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 -12:sc= -4.28! USER MOD Single : A 13 G O5' : rot 36:sc= -1.24! USER MOD Single : A 14 G O2' : rot -16:sc= -0.107 USER MOD Single : A 15 C O2' : rot -14:sc= -0.397 USER MOD Single : A 16 A O2' : rot -2:sc= -5.33! USER MOD Single : A 17 C O2' : rot -3:sc= -3.31! USER MOD Single : A 18 U O2' : rot 169:sc= -7.15! USER MOD Single : A 19 G O2' : rot -17:sc= 0.194 USER MOD Single : A 19 G O3' : rot 180:sc= 0.19 USER MOD Single : B 59 C O2' : rot -9:sc= -1.82! USER MOD Single : B 59 C O5' : rot 39:sc= -3.48! USER MOD Single : B 60 A O2' : rot -16:sc= 0.209 USER MOD Single : B 61 G O2' : rot -150:sc= -1.39 USER MOD Single : B 62 U O2' : rot -19:sc= -1.57! USER MOD Single : B 63 G O2' : rot -6:sc= -0.246 USER MOD Single : B 64 U O2' : rot -6:sc= 0.0963 USER MOD Single : B 65 C O2' : rot -13:sc= 0.141 USER MOD Single : B 65 C O3' : rot 180:sc= 0.172 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 5.084 -6.676 -5.706 1.00 0.00 O ATOM 2 C5' G A 13 5.327 -7.549 -6.814 1.00 0.00 C ATOM 3 C4' G A 13 4.094 -8.380 -7.154 1.00 0.00 C ATOM 4 O4' G A 13 3.876 -9.413 -6.181 1.00 0.00 O ATOM 5 C3' G A 13 2.832 -7.525 -7.138 1.00 0.00 C ATOM 6 O3' G A 13 2.537 -7.108 -8.471 1.00 0.00 O ATOM 7 C2' G A 13 1.768 -8.508 -6.697 1.00 0.00 C ATOM 8 O2' G A 13 1.305 -9.311 -7.789 1.00 0.00 O ATOM 9 C1' G A 13 2.533 -9.332 -5.680 1.00 0.00 C ATOM 10 N9 G A 13 2.495 -8.684 -4.356 1.00 0.00 N ATOM 11 C8 G A 13 3.192 -7.617 -3.897 1.00 0.00 C ATOM 12 N7 G A 13 2.960 -7.222 -2.690 1.00 0.00 N ATOM 13 C5 G A 13 1.982 -8.133 -2.278 1.00 0.00 C ATOM 14 C6 G A 13 1.301 -8.238 -1.035 1.00 0.00 C ATOM 15 O6 G A 13 1.427 -7.536 -0.031 1.00 0.00 O ATOM 16 N1 G A 13 0.399 -9.293 -1.041 1.00 0.00 N ATOM 17 C2 G A 13 0.173 -10.145 -2.102 1.00 0.00 C ATOM 18 N2 G A 13 -0.740 -11.097 -1.911 1.00 0.00 N ATOM 19 N3 G A 13 0.808 -10.054 -3.273 1.00 0.00 N ATOM 20 C4 G A 13 1.694 -9.032 -3.294 1.00 0.00 C ATOM 0 H5' G A 13 6.160 -8.212 -6.580 1.00 0.00 H new ATOM 0 H5'' G A 13 5.622 -6.961 -7.683 1.00 0.00 H new ATOM 0 H4' G A 13 4.280 -8.799 -8.143 1.00 0.00 H new ATOM 0 H3' G A 13 2.911 -6.639 -6.508 1.00 0.00 H new ATOM 0 H2' G A 13 0.864 -8.043 -6.305 1.00 0.00 H new ATOM 0 HO2' G A 13 1.635 -8.937 -8.633 1.00 0.00 H new ATOM 0 HO5' G A 13 4.496 -7.122 -5.061 1.00 0.00 H new ATOM 0 H1' G A 13 2.100 -10.324 -5.550 1.00 0.00 H new ATOM 0 H8 G A 13 3.917 -7.114 -4.520 1.00 0.00 H new ATOM 0 H1 G A 13 -0.141 -9.451 -0.191 1.00 0.00 H new ATOM 0 H21 G A 13 -0.952 -11.758 -2.658 1.00 0.00 H new ATOM 0 H22 G A 13 -1.227 -11.165 -1.017 1.00 0.00 H new ATOM 33 P G A 14 1.551 -5.860 -8.727 1.00 0.00 P ATOM 34 OP1 G A 14 1.393 -5.686 -10.187 1.00 0.00 O ATOM 35 OP2 G A 14 2.015 -4.727 -7.895 1.00 0.00 O ATOM 36 O5' G A 14 0.152 -6.386 -8.126 1.00 0.00 O ATOM 37 C5' G A 14 -0.541 -7.464 -8.758 1.00 0.00 C ATOM 38 C4' G A 14 -1.958 -7.633 -8.215 1.00 0.00 C ATOM 39 O4' G A 14 -1.988 -8.356 -6.973 1.00 0.00 O ATOM 40 C3' G A 14 -2.595 -6.298 -7.883 1.00 0.00 C ATOM 41 O3' G A 14 -3.167 -5.723 -9.059 1.00 0.00 O ATOM 42 C2' G A 14 -3.710 -6.742 -6.964 1.00 0.00 C ATOM 43 O2' G A 14 -4.783 -7.351 -7.694 1.00 0.00 O ATOM 44 C1' G A 14 -2.975 -7.756 -6.104 1.00 0.00 C ATOM 45 N9 G A 14 -2.344 -7.111 -4.944 1.00 0.00 N ATOM 46 C8 G A 14 -1.133 -6.513 -4.821 1.00 0.00 C ATOM 47 N7 G A 14 -0.808 -6.060 -3.659 1.00 0.00 N ATOM 48 C5 G A 14 -1.937 -6.387 -2.901 1.00 0.00 C ATOM 49 C6 G A 14 -2.210 -6.156 -1.530 1.00 0.00 C ATOM 50 O6 G A 14 -1.492 -5.614 -0.698 1.00 0.00 O ATOM 51 N1 G A 14 -3.465 -6.642 -1.171 1.00 0.00 N ATOM 52 C2 G A 14 -4.346 -7.271 -2.022 1.00 0.00 C ATOM 53 N2 G A 14 -5.505 -7.655 -1.488 1.00 0.00 N ATOM 54 N3 G A 14 -4.096 -7.493 -3.313 1.00 0.00 N ATOM 55 C4 G A 14 -2.881 -7.028 -3.684 1.00 0.00 C ATOM 0 H5' G A 14 0.016 -8.389 -8.610 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.584 -7.286 -9.833 1.00 0.00 H new ATOM 0 H4' G A 14 -2.488 -8.164 -9.006 1.00 0.00 H new ATOM 0 H3' G A 14 -1.909 -5.560 -7.468 1.00 0.00 H new ATOM 0 H2' G A 14 -4.188 -5.936 -6.407 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.696 -7.134 -8.646 1.00 0.00 H new ATOM 0 H1' G A 14 -3.655 -8.504 -5.695 1.00 0.00 H new ATOM 0 H8 G A 14 -0.466 -6.420 -5.665 1.00 0.00 H new ATOM 0 H1 G A 14 -3.755 -6.522 -0.200 1.00 0.00 H new ATOM 0 H21 G A 14 -6.201 -8.127 -2.065 1.00 0.00 H new ATOM 0 H22 G A 14 -5.696 -7.477 -0.502 1.00 0.00 H new ATOM 67 P C A 15 -3.329 -4.123 -9.156 1.00 0.00 P ATOM 68 OP1 C A 15 -4.058 -3.802 -10.403 1.00 0.00 O ATOM 69 OP2 C A 15 -2.011 -3.504 -8.888 1.00 0.00 O ATOM 70 O5' C A 15 -4.297 -3.820 -7.908 1.00 0.00 O ATOM 71 C5' C A 15 -5.661 -4.231 -7.948 1.00 0.00 C ATOM 72 C4' C A 15 -6.308 -4.203 -6.567 1.00 0.00 C ATOM 73 O4' C A 15 -5.596 -5.017 -5.631 1.00 0.00 O ATOM 74 C3' C A 15 -6.276 -2.831 -5.929 1.00 0.00 C ATOM 75 O3' C A 15 -7.341 -2.030 -6.449 1.00 0.00 O ATOM 76 C2' C A 15 -6.595 -3.192 -4.495 1.00 0.00 C ATOM 77 O2' C A 15 -7.990 -3.466 -4.318 1.00 0.00 O ATOM 78 C1' C A 15 -5.749 -4.448 -4.314 1.00 0.00 C ATOM 79 N1 C A 15 -4.447 -4.109 -3.700 1.00 0.00 N ATOM 80 C2 C A 15 -4.437 -3.888 -2.333 1.00 0.00 C ATOM 81 O2 C A 15 -5.485 -3.936 -1.694 1.00 0.00 O ATOM 82 N3 C A 15 -3.250 -3.604 -1.734 1.00 0.00 N ATOM 83 C4 C A 15 -2.118 -3.540 -2.445 1.00 0.00 C ATOM 84 N4 C A 15 -0.974 -3.263 -1.821 1.00 0.00 N ATOM 85 C5 C A 15 -2.124 -3.763 -3.857 1.00 0.00 C ATOM 86 C6 C A 15 -3.302 -4.040 -4.441 1.00 0.00 C ATOM 0 H5' C A 15 -5.724 -5.239 -8.357 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.216 -3.579 -8.622 1.00 0.00 H new ATOM 0 H4' C A 15 -7.326 -4.547 -6.751 1.00 0.00 H new ATOM 0 H3' C A 15 -5.350 -2.276 -6.083 1.00 0.00 H new ATOM 0 H2' C A 15 -6.383 -2.401 -3.776 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.487 -3.155 -5.103 1.00 0.00 H new ATOM 0 H1' C A 15 -6.220 -5.166 -3.642 1.00 0.00 H new ATOM 0 H41 C A 15 -0.104 -3.211 -2.351 1.00 0.00 H new ATOM 0 H42 C A 15 -0.968 -3.103 -0.814 1.00 0.00 H new ATOM 0 H5 C A 15 -1.213 -3.711 -4.435 1.00 0.00 H new ATOM 0 H6 C A 15 -3.344 -4.210 -5.507 1.00 0.00 H new ATOM 98 P A A 16 -7.259 -0.424 -6.354 1.00 0.00 P ATOM 99 OP1 A A 16 -8.498 0.138 -6.936 1.00 0.00 O ATOM 100 OP2 A A 16 -5.940 0.003 -6.874 1.00 0.00 O ATOM 101 O5' A A 16 -7.282 -0.157 -4.764 1.00 0.00 O ATOM 102 C5' A A 16 -8.492 -0.332 -4.023 1.00 0.00 C ATOM 103 C4' A A 16 -8.285 -0.137 -2.519 1.00 0.00 C ATOM 104 O4' A A 16 -7.336 -1.063 -1.981 1.00 0.00 O ATOM 105 C3' A A 16 -7.698 1.224 -2.197 1.00 0.00 C ATOM 106 O3' A A 16 -8.749 2.183 -2.098 1.00 0.00 O ATOM 107 C2' A A 16 -7.138 0.988 -0.810 1.00 0.00 C ATOM 108 O2' A A 16 -8.161 1.058 0.190 1.00 0.00 O ATOM 109 C1' A A 16 -6.579 -0.415 -0.937 1.00 0.00 C ATOM 110 N9 A A 16 -5.142 -0.377 -1.255 1.00 0.00 N ATOM 111 C8 A A 16 -4.502 -0.626 -2.416 1.00 0.00 C ATOM 112 N7 A A 16 -3.214 -0.625 -2.406 1.00 0.00 N ATOM 113 C5 A A 16 -2.952 -0.327 -1.071 1.00 0.00 C ATOM 114 C6 A A 16 -1.767 -0.167 -0.355 1.00 0.00 C ATOM 115 N6 A A 16 -0.563 -0.341 -0.905 1.00 0.00 N ATOM 116 N1 A A 16 -1.876 0.137 0.954 1.00 0.00 N ATOM 117 C2 A A 16 -3.086 0.268 1.512 1.00 0.00 C ATOM 118 N3 A A 16 -4.261 0.129 0.926 1.00 0.00 N ATOM 119 C4 A A 16 -4.124 -0.169 -0.370 1.00 0.00 C ATOM 0 H5' A A 16 -8.887 -1.331 -4.207 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.240 0.377 -4.380 1.00 0.00 H new ATOM 0 H4' A A 16 -9.278 -0.270 -2.091 1.00 0.00 H new ATOM 0 H3' A A 16 -6.980 1.586 -2.933 1.00 0.00 H new ATOM 0 H2' A A 16 -6.402 1.730 -0.500 1.00 0.00 H new ATOM 0 HO2' A A 16 -9.016 1.282 -0.232 1.00 0.00 H new ATOM 0 H1' A A 16 -6.670 -0.965 -0.000 1.00 0.00 H new ATOM 0 H8 A A 16 -5.052 -0.820 -3.325 1.00 0.00 H new ATOM 0 H61 A A 16 0.278 -0.213 -0.342 1.00 0.00 H new ATOM 0 H62 A A 16 -0.484 -0.602 -1.888 1.00 0.00 H new ATOM 0 H2 A A 16 -3.103 0.516 2.563 1.00 0.00 H new ATOM 131 P C A 17 -8.405 3.754 -2.173 1.00 0.00 P ATOM 132 OP1 C A 17 -9.657 4.515 -1.967 1.00 0.00 O ATOM 133 OP2 C A 17 -7.587 3.992 -3.384 1.00 0.00 O ATOM 134 O5' C A 17 -7.467 3.963 -0.879 1.00 0.00 O ATOM 135 C5' C A 17 -7.981 3.708 0.430 1.00 0.00 C ATOM 136 C4' C A 17 -6.916 3.875 1.512 1.00 0.00 C ATOM 137 O4' C A 17 -5.891 2.887 1.434 1.00 0.00 O ATOM 138 C3' C A 17 -6.185 5.191 1.382 1.00 0.00 C ATOM 139 O3' C A 17 -6.951 6.202 2.040 1.00 0.00 O ATOM 140 C2' C A 17 -4.927 4.930 2.186 1.00 0.00 C ATOM 141 O2' C A 17 -5.148 5.145 3.585 1.00 0.00 O ATOM 142 C1' C A 17 -4.648 3.461 1.885 1.00 0.00 C ATOM 143 N1 C A 17 -3.614 3.321 0.854 1.00 0.00 N ATOM 144 C2 C A 17 -2.297 3.283 1.266 1.00 0.00 C ATOM 145 O2 C A 17 -2.026 3.390 2.459 1.00 0.00 O ATOM 146 N3 C A 17 -1.331 3.128 0.316 1.00 0.00 N ATOM 147 C4 C A 17 -1.660 3.015 -0.980 1.00 0.00 C ATOM 148 N4 C A 17 -0.702 2.852 -1.892 1.00 0.00 N ATOM 149 C5 C A 17 -3.026 3.059 -1.393 1.00 0.00 C ATOM 150 C6 C A 17 -3.955 3.211 -0.453 1.00 0.00 C ATOM 0 H5' C A 17 -8.381 2.695 0.470 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.810 4.386 0.631 1.00 0.00 H new ATOM 0 H4' C A 17 -7.472 3.799 2.446 1.00 0.00 H new ATOM 0 H3' C A 17 -6.004 5.511 0.356 1.00 0.00 H new ATOM 0 H2' C A 17 -4.100 5.592 1.929 1.00 0.00 H new ATOM 0 HO2' C A 17 -6.063 5.468 3.726 1.00 0.00 H new ATOM 0 H1' C A 17 -4.278 2.951 2.774 1.00 0.00 H new ATOM 0 H41 C A 17 -0.946 2.766 -2.879 1.00 0.00 H new ATOM 0 H42 C A 17 0.276 2.814 -1.603 1.00 0.00 H new ATOM 0 H5 C A 17 -3.296 2.972 -2.435 1.00 0.00 H new ATOM 0 H6 C A 17 -4.997 3.247 -0.736 1.00 0.00 H new ATOM 162 P U A 18 -6.867 7.734 1.558 1.00 0.00 P ATOM 163 OP1 U A 18 -7.715 8.551 2.455 1.00 0.00 O ATOM 164 OP2 U A 18 -7.089 7.773 0.095 1.00 0.00 O ATOM 165 O5' U A 18 -5.328 8.104 1.844 1.00 0.00 O ATOM 166 C5' U A 18 -4.790 8.008 3.166 1.00 0.00 C ATOM 167 C4' U A 18 -3.301 8.327 3.183 1.00 0.00 C ATOM 168 O4' U A 18 -2.535 7.250 2.649 1.00 0.00 O ATOM 169 C3' U A 18 -3.006 9.527 2.300 1.00 0.00 C ATOM 170 O3' U A 18 -2.784 10.664 3.138 1.00 0.00 O ATOM 171 C2' U A 18 -1.705 9.211 1.588 1.00 0.00 C ATOM 172 O2' U A 18 -0.650 10.075 2.015 1.00 0.00 O ATOM 173 C1' U A 18 -1.404 7.763 1.935 1.00 0.00 C ATOM 174 N1 U A 18 -1.157 7.006 0.702 1.00 0.00 N ATOM 175 C2 U A 18 0.157 6.820 0.327 1.00 0.00 C ATOM 176 O2 U A 18 1.095 7.249 0.995 1.00 0.00 O ATOM 177 N3 U A 18 0.359 6.129 -0.851 1.00 0.00 N ATOM 178 C4 U A 18 -0.627 5.610 -1.672 1.00 0.00 C ATOM 179 O4 U A 18 -0.326 5.014 -2.704 1.00 0.00 O ATOM 180 C5 U A 18 -1.977 5.850 -1.198 1.00 0.00 C ATOM 181 C6 U A 18 -2.195 6.532 -0.047 1.00 0.00 C ATOM 0 H5' U A 18 -4.953 7.003 3.555 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.319 8.695 3.827 1.00 0.00 H new ATOM 0 H4' U A 18 -3.036 8.515 4.223 1.00 0.00 H new ATOM 0 H3' U A 18 -3.821 9.729 1.605 1.00 0.00 H new ATOM 0 H2' U A 18 -1.790 9.362 0.512 1.00 0.00 H new ATOM 0 HO2' U A 18 0.207 9.734 1.682 1.00 0.00 H new ATOM 0 H1' U A 18 -0.512 7.677 2.556 1.00 0.00 H new ATOM 0 H3 U A 18 1.326 5.988 -1.144 1.00 0.00 H new ATOM 0 H5 U A 18 -2.817 5.481 -1.768 1.00 0.00 H new ATOM 0 H6 U A 18 -3.209 6.704 0.284 1.00 0.00 H new ATOM 192 P G A 19 -2.662 12.139 2.500 1.00 0.00 P ATOM 193 OP1 G A 19 -2.935 13.131 3.564 1.00 0.00 O ATOM 194 OP2 G A 19 -3.440 12.169 1.242 1.00 0.00 O ATOM 195 O5' G A 19 -1.093 12.208 2.131 1.00 0.00 O ATOM 196 C5' G A 19 -0.119 12.227 3.181 1.00 0.00 C ATOM 197 C4' G A 19 1.304 11.971 2.677 1.00 0.00 C ATOM 198 O4' G A 19 1.472 10.644 2.195 1.00 0.00 O ATOM 199 C3' G A 19 1.664 12.839 1.492 1.00 0.00 C ATOM 200 O3' G A 19 1.992 14.175 1.890 1.00 0.00 O ATOM 201 C2' G A 19 2.879 12.097 0.947 1.00 0.00 C ATOM 202 O2' G A 19 4.082 12.507 1.605 1.00 0.00 O ATOM 203 C1' G A 19 2.549 10.635 1.245 1.00 0.00 C ATOM 204 N9 G A 19 2.169 9.935 0.007 1.00 0.00 N ATOM 205 C8 G A 19 0.943 9.628 -0.461 1.00 0.00 C ATOM 206 N7 G A 19 0.865 8.972 -1.568 1.00 0.00 N ATOM 207 C5 G A 19 2.213 8.819 -1.898 1.00 0.00 C ATOM 208 C6 G A 19 2.806 8.179 -3.016 1.00 0.00 C ATOM 209 O6 G A 19 2.251 7.605 -3.949 1.00 0.00 O ATOM 210 N1 G A 19 4.192 8.254 -2.968 1.00 0.00 N ATOM 211 C2 G A 19 4.922 8.870 -1.971 1.00 0.00 C ATOM 212 N2 G A 19 6.247 8.853 -2.114 1.00 0.00 N ATOM 213 N3 G A 19 4.371 9.472 -0.913 1.00 0.00 N ATOM 214 C4 G A 19 3.021 9.410 -0.938 1.00 0.00 C ATOM 0 H5' G A 19 -0.378 11.472 3.924 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.153 13.193 3.684 1.00 0.00 H new ATOM 0 H4' G A 19 1.930 12.181 3.544 1.00 0.00 H new ATOM 0 H3' G A 19 0.857 12.970 0.771 1.00 0.00 H new ATOM 0 H2' G A 19 3.059 12.289 -0.111 1.00 0.00 H new ATOM 0 HO2' G A 19 3.930 13.360 2.063 1.00 0.00 H new ATOM 0 HO3' G A 19 2.221 14.705 1.098 1.00 0.00 H new ATOM 0 H1' G A 19 3.410 10.105 1.652 1.00 0.00 H new ATOM 0 H8 G A 19 0.053 9.923 0.075 1.00 0.00 H new ATOM 0 H1 G A 19 4.712 7.819 -3.730 1.00 0.00 H new ATOM 0 H21 G A 19 6.842 9.292 -1.411 1.00 0.00 H new ATOM 0 H22 G A 19 6.666 8.401 -2.927 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.315 4.102 -7.871 1.00 0.00 O ATOM 229 C5' C B 59 9.731 3.972 -7.970 1.00 0.00 C ATOM 230 C4' C B 59 10.470 4.952 -7.050 1.00 0.00 C ATOM 231 O4' C B 59 10.067 6.312 -7.297 1.00 0.00 O ATOM 232 C3' C B 59 10.146 4.696 -5.580 1.00 0.00 C ATOM 233 O3' C B 59 11.191 3.902 -5.011 1.00 0.00 O ATOM 234 C2' C B 59 10.220 6.085 -4.977 1.00 0.00 C ATOM 235 O2' C B 59 11.573 6.488 -4.736 1.00 0.00 O ATOM 236 C1' C B 59 9.581 6.900 -6.077 1.00 0.00 C ATOM 237 N1 C B 59 8.115 6.806 -5.997 1.00 0.00 N ATOM 238 C2 C B 59 7.469 7.479 -4.973 1.00 0.00 C ATOM 239 O2 C B 59 8.113 8.156 -4.175 1.00 0.00 O ATOM 240 N3 C B 59 6.114 7.355 -4.880 1.00 0.00 N ATOM 241 C4 C B 59 5.432 6.601 -5.756 1.00 0.00 C ATOM 242 N4 C B 59 4.107 6.501 -5.645 1.00 0.00 N ATOM 243 C5 C B 59 6.109 5.909 -6.808 1.00 0.00 C ATOM 244 C6 C B 59 7.434 6.046 -6.885 1.00 0.00 C ATOM 0 H5' C B 59 10.038 4.143 -9.002 1.00 0.00 H new ATOM 0 H5'' C B 59 10.019 2.952 -7.717 1.00 0.00 H new ATOM 0 H4' C B 59 11.529 4.802 -7.258 1.00 0.00 H new ATOM 0 H3' C B 59 9.195 4.189 -5.420 1.00 0.00 H new ATOM 0 H2' C B 59 9.739 6.182 -4.004 1.00 0.00 H new ATOM 0 HO2' C B 59 12.171 5.723 -4.870 1.00 0.00 H new ATOM 0 HO5' C B 59 8.079 5.049 -7.780 1.00 0.00 H new ATOM 0 H1' C B 59 9.828 7.959 -6.009 1.00 0.00 H new ATOM 0 H41 C B 59 3.581 5.930 -6.307 1.00 0.00 H new ATOM 0 H42 C B 59 3.619 6.996 -4.898 1.00 0.00 H new ATOM 0 H5 C B 59 5.568 5.298 -7.515 1.00 0.00 H new ATOM 0 H6 C B 59 7.974 5.540 -7.672 1.00 0.00 H new ATOM 257 P A B 60 10.865 2.874 -3.816 1.00 0.00 P ATOM 258 OP1 A B 60 12.137 2.255 -3.379 1.00 0.00 O ATOM 259 OP2 A B 60 9.733 2.018 -4.237 1.00 0.00 O ATOM 260 O5' A B 60 10.351 3.851 -2.644 1.00 0.00 O ATOM 261 C5' A B 60 11.206 4.870 -2.120 1.00 0.00 C ATOM 262 C4' A B 60 10.530 5.656 -1.000 1.00 0.00 C ATOM 263 O4' A B 60 9.600 6.626 -1.508 1.00 0.00 O ATOM 264 C3' A B 60 9.695 4.749 -0.117 1.00 0.00 C ATOM 265 O3' A B 60 10.533 4.191 0.903 1.00 0.00 O ATOM 266 C2' A B 60 8.742 5.744 0.511 1.00 0.00 C ATOM 267 O2' A B 60 9.373 6.487 1.561 1.00 0.00 O ATOM 268 C1' A B 60 8.417 6.632 -0.683 1.00 0.00 C ATOM 269 N9 A B 60 7.244 6.119 -1.422 1.00 0.00 N ATOM 270 C8 A B 60 7.178 5.344 -2.537 1.00 0.00 C ATOM 271 N7 A B 60 6.005 5.024 -2.970 1.00 0.00 N ATOM 272 C5 A B 60 5.176 5.659 -2.041 1.00 0.00 C ATOM 273 C6 A B 60 3.785 5.734 -1.904 1.00 0.00 C ATOM 274 N6 A B 60 2.937 5.130 -2.743 1.00 0.00 N ATOM 275 N1 A B 60 3.302 6.451 -0.872 1.00 0.00 N ATOM 276 C2 A B 60 4.137 7.059 -0.023 1.00 0.00 C ATOM 277 N3 A B 60 5.464 7.049 -0.057 1.00 0.00 N ATOM 278 C4 A B 60 5.923 6.327 -1.098 1.00 0.00 C ATOM 0 H5' A B 60 11.492 5.552 -2.921 1.00 0.00 H new ATOM 0 H5'' A B 60 12.123 4.417 -1.744 1.00 0.00 H new ATOM 0 H4' A B 60 11.346 6.129 -0.454 1.00 0.00 H new ATOM 0 H3' A B 60 9.212 3.922 -0.637 1.00 0.00 H new ATOM 0 H2' A B 60 7.871 5.292 0.985 1.00 0.00 H new ATOM 0 HO2' A B 60 10.198 6.033 1.833 1.00 0.00 H new ATOM 0 H1' A B 60 8.157 7.644 -0.371 1.00 0.00 H new ATOM 0 H8 A B 60 8.073 5.009 -3.041 1.00 0.00 H new ATOM 0 H61 A B 60 1.931 5.215 -2.600 1.00 0.00 H new ATOM 0 H62 A B 60 3.296 4.584 -3.526 1.00 0.00 H new ATOM 0 H2 A B 60 3.681 7.620 0.779 1.00 0.00 H new ATOM 290 P G B 61 10.365 2.646 1.330 1.00 0.00 P ATOM 291 OP1 G B 61 11.528 2.268 2.165 1.00 0.00 O ATOM 292 OP2 G B 61 10.043 1.862 0.116 1.00 0.00 O ATOM 293 O5' G B 61 9.059 2.678 2.269 1.00 0.00 O ATOM 294 C5' G B 61 9.132 3.218 3.589 1.00 0.00 C ATOM 295 C4' G B 61 7.746 3.434 4.187 1.00 0.00 C ATOM 296 O4' G B 61 6.976 4.325 3.379 1.00 0.00 O ATOM 297 C3' G B 61 6.943 2.144 4.238 1.00 0.00 C ATOM 298 O3' G B 61 7.120 1.535 5.521 1.00 0.00 O ATOM 299 C2' G B 61 5.504 2.609 4.137 1.00 0.00 C ATOM 300 O2' G B 61 4.920 2.809 5.428 1.00 0.00 O ATOM 301 C1' G B 61 5.601 3.911 3.358 1.00 0.00 C ATOM 302 N9 G B 61 5.113 3.697 1.986 1.00 0.00 N ATOM 303 C8 G B 61 5.794 3.456 0.838 1.00 0.00 C ATOM 304 N7 G B 61 5.103 3.262 -0.236 1.00 0.00 N ATOM 305 C5 G B 61 3.795 3.382 0.245 1.00 0.00 C ATOM 306 C6 G B 61 2.557 3.269 -0.439 1.00 0.00 C ATOM 307 O6 G B 61 2.361 3.039 -1.630 1.00 0.00 O ATOM 308 N1 G B 61 1.484 3.455 0.424 1.00 0.00 N ATOM 309 C2 G B 61 1.584 3.717 1.774 1.00 0.00 C ATOM 310 N2 G B 61 0.439 3.852 2.435 1.00 0.00 N ATOM 311 N3 G B 61 2.741 3.825 2.421 1.00 0.00 N ATOM 312 C4 G B 61 3.799 3.647 1.605 1.00 0.00 C ATOM 0 H5' G B 61 9.670 4.166 3.565 1.00 0.00 H new ATOM 0 H5'' G B 61 9.703 2.543 4.227 1.00 0.00 H new ATOM 0 H4' G B 61 7.917 3.831 5.188 1.00 0.00 H new ATOM 0 H3' G B 61 7.233 1.434 3.463 1.00 0.00 H new ATOM 0 H2' G B 61 4.860 1.876 3.651 1.00 0.00 H new ATOM 0 HO2' G B 61 3.956 2.641 5.380 1.00 0.00 H new ATOM 0 H1' G B 61 4.985 4.693 3.802 1.00 0.00 H new ATOM 0 H8 G B 61 6.874 3.427 0.822 1.00 0.00 H new ATOM 0 H1 G B 61 0.547 3.393 0.027 1.00 0.00 H new ATOM 0 H21 G B 61 0.448 4.047 3.436 1.00 0.00 H new ATOM 0 H22 G B 61 -0.449 3.761 1.941 1.00 0.00 H new ATOM 324 P U B 62 6.590 0.035 5.789 1.00 0.00 P ATOM 325 OP1 U B 62 7.306 -0.508 6.966 1.00 0.00 O ATOM 326 OP2 U B 62 6.605 -0.702 4.507 1.00 0.00 O ATOM 327 O5' U B 62 5.054 0.301 6.206 1.00 0.00 O ATOM 328 C5' U B 62 4.769 0.960 7.442 1.00 0.00 C ATOM 329 C4' U B 62 3.324 1.458 7.531 1.00 0.00 C ATOM 330 O4' U B 62 2.996 2.314 6.429 1.00 0.00 O ATOM 331 C3' U B 62 2.295 0.343 7.454 1.00 0.00 C ATOM 332 O3' U B 62 2.075 -0.210 8.752 1.00 0.00 O ATOM 333 C2' U B 62 1.066 1.132 7.063 1.00 0.00 C ATOM 334 O2' U B 62 0.553 1.894 8.163 1.00 0.00 O ATOM 335 C1' U B 62 1.654 2.023 5.990 1.00 0.00 C ATOM 336 N1 U B 62 1.659 1.319 4.702 1.00 0.00 N ATOM 337 C2 U B 62 0.467 1.235 4.007 1.00 0.00 C ATOM 338 O2 U B 62 -0.585 1.687 4.452 1.00 0.00 O ATOM 339 N3 U B 62 0.526 0.593 2.783 1.00 0.00 N ATOM 340 C4 U B 62 1.660 0.042 2.208 1.00 0.00 C ATOM 341 O4 U B 62 1.607 -0.487 1.100 1.00 0.00 O ATOM 342 C5 U B 62 2.853 0.176 3.018 1.00 0.00 C ATOM 343 C6 U B 62 2.811 0.792 4.216 1.00 0.00 C ATOM 0 H5' U B 62 5.447 1.805 7.563 1.00 0.00 H new ATOM 0 H5'' U B 62 4.963 0.275 8.267 1.00 0.00 H new ATOM 0 H4' U B 62 3.283 1.965 8.495 1.00 0.00 H new ATOM 0 H3' U B 62 2.569 -0.478 6.791 1.00 0.00 H new ATOM 0 H2' U B 62 0.216 0.529 6.743 1.00 0.00 H new ATOM 0 HO2' U B 62 0.898 1.527 9.004 1.00 0.00 H new ATOM 0 H1' U B 62 1.078 2.937 5.847 1.00 0.00 H new ATOM 0 H3 U B 62 -0.344 0.518 2.256 1.00 0.00 H new ATOM 0 H5 U B 62 3.789 -0.223 2.657 1.00 0.00 H new ATOM 0 H6 U B 62 3.715 0.868 4.802 1.00 0.00 H new ATOM 354 P G B 63 1.504 -1.710 8.894 1.00 0.00 P ATOM 355 OP1 G B 63 1.272 -1.981 10.331 1.00 0.00 O ATOM 356 OP2 G B 63 2.369 -2.612 8.103 1.00 0.00 O ATOM 357 O5' G B 63 0.070 -1.614 8.161 1.00 0.00 O ATOM 358 C5' G B 63 -0.962 -0.774 8.686 1.00 0.00 C ATOM 359 C4' G B 63 -2.280 -0.936 7.929 1.00 0.00 C ATOM 360 O4' G B 63 -2.278 -0.236 6.680 1.00 0.00 O ATOM 361 C3' G B 63 -2.545 -2.383 7.557 1.00 0.00 C ATOM 362 O3' G B 63 -3.201 -3.015 8.657 1.00 0.00 O ATOM 363 C2' G B 63 -3.531 -2.226 6.415 1.00 0.00 C ATOM 364 O2' G B 63 -4.857 -1.966 6.892 1.00 0.00 O ATOM 365 C1' G B 63 -2.956 -1.031 5.685 1.00 0.00 C ATOM 366 N9 G B 63 -2.026 -1.466 4.628 1.00 0.00 N ATOM 367 C8 G B 63 -0.673 -1.505 4.634 1.00 0.00 C ATOM 368 N7 G B 63 -0.077 -1.863 3.550 1.00 0.00 N ATOM 369 C5 G B 63 -1.157 -2.107 2.701 1.00 0.00 C ATOM 370 C6 G B 63 -1.167 -2.538 1.353 1.00 0.00 C ATOM 371 O6 G B 63 -0.207 -2.783 0.626 1.00 0.00 O ATOM 372 N1 G B 63 -2.460 -2.666 0.871 1.00 0.00 N ATOM 373 C2 G B 63 -3.610 -2.417 1.593 1.00 0.00 C ATOM 374 N2 G B 63 -4.762 -2.625 0.955 1.00 0.00 N ATOM 375 N3 G B 63 -3.610 -2.006 2.864 1.00 0.00 N ATOM 376 C4 G B 63 -2.357 -1.872 3.355 1.00 0.00 C ATOM 0 H5' G B 63 -0.642 0.267 8.636 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.119 -1.009 9.739 1.00 0.00 H new ATOM 0 H4' G B 63 -3.035 -0.543 8.610 1.00 0.00 H new ATOM 0 H3' G B 63 -1.658 -2.966 7.308 1.00 0.00 H new ATOM 0 H2' G B 63 -3.638 -3.116 5.795 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.873 -2.036 7.869 1.00 0.00 H new ATOM 0 H1' G B 63 -3.738 -0.453 5.192 1.00 0.00 H new ATOM 0 H8 G B 63 -0.112 -1.244 5.519 1.00 0.00 H new ATOM 0 H1 G B 63 -2.571 -2.969 -0.097 1.00 0.00 H new ATOM 0 H21 G B 63 -5.647 -2.459 1.434 1.00 0.00 H new ATOM 0 H22 G B 63 -4.758 -2.950 -0.012 1.00 0.00 H new ATOM 388 P U B 64 -2.836 -4.528 9.057 1.00 0.00 P ATOM 389 OP1 U B 64 -3.414 -4.810 10.390 1.00 0.00 O ATOM 390 OP2 U B 64 -1.390 -4.736 8.819 1.00 0.00 O ATOM 391 O5' U B 64 -3.654 -5.373 7.963 1.00 0.00 O ATOM 392 C5' U B 64 -5.061 -5.183 7.815 1.00 0.00 C ATOM 393 C4' U B 64 -5.591 -5.893 6.575 1.00 0.00 C ATOM 394 O4' U B 64 -5.375 -5.127 5.386 1.00 0.00 O ATOM 395 C3' U B 64 -4.856 -7.196 6.341 1.00 0.00 C ATOM 396 O3' U B 64 -5.516 -8.233 7.071 1.00 0.00 O ATOM 397 C2' U B 64 -5.081 -7.423 4.862 1.00 0.00 C ATOM 398 O2' U B 64 -6.351 -8.036 4.613 1.00 0.00 O ATOM 399 C1' U B 64 -5.027 -6.011 4.304 1.00 0.00 C ATOM 400 N1 U B 64 -3.696 -5.689 3.754 1.00 0.00 N ATOM 401 C2 U B 64 -3.523 -5.864 2.394 1.00 0.00 C ATOM 402 O2 U B 64 -4.415 -6.309 1.674 1.00 0.00 O ATOM 403 N3 U B 64 -2.284 -5.519 1.887 1.00 0.00 N ATOM 404 C4 U B 64 -1.215 -5.023 2.618 1.00 0.00 C ATOM 405 O4 U B 64 -0.152 -4.748 2.064 1.00 0.00 O ATOM 406 C5 U B 64 -1.485 -4.877 4.033 1.00 0.00 C ATOM 407 C6 U B 64 -2.691 -5.205 4.548 1.00 0.00 C ATOM 0 H5' U B 64 -5.281 -4.117 7.748 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.575 -5.559 8.699 1.00 0.00 H new ATOM 0 H4' U B 64 -6.654 -6.045 6.761 1.00 0.00 H new ATOM 0 H3' U B 64 -3.808 -7.182 6.640 1.00 0.00 H new ATOM 0 H2' U B 64 -4.354 -8.097 4.410 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.777 -8.264 5.466 1.00 0.00 H new ATOM 0 H1' U B 64 -5.723 -5.903 3.472 1.00 0.00 H new ATOM 0 H3 U B 64 -2.143 -5.640 0.884 1.00 0.00 H new ATOM 0 H5 U B 64 -0.712 -4.501 4.686 1.00 0.00 H new ATOM 0 H6 U B 64 -2.865 -5.083 5.607 1.00 0.00 H new ATOM 418 P C B 65 -4.657 -9.384 7.799 1.00 0.00 P ATOM 419 OP1 C B 65 -5.558 -10.131 8.706 1.00 0.00 O ATOM 420 OP2 C B 65 -3.418 -8.771 8.330 1.00 0.00 O ATOM 421 O5' C B 65 -4.259 -10.349 6.574 1.00 0.00 O ATOM 422 C5' C B 65 -5.276 -11.013 5.825 1.00 0.00 C ATOM 423 C4' C B 65 -4.710 -11.726 4.600 1.00 0.00 C ATOM 424 O4' C B 65 -4.501 -10.823 3.518 1.00 0.00 O ATOM 425 C3' C B 65 -3.354 -12.340 4.888 1.00 0.00 C ATOM 426 O3' C B 65 -3.478 -13.629 5.501 1.00 0.00 O ATOM 427 C2' C B 65 -2.759 -12.438 3.495 1.00 0.00 C ATOM 428 O2' C B 65 -3.182 -13.630 2.824 1.00 0.00 O ATOM 429 C1' C B 65 -3.307 -11.187 2.812 1.00 0.00 C ATOM 430 N1 C B 65 -2.330 -10.094 2.863 1.00 0.00 N ATOM 431 C2 C B 65 -1.515 -9.907 1.763 1.00 0.00 C ATOM 432 O2 C B 65 -1.603 -10.660 0.795 1.00 0.00 O ATOM 433 N3 C B 65 -0.629 -8.874 1.789 1.00 0.00 N ATOM 434 C4 C B 65 -0.555 -8.060 2.849 1.00 0.00 C ATOM 435 N4 C B 65 0.347 -7.076 2.855 1.00 0.00 N ATOM 436 C5 C B 65 -1.409 -8.255 3.984 1.00 0.00 C ATOM 437 C6 C B 65 -2.266 -9.283 3.946 1.00 0.00 C ATOM 0 H5' C B 65 -6.025 -10.287 5.508 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.783 -11.736 6.464 1.00 0.00 H new ATOM 0 H4' C B 65 -5.445 -12.489 4.344 1.00 0.00 H new ATOM 0 H3' C B 65 -2.748 -11.764 5.588 1.00 0.00 H new ATOM 0 H2' C B 65 -1.670 -12.491 3.493 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.595 -14.240 3.470 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.586 -13.997 5.672 1.00 0.00 H new ATOM 0 H1' C B 65 -3.515 -11.381 1.760 1.00 0.00 H new ATOM 0 H41 C B 65 0.413 -6.449 3.657 1.00 0.00 H new ATOM 0 H42 C B 65 0.970 -6.951 2.057 1.00 0.00 H new ATOM 0 H5 C B 65 -1.363 -7.596 4.839 1.00 0.00 H new ATOM 0 H6 C B 65 -2.915 -9.468 4.790 1.00 0.00 H new TER 450 C B 65