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= -4.54! USER MOD Single : A 13 G O5' : rot 6:sc= -1.58! USER MOD Single : A 14 G O2' : rot -17:sc= -0.171 USER MOD Single : A 15 C O2' : rot -6:sc= -1.29 USER MOD Single : A 16 A O2' : rot -2:sc= -5.44! USER MOD Single : A 17 C O2' : rot -17:sc= -3.35! USER MOD Single : A 18 U O2' : rot 175:sc= -6.63! USER MOD Single : A 19 G O2' : rot -14:sc= 0.192 USER MOD Single : A 19 G O3' : rot 180:sc= 0.185 USER MOD Single : B 59 C O2' : rot -10:sc= -1.87! USER MOD Single : B 59 C O5' : rot 41:sc= -3.51! USER MOD Single : B 60 A O2' : rot -18:sc= 0.215 USER MOD Single : B 61 G O2' : rot -152:sc= -2.02! USER MOD Single : B 62 U O2' : rot -16:sc= -2.05! USER MOD Single : B 63 G O2' : rot -5:sc= -0.117 USER MOD Single : B 64 U O2' : rot -7:sc= -0.0405 USER MOD Single : B 65 C O2' : rot -16:sc= 0.164 USER MOD Single : B 65 C O3' : rot 180:sc= 0.17 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 4.972 -7.191 -5.402 1.00 0.00 O ATOM 2 C5' G A 13 5.161 -7.856 -6.654 1.00 0.00 C ATOM 3 C4' G A 13 3.938 -8.683 -7.040 1.00 0.00 C ATOM 4 O4' G A 13 3.681 -9.714 -6.074 1.00 0.00 O ATOM 5 C3' G A 13 2.681 -7.819 -7.073 1.00 0.00 C ATOM 6 O3' G A 13 2.407 -7.455 -8.427 1.00 0.00 O ATOM 7 C2' G A 13 1.600 -8.772 -6.608 1.00 0.00 C ATOM 8 O2' G A 13 1.126 -9.599 -7.677 1.00 0.00 O ATOM 9 C1' G A 13 2.347 -9.579 -5.565 1.00 0.00 C ATOM 10 N9 G A 13 2.342 -8.881 -4.267 1.00 0.00 N ATOM 11 C8 G A 13 3.072 -7.817 -3.856 1.00 0.00 C ATOM 12 N7 G A 13 2.866 -7.374 -2.661 1.00 0.00 N ATOM 13 C5 G A 13 1.872 -8.243 -2.204 1.00 0.00 C ATOM 14 C6 G A 13 1.206 -8.286 -0.950 1.00 0.00 C ATOM 15 O6 G A 13 1.363 -7.552 0.025 1.00 0.00 O ATOM 16 N1 G A 13 0.276 -9.316 -0.905 1.00 0.00 N ATOM 17 C2 G A 13 0.013 -10.199 -1.933 1.00 0.00 C ATOM 18 N2 G A 13 -0.922 -11.119 -1.697 1.00 0.00 N ATOM 19 N3 G A 13 0.634 -10.166 -3.114 1.00 0.00 N ATOM 20 C4 G A 13 1.546 -9.170 -3.183 1.00 0.00 C ATOM 0 H5' G A 13 6.035 -8.504 -6.594 1.00 0.00 H new ATOM 0 H5'' G A 13 5.363 -7.119 -7.431 1.00 0.00 H new ATOM 0 H4' G A 13 4.156 -9.106 -8.020 1.00 0.00 H new ATOM 0 H3' G A 13 2.760 -6.911 -6.475 1.00 0.00 H new ATOM 0 H2' G A 13 0.703 -8.280 -6.234 1.00 0.00 H new ATOM 0 HO2' G A 13 1.545 -9.319 -8.518 1.00 0.00 H new ATOM 0 HO5' G A 13 4.122 -7.475 -5.006 1.00 0.00 H new ATOM 0 H1' G A 13 1.885 -10.551 -5.392 1.00 0.00 H new ATOM 0 H8 G A 13 3.801 -7.355 -4.505 1.00 0.00 H new ATOM 0 H1 G A 13 -0.256 -9.429 -0.042 1.00 0.00 H new ATOM 0 H21 G A 13 -1.161 -11.800 -2.418 1.00 0.00 H new ATOM 0 H22 G A 13 -1.398 -11.142 -0.795 1.00 0.00 H new ATOM 33 P G A 14 1.450 -6.202 -8.746 1.00 0.00 P ATOM 34 OP1 G A 14 1.301 -6.095 -10.214 1.00 0.00 O ATOM 35 OP2 G A 14 1.931 -5.040 -7.966 1.00 0.00 O ATOM 36 O5' G A 14 0.038 -6.674 -8.129 1.00 0.00 O ATOM 37 C5' G A 14 -0.673 -7.767 -8.713 1.00 0.00 C ATOM 38 C4' G A 14 -2.094 -7.881 -8.169 1.00 0.00 C ATOM 39 O4' G A 14 -2.146 -8.552 -6.900 1.00 0.00 O ATOM 40 C3' G A 14 -2.696 -6.517 -7.894 1.00 0.00 C ATOM 41 O3' G A 14 -3.254 -5.979 -9.094 1.00 0.00 O ATOM 42 C2' G A 14 -3.822 -6.888 -6.955 1.00 0.00 C ATOM 43 O2' G A 14 -4.920 -7.481 -7.660 1.00 0.00 O ATOM 44 C1' G A 14 -3.123 -7.899 -6.060 1.00 0.00 C ATOM 45 N9 G A 14 -2.485 -7.241 -4.910 1.00 0.00 N ATOM 46 C8 G A 14 -1.260 -6.672 -4.791 1.00 0.00 C ATOM 47 N7 G A 14 -0.931 -6.206 -3.634 1.00 0.00 N ATOM 48 C5 G A 14 -2.074 -6.490 -2.878 1.00 0.00 C ATOM 49 C6 G A 14 -2.349 -6.229 -1.513 1.00 0.00 C ATOM 50 O6 G A 14 -1.623 -5.688 -0.685 1.00 0.00 O ATOM 51 N1 G A 14 -3.617 -6.675 -1.153 1.00 0.00 N ATOM 52 C2 G A 14 -4.509 -7.297 -1.998 1.00 0.00 C ATOM 53 N2 G A 14 -5.680 -7.644 -1.467 1.00 0.00 N ATOM 54 N3 G A 14 -4.256 -7.549 -3.284 1.00 0.00 N ATOM 55 C4 G A 14 -3.027 -7.122 -3.656 1.00 0.00 C ATOM 0 H5' G A 14 -0.135 -8.695 -8.518 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.708 -7.640 -9.795 1.00 0.00 H new ATOM 0 H4' G A 14 -2.635 -8.432 -8.938 1.00 0.00 H new ATOM 0 H3' G A 14 -1.989 -5.781 -7.510 1.00 0.00 H new ATOM 0 H2' G A 14 -4.265 -6.045 -6.425 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.844 -7.277 -8.615 1.00 0.00 H new ATOM 0 H1' G A 14 -3.829 -8.615 -5.639 1.00 0.00 H new ATOM 0 H8 G A 14 -0.586 -6.611 -5.632 1.00 0.00 H new ATOM 0 H1 G A 14 -3.909 -6.530 -0.187 1.00 0.00 H new ATOM 0 H21 G A 14 -6.383 -8.108 -2.042 1.00 0.00 H new ATOM 0 H22 G A 14 -5.874 -7.446 -0.485 1.00 0.00 H new ATOM 67 P C A 15 -3.370 -4.382 -9.262 1.00 0.00 P ATOM 68 OP1 C A 15 -4.098 -4.095 -10.519 1.00 0.00 O ATOM 69 OP2 C A 15 -2.034 -3.789 -9.026 1.00 0.00 O ATOM 70 O5' C A 15 -4.323 -3.998 -8.025 1.00 0.00 O ATOM 71 C5' C A 15 -5.698 -4.371 -8.043 1.00 0.00 C ATOM 72 C4' C A 15 -6.339 -4.267 -6.663 1.00 0.00 C ATOM 73 O4' C A 15 -5.655 -5.068 -5.697 1.00 0.00 O ATOM 74 C3' C A 15 -6.254 -2.873 -6.081 1.00 0.00 C ATOM 75 O3' C A 15 -7.289 -2.055 -6.629 1.00 0.00 O ATOM 76 C2' C A 15 -6.585 -3.164 -4.632 1.00 0.00 C ATOM 77 O2' C A 15 -7.992 -3.360 -4.443 1.00 0.00 O ATOM 78 C1' C A 15 -5.802 -4.452 -4.401 1.00 0.00 C ATOM 79 N1 C A 15 -4.497 -4.155 -3.774 1.00 0.00 N ATOM 80 C2 C A 15 -4.496 -3.919 -2.410 1.00 0.00 C ATOM 81 O2 C A 15 -5.553 -3.928 -1.784 1.00 0.00 O ATOM 82 N3 C A 15 -3.308 -3.664 -1.800 1.00 0.00 N ATOM 83 C4 C A 15 -2.167 -3.641 -2.499 1.00 0.00 C ATOM 84 N4 C A 15 -1.021 -3.394 -1.866 1.00 0.00 N ATOM 85 C5 C A 15 -2.164 -3.881 -3.908 1.00 0.00 C ATOM 86 C6 C A 15 -3.344 -4.130 -4.503 1.00 0.00 C ATOM 0 H5' C A 15 -5.791 -5.393 -8.409 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.237 -3.732 -8.742 1.00 0.00 H new ATOM 0 H4' C A 15 -7.369 -4.583 -6.831 1.00 0.00 H new ATOM 0 H3' C A 15 -5.308 -2.361 -6.259 1.00 0.00 H new ATOM 0 H2' C A 15 -6.330 -2.358 -3.944 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.465 -3.164 -5.279 1.00 0.00 H new ATOM 0 H1' C A 15 -6.317 -5.127 -3.718 1.00 0.00 H new ATOM 0 H41 C A 15 -0.145 -3.374 -2.387 1.00 0.00 H new ATOM 0 H42 C A 15 -1.020 -3.225 -0.860 1.00 0.00 H new ATOM 0 H5 C A 15 -1.245 -3.863 -4.476 1.00 0.00 H new ATOM 0 H6 C A 15 -3.379 -4.312 -5.567 1.00 0.00 H new ATOM 98 P A A 16 -7.172 -0.449 -6.544 1.00 0.00 P ATOM 99 OP1 A A 16 -8.406 0.136 -7.116 1.00 0.00 O ATOM 100 OP2 A A 16 -5.851 -0.052 -7.078 1.00 0.00 O ATOM 101 O5' A A 16 -7.176 -0.178 -4.953 1.00 0.00 O ATOM 102 C5' A A 16 -8.374 -0.358 -4.195 1.00 0.00 C ATOM 103 C4' A A 16 -8.140 -0.193 -2.693 1.00 0.00 C ATOM 104 O4' A A 16 -7.171 -1.117 -2.189 1.00 0.00 O ATOM 105 C3' A A 16 -7.564 1.166 -2.351 1.00 0.00 C ATOM 106 O3' A A 16 -8.624 2.114 -2.234 1.00 0.00 O ATOM 107 C2' A A 16 -6.993 0.911 -0.972 1.00 0.00 C ATOM 108 O2' A A 16 -8.013 0.950 0.033 1.00 0.00 O ATOM 109 C1' A A 16 -6.420 -0.485 -1.128 1.00 0.00 C ATOM 110 N9 A A 16 -4.983 -0.427 -1.443 1.00 0.00 N ATOM 111 C8 A A 16 -4.338 -0.654 -2.606 1.00 0.00 C ATOM 112 N7 A A 16 -3.049 -0.638 -2.593 1.00 0.00 N ATOM 113 C5 A A 16 -2.794 -0.351 -1.255 1.00 0.00 C ATOM 114 C6 A A 16 -1.611 -0.182 -0.534 1.00 0.00 C ATOM 115 N6 A A 16 -0.402 -0.335 -1.083 1.00 0.00 N ATOM 116 N1 A A 16 -1.726 0.104 0.776 1.00 0.00 N ATOM 117 C2 A A 16 -2.938 0.211 1.336 1.00 0.00 C ATOM 118 N3 A A 16 -4.109 0.065 0.747 1.00 0.00 N ATOM 119 C4 A A 16 -3.967 -0.216 -0.553 1.00 0.00 C ATOM 0 H5' A A 16 -8.779 -1.351 -4.390 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.122 0.363 -4.525 1.00 0.00 H new ATOM 0 H4' A A 16 -9.125 -0.349 -2.253 1.00 0.00 H new ATOM 0 H3' A A 16 -6.852 1.549 -3.083 1.00 0.00 H new ATOM 0 H2' A A 16 -6.263 1.654 -0.652 1.00 0.00 H new ATOM 0 HO2' A A 16 -8.873 1.173 -0.382 1.00 0.00 H new ATOM 0 H1' A A 16 -6.506 -1.056 -0.204 1.00 0.00 H new ATOM 0 H8 A A 16 -4.884 -0.843 -3.518 1.00 0.00 H new ATOM 0 H61 A A 16 0.436 -0.201 -0.517 1.00 0.00 H new ATOM 0 H62 A A 16 -0.317 -0.586 -2.068 1.00 0.00 H new ATOM 0 H2 A A 16 -2.959 0.443 2.390 1.00 0.00 H new ATOM 131 P C A 17 -8.297 3.689 -2.280 1.00 0.00 P ATOM 132 OP1 C A 17 -9.559 4.432 -2.070 1.00 0.00 O ATOM 133 OP2 C A 17 -7.472 3.958 -3.479 1.00 0.00 O ATOM 134 O5' C A 17 -7.371 3.885 -0.976 1.00 0.00 O ATOM 135 C5' C A 17 -7.885 3.578 0.322 1.00 0.00 C ATOM 136 C4' C A 17 -6.819 3.699 1.408 1.00 0.00 C ATOM 137 O4' C A 17 -5.781 2.734 1.272 1.00 0.00 O ATOM 138 C3' C A 17 -6.109 5.030 1.347 1.00 0.00 C ATOM 139 O3' C A 17 -6.884 5.992 2.067 1.00 0.00 O ATOM 140 C2' C A 17 -4.843 4.748 2.130 1.00 0.00 C ATOM 141 O2' C A 17 -5.055 4.890 3.539 1.00 0.00 O ATOM 142 C1' C A 17 -4.545 3.300 1.755 1.00 0.00 C ATOM 143 N1 C A 17 -3.510 3.224 0.720 1.00 0.00 N ATOM 144 C2 C A 17 -2.192 3.196 1.131 1.00 0.00 C ATOM 145 O2 C A 17 -1.923 3.267 2.328 1.00 0.00 O ATOM 146 N3 C A 17 -1.223 3.093 0.178 1.00 0.00 N ATOM 147 C4 C A 17 -1.549 3.022 -1.121 1.00 0.00 C ATOM 148 N4 C A 17 -0.587 2.905 -2.036 1.00 0.00 N ATOM 149 C5 C A 17 -2.916 3.058 -1.533 1.00 0.00 C ATOM 150 C6 C A 17 -3.847 3.158 -0.590 1.00 0.00 C ATOM 0 H5' C A 17 -8.287 2.565 0.321 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.713 4.249 0.551 1.00 0.00 H new ATOM 0 H4' C A 17 -7.369 3.562 2.339 1.00 0.00 H new ATOM 0 H3' C A 17 -5.941 5.406 0.338 1.00 0.00 H new ATOM 0 H2' C A 17 -4.028 5.435 1.901 1.00 0.00 H new ATOM 0 HO2' C A 17 -5.880 5.396 3.696 1.00 0.00 H new ATOM 0 H1' C A 17 -4.169 2.751 2.619 1.00 0.00 H new ATOM 0 H41 C A 17 -0.828 2.850 -3.026 1.00 0.00 H new ATOM 0 H42 C A 17 0.390 2.870 -1.747 1.00 0.00 H new ATOM 0 H5 C A 17 -3.185 3.006 -2.578 1.00 0.00 H new ATOM 0 H6 C A 17 -4.889 3.187 -0.873 1.00 0.00 H new ATOM 162 P U A 18 -6.823 7.548 1.674 1.00 0.00 P ATOM 163 OP1 U A 18 -7.667 8.302 2.626 1.00 0.00 O ATOM 164 OP2 U A 18 -7.063 7.669 0.218 1.00 0.00 O ATOM 165 O5' U A 18 -5.284 7.916 1.963 1.00 0.00 O ATOM 166 C5' U A 18 -4.730 7.758 3.271 1.00 0.00 C ATOM 167 C4' U A 18 -3.244 8.097 3.285 1.00 0.00 C ATOM 168 O4' U A 18 -2.468 7.058 2.694 1.00 0.00 O ATOM 169 C3' U A 18 -2.978 9.339 2.453 1.00 0.00 C ATOM 170 O3' U A 18 -2.778 10.442 3.338 1.00 0.00 O ATOM 171 C2' U A 18 -1.674 9.079 1.725 1.00 0.00 C ATOM 172 O2' U A 18 -0.633 9.940 2.192 1.00 0.00 O ATOM 173 C1' U A 18 -1.348 7.621 2.001 1.00 0.00 C ATOM 174 N1 U A 18 -1.093 6.926 0.733 1.00 0.00 N ATOM 175 C2 U A 18 0.223 6.774 0.346 1.00 0.00 C ATOM 176 O2 U A 18 1.156 7.183 1.032 1.00 0.00 O ATOM 177 N3 U A 18 0.429 6.140 -0.862 1.00 0.00 N ATOM 178 C4 U A 18 -0.553 5.648 -1.705 1.00 0.00 C ATOM 179 O4 U A 18 -0.249 5.102 -2.764 1.00 0.00 O ATOM 180 C5 U A 18 -1.905 5.850 -1.216 1.00 0.00 C ATOM 181 C6 U A 18 -2.126 6.475 -0.034 1.00 0.00 C ATOM 0 H5' U A 18 -4.875 6.732 3.609 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.259 8.402 3.973 1.00 0.00 H new ATOM 0 H4' U A 18 -2.970 8.241 4.330 1.00 0.00 H new ATOM 0 H3' U A 18 -3.799 9.555 1.769 1.00 0.00 H new ATOM 0 H2' U A 18 -1.763 9.280 0.657 1.00 0.00 H new ATOM 0 HO2' U A 18 0.212 9.697 1.758 1.00 0.00 H new ATOM 0 H1' U A 18 -0.452 7.519 2.613 1.00 0.00 H new ATOM 0 H3 U A 18 1.397 6.023 -1.163 1.00 0.00 H new ATOM 0 H5 U A 18 -2.743 5.499 -1.800 1.00 0.00 H new ATOM 0 H6 U A 18 -3.141 6.619 0.307 1.00 0.00 H new ATOM 192 P G A 19 -2.690 11.945 2.765 1.00 0.00 P ATOM 193 OP1 G A 19 -2.982 12.884 3.871 1.00 0.00 O ATOM 194 OP2 G A 19 -3.471 12.010 1.510 1.00 0.00 O ATOM 195 O5' G A 19 -1.124 12.061 2.396 1.00 0.00 O ATOM 196 C5' G A 19 -0.152 12.083 3.447 1.00 0.00 C ATOM 197 C4' G A 19 1.277 11.872 2.940 1.00 0.00 C ATOM 198 O4' G A 19 1.468 10.569 2.404 1.00 0.00 O ATOM 199 C3' G A 19 1.627 12.795 1.793 1.00 0.00 C ATOM 200 O3' G A 19 1.931 14.118 2.248 1.00 0.00 O ATOM 201 C2' G A 19 2.855 12.095 1.223 1.00 0.00 C ATOM 202 O2' G A 19 4.049 12.496 1.904 1.00 0.00 O ATOM 203 C1' G A 19 2.547 10.617 1.458 1.00 0.00 C ATOM 204 N9 G A 19 2.182 9.964 0.189 1.00 0.00 N ATOM 205 C8 G A 19 0.961 9.660 -0.297 1.00 0.00 C ATOM 206 N7 G A 19 0.898 9.053 -1.433 1.00 0.00 N ATOM 207 C5 G A 19 2.249 8.936 -1.764 1.00 0.00 C ATOM 208 C6 G A 19 2.857 8.356 -2.908 1.00 0.00 C ATOM 209 O6 G A 19 2.313 7.815 -3.869 1.00 0.00 O ATOM 210 N1 G A 19 4.240 8.448 -2.850 1.00 0.00 N ATOM 211 C2 G A 19 4.958 9.028 -1.824 1.00 0.00 C ATOM 212 N2 G A 19 6.283 9.038 -1.962 1.00 0.00 N ATOM 213 N3 G A 19 4.393 9.574 -0.742 1.00 0.00 N ATOM 214 C4 G A 19 3.044 9.494 -0.775 1.00 0.00 C ATOM 0 H5' G A 19 -0.393 11.307 4.174 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.210 13.038 3.969 1.00 0.00 H new ATOM 0 H4' G A 19 1.897 12.056 3.817 1.00 0.00 H new ATOM 0 H3' G A 19 0.821 12.944 1.074 1.00 0.00 H new ATOM 0 H2' G A 19 3.036 12.333 0.175 1.00 0.00 H new ATOM 0 HO2' G A 19 3.869 13.300 2.435 1.00 0.00 H new ATOM 0 HO3' G A 19 2.154 14.685 1.480 1.00 0.00 H new ATOM 0 H1' G A 19 3.415 10.083 1.846 1.00 0.00 H new ATOM 0 H8 G A 19 0.065 9.917 0.248 1.00 0.00 H new ATOM 0 H1 G A 19 4.769 8.055 -3.629 1.00 0.00 H new ATOM 0 H21 G A 19 6.868 9.453 -1.237 1.00 0.00 H new ATOM 0 H22 G A 19 6.712 8.631 -2.793 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.412 4.523 -7.902 1.00 0.00 O ATOM 229 C5' C B 59 9.828 4.398 -7.998 1.00 0.00 C ATOM 230 C4' C B 59 10.564 5.341 -7.038 1.00 0.00 C ATOM 231 O4' C B 59 10.163 6.711 -7.234 1.00 0.00 O ATOM 232 C3' C B 59 10.235 5.028 -5.581 1.00 0.00 C ATOM 233 O3' C B 59 11.276 4.213 -5.040 1.00 0.00 O ATOM 234 C2' C B 59 10.308 6.392 -4.924 1.00 0.00 C ATOM 235 O2' C B 59 11.661 6.785 -4.666 1.00 0.00 O ATOM 236 C1' C B 59 9.671 7.249 -5.994 1.00 0.00 C ATOM 237 N1 C B 59 8.204 7.149 -5.924 1.00 0.00 N ATOM 238 C2 C B 59 7.553 7.774 -4.873 1.00 0.00 C ATOM 239 O2 C B 59 8.193 8.413 -4.041 1.00 0.00 O ATOM 240 N3 C B 59 6.198 7.645 -4.792 1.00 0.00 N ATOM 241 C4 C B 59 5.519 6.933 -5.705 1.00 0.00 C ATOM 242 N4 C B 59 4.195 6.828 -5.609 1.00 0.00 N ATOM 243 C5 C B 59 6.204 6.291 -6.785 1.00 0.00 C ATOM 244 C6 C B 59 7.528 6.431 -6.850 1.00 0.00 C ATOM 0 H5' C B 59 10.140 4.609 -9.021 1.00 0.00 H new ATOM 0 H5'' C B 59 10.115 3.369 -7.783 1.00 0.00 H new ATOM 0 H4' C B 59 11.624 5.198 -7.248 1.00 0.00 H new ATOM 0 H3' C B 59 9.283 4.515 -5.444 1.00 0.00 H new ATOM 0 H2' C B 59 9.826 6.451 -3.948 1.00 0.00 H new ATOM 0 HO2' C B 59 12.257 6.021 -4.813 1.00 0.00 H new ATOM 0 HO5' C B 59 8.173 5.469 -7.810 1.00 0.00 H new ATOM 0 H1' C B 59 9.915 8.305 -5.882 1.00 0.00 H new ATOM 0 H41 C B 59 3.675 6.288 -6.300 1.00 0.00 H new ATOM 0 H42 C B 59 3.701 7.288 -4.844 1.00 0.00 H new ATOM 0 H5 C B 59 5.667 5.713 -7.522 1.00 0.00 H new ATOM 0 H6 C B 59 8.071 5.962 -7.657 1.00 0.00 H new ATOM 257 P A B 60 10.946 3.139 -3.887 1.00 0.00 P ATOM 258 OP1 A B 60 12.214 2.499 -3.472 1.00 0.00 O ATOM 259 OP2 A B 60 9.812 2.303 -4.343 1.00 0.00 O ATOM 260 O5' A B 60 10.432 4.071 -2.679 1.00 0.00 O ATOM 261 C5' A B 60 11.286 5.072 -2.121 1.00 0.00 C ATOM 262 C4' A B 60 10.595 5.842 -1.000 1.00 0.00 C ATOM 263 O4' A B 60 9.651 6.799 -1.505 1.00 0.00 O ATOM 264 C3' A B 60 9.774 4.917 -0.122 1.00 0.00 C ATOM 265 O3' A B 60 10.620 4.371 0.897 1.00 0.00 O ATOM 266 C2' A B 60 8.801 5.892 0.507 1.00 0.00 C ATOM 267 O2' A B 60 9.416 6.639 1.564 1.00 0.00 O ATOM 268 C1' A B 60 8.466 6.782 -0.684 1.00 0.00 C ATOM 269 N9 A B 60 7.303 6.257 -1.431 1.00 0.00 N ATOM 270 C8 A B 60 7.253 5.513 -2.567 1.00 0.00 C ATOM 271 N7 A B 60 6.086 5.182 -3.011 1.00 0.00 N ATOM 272 C5 A B 60 5.245 5.776 -2.064 1.00 0.00 C ATOM 273 C6 A B 60 3.852 5.820 -1.928 1.00 0.00 C ATOM 274 N6 A B 60 3.015 5.229 -2.787 1.00 0.00 N ATOM 275 N1 A B 60 3.355 6.499 -0.875 1.00 0.00 N ATOM 276 C2 A B 60 4.178 7.097 -0.008 1.00 0.00 C ATOM 277 N3 A B 60 5.505 7.113 -0.041 1.00 0.00 N ATOM 278 C4 A B 60 5.979 6.431 -1.102 1.00 0.00 C ATOM 0 H5' A B 60 11.593 5.766 -2.904 1.00 0.00 H new ATOM 0 H5'' A B 60 12.192 4.604 -1.736 1.00 0.00 H new ATOM 0 H4' A B 60 11.402 6.327 -0.451 1.00 0.00 H new ATOM 0 H3' A B 60 9.306 4.083 -0.646 1.00 0.00 H new ATOM 0 H2' A B 60 7.935 5.423 0.974 1.00 0.00 H new ATOM 0 HO2' A B 60 10.231 6.181 1.857 1.00 0.00 H new ATOM 0 H1' A B 60 8.189 7.787 -0.366 1.00 0.00 H new ATOM 0 H8 A B 60 8.154 5.210 -3.079 1.00 0.00 H new ATOM 0 H61 A B 60 2.007 5.291 -2.642 1.00 0.00 H new ATOM 0 H62 A B 60 3.384 4.716 -3.587 1.00 0.00 H new ATOM 0 H2 A B 60 3.712 7.626 0.810 1.00 0.00 H new ATOM 290 P G B 61 10.479 2.822 1.318 1.00 0.00 P ATOM 291 OP1 G B 61 11.636 2.468 2.173 1.00 0.00 O ATOM 292 OP2 G B 61 10.196 2.034 0.098 1.00 0.00 O ATOM 293 O5' G B 61 9.157 2.823 2.235 1.00 0.00 O ATOM 294 C5' G B 61 9.198 3.361 3.557 1.00 0.00 C ATOM 295 C4' G B 61 7.799 3.545 4.134 1.00 0.00 C ATOM 296 O4' G B 61 7.023 4.426 3.320 1.00 0.00 O ATOM 297 C3' G B 61 7.018 2.240 4.161 1.00 0.00 C ATOM 298 O3' G B 61 7.195 1.617 5.437 1.00 0.00 O ATOM 299 C2' G B 61 5.574 2.682 4.057 1.00 0.00 C ATOM 300 O2' G B 61 4.985 2.868 5.348 1.00 0.00 O ATOM 301 C1' G B 61 5.654 3.989 3.285 1.00 0.00 C ATOM 302 N9 G B 61 5.184 3.774 1.908 1.00 0.00 N ATOM 303 C8 G B 61 5.878 3.558 0.763 1.00 0.00 C ATOM 304 N7 G B 61 5.200 3.363 -0.318 1.00 0.00 N ATOM 305 C5 G B 61 3.886 3.454 0.152 1.00 0.00 C ATOM 306 C6 G B 61 2.657 3.326 -0.544 1.00 0.00 C ATOM 307 O6 G B 61 2.475 3.108 -1.739 1.00 0.00 O ATOM 308 N1 G B 61 1.573 3.483 0.311 1.00 0.00 N ATOM 309 C2 G B 61 1.656 3.732 1.665 1.00 0.00 C ATOM 310 N2 G B 61 0.504 3.839 2.318 1.00 0.00 N ATOM 311 N3 G B 61 2.807 3.854 2.323 1.00 0.00 N ATOM 312 C4 G B 61 3.875 3.705 1.514 1.00 0.00 C ATOM 0 H5' G B 61 9.715 4.320 3.544 1.00 0.00 H new ATOM 0 H5'' G B 61 9.774 2.697 4.202 1.00 0.00 H new ATOM 0 H4' G B 61 7.949 3.936 5.140 1.00 0.00 H new ATOM 0 H3' G B 61 7.326 1.546 3.379 1.00 0.00 H new ATOM 0 H2' G B 61 4.943 1.942 3.566 1.00 0.00 H new ATOM 0 HO2' G B 61 4.020 2.706 5.294 1.00 0.00 H new ATOM 0 H1' G B 61 5.019 4.757 3.727 1.00 0.00 H new ATOM 0 H8 G B 61 6.958 3.549 0.756 1.00 0.00 H new ATOM 0 H1 G B 61 0.641 3.408 -0.096 1.00 0.00 H new ATOM 0 H21 G B 61 0.502 4.023 3.321 1.00 0.00 H new ATOM 0 H22 G B 61 -0.378 3.737 1.816 1.00 0.00 H new ATOM 324 P U B 62 6.683 0.107 5.679 1.00 0.00 P ATOM 325 OP1 U B 62 7.388 -0.441 6.861 1.00 0.00 O ATOM 326 OP2 U B 62 6.727 -0.616 4.389 1.00 0.00 O ATOM 327 O5' U B 62 5.137 0.348 6.076 1.00 0.00 O ATOM 328 C5' U B 62 4.827 1.035 7.291 1.00 0.00 C ATOM 329 C4' U B 62 3.371 1.501 7.358 1.00 0.00 C ATOM 330 O4' U B 62 3.029 2.327 6.239 1.00 0.00 O ATOM 331 C3' U B 62 2.368 0.361 7.297 1.00 0.00 C ATOM 332 O3' U B 62 2.165 -0.175 8.605 1.00 0.00 O ATOM 333 C2' U B 62 1.121 1.115 6.894 1.00 0.00 C ATOM 334 O2' U B 62 0.584 1.872 7.985 1.00 0.00 O ATOM 335 C1' U B 62 1.687 2.014 5.814 1.00 0.00 C ATOM 336 N1 U B 62 1.693 1.311 4.526 1.00 0.00 N ATOM 337 C2 U B 62 0.500 1.216 3.833 1.00 0.00 C ATOM 338 O2 U B 62 -0.556 1.651 4.284 1.00 0.00 O ATOM 339 N3 U B 62 0.563 0.582 2.604 1.00 0.00 N ATOM 340 C4 U B 62 1.703 0.049 2.024 1.00 0.00 C ATOM 341 O4 U B 62 1.654 -0.473 0.912 1.00 0.00 O ATOM 342 C5 U B 62 2.896 0.192 2.831 1.00 0.00 C ATOM 343 C6 U B 62 2.850 0.802 4.033 1.00 0.00 C ATOM 0 H5' U B 62 5.484 1.899 7.392 1.00 0.00 H new ATOM 0 H5'' U B 62 5.032 0.378 8.136 1.00 0.00 H new ATOM 0 H4' U B 62 3.313 2.027 8.311 1.00 0.00 H new ATOM 0 H3' U B 62 2.658 -0.464 6.646 1.00 0.00 H new ATOM 0 H2' U B 62 0.290 0.486 6.576 1.00 0.00 H new ATOM 0 HO2' U B 62 0.975 1.556 8.826 1.00 0.00 H new ATOM 0 H1' U B 62 1.094 2.918 5.677 1.00 0.00 H new ATOM 0 H3 U B 62 -0.307 0.500 2.079 1.00 0.00 H new ATOM 0 H5 U B 62 3.836 -0.195 2.466 1.00 0.00 H new ATOM 0 H6 U B 62 3.755 0.887 4.616 1.00 0.00 H new ATOM 354 P G B 63 1.599 -1.674 8.777 1.00 0.00 P ATOM 355 OP1 G B 63 1.393 -1.928 10.220 1.00 0.00 O ATOM 356 OP2 G B 63 2.451 -2.585 7.981 1.00 0.00 O ATOM 357 O5' G B 63 0.152 -1.587 8.067 1.00 0.00 O ATOM 358 C5' G B 63 -0.867 -0.736 8.598 1.00 0.00 C ATOM 359 C4' G B 63 -2.187 -0.877 7.842 1.00 0.00 C ATOM 360 O4' G B 63 -2.163 -0.210 6.576 1.00 0.00 O ATOM 361 C3' G B 63 -2.493 -2.324 7.505 1.00 0.00 C ATOM 362 O3' G B 63 -3.166 -2.911 8.620 1.00 0.00 O ATOM 363 C2' G B 63 -3.476 -2.166 6.359 1.00 0.00 C ATOM 364 O2' G B 63 -4.794 -1.864 6.829 1.00 0.00 O ATOM 365 C1' G B 63 -2.872 -1.003 5.603 1.00 0.00 C ATOM 366 N9 G B 63 -1.965 -1.486 4.546 1.00 0.00 N ATOM 367 C8 G B 63 -0.614 -1.567 4.540 1.00 0.00 C ATOM 368 N7 G B 63 -0.041 -1.959 3.456 1.00 0.00 N ATOM 369 C5 G B 63 -1.136 -2.181 2.622 1.00 0.00 C ATOM 370 C6 G B 63 -1.173 -2.629 1.280 1.00 0.00 C ATOM 371 O6 G B 63 -0.230 -2.915 0.547 1.00 0.00 O ATOM 372 N1 G B 63 -2.476 -2.723 0.812 1.00 0.00 N ATOM 373 C2 G B 63 -3.610 -2.427 1.541 1.00 0.00 C ATOM 374 N2 G B 63 -4.776 -2.605 0.920 1.00 0.00 N ATOM 375 N3 G B 63 -3.583 -1.999 2.808 1.00 0.00 N ATOM 376 C4 G B 63 -2.321 -1.898 3.284 1.00 0.00 C ATOM 0 H5' G B 63 -0.533 0.301 8.552 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.025 -0.974 9.650 1.00 0.00 H new ATOM 0 H4' G B 63 -2.930 -0.444 8.512 1.00 0.00 H new ATOM 0 H3' G B 63 -1.623 -2.938 7.270 1.00 0.00 H new ATOM 0 H2' G B 63 -3.606 -3.067 5.759 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.807 -1.895 7.808 1.00 0.00 H new ATOM 0 H1' G B 63 -3.640 -0.410 5.106 1.00 0.00 H new ATOM 0 H8 G B 63 -0.036 -1.311 5.416 1.00 0.00 H new ATOM 0 H1 G B 63 -2.606 -3.037 -0.150 1.00 0.00 H new ATOM 0 H21 G B 63 -5.649 -2.403 1.407 1.00 0.00 H new ATOM 0 H22 G B 63 -4.795 -2.943 -0.042 1.00 0.00 H new ATOM 388 P U B 64 -2.842 -4.423 9.058 1.00 0.00 P ATOM 389 OP1 U B 64 -3.425 -4.653 10.400 1.00 0.00 O ATOM 390 OP2 U B 64 -1.404 -4.678 8.823 1.00 0.00 O ATOM 391 O5' U B 64 -3.688 -5.273 7.990 1.00 0.00 O ATOM 392 C5' U B 64 -5.095 -5.067 7.860 1.00 0.00 C ATOM 393 C4' U B 64 -5.652 -5.787 6.640 1.00 0.00 C ATOM 394 O4' U B 64 -5.441 -5.042 5.436 1.00 0.00 O ATOM 395 C3' U B 64 -4.942 -7.104 6.413 1.00 0.00 C ATOM 396 O3' U B 64 -5.600 -8.120 7.173 1.00 0.00 O ATOM 397 C2' U B 64 -5.199 -7.350 4.943 1.00 0.00 C ATOM 398 O2' U B 64 -6.487 -7.939 4.727 1.00 0.00 O ATOM 399 C1' U B 64 -5.125 -5.949 4.363 1.00 0.00 C ATOM 400 N1 U B 64 -3.793 -5.664 3.792 1.00 0.00 N ATOM 401 C2 U B 64 -3.641 -5.862 2.431 1.00 0.00 C ATOM 402 O2 U B 64 -4.555 -6.287 1.729 1.00 0.00 O ATOM 403 N3 U B 64 -2.399 -5.561 1.908 1.00 0.00 N ATOM 404 C4 U B 64 -1.307 -5.088 2.618 1.00 0.00 C ATOM 405 O4 U B 64 -0.243 -4.854 2.050 1.00 0.00 O ATOM 406 C5 U B 64 -1.555 -4.915 4.035 1.00 0.00 C ATOM 407 C6 U B 64 -2.765 -5.200 4.568 1.00 0.00 C ATOM 0 H5' U B 64 -5.302 -4.000 7.780 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.601 -5.424 8.757 1.00 0.00 H new ATOM 0 H4' U B 64 -6.714 -5.920 6.845 1.00 0.00 H new ATOM 0 H3' U B 64 -3.888 -7.101 6.691 1.00 0.00 H new ATOM 0 H2' U B 64 -4.495 -8.048 4.489 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.894 -8.162 5.590 1.00 0.00 H new ATOM 0 H1' U B 64 -5.830 -5.838 3.539 1.00 0.00 H new ATOM 0 H3 U B 64 -2.274 -5.700 0.905 1.00 0.00 H new ATOM 0 H5 U B 64 -0.763 -4.554 4.674 1.00 0.00 H new ATOM 0 H6 U B 64 -2.923 -5.059 5.627 1.00 0.00 H new ATOM 418 P C B 65 -4.741 -9.281 7.885 1.00 0.00 P ATOM 419 OP1 C B 65 -5.628 -10.004 8.824 1.00 0.00 O ATOM 420 OP2 C B 65 -3.474 -8.691 8.370 1.00 0.00 O ATOM 421 O5' C B 65 -4.402 -10.263 6.656 1.00 0.00 O ATOM 422 C5' C B 65 -5.457 -10.898 5.933 1.00 0.00 C ATOM 423 C4' C B 65 -4.940 -11.655 4.715 1.00 0.00 C ATOM 424 O4' C B 65 -4.718 -10.783 3.610 1.00 0.00 O ATOM 425 C3' C B 65 -3.600 -12.312 4.993 1.00 0.00 C ATOM 426 O3' C B 65 -3.760 -13.590 5.621 1.00 0.00 O ATOM 427 C2' C B 65 -3.023 -12.445 3.595 1.00 0.00 C ATOM 428 O2' C B 65 -3.490 -13.631 2.945 1.00 0.00 O ATOM 429 C1' C B 65 -3.539 -11.186 2.902 1.00 0.00 C ATOM 430 N1 C B 65 -2.534 -10.119 2.938 1.00 0.00 N ATOM 431 C2 C B 65 -1.718 -9.965 1.834 1.00 0.00 C ATOM 432 O2 C B 65 -1.828 -10.727 0.876 1.00 0.00 O ATOM 433 N3 C B 65 -0.807 -8.954 1.843 1.00 0.00 N ATOM 434 C4 C B 65 -0.709 -8.129 2.895 1.00 0.00 C ATOM 435 N4 C B 65 0.213 -7.165 2.886 1.00 0.00 N ATOM 436 C5 C B 65 -1.563 -8.291 4.034 1.00 0.00 C ATOM 437 C6 C B 65 -2.445 -9.297 4.012 1.00 0.00 C ATOM 0 H5' C B 65 -6.180 -10.148 5.613 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.984 -11.588 6.592 1.00 0.00 H new ATOM 0 H4' C B 65 -5.707 -12.396 4.488 1.00 0.00 H new ATOM 0 H3' C B 65 -2.967 -11.749 5.679 1.00 0.00 H new ATOM 0 H2' C B 65 -1.937 -12.532 3.582 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.872 -14.240 3.611 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.879 -13.987 5.785 1.00 0.00 H new ATOM 0 H1' C B 65 -3.756 -11.385 1.852 1.00 0.00 H new ATOM 0 H41 C B 65 0.296 -6.532 3.681 1.00 0.00 H new ATOM 0 H42 C B 65 0.835 -7.061 2.084 1.00 0.00 H new ATOM 0 H5 C B 65 -1.497 -7.624 4.881 1.00 0.00 H new ATOM 0 H6 C B 65 -3.094 -9.456 4.861 1.00 0.00 H new TER 450 C B 65