.00 0.00 C ATOM 176 O2 U A 18 1.080 7.230 1.005 1.00 0.00 O ATOM 177 N3 U A 18 0.312 6.186 -0.873 1.00 0.00 N ATOM 178 C4 U A 18 -0.689 5.699 -1.698 1.00 0.00 C ATOM 179 O4 U A 18 -0.409 5.143 -2.757 1.00 0.00 O ATOM 180 C5 U A 18 -2.029 5.917 -1.189 1.00 0.00 C ATOM 181 C6 U A 18 -2.227 6.550 -0.006 1.00 0.00 C ATOM 0 H5' U A 18 -4.934 6.864 3.642 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.298 8.542 3.991 1.00 0.00 H new ATOM 0 H4' U A 18 -3.010 8.349 4.351 1.00 0.00 H new ATOM 0 H3' U A 18 -3.828 9.669 1.793 1.00 0.00 H new ATOM 0 H2' U A 18 -1.807 9.360 0.668 1.00 0.00 H new ATOM 0 HO2' U A 18 0.189 9.729 1.774 1.00 0.00 H new ATOM 0 H1' U A 18 -0.503 7.584 2.612 1.00 0.00 H new ATOM 0 H3 U A 18 1.274 6.059 -1.189 1.00 0.00 H new ATOM 0 H5 U A 18 -2.879 5.571 -1.758 1.00 0.00 H new ATOM 0 H6 U A 18 -3.235 6.705 0.350 1.00 0.00 H new ATOM 192 P G A 19 -2.666 12.044 2.779 1.00 0.00 P ATOM 193 OP1 G A 19 -2.940 12.990 3.883 1.00 0.00 O ATOM 194 OP2 G A 19 -3.446 12.122 1.523 1.00 0.00 O ATOM 195 O5' G A 19 -1.098 12.132 2.411 1.00 0.00 O ATOM 196 C5' G A 19 -0.123 12.091 3.460 1.00 0.00 C ATOM 197 C4' G A 19 1.299 11.862 2.943 1.00 0.00 C ATOM 198 O4' G A 19 1.468 10.560 2.395 1.00 0.00 O ATOM 199 C3' G A 19 1.658 12.790 1.804 1.00 0.00 C ATOM 200 O3' G A 19 1.988 14.104 2.271 1.00 0.00 O ATOM 201 C2' G A 19 2.870 12.077 1.219 1.00 0.00 C ATOM 202 O2' G A 19 4.075 12.448 1.899 1.00 0.00 O ATOM 203 C1' G A 19 2.537 10.602 1.438 1.00 0.00 C ATOM 204 N9 G A 19 2.146 9.971 0.166 1.00 0.00 N ATOM 205 C8 G A 19 0.914 9.700 -0.312 1.00 0.00 C ATOM 206 N7 G A 19 0.827 9.108 -1.455 1.00 0.00 N ATOM 207 C5 G A 19 2.172 8.964 -1.800 1.00 0.00 C ATOM 208 C6 G A 19 2.754 8.384 -2.956 1.00 0.00 C ATOM 209 O6 G A 19 2.188 7.869 -3.917 1.00 0.00 O ATOM 210 N1 G A 19 4.140 8.445 -2.912 1.00 0.00 N ATOM 211 C2 G A 19 4.881 8.998 -1.886 1.00 0.00 C ATOM 212 N2 G A 19 6.205 8.979 -2.037 1.00 0.00 N ATOM 213 N3 G A 19 4.340 9.544 -0.792 1.00 0.00 N ATOM 214 C4 G A 19 2.988 9.494 -0.812 1.00 0.00 C ATOM 0 H5' G A 19 -0.382 11.296 4.159 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.155 13.028 4.016 1.00 0.00 H new ATOM 0 H4' G A 19 1.926 12.028 3.819 1.00 0.00 H new ATOM 0 H3' G A 19 0.850 12.959 1.092 1.00 0.00 H new ATOM 0 H2' G A 19 3.050 12.326 0.173 1.00 0.00 H new ATOM 0 HO2' G A 19 3.935 13.292 2.376 1.00 0.00 H new ATOM 0 HO3' G A 19 2.216 14.675 1.508 1.00 0.00 H new ATOM 0 H1' G A 19 3.400 10.049 1.809 1.00 0.00 H new ATOM 0 H8 G A 19 0.029 9.970 0.244 1.00 0.00 H new ATOM 0 H1 G A 19 4.652 8.050 -3.701 1.00 0.00 H new ATOM 0 H21 G A 19 6.807 9.373 -1.313 1.00 0.00 H new ATOM 0 H22 G A 19 6.617 8.571 -2.876 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.134 4.490 -8.082 1.00 0.00 O ATOM 229 C5' C B 59 9.545 4.327 -8.190 1.00 0.00 C ATOM 230 C4' C B 59 10.313 5.231 -7.217 1.00 0.00 C ATOM 231 O4' C B 59 9.951 6.616 -7.386 1.00 0.00 O ATOM 232 C3' C B 59 9.982 4.902 -5.763 1.00 0.00 C ATOM 233 O3' C B 59 10.997 4.041 -5.243 1.00 0.00 O ATOM 234 C2' C B 59 10.104 6.250 -5.082 1.00 0.00 C ATOM 235 O2' C B 59 11.471 6.595 -4.827 1.00 0.00 O ATOM 236 C1' C B 59 9.488 7.146 -6.131 1.00 0.00 C ATOM 237 N1 C B 59 8.019 7.092 -6.051 1.00 0.00 N ATOM 238 C2 C B 59 7.395 7.724 -4.989 1.00 0.00 C ATOM 239 O2 C B 59 8.061 8.340 -4.159 1.00 0.00 O ATOM 240 N3 C B 59 6.038 7.632 -4.896 1.00 0.00 N ATOM 241 C4 C B 59 5.333 6.945 -5.808 1.00 0.00 C ATOM 242 N4 C B 59 4.006 6.873 -5.694 1.00 0.00 N ATOM 243 C5 C B 59 5.986 6.294 -6.899 1.00 0.00 C ATOM 244 C6 C B 59 7.314 6.400 -6.976 1.00 0.00 C ATOM 0 H5' C B 59 9.857 4.548 -9.211 1.00 0.00 H new ATOM 0 H5'' C B 59 9.804 3.286 -7.996 1.00 0.00 H new ATOM 0 H4' C B 59 11.367 5.061 -7.435 1.00 0.00 H new ATOM 0 H3' C B 59 9.014 4.419 -5.630 1.00 0.00 H new ATOM 0 H2' C B 59 9.631 6.307 -4.102 1.00 0.00 H new ATOM 0 HO2' C B 59 12.040 5.811 -4.976 1.00 0.00 H new ATOM 0 HO5' C B 59 7.925 5.433 -7.918 1.00 0.00 H new ATOM 0 H1' C B 59 9.769 8.191 -6.002 1.00 0.00 H new ATOM 0 H41 C B 59 3.462 6.353 -6.383 1.00 0.00 H new ATOM 0 H42 C B 59 3.535 7.338 -4.918 1.00 0.00 H new ATOM 0 H5 C B 59 5.425 5.736 -7.635 1.00 0.00 H new ATOM 0 H6 C B 59 7.837 5.924 -7.793 1.00 0.00 H new ATOM 257 P A B 60 10.638 2.970 -4.097 1.00 0.00 P ATOM 258 OP1 A B 60 11.885 2.274 -3.706 1.00 0.00 O ATOM 259 OP2 A B 60 9.464 2.188 -4.543 1.00 0.00 O ATOM 260 O5' A B 60 10.181 3.911 -2.872 1.00 0.00 O ATOM 261 C5' A B 60 11.085 4.869 -2.315 1.00 0.00 C ATOM 262 C4' A B 60 10.443 5.653 -1.174 1.00 0.00 C ATOM 263 O4' A B 60 9.522 6.646 -1.654 1.00 0.00 O ATOM 264 C3' A B 60 9.610 4.748 -0.287 1.00 0.00 C ATOM 265 O3' A B 60 10.458 4.173 0.715 1.00 0.00 O ATOM 266 C2' A B 60 8.679 5.750 0.364 1.00 0.00 C ATOM 267 O2' A B 60 9.334 6.476 1.412 1.00 0.00 O ATOM 268 C1' A B 60 8.348 6.653 -0.817 1.00 0.00 C ATOM 269 N9 A B 60 7.163 6.158 -1.548 1.00 0.00 N ATOM 270 C8 A B 60 7.079 5.416 -2.684 1.00 0.00 C ATOM 271 N7 A B 60 5.899 5.111 -3.110 1.00 0.00 N ATOM 272 C5 A B 60 5.086 5.723 -2.151 1.00 0.00 C ATOM 273 C6 A B 60 3.697 5.797 -1.993 1.00 0.00 C ATOM 274 N6 A B 60 2.837 5.222 -2.837 1.00 0.00 N ATOM 275 N1 A B 60 3.231 6.485 -0.934 1.00 0.00 N ATOM 276 C2 A B 60 4.079 7.065 -0.079 1.00 0.00 C ATOM 277 N3 A B 60 5.407 7.054 -0.133 1.00 0.00 N ATOM 278 C4 A B 60 5.848 6.361 -1.199 1.00 0.00 C ATOM 0 H5' A B 60 11.409 5.559 -3.094 1.00 0.00 H new ATOM 0 H5'' A B 60 11.976 4.359 -1.950 1.00 0.00 H new ATOM 0 H4' A B 60 11.276 6.107 -0.636 1.00 0.00 H new ATOM 0 H3' A B 60 9.108 3.931 -0.806 1.00 0.00 H new ATOM 0 H2' A B 60 7.809 5.304 0.847 1.00 0.00 H new ATOM 0 HO2' A B 60 10.158 6.010 1.667 1.00 0.00 H new ATOM 0 H1' A B 60 8.099 7.663 -0.492 1.00 0.00 H new ATOM 0 H8 A B 60 7.966 5.094 -3.210 1.00 0.00 H new ATOM 0 H61 A B 60 1.833 5.305 -2.677 1.00 0.00 H new ATOM 0 H62 A B 60 3.184 4.699 -3.641 1.00 0.00 H new ATOM 0 H2 A B 60 3.636 7.602 0.747 1.00 0.00 H new ATOM 290 P G B 61 10.290 2.623 1.124 1.00 0.00 P ATOM 291 OP1 G B 61 11.484 2.217 1.900 1.00 0.00 O ATOM 292 OP2 G B 61 9.905 1.864 -0.086 1.00 0.00 O ATOM 293 O5' G B 61 9.029 2.652 2.123 1.00 0.00 O ATOM 294 C5' G B 61 9.170 3.161 3.450 1.00 0.00 C ATOM 295 C4' G B 61 7.814 3.385 4.109 1.00 0.00 C ATOM 296 O4' G B 61 7.030 4.311 3.353 1.00 0.00 O ATOM 297 C3' G B 61 6.991 2.106 4.161 1.00 0.00 C ATOM 298 O3' G B 61 7.184 1.478 5.431 1.00 0.00 O ATOM 299 C2' G B 61 5.559 2.593 4.099 1.00 0.00 C ATOM 300 O2' G B 61 5.012 2.795 5.406 1.00 0.00 O ATOM 301 C1' G B 61 5.656 3.894 3.324 1.00 0.00 C ATOM 302 N9 G B 61 5.174 3.682 1.950 1.00 0.00 N ATOM 303 C8 G B 61 5.859 3.448 0.803 1.00 0.00 C ATOM 304 N7 G B 61 5.171 3.267 -0.275 1.00 0.00 N ATOM 305 C5 G B 61 3.862 3.387 0.202 1.00 0.00 C ATOM 306 C6 G B 61 2.626 3.285 -0.488 1.00 0.00 C ATOM 307 O6 G B 61 2.433 3.069 -1.682 1.00 0.00 O ATOM 308 N1 G B 61 1.550 3.466 0.373 1.00 0.00 N ATOM 309 C2 G B 61 1.646 3.714 1.725 1.00 0.00 C ATOM 310 N2 G B 61 0.499 3.843 2.383 1.00 0.00 N ATOM 311 N3 G B 61 2.801 3.814 2.377 1.00 0.00 N ATOM 312 C4 G B 61 3.862 3.641 1.563 1.00 0.00 C ATOM 0 H5' G B 61 9.723 4.100 3.424 1.00 0.00 H new ATOM 0 H5'' G B 61 9.756 2.463 4.048 1.00 0.00 H new ATOM 0 H4' G B 61 8.030 3.753 5.112 1.00 0.00 H new ATOM 0 H3' G B 61 7.254 1.403 3.370 1.00 0.00 H new ATOM 0 H2' G B 61 4.891 1.873 3.627 1.00 0.00 H new ATOM 0 HO2' G B 61 4.045 2.640 5.383 1.00 0.00 H new ATOM 0 H1' G B 61 5.036 4.674 3.766 1.00 0.00 H new ATOM 0 H8 G B 61 6.938 3.414 0.792 1.00 0.00 H new ATOM 0 H1 G B 61 0.614 3.411 -0.028 1.00 0.00 H new ATOM 0 H21 G B 61 0.504 4.027 3.386 1.00 0.00 H new ATOM 0 H22 G B 61 -0.387 3.758 1.885 1.00 0.00 H new ATOM 324 P U B 62 6.644 -0.021 5.685 1.00 0.00 P ATOM 325 OP1 U B 62 7.354 -0.581 6.855 1.00 0.00 O ATOM 326 OP2 U B 62 6.652 -0.745 4.394 1.00 0.00 O ATOM 327 O5' U B 62 5.110 0.254 6.104 1.00 0.00 O ATOM 328 C5' U B 62 4.830 0.945 7.324 1.00 0.00 C ATOM 329 C4' U B 62 3.384 1.436 7.412 1.00 0.00 C ATOM 330 O4' U B 62 3.042 2.272 6.299 1.00 0.00 O ATOM 331 C3' U B 62 2.362 0.315 7.356 1.00 0.00 C ATOM 332 O3' U B 62 2.161 -0.227 8.662 1.00 0.00 O ATOM 333 C2' U B 62 1.122 1.092 6.973 1.00 0.00 C ATOM 334 O2' U B 62 0.613 1.853 8.075 1.00 0.00 O ATOM 335 C1' U B 62 1.690 1.985 5.890 1.00 0.00 C ATOM 336 N1 U B 62 1.665 1.285 4.599 1.00 0.00 N ATOM 337 C2 U B 62 0.462 1.223 3.918 1.00 0.00 C ATOM 338 O2 U B 62 -0.576 1.686 4.382 1.00 0.00 O ATOM 339 N3 U B 62 0.496 0.588 2.690 1.00 0.00 N ATOM 340 C4 U B 62 1.614 0.023 2.097 1.00 0.00 C ATOM 341 O4 U B 62 1.538 -0.498 0.987 1.00 0.00 O ATOM 342 C5 U B 62 2.819 0.134 2.893 1.00 0.00 C ATOM 343 C6 U B 62 2.803 0.744 4.095 1.00 0.00 C ATOM 0 H5' U B 62 5.504 1.797 7.416 1.00 0.00 H new ATOM 0 H5'' U B 62 5.036 0.284 8.166 1.00 0.00 H new ATOM 0 H4' U B 62 3.347 1.959 8.368 1.00 0.00 H new ATOM 0 H3' U B 62 2.633 -0.509 6.697 1.00 0.00 H new ATOM 0 H2' U B 62 0.275 0.480 6.663 1.00 0.00 H new ATOM 0 HO2' U B 62 0.996 1.514 8.911 1.00 0.00 H new ATOM 0 H1' U B 62 1.113 2.901 5.763 1.00 0.00 H new ATOM 0 H3 U B 62 -0.382 0.530 2.174 1.00 0.00 H new ATOM 0 H5 U B 62 3.744 -0.278 2.518 1.00 0.00 H new ATOM 0 H6 U B 62 3.716 0.803 4.669 1.00 0.00 H new ATOM 354 P G B 63 1.585 -1.723 8.825 1.00 0.00 P ATOM 355 OP1 G B 63 1.371 -1.984 10.266 1.00 0.00 O ATOM 356 OP2 G B 63 2.435 -2.635 8.028 1.00 0.00 O ATOM 357 O5' G B 63 0.141 -1.626 8.110 1.00 0.00 O ATOM 358 C5' G B 63 -0.879 -0.777 8.643 1.00 0.00 C ATOM 359 C4' G B 63 -2.197 -0.907 7.877 1.00 0.00 C ATOM 360 O4' G B 63 -2.164 -0.228 6.616 1.00 0.00 O ATOM 361 C3' G B 63 -2.506 -2.350 7.526 1.00 0.00 C ATOM 362 O3' G B 63 -3.189 -2.941 8.633 1.00 0.00 O ATOM 363 C2' G B 63 -3.479 -2.181 6.376 1.00 0.00 C ATOM 364 O2' G B 63 -4.800 -1.877 6.839 1.00 0.00 O ATOM 365 C1' G B 63 -2.868 -1.013 5.631 1.00 0.00 C ATOM 366 N9 G B 63 -1.951 -1.489 4.579 1.00 0.00 N ATOM 367 C8 G B 63 -0.602 -1.569 4.586 1.00 0.00 C ATOM 368 N7 G B 63 -0.016 -1.958 3.508 1.00 0.00 N ATOM 369 C5 G B 63 -1.102 -2.177 2.662 1.00 0.00 C ATOM 370 C6 G B 63 -1.124 -2.621 1.318 1.00 0.00 C ATOM 371 O6 G B 63 -0.171 -2.904 0.596 1.00 0.00 O ATOM 372 N1 G B 63 -2.421 -2.713 0.835 1.00 0.00 N ATOM 373 C2 G B 63 -3.562 -2.420 1.553 1.00 0.00 C ATOM 374 N2 G B 63 -4.721 -2.597 0.916 1.00 0.00 N ATOM 375 N3 G B 63 -3.551 -1.996 2.821 1.00 0.00 N ATOM 376 C4 G B 63 -2.295 -1.897 3.311 1.00 0.00 C ATOM 0 H5' G B 63 -0.542 0.259 8.609 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.044 -1.024 9.692 1.00 0.00 H new ATOM 0 H4' G B 63 -2.943 -0.477 8.546 1.00 0.00 H new ATOM 0 H3' G B 63 -1.637 -2.965 7.291 1.00 0.00 H new ATOM 0 H2' G B 63 -3.606 -3.078 5.769 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.820 -1.915 7.818 1.00 0.00 H new ATOM 0 H1' G B 63 -3.632 -0.418 5.132 1.00 0.00 H new ATOM 0 H8 G B 63 -0.033 -1.315 5.468 1.00 0.00 H new ATOM 0 H1 G B 63 -2.541 -3.022 -0.129 1.00 0.00 H new ATOM 0 H21 G B 63 -5.601 -2.398 1.393 1.00 0.00 H new ATOM 0 H22 G B 63 -4.727 -2.931 -0.048 1.00 0.00 H new ATOM 388 P U B 64 -2.876 -4.457 9.064 1.00 0.00 P ATOM 389 OP1 U B 64 -3.474 -4.695 10.397 1.00 0.00 O ATOM 390 OP2 U B 64 -1.436 -4.717 8.841 1.00 0.00 O ATOM 391 O5' U B 64 -3.714 -5.294 7.979 1.00 0.00 O ATOM 392 C5' U B 64 -5.114 -5.062 7.819 1.00 0.00 C ATOM 393 C4' U B 64 -5.659 -5.778 6.591 1.00 0.00 C ATOM 394 O4' U B 64 -5.417 -5.042 5.388 1.00 0.00 O ATOM 395 C3' U B 64 -4.960 -7.105 6.384 1.00 0.00 C ATOM 396 O3' U B 64 -5.645 -8.108 7.135 1.00 0.00 O ATOM 397 C2' U B 64 -5.192 -7.354 4.907 1.00 0.00 C ATOM 398 O2' U B 64 -6.482 -7.931 4.671 1.00 0.00 O ATOM 399 C1' U B 64 -5.092 -5.955 4.324 1.00 0.00 C ATOM 400 N1 U B 64 -3.749 -5.685 3.774 1.00 0.00 N ATOM 401 C2 U B 64 -3.573 -5.892 2.418 1.00 0.00 C ATOM 402 O2 U B 64 -4.478 -6.313 1.699 1.00 0.00 O ATOM 403 N3 U B 64 -2.319 -5.600 1.914 1.00 0.00 N ATOM 404 C4 U B 64 -1.238 -5.131 2.643 1.00 0.00 C ATOM 405 O4 U B 64 -0.163 -4.902 2.092 1.00 0.00 O ATOM 406 C5 U B 64 -1.511 -4.949 4.054 1.00 0.00 C ATOM 407 C6 U B 64 -2.732 -5.224 4.566 1.00 0.00 C ATOM 0 H5' U B 64 -5.299 -3.992 7.730 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.645 -5.404 8.707 1.00 0.00 H new ATOM 0 H4' U B 64 -6.727 -5.895 6.775 1.00 0.00 H new ATOM 0 H3' U B 64 -3.912 -7.114 6.683 1.00 0.00 H new ATOM 0 H2' U B 64 -4.488 -8.060 4.467 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.907 -8.144 5.528 1.00 0.00 H new ATOM 0 H1' U B 64 -5.781 -5.839 3.487 1.00 0.00 H new ATOM 0 H3 U B 64 -2.177 -5.743 0.914 1.00 0.00 H new ATOM 0 H5 U B 64 -0.729 -4.589 4.706 1.00 0.00 H new ATOM 0 H6 U B 64 -2.908 -5.077 5.621 1.00 0.00 H new ATOM 418 P C B 65 -4.814 -9.255 7.902 1.00 0.00 P ATOM 419 OP1 C B 65 -5.727 -9.941 8.843 1.00 0.00 O ATOM 420 OP2 C B 65 -3.553 -8.660 8.398 1.00 0.00 O ATOM 421 O5' C B 65 -4.454 -10.279 6.712 1.00 0.00 O ATOM 422 C5' C B 65 -5.498 -10.928 5.986 1.00 0.00 C ATOM 423 C4' C B 65 -4.962 -11.693 4.780 1.00 0.00 C ATOM 424 O4' C B 65 -4.729 -10.828 3.671 1.00 0.00 O ATOM 425 C3' C B 65 -3.624 -12.344 5.078 1.00 0.00 C ATOM 426 O3' C B 65 -3.788 -13.614 5.722 1.00 0.00 O ATOM 427 C2' C B 65 -3.038 -12.495 3.686 1.00 0.00 C ATOM 428 O2' C B 65 -3.510 -13.684 3.043 1.00 0.00 O ATOM 429 C1' C B 65 -3.542 -11.239 2.979 1.00 0.00 C ATOM 430 N1 C B 65 -2.533 -10.176 3.017 1.00 0.00 N ATOM 431 C2 C B 65 -1.699 -10.040 1.924 1.00 0.00 C ATOM 432 O2 C B 65 -1.799 -10.812 0.972 1.00 0.00 O ATOM 433 N3 C B 65 -0.782 -9.034 1.935 1.00 0.00 N ATOM 434 C4 C B 65 -0.695 -8.198 2.978 1.00 0.00 C ATOM 435 N4 C B 65 0.234 -7.242 2.973 1.00 0.00 N ATOM 436 C5 C B 65 -1.567 -8.340 4.107 1.00 0.00 C ATOM 437 C6 C B 65 -2.455 -9.342 4.083 1.00 0.00 C ATOM 0 H5' C B 65 -6.223 -10.186 5.652 1.00 0.00 H new ATOM 0 H5'' C B 65 -6.026 -11.616 6.647 1.00 0.00 H new ATOM 0 H4' C B 65 -5.723 -12.438 4.551 1.00 0.00 H new ATOM 0 H3' C B 65 -2.997 -11.772 5.761 1.00 0.00 H new ATOM 0 H2' C B 65 -1.952 -12.590 3.681 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.913 -14.279 3.710 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.908 -14.007 5.898 1.00 0.00 H new ATOM 0 H1' C B 65 -3.748 -11.443 1.928 1.00 0.00 H new ATOM 0 H41 C B 65 0.309 -6.600 3.762 1.00 0.00 H new ATOM 0 H42 C B 65 0.870 -7.153 2.180 1.00 0.00 H new ATOM 0 H5 C B 65 -1.510 -7.663 4.947 1.00 0.00 H new ATOM 0 H6 C B 65 -3.117 -9.488 4.923 1.00 0.00 H new TER 450 C B 65