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 -10:sc= -4.11! USER MOD Single : A 13 G O5' : rot 32:sc= -0.818! USER MOD Single : A 14 G O2' : rot -17:sc= -0.0179 USER MOD Single : A 15 C O2' : rot -14:sc= -0.501 USER MOD Single : A 16 A O2' : rot -2:sc= -5.13! USER MOD Single : A 17 C O2' : rot -4:sc= -3.44! USER MOD Single : A 18 U O2' : rot 172:sc= -7.39! USER MOD Single : A 19 G O2' : rot -21:sc= 0.19 USER MOD Single : A 19 G O3' : rot 180:sc= 0.181 USER MOD Single : B 59 C O2' : rot -10:sc= -2.62! USER MOD Single : B 59 C O5' : rot 31:sc= -2.6! USER MOD Single : B 60 A O2' : rot -20:sc= 0.22 USER MOD Single : B 61 G O2' : rot -132:sc= -0.664 USER MOD Single : B 62 U O2' : rot -19:sc= -1.46! USER MOD Single : B 63 G O2' : rot -8:sc= -0.235 USER MOD Single : B 64 U O2' : rot -5:sc= 0.0137 USER MOD Single : B 65 C O2' : rot -13:sc= 0.15 USER MOD Single : B 65 C O3' : rot 180:sc= 0.172 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 5.002 -6.454 -5.433 1.00 0.00 O ATOM 2 C5' G A 13 5.373 -7.250 -6.561 1.00 0.00 C ATOM 3 C4' G A 13 4.214 -8.116 -7.042 1.00 0.00 C ATOM 4 O4' G A 13 3.999 -9.232 -6.164 1.00 0.00 O ATOM 5 C3' G A 13 2.907 -7.328 -7.047 1.00 0.00 C ATOM 6 O3' G A 13 2.637 -6.887 -8.379 1.00 0.00 O ATOM 7 C2' G A 13 1.877 -8.374 -6.672 1.00 0.00 C ATOM 8 O2' G A 13 1.475 -9.153 -7.805 1.00 0.00 O ATOM 9 C1' G A 13 2.653 -9.202 -5.670 1.00 0.00 C ATOM 10 N9 G A 13 2.592 -8.588 -4.331 1.00 0.00 N ATOM 11 C8 G A 13 3.273 -7.525 -3.838 1.00 0.00 C ATOM 12 N7 G A 13 3.020 -7.161 -2.625 1.00 0.00 N ATOM 13 C5 G A 13 2.045 -8.090 -2.248 1.00 0.00 C ATOM 14 C6 G A 13 1.348 -8.228 -1.019 1.00 0.00 C ATOM 15 O6 G A 13 1.453 -7.548 0.001 1.00 0.00 O ATOM 16 N1 G A 13 0.455 -9.290 -1.061 1.00 0.00 N ATOM 17 C2 G A 13 0.251 -10.119 -2.145 1.00 0.00 C ATOM 18 N2 G A 13 -0.656 -11.083 -1.988 1.00 0.00 N ATOM 19 N3 G A 13 0.902 -9.996 -3.304 1.00 0.00 N ATOM 20 C4 G A 13 1.779 -8.967 -3.289 1.00 0.00 C ATOM 0 H5' G A 13 6.218 -7.886 -6.296 1.00 0.00 H new ATOM 0 H5'' G A 13 5.704 -6.601 -7.372 1.00 0.00 H new ATOM 0 H4' G A 13 4.481 -8.450 -8.045 1.00 0.00 H new ATOM 0 H3' G A 13 2.919 -6.460 -6.388 1.00 0.00 H new ATOM 0 H2' G A 13 0.943 -7.964 -6.286 1.00 0.00 H new ATOM 0 HO2' G A 13 1.826 -8.745 -8.624 1.00 0.00 H new ATOM 0 HO5' G A 13 4.334 -6.933 -4.900 1.00 0.00 H new ATOM 0 H1' G A 13 2.243 -10.207 -5.565 1.00 0.00 H new ATOM 0 H8 G A 13 4.002 -7.001 -4.438 1.00 0.00 H new ATOM 0 H1 G A 13 -0.095 -9.472 -0.222 1.00 0.00 H new ATOM 0 H21 G A 13 -0.852 -11.728 -2.753 1.00 0.00 H new ATOM 0 H22 G A 13 -1.154 -11.175 -1.103 1.00 0.00 H new ATOM 33 P G A 14 1.638 -5.651 -8.630 1.00 0.00 P ATOM 34 OP1 G A 14 1.504 -5.452 -10.091 1.00 0.00 O ATOM 35 OP2 G A 14 2.068 -4.526 -7.769 1.00 0.00 O ATOM 36 O5' G A 14 0.238 -6.210 -8.066 1.00 0.00 O ATOM 37 C5' G A 14 -0.421 -7.295 -8.724 1.00 0.00 C ATOM 38 C4' G A 14 -1.842 -7.501 -8.207 1.00 0.00 C ATOM 39 O4' G A 14 -1.875 -8.243 -6.975 1.00 0.00 O ATOM 40 C3' G A 14 -2.513 -6.185 -7.863 1.00 0.00 C ATOM 41 O3' G A 14 -3.087 -5.607 -9.039 1.00 0.00 O ATOM 42 C2' G A 14 -3.627 -6.664 -6.961 1.00 0.00 C ATOM 43 O2' G A 14 -4.679 -7.287 -7.709 1.00 0.00 O ATOM 44 C1' G A 14 -2.877 -7.671 -6.107 1.00 0.00 C ATOM 45 N9 G A 14 -2.264 -7.028 -4.935 1.00 0.00 N ATOM 46 C8 G A 14 -1.054 -6.433 -4.791 1.00 0.00 C ATOM 47 N7 G A 14 -0.744 -5.989 -3.620 1.00 0.00 N ATOM 48 C5 G A 14 -1.884 -6.321 -2.882 1.00 0.00 C ATOM 49 C6 G A 14 -2.174 -6.102 -1.513 1.00 0.00 C ATOM 50 O6 G A 14 -1.465 -5.567 -0.666 1.00 0.00 O ATOM 51 N1 G A 14 -3.434 -6.587 -1.173 1.00 0.00 N ATOM 52 C2 G A 14 -4.306 -7.207 -2.041 1.00 0.00 C ATOM 53 N2 G A 14 -5.472 -7.592 -1.525 1.00 0.00 N ATOM 54 N3 G A 14 -4.038 -7.419 -3.330 1.00 0.00 N ATOM 55 C4 G A 14 -2.819 -6.953 -3.682 1.00 0.00 C ATOM 0 H5' G A 14 0.154 -8.210 -8.578 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.450 -7.104 -9.797 1.00 0.00 H new ATOM 0 H4' G A 14 -2.348 -8.030 -9.015 1.00 0.00 H new ATOM 0 H3' G A 14 -1.847 -5.438 -7.431 1.00 0.00 H new ATOM 0 H2' G A 14 -4.129 -5.876 -6.400 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.597 -7.043 -8.655 1.00 0.00 H new ATOM 0 H1' G A 14 -3.546 -8.434 -5.710 1.00 0.00 H new ATOM 0 H8 G A 14 -0.375 -6.334 -5.625 1.00 0.00 H new ATOM 0 H1 G A 14 -3.735 -6.474 -0.205 1.00 0.00 H new ATOM 0 H21 G A 14 -6.162 -8.057 -2.115 1.00 0.00 H new ATOM 0 H22 G A 14 -5.675 -7.422 -0.540 1.00 0.00 H new ATOM 67 P C A 15 -3.271 -4.010 -9.123 1.00 0.00 P ATOM 68 OP1 C A 15 -4.000 -3.687 -10.370 1.00 0.00 O ATOM 69 OP2 C A 15 -1.965 -3.373 -8.841 1.00 0.00 O ATOM 70 O5' C A 15 -4.250 -3.732 -7.877 1.00 0.00 O ATOM 71 C5' C A 15 -5.611 -4.154 -7.934 1.00 0.00 C ATOM 72 C4' C A 15 -6.268 -4.153 -6.557 1.00 0.00 C ATOM 73 O4' C A 15 -5.554 -4.972 -5.628 1.00 0.00 O ATOM 74 C3' C A 15 -6.254 -2.789 -5.899 1.00 0.00 C ATOM 75 O3' C A 15 -7.321 -1.991 -6.417 1.00 0.00 O ATOM 76 C2' C A 15 -6.582 -3.175 -4.474 1.00 0.00 C ATOM 77 O2' C A 15 -7.975 -3.471 -4.315 1.00 0.00 O ATOM 78 C1' C A 15 -5.720 -4.423 -4.304 1.00 0.00 C ATOM 79 N1 C A 15 -4.427 -4.073 -3.679 1.00 0.00 N ATOM 80 C2 C A 15 -4.428 -3.859 -2.311 1.00 0.00 C ATOM 81 O2 C A 15 -5.480 -3.923 -1.680 1.00 0.00 O ATOM 82 N3 C A 15 -3.249 -3.564 -1.702 1.00 0.00 N ATOM 83 C4 C A 15 -2.113 -3.482 -2.406 1.00 0.00 C ATOM 84 N4 C A 15 -0.974 -3.200 -1.774 1.00 0.00 N ATOM 85 C5 C A 15 -2.106 -3.699 -3.819 1.00 0.00 C ATOM 86 C6 C A 15 -3.278 -3.985 -4.413 1.00 0.00 C ATOM 0 H5' C A 15 -5.662 -5.156 -8.359 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.167 -3.496 -8.601 1.00 0.00 H new ATOM 0 H4' C A 15 -7.281 -4.506 -6.753 1.00 0.00 H new ATOM 0 H3' C A 15 -5.333 -2.223 -6.037 1.00 0.00 H new ATOM 0 H2' C A 15 -6.388 -2.392 -3.741 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.469 -3.154 -5.100 1.00 0.00 H new ATOM 0 H1' C A 15 -6.183 -5.157 -3.644 1.00 0.00 H new ATOM 0 H41 C A 15 -0.102 -3.135 -2.299 1.00 0.00 H new ATOM 0 H42 C A 15 -0.974 -3.049 -0.765 1.00 0.00 H new ATOM 0 H5 C A 15 -1.191 -3.635 -4.390 1.00 0.00 H new ATOM 0 H6 C A 15 -3.311 -4.147 -5.480 1.00 0.00 H new ATOM 98 P A A 16 -7.256 -0.385 -6.293 1.00 0.00 P ATOM 99 OP1 A A 16 -8.504 0.173 -6.861 1.00 0.00 O ATOM 100 OP2 A A 16 -5.944 0.065 -6.811 1.00 0.00 O ATOM 101 O5' A A 16 -7.276 -0.147 -4.698 1.00 0.00 O ATOM 102 C5' A A 16 -8.481 -0.352 -3.956 1.00 0.00 C ATOM 103 C4' A A 16 -8.275 -0.160 -2.452 1.00 0.00 C ATOM 104 O4' A A 16 -7.322 -1.083 -1.916 1.00 0.00 O ATOM 105 C3' A A 16 -7.697 1.203 -2.124 1.00 0.00 C ATOM 106 O3' A A 16 -8.755 2.156 -2.024 1.00 0.00 O ATOM 107 C2' A A 16 -7.139 0.965 -0.738 1.00 0.00 C ATOM 108 O2' A A 16 -8.166 1.024 0.259 1.00 0.00 O ATOM 109 C1' A A 16 -6.571 -0.435 -0.868 1.00 0.00 C ATOM 110 N9 A A 16 -5.132 -0.387 -1.182 1.00 0.00 N ATOM 111 C8 A A 16 -4.488 -0.638 -2.339 1.00 0.00 C ATOM 112 N7 A A 16 -3.199 -0.638 -2.323 1.00 0.00 N ATOM 113 C5 A A 16 -2.944 -0.335 -0.987 1.00 0.00 C ATOM 114 C6 A A 16 -1.762 -0.172 -0.266 1.00 0.00 C ATOM 115 N6 A A 16 -0.555 -0.352 -0.807 1.00 0.00 N ATOM 116 N1 A A 16 -1.878 0.136 1.041 1.00 0.00 N ATOM 117 C2 A A 16 -3.091 0.266 1.594 1.00 0.00 C ATOM 118 N3 A A 16 -4.263 0.126 1.002 1.00 0.00 N ATOM 119 C4 A A 16 -4.118 -0.176 -0.292 1.00 0.00 C ATOM 0 H5' A A 16 -8.854 -1.359 -4.144 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.244 0.342 -4.308 1.00 0.00 H new ATOM 0 H4' A A 16 -9.268 -0.300 -2.025 1.00 0.00 H new ATOM 0 H3' A A 16 -6.980 1.573 -2.857 1.00 0.00 H new ATOM 0 H2' A A 16 -6.408 1.710 -0.424 1.00 0.00 H new ATOM 0 HO2' A A 16 -9.021 1.245 -0.165 1.00 0.00 H new ATOM 0 H1' A A 16 -6.660 -0.990 0.066 1.00 0.00 H new ATOM 0 H8 A A 16 -5.034 -0.833 -3.250 1.00 0.00 H new ATOM 0 H61 A A 16 0.283 -0.221 -0.240 1.00 0.00 H new ATOM 0 H62 A A 16 -0.470 -0.620 -1.787 1.00 0.00 H new ATOM 0 H2 A A 16 -3.113 0.514 2.645 1.00 0.00 H new ATOM 131 P C A 17 -8.420 3.729 -2.098 1.00 0.00 P ATOM 132 OP1 C A 17 -9.679 4.481 -1.890 1.00 0.00 O ATOM 133 OP2 C A 17 -7.604 3.973 -3.309 1.00 0.00 O ATOM 134 O5' C A 17 -7.483 3.944 -0.805 1.00 0.00 O ATOM 135 C5' C A 17 -7.994 3.691 0.507 1.00 0.00 C ATOM 136 C4' C A 17 -6.931 3.890 1.587 1.00 0.00 C ATOM 137 O4' C A 17 -5.906 2.900 1.535 1.00 0.00 O ATOM 138 C3' C A 17 -6.200 5.203 1.422 1.00 0.00 C ATOM 139 O3' C A 17 -6.961 6.230 2.063 1.00 0.00 O ATOM 140 C2' C A 17 -4.938 4.964 2.224 1.00 0.00 C ATOM 141 O2' C A 17 -5.149 5.213 3.619 1.00 0.00 O ATOM 142 C1' C A 17 -4.659 3.487 1.957 1.00 0.00 C ATOM 143 N1 C A 17 -3.636 3.323 0.919 1.00 0.00 N ATOM 144 C2 C A 17 -2.315 3.281 1.320 1.00 0.00 C ATOM 145 O2 C A 17 -2.033 3.408 2.510 1.00 0.00 O ATOM 146 N3 C A 17 -1.359 3.098 0.366 1.00 0.00 N ATOM 147 C4 C A 17 -1.699 2.965 -0.925 1.00 0.00 C ATOM 148 N4 C A 17 -0.751 2.775 -1.842 1.00 0.00 N ATOM 149 C5 C A 17 -3.068 3.015 -1.328 1.00 0.00 C ATOM 150 C6 C A 17 -3.989 3.193 -0.383 1.00 0.00 C ATOM 0 H5' C A 17 -8.374 2.671 0.557 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.836 4.355 0.702 1.00 0.00 H new ATOM 0 H4' C A 17 -7.488 3.842 2.523 1.00 0.00 H new ATOM 0 H3' C A 17 -6.026 5.496 0.387 1.00 0.00 H new ATOM 0 H2' C A 17 -4.114 5.621 1.946 1.00 0.00 H new ATOM 0 HO2' C A 17 -6.057 5.554 3.757 1.00 0.00 H new ATOM 0 H1' C A 17 -4.278 3.000 2.854 1.00 0.00 H new ATOM 0 H41 C A 17 -1.005 2.673 -2.825 1.00 0.00 H new ATOM 0 H42 C A 17 0.229 2.731 -1.561 1.00 0.00 H new ATOM 0 H5 C A 17 -3.347 2.912 -2.366 1.00 0.00 H new ATOM 0 H6 C A 17 -5.033 3.234 -0.658 1.00 0.00 H new ATOM 162 P U A 18 -6.868 7.753 1.552 1.00 0.00 P ATOM 163 OP1 U A 18 -7.701 8.592 2.441 1.00 0.00 O ATOM 164 OP2 U A 18 -7.101 7.766 0.091 1.00 0.00 O ATOM 165 O5' U A 18 -5.322 8.115 1.820 1.00 0.00 O ATOM 166 C5' U A 18 -4.775 8.050 3.140 1.00 0.00 C ATOM 167 C4' U A 18 -3.282 8.355 3.136 1.00 0.00 C ATOM 168 O4' U A 18 -2.531 7.262 2.613 1.00 0.00 O ATOM 169 C3' U A 18 -2.983 9.538 2.232 1.00 0.00 C ATOM 170 O3' U A 18 -2.743 10.686 3.050 1.00 0.00 O ATOM 171 C2' U A 18 -1.692 9.198 1.514 1.00 0.00 C ATOM 172 O2' U A 18 -0.624 10.056 1.918 1.00 0.00 O ATOM 173 C1' U A 18 -1.401 7.752 1.879 1.00 0.00 C ATOM 174 N1 U A 18 -1.176 6.972 0.656 1.00 0.00 N ATOM 175 C2 U A 18 0.132 6.762 0.267 1.00 0.00 C ATOM 176 O2 U A 18 1.083 7.187 0.920 1.00 0.00 O ATOM 177 N3 U A 18 0.311 6.051 -0.902 1.00 0.00 N ATOM 178 C4 U A 18 -0.693 5.533 -1.704 1.00 0.00 C ATOM 179 O4 U A 18 -0.414 4.915 -2.730 1.00 0.00 O ATOM 180 C5 U A 18 -2.033 5.799 -1.218 1.00 0.00 C ATOM 181 C6 U A 18 -2.228 6.502 -0.075 1.00 0.00 C ATOM 0 H5' U A 18 -4.945 7.058 3.558 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.292 8.760 3.786 1.00 0.00 H new ATOM 0 H4' U A 18 -3.006 8.558 4.171 1.00 0.00 H new ATOM 0 H3' U A 18 -3.802 9.738 1.541 1.00 0.00 H new ATOM 0 H2' U A 18 -1.787 9.335 0.437 1.00 0.00 H new ATOM 0 HO2' U A 18 0.218 9.733 1.534 1.00 0.00 H new ATOM 0 H1' U A 18 -0.502 7.667 2.490 1.00 0.00 H new ATOM 0 H3 U A 18 1.272 5.892 -1.204 1.00 0.00 H new ATOM 0 H5 U A 18 -2.885 5.433 -1.772 1.00 0.00 H new ATOM 0 H6 U A 18 -3.236 6.694 0.263 1.00 0.00 H new ATOM 192 P G A 19 -2.606 12.149 2.388 1.00 0.00 P ATOM 193 OP1 G A 19 -2.870 13.161 3.435 1.00 0.00 O ATOM 194 OP2 G A 19 -3.381 12.167 1.128 1.00 0.00 O ATOM 195 O5' G A 19 -1.035 12.195 2.020 1.00 0.00 O ATOM 196 C5' G A 19 -0.065 12.191 3.074 1.00 0.00 C ATOM 197 C4' G A 19 1.356 11.915 2.575 1.00 0.00 C ATOM 198 O4' G A 19 1.509 10.581 2.104 1.00 0.00 O ATOM 199 C3' G A 19 1.730 12.771 1.385 1.00 0.00 C ATOM 200 O3' G A 19 2.076 14.105 1.776 1.00 0.00 O ATOM 201 C2' G A 19 2.934 12.008 0.846 1.00 0.00 C ATOM 202 O2' G A 19 4.142 12.400 1.509 1.00 0.00 O ATOM 203 C1' G A 19 2.579 10.552 1.147 1.00 0.00 C ATOM 204 N9 G A 19 2.180 9.857 -0.088 1.00 0.00 N ATOM 205 C8 G A 19 0.945 9.576 -0.552 1.00 0.00 C ATOM 206 N7 G A 19 0.851 8.923 -1.660 1.00 0.00 N ATOM 207 C5 G A 19 2.193 8.744 -1.995 1.00 0.00 C ATOM 208 C6 G A 19 2.769 8.094 -3.117 1.00 0.00 C ATOM 209 O6 G A 19 2.198 7.533 -4.050 1.00 0.00 O ATOM 210 N1 G A 19 4.154 8.139 -3.073 1.00 0.00 N ATOM 211 C2 G A 19 4.902 8.737 -2.078 1.00 0.00 C ATOM 212 N2 G A 19 6.225 8.696 -2.229 1.00 0.00 N ATOM 213 N3 G A 19 4.367 9.349 -1.017 1.00 0.00 N ATOM 214 C4 G A 19 3.016 9.316 -1.037 1.00 0.00 C ATOM 0 H5' G A 19 -0.339 11.436 3.810 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.085 13.155 3.583 1.00 0.00 H new ATOM 0 H4' G A 19 1.983 12.124 3.441 1.00 0.00 H new ATOM 0 H3' G A 19 0.926 12.910 0.662 1.00 0.00 H new ATOM 0 H2' G A 19 3.121 12.194 -0.212 1.00 0.00 H new ATOM 0 HO2' G A 19 4.017 13.280 1.923 1.00 0.00 H new ATOM 0 HO3' G A 19 2.313 14.628 0.982 1.00 0.00 H new ATOM 0 H1' G A 19 3.433 10.007 1.549 1.00 0.00 H new ATOM 0 H8 G A 19 0.063 9.888 -0.013 1.00 0.00 H new ATOM 0 H1 G A 19 4.662 7.694 -3.838 1.00 0.00 H new ATOM 0 H21 G A 19 6.832 9.120 -1.527 1.00 0.00 H new ATOM 0 H22 G A 19 6.631 8.240 -3.046 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.481 4.273 -8.144 1.00 0.00 O ATOM 229 C5' C B 59 9.902 4.149 -8.145 1.00 0.00 C ATOM 230 C4' C B 59 10.562 5.039 -7.086 1.00 0.00 C ATOM 231 O4' C B 59 10.155 6.414 -7.226 1.00 0.00 O ATOM 232 C3' C B 59 10.142 4.639 -5.674 1.00 0.00 C ATOM 233 O3' C B 59 11.140 3.776 -5.122 1.00 0.00 O ATOM 234 C2' C B 59 10.191 5.960 -4.933 1.00 0.00 C ATOM 235 O2' C B 59 11.534 6.329 -4.595 1.00 0.00 O ATOM 236 C1' C B 59 9.605 6.880 -5.979 1.00 0.00 C ATOM 237 N1 C B 59 8.135 6.782 -5.980 1.00 0.00 N ATOM 238 C2 C B 59 7.436 7.413 -4.965 1.00 0.00 C ATOM 239 O2 C B 59 8.038 8.061 -4.111 1.00 0.00 O ATOM 240 N3 C B 59 6.078 7.285 -4.944 1.00 0.00 N ATOM 241 C4 C B 59 5.443 6.564 -5.883 1.00 0.00 C ATOM 242 N4 C B 59 4.115 6.460 -5.841 1.00 0.00 N ATOM 243 C5 C B 59 6.175 5.915 -6.925 1.00 0.00 C ATOM 244 C6 C B 59 7.500 6.056 -6.931 1.00 0.00 C ATOM 0 H5' C B 59 10.287 4.413 -9.130 1.00 0.00 H new ATOM 0 H5'' C B 59 10.174 3.109 -7.964 1.00 0.00 H new ATOM 0 H4' C B 59 11.635 4.918 -7.235 1.00 0.00 H new ATOM 0 H3' C B 59 9.179 4.131 -5.626 1.00 0.00 H new ATOM 0 H2' C B 59 9.668 5.966 -3.977 1.00 0.00 H new ATOM 0 HO2' C B 59 12.134 5.574 -4.770 1.00 0.00 H new ATOM 0 HO5' C B 59 8.232 5.178 -7.863 1.00 0.00 H new ATOM 0 H1' C B 59 9.844 7.928 -5.796 1.00 0.00 H new ATOM 0 H41 C B 59 3.623 5.915 -6.549 1.00 0.00 H new ATOM 0 H42 C B 59 3.590 6.926 -5.101 1.00 0.00 H new ATOM 0 H5 C B 59 5.672 5.331 -7.681 1.00 0.00 H new ATOM 0 H6 C B 59 8.079 5.582 -7.710 1.00 0.00 H new ATOM 257 P A B 60 10.747 2.711 -3.982 1.00 0.00 P ATOM 258 OP1 A B 60 11.979 2.015 -3.551 1.00 0.00 O ATOM 259 OP2 A B 60 9.586 1.928 -4.461 1.00 0.00 O ATOM 260 O5' A B 60 10.253 3.658 -2.777 1.00 0.00 O ATOM 261 C5' A B 60 11.145 4.609 -2.189 1.00 0.00 C ATOM 262 C4' A B 60 10.460 5.433 -1.104 1.00 0.00 C ATOM 263 O4' A B 60 9.534 6.385 -1.650 1.00 0.00 O ATOM 264 C3' A B 60 9.619 4.558 -0.195 1.00 0.00 C ATOM 265 O3' A B 60 10.453 4.028 0.841 1.00 0.00 O ATOM 266 C2' A B 60 8.671 5.579 0.400 1.00 0.00 C ATOM 267 O2' A B 60 9.305 6.347 1.430 1.00 0.00 O ATOM 268 C1' A B 60 8.355 6.433 -0.820 1.00 0.00 C ATOM 269 N9 A B 60 7.170 5.918 -1.538 1.00 0.00 N ATOM 270 C8 A B 60 7.086 5.118 -2.633 1.00 0.00 C ATOM 271 N7 A B 60 5.904 4.803 -3.051 1.00 0.00 N ATOM 272 C5 A B 60 5.092 5.471 -2.130 1.00 0.00 C ATOM 273 C6 A B 60 3.703 5.569 -1.986 1.00 0.00 C ATOM 274 N6 A B 60 2.840 4.958 -2.803 1.00 0.00 N ATOM 275 N1 A B 60 3.239 6.317 -0.966 1.00 0.00 N ATOM 276 C2 A B 60 4.088 6.933 -0.139 1.00 0.00 C ATOM 277 N3 A B 60 5.414 6.904 -0.183 1.00 0.00 N ATOM 278 C4 A B 60 5.856 6.152 -1.209 1.00 0.00 C ATOM 0 H5' A B 60 11.529 5.274 -2.963 1.00 0.00 H new ATOM 0 H5'' A B 60 12.002 4.088 -1.763 1.00 0.00 H new ATOM 0 H4' A B 60 11.273 5.925 -0.571 1.00 0.00 H new ATOM 0 H3' A B 60 9.131 3.717 -0.688 1.00 0.00 H new ATOM 0 H2' A B 60 7.794 5.148 0.884 1.00 0.00 H new ATOM 0 HO2' A B 60 10.092 5.865 1.760 1.00 0.00 H new ATOM 0 H1' A B 60 8.112 7.458 -0.538 1.00 0.00 H new ATOM 0 H8 A B 60 7.972 4.759 -3.135 1.00 0.00 H new ATOM 0 H61 A B 60 1.836 5.062 -2.654 1.00 0.00 H new ATOM 0 H62 A B 60 3.185 4.388 -3.575 1.00 0.00 H new ATOM 0 H2 A B 60 3.646 7.520 0.653 1.00 0.00 H new ATOM 290 P G B 61 10.280 2.494 1.311 1.00 0.00 P ATOM 291 OP1 G B 61 11.455 2.127 2.133 1.00 0.00 O ATOM 292 OP2 G B 61 9.927 1.684 0.124 1.00 0.00 O ATOM 293 O5' G B 61 8.993 2.562 2.273 1.00 0.00 O ATOM 294 C5' G B 61 9.098 3.129 3.581 1.00 0.00 C ATOM 295 C4' G B 61 7.725 3.373 4.196 1.00 0.00 C ATOM 296 O4' G B 61 6.955 4.265 3.387 1.00 0.00 O ATOM 297 C3' G B 61 6.905 2.095 4.276 1.00 0.00 C ATOM 298 O3' G B 61 7.091 1.499 5.564 1.00 0.00 O ATOM 299 C2' G B 61 5.472 2.579 4.188 1.00 0.00 C ATOM 300 O2' G B 61 4.915 2.819 5.484 1.00 0.00 O ATOM 301 C1' G B 61 5.576 3.859 3.376 1.00 0.00 C ATOM 302 N9 G B 61 5.087 3.612 2.011 1.00 0.00 N ATOM 303 C8 G B 61 5.764 3.326 0.870 1.00 0.00 C ATOM 304 N7 G B 61 5.070 3.115 -0.199 1.00 0.00 N ATOM 305 C5 G B 61 3.764 3.274 0.277 1.00 0.00 C ATOM 306 C6 G B 61 2.525 3.168 -0.407 1.00 0.00 C ATOM 307 O6 G B 61 2.326 2.909 -1.591 1.00 0.00 O ATOM 308 N1 G B 61 1.455 3.399 0.448 1.00 0.00 N ATOM 309 C2 G B 61 1.559 3.696 1.791 1.00 0.00 C ATOM 310 N2 G B 61 0.417 3.872 2.446 1.00 0.00 N ATOM 311 N3 G B 61 2.718 3.800 2.437 1.00 0.00 N ATOM 312 C4 G B 61 3.773 3.578 1.628 1.00 0.00 C ATOM 0 H5' G B 61 9.646 4.069 3.528 1.00 0.00 H new ATOM 0 H5'' G B 61 9.672 2.461 4.223 1.00 0.00 H new ATOM 0 H4' G B 61 7.917 3.781 5.189 1.00 0.00 H new ATOM 0 H3' G B 61 7.174 1.371 3.507 1.00 0.00 H new ATOM 0 H2' G B 61 4.808 1.845 3.732 1.00 0.00 H new ATOM 0 HO2' G B 61 4.033 2.395 5.545 1.00 0.00 H new ATOM 0 H1' G B 61 4.965 4.656 3.799 1.00 0.00 H new ATOM 0 H8 G B 61 6.843 3.277 0.856 1.00 0.00 H new ATOM 0 H1 G B 61 0.517 3.345 0.051 1.00 0.00 H new ATOM 0 H21 G B 61 0.429 4.094 3.442 1.00 0.00 H new ATOM 0 H22 G B 61 -0.472 3.785 1.953 1.00 0.00 H new ATOM 324 P U B 62 6.558 0.004 5.853 1.00 0.00 P ATOM 325 OP1 U B 62 7.280 -0.529 7.030 1.00 0.00 O ATOM 326 OP2 U B 62 6.563 -0.747 4.578 1.00 0.00 O ATOM 327 O5' U B 62 5.026 0.276 6.277 1.00 0.00 O ATOM 328 C5' U B 62 4.746 0.922 7.523 1.00 0.00 C ATOM 329 C4' U B 62 3.305 1.424 7.621 1.00 0.00 C ATOM 330 O4' U B 62 2.975 2.286 6.524 1.00 0.00 O ATOM 331 C3' U B 62 2.272 0.312 7.539 1.00 0.00 C ATOM 332 O3' U B 62 2.055 -0.250 8.835 1.00 0.00 O ATOM 333 C2' U B 62 1.043 1.107 7.159 1.00 0.00 C ATOM 334 O2' U B 62 0.538 1.865 8.265 1.00 0.00 O ATOM 335 C1' U B 62 1.631 2.001 6.088 1.00 0.00 C ATOM 336 N1 U B 62 1.628 1.300 4.799 1.00 0.00 N ATOM 337 C2 U B 62 0.435 1.228 4.104 1.00 0.00 C ATOM 338 O2 U B 62 -0.612 1.690 4.551 1.00 0.00 O ATOM 339 N3 U B 62 0.486 0.586 2.880 1.00 0.00 N ATOM 340 C4 U B 62 1.615 0.024 2.304 1.00 0.00 C ATOM 341 O4 U B 62 1.555 -0.505 1.196 1.00 0.00 O ATOM 342 C5 U B 62 2.809 0.145 3.113 1.00 0.00 C ATOM 343 C6 U B 62 2.774 0.762 4.312 1.00 0.00 C ATOM 0 H5' U B 62 5.428 1.762 7.652 1.00 0.00 H new ATOM 0 H5'' U B 62 4.939 0.226 8.339 1.00 0.00 H new ATOM 0 H4' U B 62 3.269 1.926 8.588 1.00 0.00 H new ATOM 0 H3' U B 62 2.541 -0.504 6.869 1.00 0.00 H new ATOM 0 H2' U B 62 0.189 0.509 6.841 1.00 0.00 H new ATOM 0 HO2' U B 62 0.885 1.492 9.102 1.00 0.00 H new ATOM 0 H1' U B 62 1.060 2.919 5.949 1.00 0.00 H new ATOM 0 H3 U B 62 -0.385 0.520 2.354 1.00 0.00 H new ATOM 0 H5 U B 62 3.741 -0.264 2.752 1.00 0.00 H new ATOM 0 H6 U B 62 3.679 0.829 4.898 1.00 0.00 H new ATOM 354 P G B 63 1.493 -1.754 8.970 1.00 0.00 P ATOM 355 OP1 G B 63 1.263 -2.035 10.405 1.00 0.00 O ATOM 356 OP2 G B 63 2.364 -2.648 8.173 1.00 0.00 O ATOM 357 O5' G B 63 0.058 -1.663 8.236 1.00 0.00 O ATOM 358 C5' G B 63 -0.976 -0.830 8.765 1.00 0.00 C ATOM 359 C4' G B 63 -2.289 -0.984 7.996 1.00 0.00 C ATOM 360 O4' G B 63 -2.277 -0.273 6.752 1.00 0.00 O ATOM 361 C3' G B 63 -2.554 -2.427 7.608 1.00 0.00 C ATOM 362 O3' G B 63 -3.218 -3.070 8.698 1.00 0.00 O ATOM 363 C2' G B 63 -3.533 -2.258 6.463 1.00 0.00 C ATOM 364 O2' G B 63 -4.862 -2.005 6.935 1.00 0.00 O ATOM 365 C1' G B 63 -2.955 -1.055 5.748 1.00 0.00 C ATOM 366 N9 G B 63 -2.025 -1.478 4.686 1.00 0.00 N ATOM 367 C8 G B 63 -0.673 -1.507 4.689 1.00 0.00 C ATOM 368 N7 G B 63 -0.076 -1.854 3.602 1.00 0.00 N ATOM 369 C5 G B 63 -1.157 -2.101 2.755 1.00 0.00 C ATOM 370 C6 G B 63 -1.169 -2.524 1.403 1.00 0.00 C ATOM 371 O6 G B 63 -0.209 -2.757 0.671 1.00 0.00 O ATOM 372 N1 G B 63 -2.463 -2.658 0.925 1.00 0.00 N ATOM 373 C2 G B 63 -3.612 -2.420 1.651 1.00 0.00 C ATOM 374 N2 G B 63 -4.765 -2.631 1.018 1.00 0.00 N ATOM 375 N3 G B 63 -3.610 -2.018 2.925 1.00 0.00 N ATOM 376 C4 G B 63 -2.357 -1.878 3.413 1.00 0.00 C ATOM 0 H5' G B 63 -0.656 0.211 8.730 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.139 -1.078 9.814 1.00 0.00 H new ATOM 0 H4' G B 63 -3.047 -0.596 8.676 1.00 0.00 H new ATOM 0 H3' G B 63 -1.666 -3.008 7.358 1.00 0.00 H new ATOM 0 H2' G B 63 -3.636 -3.142 5.833 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.890 -2.117 7.908 1.00 0.00 H new ATOM 0 H1' G B 63 -3.736 -0.470 5.262 1.00 0.00 H new ATOM 0 H8 G B 63 -0.112 -1.247 5.575 1.00 0.00 H new ATOM 0 H1 G B 63 -2.575 -2.957 -0.044 1.00 0.00 H new ATOM 0 H21 G B 63 -5.649 -2.473 1.502 1.00 0.00 H new ATOM 0 H22 G B 63 -4.764 -2.951 0.049 1.00 0.00 H new ATOM 388 P U B 64 -2.858 -4.588 9.087 1.00 0.00 P ATOM 389 OP1 U B 64 -3.443 -4.878 10.415 1.00 0.00 O ATOM 390 OP2 U B 64 -1.411 -4.797 8.854 1.00 0.00 O ATOM 391 O5' U B 64 -3.673 -5.423 7.982 1.00 0.00 O ATOM 392 C5' U B 64 -5.080 -5.232 7.830 1.00 0.00 C ATOM 393 C4' U B 64 -5.604 -5.926 6.581 1.00 0.00 C ATOM 394 O4' U B 64 -5.377 -5.149 5.401 1.00 0.00 O ATOM 395 C3' U B 64 -4.871 -7.230 6.337 1.00 0.00 C ATOM 396 O3' U B 64 -5.544 -8.273 7.044 1.00 0.00 O ATOM 397 C2' U B 64 -5.076 -7.439 4.852 1.00 0.00 C ATOM 398 O2' U B 64 -6.339 -8.057 4.578 1.00 0.00 O ATOM 399 C1' U B 64 -5.024 -6.020 4.311 1.00 0.00 C ATOM 400 N1 U B 64 -3.692 -5.690 3.769 1.00 0.00 N ATOM 401 C2 U B 64 -3.514 -5.851 2.409 1.00 0.00 C ATOM 402 O2 U B 64 -4.404 -6.285 1.681 1.00 0.00 O ATOM 403 N3 U B 64 -2.273 -5.503 1.910 1.00 0.00 N ATOM 404 C4 U B 64 -1.206 -5.017 2.649 1.00 0.00 C ATOM 405 O4 U B 64 -0.142 -4.736 2.101 1.00 0.00 O ATOM 406 C5 U B 64 -1.480 -4.884 4.064 1.00 0.00 C ATOM 407 C6 U B 64 -2.688 -5.216 4.572 1.00 0.00 C ATOM 0 H5' U B 64 -5.300 -4.166 7.775 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.598 -5.619 8.707 1.00 0.00 H new ATOM 0 H4' U B 64 -6.669 -6.076 6.759 1.00 0.00 H new ATOM 0 H3' U B 64 -3.827 -7.222 6.649 1.00 0.00 H new ATOM 0 H2' U B 64 -4.338 -8.103 4.402 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.776 -8.295 5.422 1.00 0.00 H new ATOM 0 H1' U B 64 -5.719 -5.903 3.479 1.00 0.00 H new ATOM 0 H3 U B 64 -2.129 -5.614 0.906 1.00 0.00 H new ATOM 0 H5 U B 64 -0.709 -4.514 4.723 1.00 0.00 H new ATOM 0 H6 U B 64 -2.865 -5.105 5.632 1.00 0.00 H new ATOM 418 P C B 65 -4.699 -9.443 7.757 1.00 0.00 P ATOM 419 OP1 C B 65 -5.614 -10.206 8.636 1.00 0.00 O ATOM 420 OP2 C B 65 -3.463 -8.849 8.314 1.00 0.00 O ATOM 421 O5' C B 65 -4.292 -10.383 6.515 1.00 0.00 O ATOM 422 C5' C B 65 -5.305 -11.027 5.743 1.00 0.00 C ATOM 423 C4' C B 65 -4.727 -11.729 4.518 1.00 0.00 C ATOM 424 O4' C B 65 -4.497 -10.816 3.449 1.00 0.00 O ATOM 425 C3' C B 65 -3.380 -12.357 4.817 1.00 0.00 C ATOM 426 O3' C B 65 -3.521 -13.651 5.413 1.00 0.00 O ATOM 427 C2' C B 65 -2.768 -12.445 3.429 1.00 0.00 C ATOM 428 O2' C B 65 -3.191 -13.629 2.743 1.00 0.00 O ATOM 429 C1' C B 65 -3.300 -11.184 2.751 1.00 0.00 C ATOM 430 N1 C B 65 -2.317 -10.099 2.819 1.00 0.00 N ATOM 431 C2 C B 65 -1.491 -9.906 1.729 1.00 0.00 C ATOM 432 O2 C B 65 -1.572 -10.652 0.755 1.00 0.00 O ATOM 433 N3 C B 65 -0.602 -8.877 1.769 1.00 0.00 N ATOM 434 C4 C B 65 -0.536 -8.070 2.836 1.00 0.00 C ATOM 435 N4 C B 65 0.366 -7.086 2.856 1.00 0.00 N ATOM 436 C5 C B 65 -1.399 -8.270 3.961 1.00 0.00 C ATOM 437 C6 C B 65 -2.259 -9.296 3.910 1.00 0.00 C ATOM 0 H5' C B 65 -6.042 -10.290 5.425 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.828 -11.754 6.365 1.00 0.00 H new ATOM 0 H4' C B 65 -5.464 -12.483 4.244 1.00 0.00 H new ATOM 0 H3' C B 65 -2.779 -11.794 5.531 1.00 0.00 H new ATOM 0 H2' C B 65 -1.680 -12.504 3.439 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.616 -14.242 3.379 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.634 -14.028 5.591 1.00 0.00 H new ATOM 0 H1' C B 65 -3.499 -11.369 1.695 1.00 0.00 H new ATOM 0 H41 C B 65 0.426 -6.465 3.663 1.00 0.00 H new ATOM 0 H42 C B 65 0.996 -6.955 2.064 1.00 0.00 H new ATOM 0 H5 C B 65 -1.358 -7.617 4.820 1.00 0.00 H new ATOM 0 H6 C B 65 -2.914 -9.486 4.748 1.00 0.00 H new TER 450 C B 65