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 -6:sc= -4.65! USER MOD Single : A 13 G O5' : rot 34:sc= -0.579! USER MOD Single : A 14 G O2' : rot -15:sc= -0.0541 USER MOD Single : A 15 C O2' : rot -5:sc= -1.61! USER MOD Single : A 16 A O2' : rot -1:sc= -5.36! USER MOD Single : A 17 C O2' : rot -2:sc= -3.23! USER MOD Single : A 18 U O2' : rot 174:sc= -7.08! USER MOD Single : A 19 G O2' : rot -16:sc= 0.192 USER MOD Single : A 19 G O3' : rot 180:sc= 0.193 USER MOD Single : B 59 C O2' : rot -14:sc= -1.99! USER MOD Single : B 59 C O5' : rot 40:sc= -2.97! USER MOD Single : B 60 A O2' : rot -16:sc= 0.193 USER MOD Single : B 61 G O2' : rot -146:sc= -2.18! USER MOD Single : B 62 U O2' : rot -13:sc= -2.31! USER MOD Single : B 63 G O2' : rot -6:sc= -0.188 USER MOD Single : B 64 U O2' : rot -4:sc= 0.0731 USER MOD Single : B 65 C O2' : rot -19:sc= 0.153 USER MOD Single : B 65 C O3' : rot 180:sc= 0.173 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 4.919 -7.206 -5.448 1.00 0.00 O ATOM 2 C5' G A 13 5.217 -8.111 -6.514 1.00 0.00 C ATOM 3 C4' G A 13 3.983 -8.902 -6.939 1.00 0.00 C ATOM 4 O4' G A 13 3.691 -9.949 -6.000 1.00 0.00 O ATOM 5 C3' G A 13 2.745 -8.012 -6.971 1.00 0.00 C ATOM 6 O3' G A 13 2.502 -7.608 -8.319 1.00 0.00 O ATOM 7 C2' G A 13 1.637 -8.953 -6.548 1.00 0.00 C ATOM 8 O2' G A 13 1.165 -9.742 -7.647 1.00 0.00 O ATOM 9 C1' G A 13 2.350 -9.802 -5.514 1.00 0.00 C ATOM 10 N9 G A 13 2.330 -9.139 -4.199 1.00 0.00 N ATOM 11 C8 G A 13 3.073 -8.101 -3.746 1.00 0.00 C ATOM 12 N7 G A 13 2.846 -7.679 -2.548 1.00 0.00 N ATOM 13 C5 G A 13 1.821 -8.537 -2.135 1.00 0.00 C ATOM 14 C6 G A 13 1.121 -8.590 -0.900 1.00 0.00 C ATOM 15 O6 G A 13 1.268 -7.881 0.093 1.00 0.00 O ATOM 16 N1 G A 13 0.168 -9.600 -0.902 1.00 0.00 N ATOM 17 C2 G A 13 -0.087 -10.455 -1.955 1.00 0.00 C ATOM 18 N2 G A 13 -1.047 -11.359 -1.762 1.00 0.00 N ATOM 19 N3 G A 13 0.566 -10.410 -3.119 1.00 0.00 N ATOM 20 C4 G A 13 1.501 -9.434 -3.143 1.00 0.00 C ATOM 0 H5' G A 13 6.001 -8.800 -6.199 1.00 0.00 H new ATOM 0 H5'' G A 13 5.605 -7.555 -7.367 1.00 0.00 H new ATOM 0 H4' G A 13 4.207 -9.306 -7.926 1.00 0.00 H new ATOM 0 H3' G A 13 2.832 -7.121 -6.349 1.00 0.00 H new ATOM 0 H2' G A 13 0.744 -8.452 -6.175 1.00 0.00 H new ATOM 0 HO2' G A 13 1.592 -9.438 -8.475 1.00 0.00 H new ATOM 0 HO5' G A 13 4.235 -7.599 -4.867 1.00 0.00 H new ATOM 0 H1' G A 13 1.869 -10.770 -5.377 1.00 0.00 H new ATOM 0 H8 G A 13 3.829 -7.643 -4.366 1.00 0.00 H new ATOM 0 H1 G A 13 -0.389 -9.720 -0.056 1.00 0.00 H new ATOM 0 H21 G A 13 -1.282 -12.019 -2.503 1.00 0.00 H new ATOM 0 H22 G A 13 -1.547 -11.391 -0.873 1.00 0.00 H new ATOM 33 P G A 14 1.580 -6.323 -8.621 1.00 0.00 P ATOM 34 OP1 G A 14 1.456 -6.178 -10.088 1.00 0.00 O ATOM 35 OP2 G A 14 2.079 -5.193 -7.806 1.00 0.00 O ATOM 36 O5' G A 14 0.148 -6.775 -8.036 1.00 0.00 O ATOM 37 C5' G A 14 -0.572 -7.848 -8.643 1.00 0.00 C ATOM 38 C4' G A 14 -2.005 -7.940 -8.126 1.00 0.00 C ATOM 39 O4' G A 14 -2.091 -8.619 -6.861 1.00 0.00 O ATOM 40 C3' G A 14 -2.589 -6.568 -7.852 1.00 0.00 C ATOM 41 O3' G A 14 -3.119 -6.017 -9.059 1.00 0.00 O ATOM 42 C2' G A 14 -3.735 -6.925 -6.932 1.00 0.00 C ATOM 43 O2' G A 14 -4.829 -7.504 -7.653 1.00 0.00 O ATOM 44 C1' G A 14 -3.060 -7.946 -6.029 1.00 0.00 C ATOM 45 N9 G A 14 -2.416 -7.297 -4.877 1.00 0.00 N ATOM 46 C8 G A 14 -1.174 -6.763 -4.750 1.00 0.00 C ATOM 47 N7 G A 14 -0.841 -6.299 -3.594 1.00 0.00 N ATOM 48 C5 G A 14 -1.999 -6.544 -2.847 1.00 0.00 C ATOM 49 C6 G A 14 -2.278 -6.265 -1.487 1.00 0.00 C ATOM 50 O6 G A 14 -1.543 -5.740 -0.656 1.00 0.00 O ATOM 51 N1 G A 14 -3.562 -6.671 -1.134 1.00 0.00 N ATOM 52 C2 G A 14 -4.465 -7.272 -1.983 1.00 0.00 C ATOM 53 N2 G A 14 -5.650 -7.579 -1.459 1.00 0.00 N ATOM 54 N3 G A 14 -4.208 -7.541 -3.265 1.00 0.00 N ATOM 55 C4 G A 14 -2.965 -7.152 -3.629 1.00 0.00 C ATOM 0 H5' G A 14 -0.055 -8.788 -8.448 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.585 -7.710 -9.724 1.00 0.00 H new ATOM 0 H4' G A 14 -2.541 -8.475 -8.909 1.00 0.00 H new ATOM 0 H3' G A 14 -1.878 -5.845 -7.453 1.00 0.00 H new ATOM 0 H2' G A 14 -4.177 -6.077 -6.409 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.720 -7.327 -8.611 1.00 0.00 H new ATOM 0 H1' G A 14 -3.782 -8.647 -5.610 1.00 0.00 H new ATOM 0 H8 G A 14 -0.491 -6.728 -5.586 1.00 0.00 H new ATOM 0 H1 G A 14 -3.857 -6.511 -0.171 1.00 0.00 H new ATOM 0 H21 G A 14 -6.362 -8.026 -2.036 1.00 0.00 H new ATOM 0 H22 G A 14 -5.845 -7.367 -0.480 1.00 0.00 H new ATOM 67 P C A 15 -3.195 -4.418 -9.230 1.00 0.00 P ATOM 68 OP1 C A 15 -3.895 -4.116 -10.498 1.00 0.00 O ATOM 69 OP2 C A 15 -1.851 -3.856 -8.971 1.00 0.00 O ATOM 70 O5' C A 15 -4.160 -4.011 -8.008 1.00 0.00 O ATOM 71 C5' C A 15 -5.544 -4.348 -8.054 1.00 0.00 C ATOM 72 C4' C A 15 -6.204 -4.236 -6.684 1.00 0.00 C ATOM 73 O4' C A 15 -5.550 -5.059 -5.714 1.00 0.00 O ATOM 74 C3' C A 15 -6.099 -2.849 -6.092 1.00 0.00 C ATOM 75 O3' C A 15 -7.111 -2.007 -6.647 1.00 0.00 O ATOM 76 C2' C A 15 -6.452 -3.141 -4.650 1.00 0.00 C ATOM 77 O2' C A 15 -7.864 -3.317 -4.479 1.00 0.00 O ATOM 78 C1' C A 15 -5.693 -4.443 -4.417 1.00 0.00 C ATOM 79 N1 C A 15 -4.387 -4.167 -3.784 1.00 0.00 N ATOM 80 C2 C A 15 -4.392 -3.922 -2.421 1.00 0.00 C ATOM 81 O2 C A 15 -5.454 -3.907 -1.802 1.00 0.00 O ATOM 82 N3 C A 15 -3.205 -3.687 -1.803 1.00 0.00 N ATOM 83 C4 C A 15 -2.057 -3.692 -2.493 1.00 0.00 C ATOM 84 N4 C A 15 -0.914 -3.460 -1.850 1.00 0.00 N ATOM 85 C5 C A 15 -2.047 -3.941 -3.900 1.00 0.00 C ATOM 86 C6 C A 15 -3.226 -4.169 -4.503 1.00 0.00 C ATOM 0 H5' C A 15 -5.657 -5.365 -8.429 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.054 -3.690 -8.757 1.00 0.00 H new ATOM 0 H4' C A 15 -7.238 -4.526 -6.869 1.00 0.00 H new ATOM 0 H3' C A 15 -5.141 -2.355 -6.256 1.00 0.00 H new ATOM 0 H2' C A 15 -6.193 -2.342 -3.956 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.322 -3.124 -5.323 1.00 0.00 H new ATOM 0 H1' C A 15 -6.222 -5.112 -3.738 1.00 0.00 H new ATOM 0 H41 C A 15 -0.032 -3.461 -2.362 1.00 0.00 H new ATOM 0 H42 C A 15 -0.921 -3.282 -0.846 1.00 0.00 H new ATOM 0 H5 C A 15 -1.123 -3.946 -4.460 1.00 0.00 H new ATOM 0 H6 C A 15 -3.256 -4.356 -5.566 1.00 0.00 H new ATOM 98 P A A 16 -6.970 -0.405 -6.537 1.00 0.00 P ATOM 99 OP1 A A 16 -8.180 0.208 -7.128 1.00 0.00 O ATOM 100 OP2 A A 16 -5.630 -0.023 -7.036 1.00 0.00 O ATOM 101 O5' A A 16 -7.004 -0.155 -4.943 1.00 0.00 O ATOM 102 C5' A A 16 -8.217 -0.348 -4.211 1.00 0.00 C ATOM 103 C4' A A 16 -8.012 -0.201 -2.702 1.00 0.00 C ATOM 104 O4' A A 16 -7.050 -1.130 -2.192 1.00 0.00 O ATOM 105 C3' A A 16 -7.446 1.156 -2.335 1.00 0.00 C ATOM 106 O3' A A 16 -8.512 2.099 -2.220 1.00 0.00 O ATOM 107 C2' A A 16 -6.893 0.885 -0.952 1.00 0.00 C ATOM 108 O2' A A 16 -7.926 0.905 0.040 1.00 0.00 O ATOM 109 C1' A A 16 -6.310 -0.505 -1.120 1.00 0.00 C ATOM 110 N9 A A 16 -4.869 -0.435 -1.426 1.00 0.00 N ATOM 111 C8 A A 16 -4.217 -0.653 -2.586 1.00 0.00 C ATOM 112 N7 A A 16 -2.930 -0.631 -2.566 1.00 0.00 N ATOM 113 C5 A A 16 -2.682 -0.353 -1.224 1.00 0.00 C ATOM 114 C6 A A 16 -1.504 -0.185 -0.496 1.00 0.00 C ATOM 115 N6 A A 16 -0.292 -0.332 -1.039 1.00 0.00 N ATOM 116 N1 A A 16 -1.627 0.093 0.816 1.00 0.00 N ATOM 117 C2 A A 16 -2.843 0.192 1.368 1.00 0.00 C ATOM 118 N3 A A 16 -4.011 0.046 0.771 1.00 0.00 N ATOM 119 C4 A A 16 -3.860 -0.225 -0.529 1.00 0.00 C ATOM 0 H5' A A 16 -8.616 -1.339 -4.427 1.00 0.00 H new ATOM 0 H5'' A A 16 -8.961 0.375 -4.547 1.00 0.00 H new ATOM 0 H4' A A 16 -9.004 -0.365 -2.280 1.00 0.00 H new ATOM 0 H3' A A 16 -6.726 1.551 -3.052 1.00 0.00 H new ATOM 0 H2' A A 16 -6.172 1.628 -0.611 1.00 0.00 H new ATOM 0 HO2' A A 16 -8.784 1.114 -0.385 1.00 0.00 H new ATOM 0 H1' A A 16 -6.398 -1.086 -0.202 1.00 0.00 H new ATOM 0 H8 A A 16 -4.757 -0.840 -3.502 1.00 0.00 H new ATOM 0 H61 A A 16 0.542 -0.199 -0.468 1.00 0.00 H new ATOM 0 H62 A A 16 -0.201 -0.577 -2.025 1.00 0.00 H new ATOM 0 H2 A A 16 -2.871 0.417 2.424 1.00 0.00 H new ATOM 131 P C A 17 -8.191 3.675 -2.245 1.00 0.00 P ATOM 132 OP1 C A 17 -9.459 4.410 -2.041 1.00 0.00 O ATOM 133 OP2 C A 17 -7.353 3.961 -3.430 1.00 0.00 O ATOM 134 O5' C A 17 -7.282 3.860 -0.927 1.00 0.00 O ATOM 135 C5' C A 17 -7.812 3.543 0.362 1.00 0.00 C ATOM 136 C4' C A 17 -6.763 3.667 1.464 1.00 0.00 C ATOM 137 O4' C A 17 -5.717 2.708 1.337 1.00 0.00 O ATOM 138 C3' C A 17 -6.063 5.005 1.421 1.00 0.00 C ATOM 139 O3' C A 17 -6.855 5.951 2.144 1.00 0.00 O ATOM 140 C2' C A 17 -4.798 4.725 2.208 1.00 0.00 C ATOM 141 O2' C A 17 -5.020 4.851 3.617 1.00 0.00 O ATOM 142 C1' C A 17 -4.487 3.283 1.818 1.00 0.00 C ATOM 143 N1 C A 17 -3.454 3.226 0.778 1.00 0.00 N ATOM 144 C2 C A 17 -2.135 3.205 1.184 1.00 0.00 C ATOM 145 O2 C A 17 -1.861 3.263 2.380 1.00 0.00 O ATOM 146 N3 C A 17 -1.170 3.120 0.225 1.00 0.00 N ATOM 147 C4 C A 17 -1.501 3.061 -1.074 1.00 0.00 C ATOM 148 N4 C A 17 -0.543 2.961 -1.995 1.00 0.00 N ATOM 149 C5 C A 17 -2.869 3.089 -1.480 1.00 0.00 C ATOM 150 C6 C A 17 -3.798 3.172 -0.532 1.00 0.00 C ATOM 0 H5' C A 17 -8.206 2.527 0.351 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.648 4.207 0.582 1.00 0.00 H new ATOM 0 H4' C A 17 -7.324 3.523 2.387 1.00 0.00 H new ATOM 0 H3' C A 17 -5.889 5.394 0.418 1.00 0.00 H new ATOM 0 H2' C A 17 -3.986 5.420 1.992 1.00 0.00 H new ATOM 0 HO2' C A 17 -5.947 5.126 3.779 1.00 0.00 H new ATOM 0 H1' C A 17 -4.102 2.731 2.675 1.00 0.00 H new ATOM 0 H41 C A 17 -0.789 2.916 -2.984 1.00 0.00 H new ATOM 0 H42 C A 17 0.436 2.930 -1.711 1.00 0.00 H new ATOM 0 H5 C A 17 -3.141 3.044 -2.524 1.00 0.00 H new ATOM 0 H6 C A 17 -4.841 3.197 -0.810 1.00 0.00 H new ATOM 162 P U A 18 -6.830 7.509 1.750 1.00 0.00 P ATOM 163 OP1 U A 18 -7.697 8.242 2.699 1.00 0.00 O ATOM 164 OP2 U A 18 -7.066 7.623 0.293 1.00 0.00 O ATOM 165 O5' U A 18 -5.302 7.915 2.046 1.00 0.00 O ATOM 166 C5' U A 18 -4.744 7.748 3.351 1.00 0.00 C ATOM 167 C4' U A 18 -3.261 8.094 3.368 1.00 0.00 C ATOM 168 O4' U A 18 -2.482 7.066 2.763 1.00 0.00 O ATOM 169 C3' U A 18 -3.002 9.349 2.553 1.00 0.00 C ATOM 170 O3' U A 18 -2.791 10.439 3.454 1.00 0.00 O ATOM 171 C2' U A 18 -1.706 9.101 1.806 1.00 0.00 C ATOM 172 O2' U A 18 -0.662 9.959 2.268 1.00 0.00 O ATOM 173 C1' U A 18 -1.371 7.641 2.065 1.00 0.00 C ATOM 174 N1 U A 18 -1.127 6.959 0.788 1.00 0.00 N ATOM 175 C2 U A 18 0.184 6.821 0.385 1.00 0.00 C ATOM 176 O2 U A 18 1.123 7.229 1.064 1.00 0.00 O ATOM 177 N3 U A 18 0.382 6.198 -0.831 1.00 0.00 N ATOM 178 C4 U A 18 -0.606 5.706 -1.667 1.00 0.00 C ATOM 179 O4 U A 18 -0.310 5.171 -2.734 1.00 0.00 O ATOM 180 C5 U A 18 -1.952 5.895 -1.163 1.00 0.00 C ATOM 181 C6 U A 18 -2.166 6.508 0.026 1.00 0.00 C ATOM 0 H5' U A 18 -4.883 6.718 3.679 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.276 8.383 4.060 1.00 0.00 H new ATOM 0 H4' U A 18 -2.985 8.226 4.414 1.00 0.00 H new ATOM 0 H3' U A 18 -3.830 9.576 1.882 1.00 0.00 H new ATOM 0 H2' U A 18 -1.810 9.313 0.742 1.00 0.00 H new ATOM 0 HO2' U A 18 0.182 9.708 1.838 1.00 0.00 H new ATOM 0 H1' U A 18 -0.468 7.538 2.667 1.00 0.00 H new ATOM 0 H3 U A 18 1.347 6.090 -1.143 1.00 0.00 H new ATOM 0 H5 U A 18 -2.793 5.543 -1.742 1.00 0.00 H new ATOM 0 H6 U A 18 -3.178 6.642 0.378 1.00 0.00 H new ATOM 192 P G A 19 -2.707 11.952 2.903 1.00 0.00 P ATOM 193 OP1 G A 19 -2.986 12.872 4.028 1.00 0.00 O ATOM 194 OP2 G A 19 -3.500 12.040 1.658 1.00 0.00 O ATOM 195 O5' G A 19 -1.144 12.073 2.522 1.00 0.00 O ATOM 196 C5' G A 19 -0.158 12.043 3.560 1.00 0.00 C ATOM 197 C4' G A 19 1.263 11.845 3.027 1.00 0.00 C ATOM 198 O4' G A 19 1.450 10.553 2.463 1.00 0.00 O ATOM 199 C3' G A 19 1.593 12.792 1.894 1.00 0.00 C ATOM 200 O3' G A 19 1.903 14.107 2.373 1.00 0.00 O ATOM 201 C2' G A 19 2.814 12.109 1.290 1.00 0.00 C ATOM 202 O2' G A 19 4.018 12.500 1.959 1.00 0.00 O ATOM 203 C1' G A 19 2.514 10.624 1.501 1.00 0.00 C ATOM 204 N9 G A 19 2.132 9.993 0.227 1.00 0.00 N ATOM 205 C8 G A 19 0.905 9.699 -0.249 1.00 0.00 C ATOM 206 N7 G A 19 0.827 9.111 -1.394 1.00 0.00 N ATOM 207 C5 G A 19 2.174 8.998 -1.745 1.00 0.00 C ATOM 208 C6 G A 19 2.765 8.437 -2.905 1.00 0.00 C ATOM 209 O6 G A 19 2.209 7.915 -3.868 1.00 0.00 O ATOM 210 N1 G A 19 4.149 8.528 -2.863 1.00 0.00 N ATOM 211 C2 G A 19 4.881 9.091 -1.836 1.00 0.00 C ATOM 212 N2 G A 19 6.204 9.104 -1.994 1.00 0.00 N ATOM 213 N3 G A 19 4.331 9.619 -0.739 1.00 0.00 N ATOM 214 C4 G A 19 2.982 9.541 -0.756 1.00 0.00 C ATOM 0 H5' G A 19 -0.395 11.238 4.256 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.203 12.975 4.123 1.00 0.00 H new ATOM 0 H4' G A 19 1.896 12.013 3.899 1.00 0.00 H new ATOM 0 H3' G A 19 0.775 12.952 1.192 1.00 0.00 H new ATOM 0 H2' G A 19 2.977 12.370 0.244 1.00 0.00 H new ATOM 0 HO2' G A 19 3.852 13.310 2.484 1.00 0.00 H new ATOM 0 HO3' G A 19 2.113 14.691 1.614 1.00 0.00 H new ATOM 0 H1' G A 19 3.390 10.087 1.864 1.00 0.00 H new ATOM 0 H8 G A 19 0.016 9.948 0.311 1.00 0.00 H new ATOM 0 H1 G A 19 4.668 8.148 -3.655 1.00 0.00 H new ATOM 0 H21 G A 19 6.800 9.506 -1.271 1.00 0.00 H new ATOM 0 H22 G A 19 6.621 8.712 -2.838 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.434 4.893 -8.118 1.00 0.00 O ATOM 229 C5' C B 59 9.855 4.782 -8.160 1.00 0.00 C ATOM 230 C4' C B 59 10.539 5.668 -7.113 1.00 0.00 C ATOM 231 O4' C B 59 10.118 7.041 -7.228 1.00 0.00 O ATOM 232 C3' C B 59 10.162 5.253 -5.694 1.00 0.00 C ATOM 233 O3' C B 59 11.179 4.389 -5.179 1.00 0.00 O ATOM 234 C2' C B 59 10.226 6.567 -4.944 1.00 0.00 C ATOM 235 O2' C B 59 11.576 6.945 -4.646 1.00 0.00 O ATOM 236 C1' C B 59 9.598 7.489 -5.963 1.00 0.00 C ATOM 237 N1 C B 59 8.130 7.370 -5.924 1.00 0.00 N ATOM 238 C2 C B 59 7.451 7.955 -4.869 1.00 0.00 C ATOM 239 O2 C B 59 8.067 8.579 -4.008 1.00 0.00 O ATOM 240 N3 C B 59 6.096 7.805 -4.816 1.00 0.00 N ATOM 241 C4 C B 59 5.445 7.109 -5.761 1.00 0.00 C ATOM 242 N4 C B 59 4.120 6.981 -5.687 1.00 0.00 N ATOM 243 C5 C B 59 6.156 6.507 -6.845 1.00 0.00 C ATOM 244 C6 C B 59 7.479 6.669 -6.883 1.00 0.00 C ATOM 0 H5' C B 59 10.209 5.057 -9.153 1.00 0.00 H new ATOM 0 H5'' C B 59 10.141 3.743 -7.996 1.00 0.00 H new ATOM 0 H4' C B 59 11.608 5.556 -7.294 1.00 0.00 H new ATOM 0 H3' C B 59 9.203 4.740 -5.622 1.00 0.00 H new ATOM 0 H2' C B 59 9.736 6.561 -3.970 1.00 0.00 H new ATOM 0 HO2' C B 59 12.169 6.177 -4.784 1.00 0.00 H new ATOM 0 HO5' C B 59 8.183 5.829 -7.973 1.00 0.00 H new ATOM 0 H1' C B 59 9.828 8.538 -5.777 1.00 0.00 H new ATOM 0 H41 C B 59 3.618 6.454 -6.401 1.00 0.00 H new ATOM 0 H42 C B 59 3.608 7.410 -4.916 1.00 0.00 H new ATOM 0 H5 C B 59 5.640 5.941 -7.606 1.00 0.00 H new ATOM 0 H6 C B 59 8.043 6.233 -7.694 1.00 0.00 H new ATOM 257 P A B 60 10.812 3.279 -4.073 1.00 0.00 P ATOM 258 OP1 A B 60 12.061 2.589 -3.677 1.00 0.00 O ATOM 259 OP2 A B 60 9.659 2.494 -4.568 1.00 0.00 O ATOM 260 O5' A B 60 10.317 4.176 -2.830 1.00 0.00 O ATOM 261 C5' A B 60 11.201 5.119 -2.220 1.00 0.00 C ATOM 262 C4' A B 60 10.528 5.866 -1.072 1.00 0.00 C ATOM 263 O4' A B 60 9.593 6.850 -1.543 1.00 0.00 O ATOM 264 C3' A B 60 9.701 4.928 -0.213 1.00 0.00 C ATOM 265 O3' A B 60 10.546 4.341 0.783 1.00 0.00 O ATOM 266 C2' A B 60 8.750 5.903 0.450 1.00 0.00 C ATOM 267 O2' A B 60 9.388 6.618 1.516 1.00 0.00 O ATOM 268 C1' A B 60 8.413 6.822 -0.716 1.00 0.00 C ATOM 269 N9 A B 60 7.242 6.320 -1.466 1.00 0.00 N ATOM 270 C8 A B 60 7.179 5.595 -2.613 1.00 0.00 C ATOM 271 N7 A B 60 6.007 5.278 -3.053 1.00 0.00 N ATOM 272 C5 A B 60 5.176 5.859 -2.089 1.00 0.00 C ATOM 273 C6 A B 60 3.786 5.908 -1.940 1.00 0.00 C ATOM 274 N6 A B 60 2.941 5.332 -2.799 1.00 0.00 N ATOM 275 N1 A B 60 3.301 6.570 -0.872 1.00 0.00 N ATOM 276 C2 A B 60 4.135 7.150 -0.002 1.00 0.00 C ATOM 277 N3 A B 60 5.462 7.161 -0.047 1.00 0.00 N ATOM 278 C4 A B 60 5.922 6.495 -1.122 1.00 0.00 C ATOM 0 H5' A B 60 11.542 5.834 -2.968 1.00 0.00 H new ATOM 0 H5'' A B 60 12.085 4.601 -1.848 1.00 0.00 H new ATOM 0 H4' A B 60 11.346 6.324 -0.515 1.00 0.00 H new ATOM 0 H3' A B 60 9.217 4.115 -0.754 1.00 0.00 H new ATOM 0 H2' A B 60 7.883 5.436 0.918 1.00 0.00 H new ATOM 0 HO2' A B 60 10.216 6.158 1.769 1.00 0.00 H new ATOM 0 H1' A B 60 8.145 7.822 -0.375 1.00 0.00 H new ATOM 0 H8 A B 60 8.075 5.295 -3.137 1.00 0.00 H new ATOM 0 H61 A B 60 1.935 5.397 -2.645 1.00 0.00 H new ATOM 0 H62 A B 60 3.302 4.827 -3.609 1.00 0.00 H new ATOM 0 H2 A B 60 3.678 7.667 0.829 1.00 0.00 H new ATOM 290 P G B 61 10.392 2.779 1.156 1.00 0.00 P ATOM 291 OP1 G B 61 11.580 2.371 1.939 1.00 0.00 O ATOM 292 OP2 G B 61 10.033 2.044 -0.077 1.00 0.00 O ATOM 293 O5' G B 61 9.116 2.771 2.136 1.00 0.00 O ATOM 294 C5' G B 61 9.231 3.251 3.477 1.00 0.00 C ATOM 295 C4' G B 61 7.864 3.445 4.123 1.00 0.00 C ATOM 296 O4' G B 61 7.078 4.376 3.374 1.00 0.00 O ATOM 297 C3' G B 61 7.055 2.156 4.139 1.00 0.00 C ATOM 298 O3' G B 61 7.243 1.502 5.397 1.00 0.00 O ATOM 299 C2' G B 61 5.618 2.630 4.076 1.00 0.00 C ATOM 300 O2' G B 61 5.061 2.806 5.384 1.00 0.00 O ATOM 301 C1' G B 61 5.709 3.945 3.325 1.00 0.00 C ATOM 302 N9 G B 61 5.243 3.750 1.943 1.00 0.00 N ATOM 303 C8 G B 61 5.940 3.548 0.798 1.00 0.00 C ATOM 304 N7 G B 61 5.264 3.371 -0.289 1.00 0.00 N ATOM 305 C5 G B 61 3.950 3.458 0.181 1.00 0.00 C ATOM 306 C6 G B 61 2.721 3.344 -0.519 1.00 0.00 C ATOM 307 O6 G B 61 2.540 3.144 -1.718 1.00 0.00 O ATOM 308 N1 G B 61 1.636 3.491 0.337 1.00 0.00 N ATOM 309 C2 G B 61 1.719 3.718 1.694 1.00 0.00 C ATOM 310 N2 G B 61 0.566 3.816 2.348 1.00 0.00 N ATOM 311 N3 G B 61 2.868 3.829 2.356 1.00 0.00 N ATOM 312 C4 G B 61 3.935 3.689 1.546 1.00 0.00 C ATOM 0 H5' G B 61 9.773 4.197 3.480 1.00 0.00 H new ATOM 0 H5'' G B 61 9.816 2.546 4.067 1.00 0.00 H new ATOM 0 H4' G B 61 8.063 3.795 5.136 1.00 0.00 H new ATOM 0 H3' G B 61 7.333 1.474 3.336 1.00 0.00 H new ATOM 0 H2' G B 61 4.960 1.911 3.588 1.00 0.00 H new ATOM 0 HO2' G B 61 4.108 2.580 5.367 1.00 0.00 H new ATOM 0 H1' G B 61 5.077 4.711 3.774 1.00 0.00 H new ATOM 0 H8 G B 61 7.020 3.535 0.794 1.00 0.00 H new ATOM 0 H1 G B 61 0.704 3.426 -0.072 1.00 0.00 H new ATOM 0 H21 G B 61 0.563 3.984 3.354 1.00 0.00 H new ATOM 0 H22 G B 61 -0.316 3.724 1.844 1.00 0.00 H new ATOM 324 P U B 62 6.711 -0.005 5.616 1.00 0.00 P ATOM 325 OP1 U B 62 7.418 -0.586 6.778 1.00 0.00 O ATOM 326 OP2 U B 62 6.732 -0.702 4.310 1.00 0.00 O ATOM 327 O5' U B 62 5.172 0.249 6.032 1.00 0.00 O ATOM 328 C5' U B 62 4.881 0.930 7.256 1.00 0.00 C ATOM 329 C4' U B 62 3.428 1.403 7.344 1.00 0.00 C ATOM 330 O4' U B 62 3.078 2.236 6.233 1.00 0.00 O ATOM 331 C3' U B 62 2.422 0.267 7.289 1.00 0.00 C ATOM 332 O3' U B 62 2.226 -0.270 8.599 1.00 0.00 O ATOM 333 C2' U B 62 1.172 1.024 6.898 1.00 0.00 C ATOM 334 O2' U B 62 0.640 1.772 7.998 1.00 0.00 O ATOM 335 C1' U B 62 1.730 1.932 5.821 1.00 0.00 C ATOM 336 N1 U B 62 1.717 1.244 4.524 1.00 0.00 N ATOM 337 C2 U B 62 0.517 1.161 3.842 1.00 0.00 C ATOM 338 O2 U B 62 -0.533 1.595 4.311 1.00 0.00 O ATOM 339 N3 U B 62 0.565 0.543 2.605 1.00 0.00 N ATOM 340 C4 U B 62 1.696 0.015 2.005 1.00 0.00 C ATOM 341 O4 U B 62 1.634 -0.494 0.888 1.00 0.00 O ATOM 342 C5 U B 62 2.898 0.144 2.802 1.00 0.00 C ATOM 343 C6 U B 62 2.867 0.736 4.013 1.00 0.00 C ATOM 0 H5' U B 62 5.544 1.790 7.354 1.00 0.00 H new ATOM 0 H5'' U B 62 5.093 0.266 8.094 1.00 0.00 H new ATOM 0 H4' U B 62 3.381 1.925 8.299 1.00 0.00 H new ATOM 0 H3' U B 62 2.706 -0.557 6.634 1.00 0.00 H new ATOM 0 H2' U B 62 0.340 0.396 6.579 1.00 0.00 H new ATOM 0 HO2' U B 62 1.072 1.484 8.829 1.00 0.00 H new ATOM 0 H1' U B 62 1.139 2.840 5.701 1.00 0.00 H new ATOM 0 H3 U B 62 -0.312 0.470 2.089 1.00 0.00 H new ATOM 0 H5 U B 62 3.833 -0.240 2.421 1.00 0.00 H new ATOM 0 H6 U B 62 3.778 0.808 4.589 1.00 0.00 H new ATOM 354 P G B 63 1.645 -1.762 8.774 1.00 0.00 P ATOM 355 OP1 G B 63 1.445 -2.015 10.218 1.00 0.00 O ATOM 356 OP2 G B 63 2.482 -2.682 7.972 1.00 0.00 O ATOM 357 O5' G B 63 0.194 -1.661 8.073 1.00 0.00 O ATOM 358 C5' G B 63 -0.813 -0.802 8.611 1.00 0.00 C ATOM 359 C4' G B 63 -2.128 -0.903 7.837 1.00 0.00 C ATOM 360 O4' G B 63 -2.060 -0.249 6.565 1.00 0.00 O ATOM 361 C3' G B 63 -2.482 -2.341 7.511 1.00 0.00 C ATOM 362 O3' G B 63 -3.196 -2.888 8.620 1.00 0.00 O ATOM 363 C2' G B 63 -3.437 -2.164 6.346 1.00 0.00 C ATOM 364 O2' G B 63 -4.754 -1.817 6.791 1.00 0.00 O ATOM 365 C1' G B 63 -2.786 -1.026 5.589 1.00 0.00 C ATOM 366 N9 G B 63 -1.883 -1.542 4.545 1.00 0.00 N ATOM 367 C8 G B 63 -0.535 -1.661 4.554 1.00 0.00 C ATOM 368 N7 G B 63 0.039 -2.074 3.478 1.00 0.00 N ATOM 369 C5 G B 63 -1.053 -2.269 2.633 1.00 0.00 C ATOM 370 C6 G B 63 -1.089 -2.723 1.293 1.00 0.00 C ATOM 371 O6 G B 63 -0.144 -3.039 0.573 1.00 0.00 O ATOM 372 N1 G B 63 -2.387 -2.783 0.811 1.00 0.00 N ATOM 373 C2 G B 63 -3.520 -2.452 1.527 1.00 0.00 C ATOM 374 N2 G B 63 -4.683 -2.602 0.893 1.00 0.00 N ATOM 375 N3 G B 63 -3.496 -2.019 2.790 1.00 0.00 N ATOM 376 C4 G B 63 -2.237 -1.951 3.280 1.00 0.00 C ATOM 0 H5' G B 63 -0.459 0.229 8.590 1.00 0.00 H new ATOM 0 H5'' G B 63 -0.987 -1.058 9.656 1.00 0.00 H new ATOM 0 H4' G B 63 -2.866 -0.437 8.491 1.00 0.00 H new ATOM 0 H3' G B 63 -1.631 -2.988 7.299 1.00 0.00 H new ATOM 0 H2' G B 63 -3.581 -3.066 5.751 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.788 -1.852 7.770 1.00 0.00 H new ATOM 0 H1' G B 63 -3.531 -0.414 5.081 1.00 0.00 H new ATOM 0 H8 G B 63 0.040 -1.418 5.435 1.00 0.00 H new ATOM 0 H1 G B 63 -2.516 -3.097 -0.151 1.00 0.00 H new ATOM 0 H21 G B 63 -5.556 -2.374 1.369 1.00 0.00 H new ATOM 0 H22 G B 63 -4.700 -2.945 -0.068 1.00 0.00 H new ATOM 388 P U B 64 -2.938 -4.406 9.084 1.00 0.00 P ATOM 389 OP1 U B 64 -3.570 -4.601 10.408 1.00 0.00 O ATOM 390 OP2 U B 64 -1.503 -4.713 8.895 1.00 0.00 O ATOM 391 O5' U B 64 -3.779 -5.239 7.997 1.00 0.00 O ATOM 392 C5' U B 64 -5.173 -4.986 7.820 1.00 0.00 C ATOM 393 C4' U B 64 -5.717 -5.701 6.591 1.00 0.00 C ATOM 394 O4' U B 64 -5.446 -4.977 5.386 1.00 0.00 O ATOM 395 C3' U B 64 -5.041 -7.043 6.400 1.00 0.00 C ATOM 396 O3' U B 64 -5.762 -8.029 7.141 1.00 0.00 O ATOM 397 C2' U B 64 -5.248 -7.296 4.922 1.00 0.00 C ATOM 398 O2' U B 64 -6.537 -7.866 4.663 1.00 0.00 O ATOM 399 C1' U B 64 -5.128 -5.902 4.330 1.00 0.00 C ATOM 400 N1 U B 64 -3.779 -5.655 3.785 1.00 0.00 N ATOM 401 C2 U B 64 -3.607 -5.853 2.428 1.00 0.00 C ATOM 402 O2 U B 64 -4.519 -6.250 1.705 1.00 0.00 O ATOM 403 N3 U B 64 -2.347 -5.585 1.927 1.00 0.00 N ATOM 404 C4 U B 64 -1.255 -5.147 2.660 1.00 0.00 C ATOM 405 O4 U B 64 -0.175 -4.940 2.111 1.00 0.00 O ATOM 406 C5 U B 64 -1.527 -4.970 4.072 1.00 0.00 C ATOM 407 C6 U B 64 -2.753 -5.222 4.581 1.00 0.00 C ATOM 0 H5' U B 64 -5.340 -3.913 7.722 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.719 -5.314 8.705 1.00 0.00 H new ATOM 0 H4' U B 64 -6.789 -5.798 6.764 1.00 0.00 H new ATOM 0 H3' U B 64 -3.999 -7.070 6.718 1.00 0.00 H new ATOM 0 H2' U B 64 -4.539 -8.009 4.501 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.995 -8.039 5.512 1.00 0.00 H new ATOM 0 H1' U B 64 -5.812 -5.782 3.490 1.00 0.00 H new ATOM 0 H3 U B 64 -2.208 -5.722 0.926 1.00 0.00 H new ATOM 0 H5 U B 64 -0.738 -4.632 4.727 1.00 0.00 H new ATOM 0 H6 U B 64 -2.927 -5.079 5.637 1.00 0.00 H new ATOM 418 P C B 65 -4.973 -9.213 7.896 1.00 0.00 P ATOM 419 OP1 C B 65 -5.919 -9.892 8.808 1.00 0.00 O ATOM 420 OP2 C B 65 -3.705 -8.661 8.425 1.00 0.00 O ATOM 421 O5' C B 65 -4.620 -10.220 6.692 1.00 0.00 O ATOM 422 C5' C B 65 -5.668 -10.853 5.956 1.00 0.00 C ATOM 423 C4' C B 65 -5.135 -11.629 4.756 1.00 0.00 C ATOM 424 O4' C B 65 -4.876 -10.773 3.647 1.00 0.00 O ATOM 425 C3' C B 65 -3.813 -12.305 5.067 1.00 0.00 C ATOM 426 O3' C B 65 -4.006 -13.564 5.722 1.00 0.00 O ATOM 427 C2' C B 65 -3.226 -12.481 3.678 1.00 0.00 C ATOM 428 O2' C B 65 -3.719 -13.668 3.045 1.00 0.00 O ATOM 429 C1' C B 65 -3.702 -11.222 2.956 1.00 0.00 C ATOM 430 N1 C B 65 -2.667 -10.184 2.979 1.00 0.00 N ATOM 431 C2 C B 65 -1.841 -10.070 1.876 1.00 0.00 C ATOM 432 O2 C B 65 -1.970 -10.842 0.929 1.00 0.00 O ATOM 433 N3 C B 65 -0.900 -9.087 1.877 1.00 0.00 N ATOM 434 C4 C B 65 -0.783 -8.250 2.916 1.00 0.00 C ATOM 435 N4 C B 65 0.169 -7.316 2.901 1.00 0.00 N ATOM 436 C5 C B 65 -1.646 -8.369 4.054 1.00 0.00 C ATOM 437 C6 C B 65 -2.559 -9.351 4.042 1.00 0.00 C ATOM 0 H5' C B 65 -6.377 -10.099 5.614 1.00 0.00 H new ATOM 0 H5'' C B 65 -6.214 -11.530 6.612 1.00 0.00 H new ATOM 0 H4' C B 65 -5.909 -12.359 4.521 1.00 0.00 H new ATOM 0 H3' C B 65 -3.176 -11.740 5.748 1.00 0.00 H new ATOM 0 H2' C B 65 -2.142 -12.597 3.678 1.00 0.00 H new ATOM 0 HO2' C B 65 -4.079 -14.276 3.724 1.00 0.00 H new ATOM 0 HO3' C B 65 -3.135 -13.974 5.907 1.00 0.00 H new ATOM 0 H1' C B 65 -3.917 -11.434 1.909 1.00 0.00 H new ATOM 0 H41 C B 65 0.266 -6.674 3.688 1.00 0.00 H new ATOM 0 H42 C B 65 0.800 -7.244 2.103 1.00 0.00 H new ATOM 0 H5 C B 65 -1.564 -7.692 4.891 1.00 0.00 H new ATOM 0 H6 C B 65 -3.216 -9.479 4.890 1.00 0.00 H new TER 450 C B 65