USER MOD reduce.3.24.130724 H: found=0, std=0, add=194, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 195 hydrogens (52 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 27 C O2' : rot -20:sc= 0.126 USER MOD Single : A 27 C O5' : rot 180:sc=-0.00221 USER MOD Single : A 28 C O2' : rot -16:sc= 0.105 USER MOD Single : A 29 A O2' : rot -20:sc= 0.327 USER MOD Single : A 30 G O2' : rot -17:sc= 0.205 USER MOD Single : A 31 A O2' : rot -18:sc= 0.25 USER MOD Single : A 33 U O2' : rot 11:sc= 0.417 USER MOD Single : A 35 A O2' : rot 166:sc= 1.21 USER MOD Single : A 36 A O2' : rot 24:sc= 0.817 USER MOD Single : A 37 1MG O2' : rot -34:sc= 0.369 USER MOD Single : A 38 A O2' : rot -60:sc= 0.671 USER MOD Single : A 39 U O2' : rot -114:sc= 0.263 USER MOD Single : A 40 5MC O2' : rot -16:sc= 0.0975 USER MOD Single : A 41 U O2' : rot -17:sc= 0.152 USER MOD Single : A 42 G O2' : rot -18:sc= 0.208 USER MOD Single : A 43 G O2' : rot -20:sc= 0.0998 USER MOD Single : A 43 G O3' : rot 180:sc= 0.107 USER MOD ----------------------------------------------------------------- ATOM 1 O5' C A 27 -2.143 12.946 -2.102 1.00 16.34 O ATOM 2 C5' C A 27 -2.994 14.046 -2.340 1.00 15.72 C ATOM 3 C4' C A 27 -4.370 13.855 -1.686 1.00 17.30 C ATOM 4 O4' C A 27 -5.256 13.087 -2.466 1.00 18.55 O ATOM 5 C3' C A 27 -4.344 13.159 -0.329 1.00 18.37 C ATOM 6 O3' C A 27 -3.821 14.025 0.663 1.00 23.90 O ATOM 7 C2' C A 27 -5.826 12.841 -0.162 1.00 17.05 C ATOM 8 O2' C A 27 -6.526 13.964 0.334 1.00 19.18 O ATOM 9 C1' C A 27 -6.260 12.554 -1.610 1.00 14.80 C ATOM 10 N1 C A 27 -6.446 11.097 -1.865 1.00 20.01 N ATOM 11 C2 C A 27 -7.600 10.482 -1.372 1.00 18.21 C ATOM 12 O2 C A 27 -8.358 11.089 -0.619 1.00 16.44 O ATOM 13 N3 C A 27 -7.867 9.195 -1.750 1.00 17.00 N ATOM 14 C4 C A 27 -7.025 8.521 -2.555 1.00 21.09 C ATOM 15 N4 C A 27 -7.335 7.274 -2.929 1.00 23.04 N ATOM 16 C5 C A 27 -5.801 9.115 -3.019 1.00 18.01 C ATOM 17 C6 C A 27 -5.561 10.396 -2.651 1.00 19.95 C ATOM 0 H5' C A 27 -3.118 14.184 -3.414 1.00 15.72 H new ATOM 0 H5'' C A 27 -2.531 14.954 -1.954 1.00 15.72 H new ATOM 0 H4' C A 27 -4.704 14.887 -1.580 1.00 17.30 H new ATOM 0 H3' C A 27 -3.708 12.278 -0.247 1.00 18.37 H new ATOM 0 H2' C A 27 -6.020 12.026 0.536 1.00 17.05 H new ATOM 0 HO2' C A 27 -5.894 14.582 0.757 1.00 19.18 H new ATOM 0 HO5' C A 27 -1.278 13.102 -2.534 1.00 16.34 H new ATOM 0 H1' C A 27 -7.227 13.020 -1.799 1.00 14.80 H new ATOM 0 H41 C A 27 -6.705 6.753 -3.539 1.00 23.04 H new ATOM 0 H42 C A 27 -8.201 6.845 -2.604 1.00 23.04 H new ATOM 0 H5 C A 27 -5.104 8.564 -3.633 1.00 18.01 H new ATOM 0 H6 C A 27 -4.653 10.879 -2.982 1.00 19.95 H new ATOM 30 P C A 28 -2.724 13.524 1.734 1.00 33.10 P ATOM 31 OP1 C A 28 -2.316 14.683 2.559 1.00 25.70 O ATOM 32 OP2 C A 28 -1.697 12.734 1.016 1.00 32.53 O ATOM 33 O5' C A 28 -3.591 12.523 2.649 1.00 19.71 O ATOM 34 C5' C A 28 -4.442 13.011 3.668 1.00 18.88 C ATOM 35 C4' C A 28 -5.400 11.910 4.124 1.00 20.19 C ATOM 36 O4' C A 28 -6.262 11.529 3.069 1.00 20.55 O ATOM 37 C3' C A 28 -4.728 10.601 4.522 1.00 19.77 C ATOM 38 O3' C A 28 -4.043 10.663 5.762 1.00 25.59 O ATOM 39 C2' C A 28 -5.935 9.668 4.521 1.00 17.66 C ATOM 40 O2' C A 28 -6.644 9.769 5.740 1.00 20.65 O ATOM 41 C1' C A 28 -6.779 10.243 3.373 1.00 17.06 C ATOM 42 N1 C A 28 -6.713 9.321 2.203 1.00 15.63 N ATOM 43 C2 C A 28 -7.697 8.334 2.104 1.00 16.77 C ATOM 44 O2 C A 28 -8.719 8.389 2.784 1.00 17.51 O ATOM 45 N3 C A 28 -7.493 7.295 1.245 1.00 16.03 N ATOM 46 C4 C A 28 -6.397 7.229 0.472 1.00 15.19 C ATOM 47 N4 C A 28 -6.225 6.152 -0.306 1.00 14.44 N ATOM 48 C5 C A 28 -5.410 8.276 0.500 1.00 17.77 C ATOM 49 C6 C A 28 -5.610 9.290 1.378 1.00 16.79 C ATOM 0 H5' C A 28 -5.008 13.867 3.301 1.00 18.88 H new ATOM 0 H5'' C A 28 -3.848 13.360 4.513 1.00 18.88 H new ATOM 0 H4' C A 28 -5.902 12.357 4.982 1.00 20.19 H new ATOM 0 H3' C A 28 -3.920 10.287 3.861 1.00 19.77 H new ATOM 0 H2' C A 28 -5.677 8.615 4.406 1.00 17.66 H new ATOM 0 HO2' C A 28 -6.078 10.203 6.412 1.00 20.65 H new ATOM 0 H1' C A 28 -7.829 10.338 3.649 1.00 17.06 H new ATOM 0 H41 C A 28 -5.400 6.080 -0.902 1.00 14.44 H new ATOM 0 H42 C A 28 -6.919 5.404 -0.303 1.00 14.44 H new ATOM 0 H5 C A 28 -4.548 8.255 -0.150 1.00 17.77 H new ATOM 0 H6 C A 28 -4.888 10.092 1.432 1.00 16.79 H new ATOM 61 P A A 29 -3.009 9.498 6.197 1.00 34.75 P ATOM 62 OP1 A A 29 -2.387 9.897 7.480 1.00 29.69 O ATOM 63 OP2 A A 29 -2.152 9.164 5.038 1.00 31.89 O ATOM 64 O5' A A 29 -4.011 8.259 6.462 1.00 26.67 O ATOM 65 C5' A A 29 -4.090 7.582 7.703 1.00 27.49 C ATOM 66 C4' A A 29 -5.359 6.713 7.771 1.00 26.49 C ATOM 67 O4' A A 29 -6.014 6.645 6.521 1.00 25.60 O ATOM 68 C3' A A 29 -5.098 5.285 8.272 1.00 25.08 C ATOM 69 O3' A A 29 -5.374 5.279 9.666 1.00 22.54 O ATOM 70 C2' A A 29 -6.095 4.452 7.466 1.00 23.29 C ATOM 71 O2' A A 29 -7.284 4.249 8.201 1.00 22.73 O ATOM 72 C1' A A 29 -6.404 5.320 6.239 1.00 21.55 C ATOM 73 N9 A A 29 -5.715 4.889 5.001 1.00 18.46 N ATOM 74 C8 A A 29 -4.704 5.517 4.311 1.00 19.07 C ATOM 75 N7 A A 29 -4.525 5.072 3.099 1.00 17.22 N ATOM 76 C5 A A 29 -5.462 4.053 2.980 1.00 16.57 C ATOM 77 C6 A A 29 -5.822 3.191 1.921 1.00 19.45 C ATOM 78 N6 A A 29 -5.274 3.256 0.698 1.00 18.51 N ATOM 79 N1 A A 29 -6.757 2.251 2.169 1.00 21.52 N ATOM 80 C2 A A 29 -7.344 2.203 3.363 1.00 18.07 C ATOM 81 N3 A A 29 -7.134 2.989 4.414 1.00 17.75 N ATOM 82 C4 A A 29 -6.158 3.903 4.156 1.00 17.61 C ATOM 0 H5' A A 29 -4.095 8.306 8.518 1.00 27.49 H new ATOM 0 H5'' A A 29 -3.208 6.957 7.838 1.00 27.49 H new ATOM 0 H4' A A 29 -5.999 7.212 8.498 1.00 26.49 H new ATOM 0 H3' A A 29 -4.084 4.905 8.145 1.00 25.08 H new ATOM 0 H2' A A 29 -5.697 3.469 7.214 1.00 23.29 H new ATOM 0 HO2' A A 29 -7.110 4.402 9.153 1.00 22.73 H new ATOM 0 H1' A A 29 -7.474 5.226 6.053 1.00 21.55 H new ATOM 0 H8 A A 29 -4.109 6.311 4.737 1.00 19.07 H new ATOM 0 H61 A A 29 -5.573 2.607 -0.030 1.00 18.51 H new ATOM 0 H62 A A 29 -4.559 3.954 0.496 1.00 18.51 H new ATOM 0 H2 A A 29 -8.084 1.428 3.494 1.00 18.07 H new ATOM 94 P G A 30 -4.807 4.189 10.718 1.00 28.73 P ATOM 95 OP1 G A 30 -5.441 4.467 12.026 1.00 28.93 O ATOM 96 OP2 G A 30 -3.330 4.196 10.613 1.00 28.96 O ATOM 97 O5' G A 30 -5.354 2.754 10.211 1.00 24.12 O ATOM 98 C5' G A 30 -4.460 1.696 9.923 1.00 23.01 C ATOM 99 C4' G A 30 -5.190 0.498 9.308 1.00 22.38 C ATOM 100 O4' G A 30 -5.750 0.811 8.040 1.00 23.65 O ATOM 101 C3' G A 30 -4.217 -0.663 9.101 1.00 23.59 C ATOM 102 O3' G A 30 -4.162 -1.496 10.247 1.00 25.81 O ATOM 103 C2' G A 30 -4.829 -1.371 7.907 1.00 22.06 C ATOM 104 O2' G A 30 -5.819 -2.290 8.323 1.00 21.95 O ATOM 105 C1' G A 30 -5.475 -0.239 7.122 1.00 21.11 C ATOM 106 N9 G A 30 -4.664 0.263 5.992 1.00 17.84 N ATOM 107 C8 G A 30 -3.952 1.430 5.893 1.00 15.79 C ATOM 108 N7 G A 30 -3.521 1.701 4.695 1.00 14.31 N ATOM 109 C5 G A 30 -3.952 0.619 3.941 1.00 16.78 C ATOM 110 C6 G A 30 -3.751 0.335 2.559 1.00 19.20 C ATOM 111 O6 G A 30 -3.246 1.069 1.715 1.00 18.18 O ATOM 112 N1 G A 30 -4.171 -0.953 2.218 1.00 18.94 N ATOM 113 C2 G A 30 -4.876 -1.791 3.067 1.00 19.57 C ATOM 114 N2 G A 30 -5.298 -2.954 2.555 1.00 17.51 N ATOM 115 N3 G A 30 -5.142 -1.485 4.349 1.00 19.89 N ATOM 116 C4 G A 30 -4.627 -0.283 4.730 1.00 18.38 C ATOM 0 H5' G A 30 -3.955 1.386 10.838 1.00 23.01 H new ATOM 0 H5'' G A 30 -3.689 2.046 9.236 1.00 23.01 H new ATOM 0 H4' G A 30 -5.986 0.229 10.002 1.00 22.38 H new ATOM 0 H3' G A 30 -3.183 -0.358 8.939 1.00 23.59 H new ATOM 0 H2' G A 30 -4.097 -1.940 7.333 1.00 22.06 H new ATOM 0 HO2' G A 30 -5.712 -2.476 9.279 1.00 21.95 H new ATOM 0 H1' G A 30 -6.382 -0.628 6.659 1.00 21.11 H new ATOM 0 H8 G A 30 -3.764 2.073 6.740 1.00 15.79 H new ATOM 0 H1 G A 30 -3.944 -1.298 1.285 1.00 18.94 H new ATOM 0 H21 G A 30 -5.822 -3.608 3.137 1.00 17.51 H new ATOM 0 H22 G A 30 -5.096 -3.186 1.583 1.00 17.51 H new ATOM 128 P A A 31 -3.013 -2.613 10.466 1.00 37.02 P ATOM 129 OP1 A A 31 -3.315 -3.325 11.728 1.00 30.97 O ATOM 130 OP2 A A 31 -1.697 -1.958 10.295 1.00 26.58 O ATOM 131 O5' A A 31 -3.240 -3.657 9.248 1.00 30.07 O ATOM 132 C5' A A 31 -2.217 -3.931 8.307 1.00 30.35 C ATOM 133 C4' A A 31 -2.709 -4.920 7.242 1.00 27.81 C ATOM 134 O4' A A 31 -3.492 -4.260 6.259 1.00 26.76 O ATOM 135 C3' A A 31 -1.533 -5.598 6.530 1.00 26.45 C ATOM 136 O3' A A 31 -1.279 -6.889 7.067 1.00 30.61 O ATOM 137 C2' A A 31 -2.032 -5.696 5.096 1.00 24.54 C ATOM 138 O2' A A 31 -2.830 -6.850 4.928 1.00 28.13 O ATOM 139 C1' A A 31 -2.920 -4.457 4.976 1.00 22.42 C ATOM 140 N9 A A 31 -2.159 -3.260 4.539 1.00 21.95 N ATOM 141 C8 A A 31 -2.015 -2.039 5.153 1.00 22.76 C ATOM 142 N7 A A 31 -1.354 -1.158 4.457 1.00 19.49 N ATOM 143 C5 A A 31 -1.057 -1.826 3.276 1.00 20.04 C ATOM 144 C6 A A 31 -0.405 -1.436 2.085 1.00 20.83 C ATOM 145 N6 A A 31 0.116 -0.216 1.891 1.00 21.29 N ATOM 146 N1 A A 31 -0.301 -2.347 1.097 1.00 25.93 N ATOM 147 C2 A A 31 -0.822 -3.559 1.265 1.00 26.19 C ATOM 148 N3 A A 31 -1.470 -4.038 2.323 1.00 23.41 N ATOM 149 C4 A A 31 -1.552 -3.108 3.314 1.00 22.31 C ATOM 0 H5' A A 31 -1.347 -4.343 8.818 1.00 30.35 H new ATOM 0 H5'' A A 31 -1.898 -3.005 7.830 1.00 30.35 H new ATOM 0 H4' A A 31 -3.310 -5.667 7.761 1.00 27.81 H new ATOM 0 H3' A A 31 -0.594 -5.054 6.633 1.00 26.45 H new ATOM 0 H2' A A 31 -1.228 -5.753 4.363 1.00 24.54 H new ATOM 0 HO2' A A 31 -2.656 -7.477 5.660 1.00 28.13 H new ATOM 0 H1' A A 31 -3.684 -4.607 4.213 1.00 22.42 H new ATOM 0 H8 A A 31 -2.417 -1.827 6.133 1.00 22.76 H new ATOM 0 H61 A A 31 0.576 0.008 1.008 1.00 21.29 H new ATOM 0 H62 A A 31 0.053 0.488 2.626 1.00 21.29 H new ATOM 0 H2 A A 31 -0.704 -4.241 0.436 1.00 26.19 H new HETATM 161 N1 OMC A 32 2.164 -4.759 2.936 1.00 0.00 N HETATM 162 C2 OMC A 32 2.693 -3.785 2.098 1.00 0.00 C HETATM 163 N3 OMC A 32 2.729 -2.485 2.513 1.00 0.00 N HETATM 164 C4 OMC A 32 2.345 -2.175 3.767 1.00 0.00 C HETATM 165 C5 OMC A 32 1.793 -3.161 4.654 1.00 0.00 C HETATM 166 C6 OMC A 32 1.724 -4.433 4.193 1.00 0.00 C HETATM 167 O2 OMC A 32 3.135 -4.099 1.003 1.00 0.00 O HETATM 168 N4 OMC A 32 2.419 -0.901 4.164 1.00 0.00 N HETATM 169 C1' OMC A 32 2.065 -6.141 2.404 1.00 37.12 C HETATM 170 C2' OMC A 32 3.358 -6.948 2.658 1.00 38.77 C HETATM 171 O2' OMC A 32 3.954 -7.661 1.569 1.00 44.03 O HETATM 172 CM2 OMC A 32 3.111 -7.914 0.457 1.00 45.01 C HETATM 173 C3' OMC A 32 2.987 -7.867 3.819 1.00 37.31 C HETATM 174 C4' OMC A 32 1.491 -8.018 3.605 1.00 37.40 C HETATM 175 O4' OMC A 32 1.004 -6.815 3.053 1.00 41.20 O HETATM 176 O3' OMC A 32 3.581 -9.156 3.794 0.86 37.82 O HETATM 177 C5' OMC A 32 0.707 -8.412 4.865 1.00 34.16 C HETATM 178 O5' OMC A 32 0.912 -7.419 5.853 1.00 30.92 O HETATM 179 P OMC A 32 0.214 -7.460 7.307 1.00 40.89 P HETATM 180 OP1 OMC A 32 0.099 -8.875 7.726 1.00 30.60 O HETATM 181 OP2 OMC A 32 0.930 -6.499 8.175 1.00 32.99 O HETATM 0 HN42 OMC A 32 2.134 -0.644 5.109 1.00 0.00 H new HETATM 0 HN41 OMC A 32 2.761 -0.186 3.522 1.00 0.00 H new HETATM 0 HM23 OMC A 32 2.256 -8.510 0.777 1.00 45.01 H new HETATM 0 HM22 OMC A 32 2.760 -6.968 0.044 1.00 45.01 H new HETATM 0 HM21 OMC A 32 3.668 -8.459 -0.305 1.00 45.01 H new HETATM 0 H5'' OMC A 32 -0.355 -8.505 4.636 1.00 34.16 H new HETATM 0 H6 OMC A 32 1.311 -5.212 4.834 1.00 0.00 H new HETATM 0 H5' OMC A 32 1.041 -9.383 5.230 1.00 34.16 H new HETATM 0 H5 OMC A 32 1.445 -2.898 5.653 1.00 0.00 H new HETATM 0 H4' OMC A 32 1.336 -8.853 2.921 1.00 37.40 H new HETATM 0 H3' OMC A 32 3.321 -7.448 4.768 1.00 37.31 H new HETATM 0 H2' OMC A 32 4.166 -6.244 2.858 1.00 38.77 H new HETATM 0 H1' OMC A 32 1.897 -6.067 1.330 1.00 37.12 H new ATOM 195 P U A 33 5.102 -9.452 4.250 0.86 37.78 P ATOM 196 OP1 U A 33 5.138 -10.786 4.890 0.86 32.75 O ATOM 197 OP2 U A 33 5.631 -8.271 4.970 0.86 34.57 O ATOM 198 O5' U A 33 5.835 -9.570 2.815 0.86 34.32 O ATOM 199 C5' U A 33 6.903 -8.728 2.426 0.70 33.58 C ATOM 200 C4' U A 33 7.264 -9.050 0.966 0.70 30.43 C ATOM 201 O4' U A 33 6.549 -8.188 0.096 0.70 31.83 O ATOM 202 C3' U A 33 8.764 -8.907 0.664 0.70 30.27 C ATOM 203 O3' U A 33 9.245 -10.090 0.038 0.69 33.13 O ATOM 204 C2' U A 33 8.864 -7.734 -0.305 0.70 30.04 C ATOM 205 O2' U A 33 9.701 -8.024 -1.408 0.70 25.89 O ATOM 206 C1' U A 33 7.427 -7.467 -0.756 0.70 29.86 C ATOM 207 N1 U A 33 7.168 -5.999 -0.719 1.00 27.37 N ATOM 208 C2 U A 33 7.659 -5.224 -1.772 1.00 25.07 C ATOM 209 O2 U A 33 8.158 -5.714 -2.783 1.00 22.79 O ATOM 210 N3 U A 33 7.570 -3.843 -1.621 1.00 24.34 N ATOM 211 C4 U A 33 7.051 -3.179 -0.515 1.00 24.68 C ATOM 212 O4 U A 33 7.050 -1.950 -0.471 1.00 30.20 O ATOM 213 C5 U A 33 6.542 -4.058 0.522 1.00 22.57 C ATOM 214 C6 U A 33 6.616 -5.406 0.395 1.00 24.36 C ATOM 0 H5' U A 33 7.765 -8.885 3.074 0.70 33.58 H new ATOM 0 H5'' U A 33 6.616 -7.681 2.524 0.70 33.58 H new ATOM 0 H4' U A 33 6.992 -10.093 0.806 0.70 30.43 H new ATOM 0 H3' U A 33 9.352 -8.747 1.568 0.70 30.27 H new ATOM 0 H2' U A 33 9.314 -6.864 0.173 0.70 30.04 H new ATOM 0 HO2' U A 33 9.916 -8.980 -1.413 0.70 25.89 H new ATOM 0 H1' U A 33 7.263 -7.803 -1.780 0.70 29.86 H new ATOM 0 H3 U A 33 7.916 -3.268 -2.389 1.00 24.34 H new ATOM 0 H5 U A 33 6.097 -3.632 1.409 1.00 22.57 H new ATOM 0 H6 U A 33 6.232 -6.031 1.188 1.00 24.36 H new HETATM 225 P OMG A 34 10.172 -11.180 0.800 0.69 39.54 P HETATM 226 OP1 OMG A 34 9.795 -12.517 0.291 0.69 37.74 O HETATM 227 OP2 OMG A 34 10.141 -10.918 2.257 0.69 31.79 O HETATM 228 O5' OMG A 34 11.659 -10.854 0.247 0.69 33.84 O HETATM 229 C5' OMG A 34 12.423 -9.749 0.701 0.79 30.14 C HETATM 230 C4' OMG A 34 13.632 -9.567 -0.230 0.79 28.23 C HETATM 231 O4' OMG A 34 12.964 -9.247 -1.430 0.79 24.42 O HETATM 232 C3' OMG A 34 14.499 -8.366 0.133 0.79 29.46 C HETATM 233 O3' OMG A 34 15.808 -8.737 0.538 1.00 36.37 O HETATM 234 C2' OMG A 34 14.666 -7.666 -1.223 0.79 26.04 C HETATM 235 O2' OMG A 34 15.964 -7.851 -1.775 0.79 27.05 O HETATM 236 CM2 OMG A 34 16.251 -6.892 -2.773 0.79 23.06 C HETATM 237 C1' OMG A 34 13.679 -8.317 -2.192 0.79 24.20 C HETATM 238 N9 OMG A 34 12.699 -7.360 -2.758 1.00 0.00 N HETATM 239 C8 OMG A 34 12.101 -6.253 -2.195 1.00 0.00 C HETATM 240 N7 OMG A 34 11.219 -5.684 -2.966 1.00 0.00 N HETATM 241 C5 OMG A 34 11.271 -6.427 -4.140 1.00 0.00 C HETATM 242 C6 OMG A 34 10.472 -6.346 -5.320 1.00 0.00 C HETATM 243 O6 OMG A 34 9.488 -5.640 -5.516 1.00 0.00 O HETATM 244 N1 OMG A 34 10.903 -7.224 -6.318 1.00 0.00 N HETATM 245 C2 OMG A 34 11.953 -8.117 -6.173 1.00 0.00 C HETATM 246 N2 OMG A 34 12.230 -8.908 -7.218 1.00 0.00 N HETATM 247 N3 OMG A 34 12.658 -8.239 -5.034 1.00 0.00 N HETATM 248 C4 OMG A 34 12.274 -7.363 -4.065 1.00 0.00 C HETATM 0 HN22 OMG A 34 12.994 -9.582 -7.159 1.00 0.00 H new HETATM 0 HN21 OMG A 34 11.677 -8.837 -8.072 1.00 0.00 H new HETATM 0 HM23 OMG A 34 15.522 -6.976 -3.579 0.79 23.06 H new HETATM 0 HM22 OMG A 34 16.202 -5.892 -2.342 0.79 23.06 H new HETATM 0 HM21 OMG A 34 17.251 -7.068 -3.169 0.79 23.06 H new HETATM 0 H5'' OMG A 34 11.813 -8.846 0.708 0.79 30.14 H new HETATM 0 HN1 OMG A 34 10.413 -7.207 -7.212 1.00 0.00 H new HETATM 0 H8 OMG A 34 12.344 -5.888 -1.197 1.00 0.00 H new HETATM 0 H5' OMG A 34 12.757 -9.916 1.725 0.79 30.14 H new HETATM 0 H4' OMG A 34 14.298 -10.430 -0.223 0.79 28.23 H new HETATM 0 H3' OMG A 34 14.051 -7.791 0.943 0.79 29.46 H new HETATM 0 H2' OMG A 34 14.499 -6.599 -1.077 0.79 26.04 H new HETATM 0 H1' OMG A 34 14.232 -8.744 -3.029 0.79 24.20 H new ATOM 262 P A A 35 16.509 -8.048 1.827 1.00 42.69 P ATOM 263 OP1 A A 35 17.944 -8.410 1.819 1.00 40.46 O ATOM 264 OP2 A A 35 15.682 -8.362 3.013 1.00 32.74 O ATOM 265 O5' A A 35 16.380 -6.458 1.538 1.00 29.05 O ATOM 266 C5' A A 35 17.219 -5.801 0.607 1.00 32.39 C ATOM 267 C4' A A 35 16.703 -4.396 0.245 1.00 31.49 C ATOM 268 O4' A A 35 17.282 -3.982 -0.982 1.00 32.06 O ATOM 269 C3' A A 35 15.179 -4.236 0.076 1.00 31.01 C ATOM 270 O3' A A 35 14.846 -3.072 0.827 1.00 32.13 O ATOM 271 C2' A A 35 14.988 -4.044 -1.443 1.00 31.04 C ATOM 272 O2' A A 35 13.820 -3.322 -1.765 1.00 33.84 O ATOM 273 C1' A A 35 16.291 -3.356 -1.780 1.00 30.29 C ATOM 274 N9 A A 35 16.702 -3.267 -3.206 1.00 28.33 N ATOM 275 C8 A A 35 17.970 -3.409 -3.726 1.00 30.43 C ATOM 276 N7 A A 35 18.067 -3.143 -4.997 1.00 29.55 N ATOM 277 C5 A A 35 16.785 -2.747 -5.351 1.00 26.03 C ATOM 278 C6 A A 35 16.229 -2.271 -6.561 1.00 29.14 C ATOM 279 N6 A A 35 16.934 -2.174 -7.697 1.00 30.66 N ATOM 280 N1 A A 35 14.941 -1.869 -6.559 1.00 29.22 N ATOM 281 C2 A A 35 14.245 -1.939 -5.425 1.00 28.74 C ATOM 282 N3 A A 35 14.651 -2.372 -4.234 1.00 24.86 N ATOM 283 C4 A A 35 15.951 -2.778 -4.258 1.00 25.40 C ATOM 0 H5' A A 35 17.294 -6.403 -0.299 1.00 32.39 H new ATOM 0 H5'' A A 35 18.224 -5.721 1.021 1.00 32.39 H new ATOM 0 H4' A A 35 16.989 -3.794 1.107 1.00 31.49 H new ATOM 0 H3' A A 35 14.556 -5.062 0.419 1.00 31.01 H new ATOM 0 H2' A A 35 14.818 -4.954 -2.019 1.00 31.04 H new ATOM 0 HO2' A A 35 13.863 -3.031 -2.700 1.00 33.84 H new ATOM 0 H1' A A 35 16.148 -2.298 -1.561 1.00 30.29 H new ATOM 0 H8 A A 35 18.815 -3.716 -3.128 1.00 30.43 H new ATOM 0 H61 A A 35 16.489 -1.824 -8.545 1.00 30.66 H new ATOM 0 H62 A A 35 17.916 -2.450 -7.713 1.00 30.66 H new ATOM 0 H2 A A 35 13.221 -1.601 -5.479 1.00 28.74 H new ATOM 295 P A A 36 13.337 -2.650 1.239 1.00 32.39 P ATOM 296 OP1 A A 36 13.385 -2.035 2.584 1.00 27.38 O ATOM 297 OP2 A A 36 12.434 -3.797 0.988 1.00 26.17 O ATOM 298 O5' A A 36 12.976 -1.491 0.173 1.00 29.40 O ATOM 299 C5' A A 36 13.791 -0.343 0.017 1.00 29.36 C ATOM 300 C4' A A 36 13.179 0.651 -0.979 1.00 29.96 C ATOM 301 O4' A A 36 12.843 -0.010 -2.194 1.00 26.55 O ATOM 302 C3' A A 36 11.913 1.338 -0.470 1.00 31.22 C ATOM 303 O3' A A 36 11.892 2.664 -0.998 1.00 34.74 O ATOM 304 C2' A A 36 10.846 0.411 -1.059 1.00 28.02 C ATOM 305 O2' A A 36 9.538 0.928 -1.105 1.00 31.89 O ATOM 306 C1' A A 36 11.465 0.213 -2.441 1.00 27.57 C ATOM 307 N9 A A 36 10.845 -0.864 -3.251 1.00 28.30 N ATOM 308 C8 A A 36 10.469 -2.140 -2.900 1.00 28.20 C ATOM 309 N7 A A 36 9.912 -2.818 -3.867 1.00 30.17 N ATOM 310 C5 A A 36 9.934 -1.942 -4.947 1.00 28.26 C ATOM 311 C6 A A 36 9.505 -2.045 -6.292 1.00 32.35 C ATOM 312 N6 A A 36 8.915 -3.134 -6.800 1.00 31.13 N ATOM 313 N1 A A 36 9.714 -0.994 -7.112 1.00 31.00 N ATOM 314 C2 A A 36 10.302 0.097 -6.626 1.00 27.16 C ATOM 315 N3 A A 36 10.731 0.324 -5.388 1.00 28.43 N ATOM 316 C4 A A 36 10.515 -0.752 -4.582 1.00 27.49 C ATOM 0 H5' A A 36 14.781 -0.642 -0.328 1.00 29.36 H new ATOM 0 H5'' A A 36 13.924 0.144 0.983 1.00 29.36 H new ATOM 0 H4' A A 36 13.945 1.413 -1.127 1.00 29.96 H new ATOM 0 H3' A A 36 11.797 1.463 0.607 1.00 31.22 H new ATOM 0 H2' A A 36 10.662 -0.487 -0.470 1.00 28.02 H new ATOM 0 HO2' A A 36 9.573 1.907 -1.106 1.00 31.89 H new ATOM 0 H1' A A 36 11.292 1.092 -3.062 1.00 27.57 H new ATOM 0 H8 A A 36 10.621 -2.546 -1.911 1.00 28.20 H new ATOM 0 H61 A A 36 8.627 -3.149 -7.779 1.00 31.13 H new ATOM 0 H62 A A 36 8.753 -3.949 -6.209 1.00 31.13 H new ATOM 0 H2 A A 36 10.450 0.903 -7.329 1.00 27.16 H new HETATM 328 P 1MG A 37 11.008 3.856 -0.351 1.00 45.47 P HETATM 329 OP1 1MG A 37 11.616 5.146 -0.750 1.00 43.57 O HETATM 330 OP2 1MG A 37 10.795 3.562 1.084 1.00 39.46 O HETATM 331 O5' 1MG A 37 9.600 3.708 -1.113 1.00 34.35 O HETATM 332 C5' 1MG A 37 9.388 4.219 -2.415 1.00 32.52 C HETATM 333 C4' 1MG A 37 8.597 3.194 -3.237 1.00 36.00 C HETATM 334 O4' 1MG A 37 7.522 2.662 -2.484 1.00 37.29 O HETATM 335 C3' 1MG A 37 7.974 3.849 -4.469 1.00 36.71 C HETATM 336 O3' 1MG A 37 7.771 2.847 -5.451 1.00 40.56 O HETATM 337 C2' 1MG A 37 6.669 4.397 -3.874 1.00 35.84 C HETATM 338 O2' 1MG A 37 5.588 4.459 -4.781 1.00 32.99 O HETATM 339 C1' 1MG A 37 6.354 3.412 -2.749 1.00 35.07 C HETATM 340 N9 1MG A 37 5.827 4.090 -1.547 1.00 0.00 N HETATM 341 C8 1MG A 37 6.486 4.505 -0.417 1.00 0.00 C HETATM 342 N7 1MG A 37 5.710 5.037 0.484 1.00 0.00 N HETATM 343 C5 1MG A 37 4.441 4.970 -0.081 1.00 0.00 C HETATM 344 C6 1MG A 37 3.180 5.385 0.447 1.00 0.00 C HETATM 345 O6 1MG A 37 2.984 5.920 1.537 1.00 0.00 O HETATM 346 N1 1MG A 37 2.117 5.114 -0.436 1.00 0.00 N HETATM 347 CM1 1MG A 37 0.753 5.468 -0.018 1.00 0.00 C HETATM 348 C2 1MG A 37 2.282 4.542 -1.698 1.00 0.00 C HETATM 349 N2 1MG A 37 1.217 4.402 -2.499 1.00 0.00 N HETATM 350 N3 1MG A 37 3.475 4.164 -2.183 1.00 0.00 N HETATM 351 C4 1MG A 37 4.505 4.394 -1.327 1.00 0.00 C HETATM 0 HO2' 1MG A 37 5.924 4.676 -5.676 1.00 32.99 H new HETATM 0 HN22 1MG A 37 1.326 3.985 -3.424 1.00 0.00 H new HETATM 0 HN21 1MG A 37 0.298 4.712 -2.184 1.00 0.00 H new HETATM 0 HM13 1MG A 37 0.501 4.929 0.895 1.00 0.00 H new HETATM 0 HM12 1MG A 37 0.696 6.541 0.166 1.00 0.00 H new HETATM 0 HM11 1MG A 37 0.049 5.197 -0.805 1.00 0.00 H new HETATM 0 H5'' 1MG A 37 8.842 5.161 -2.364 1.00 32.52 H new HETATM 0 H8 1MG A 37 7.563 4.399 -0.285 1.00 0.00 H new HETATM 0 H5' 1MG A 37 10.343 4.429 -2.896 1.00 32.52 H new HETATM 0 H4' 1MG A 37 9.302 2.413 -3.520 1.00 36.00 H new HETATM 0 H3' 1MG A 37 8.557 4.624 -4.968 1.00 36.71 H new HETATM 0 H2' 1MG A 37 6.800 5.432 -3.557 1.00 35.84 H new HETATM 0 H1' 1MG A 37 5.557 2.737 -3.061 1.00 35.07 H new ATOM 365 P A A 38 7.634 3.220 -7.016 1.00 42.64 P ATOM 366 OP1 A A 38 8.833 2.729 -7.729 1.00 37.89 O ATOM 367 OP2 A A 38 7.269 4.649 -7.135 1.00 39.37 O ATOM 368 O5' A A 38 6.325 2.361 -7.472 1.00 32.99 O ATOM 369 C5' A A 38 6.424 1.265 -8.387 1.00 30.76 C ATOM 370 C4' A A 38 5.998 -0.082 -7.786 1.00 33.37 C ATOM 371 O4' A A 38 6.272 -0.169 -6.407 1.00 32.03 O ATOM 372 C3' A A 38 4.506 -0.380 -7.924 1.00 33.48 C ATOM 373 O3' A A 38 4.242 -0.893 -9.221 1.00 33.69 O ATOM 374 C2' A A 38 4.279 -1.401 -6.802 1.00 31.61 C ATOM 375 O2' A A 38 4.212 -2.730 -7.279 1.00 33.00 O ATOM 376 C1' A A 38 5.522 -1.263 -5.914 1.00 30.13 C ATOM 377 N9 A A 38 5.131 -1.052 -4.512 1.00 27.03 N ATOM 378 C8 A A 38 5.017 0.133 -3.856 1.00 26.03 C ATOM 379 N7 A A 38 4.633 0.038 -2.614 1.00 24.70 N ATOM 380 C5 A A 38 4.450 -1.331 -2.449 1.00 26.51 C ATOM 381 C6 A A 38 4.032 -2.121 -1.366 1.00 27.76 C ATOM 382 N6 A A 38 3.724 -1.615 -0.158 1.00 30.99 N ATOM 383 N1 A A 38 3.960 -3.504 -1.519 1.00 28.54 N ATOM 384 C2 A A 38 4.237 -4.057 -2.765 1.00 30.31 C ATOM 385 N3 A A 38 4.643 -3.341 -3.831 1.00 30.93 N ATOM 386 C4 A A 38 4.740 -2.004 -3.609 1.00 27.66 C ATOM 0 H5' A A 38 7.453 1.187 -8.737 1.00 30.76 H new ATOM 0 H5'' A A 38 5.806 1.475 -9.260 1.00 30.76 H new ATOM 0 H4' A A 38 6.582 -0.800 -8.361 1.00 33.37 H new ATOM 0 H3' A A 38 3.842 0.479 -7.829 1.00 33.48 H new ATOM 0 H2' A A 38 3.334 -1.210 -6.294 1.00 31.61 H new ATOM 0 HO2' A A 38 3.472 -2.812 -7.916 1.00 33.00 H new ATOM 0 H1' A A 38 6.123 -2.172 -5.943 1.00 30.13 H new ATOM 0 H8 A A 38 5.228 1.081 -4.328 1.00 26.03 H new ATOM 0 H61 A A 38 3.425 -2.236 0.594 1.00 30.99 H new ATOM 0 H62 A A 38 3.789 -0.610 0.006 1.00 30.99 H new ATOM 0 H2 A A 38 4.120 -5.124 -2.885 1.00 30.31 H new ATOM 399 P U A 39 2.757 -0.997 -9.858 1.00 32.28 P ATOM 400 OP1 U A 39 2.890 -1.613 -11.197 1.00 37.67 O ATOM 401 OP2 U A 39 2.111 0.328 -9.727 1.00 32.24 O ATOM 402 O5' U A 39 1.979 -2.054 -8.911 1.00 32.59 O ATOM 403 C5' U A 39 0.792 -1.704 -8.227 1.00 33.91 C ATOM 404 C4' U A 39 0.393 -2.815 -7.250 1.00 34.51 C ATOM 405 O4' U A 39 1.251 -2.796 -6.123 1.00 34.97 O ATOM 406 C3' U A 39 -1.029 -2.597 -6.733 1.00 33.21 C ATOM 407 O3' U A 39 -1.972 -3.202 -7.613 1.00 34.14 O ATOM 408 C2' U A 39 -0.957 -3.257 -5.361 1.00 32.27 C ATOM 409 O2' U A 39 -1.303 -4.625 -5.450 1.00 33.25 O ATOM 410 C1' U A 39 0.520 -3.129 -4.955 1.00 29.21 C ATOM 411 N1 U A 39 0.714 -2.082 -3.895 1.00 0.00 N ATOM 412 C2 U A 39 0.390 -2.483 -2.595 1.00 0.00 C ATOM 413 O2 U A 39 -0.070 -3.594 -2.335 1.00 0.00 O ATOM 414 N3 U A 39 0.605 -1.559 -1.583 1.00 0.00 N ATOM 415 C4 U A 39 1.077 -0.265 -1.739 1.00 0.00 C ATOM 416 O4 U A 39 1.225 0.463 -0.760 1.00 0.00 O ATOM 417 C5 U A 39 1.354 0.096 -3.116 1.00 0.00 C ATOM 418 C6 U A 39 1.173 -0.785 -4.132 1.00 0.00 C ATOM 0 H5' U A 39 -0.012 -1.535 -8.943 1.00 33.91 H new ATOM 0 H5'' U A 39 0.939 -0.770 -7.685 1.00 33.91 H new ATOM 0 H4' U A 39 0.462 -3.763 -7.784 1.00 34.51 H new ATOM 0 H3' U A 39 -1.356 -1.559 -6.675 1.00 33.21 H new ATOM 0 H2' U A 39 -1.640 -2.796 -4.647 1.00 32.27 H new ATOM 0 HO2' U A 39 -2.140 -4.783 -4.966 1.00 33.25 H new ATOM 0 H1' U A 39 0.871 -4.070 -4.531 1.00 29.21 H new ATOM 0 H3 U A 39 0.395 -1.861 -0.632 1.00 0.00 H new ATOM 0 H5 U A 39 1.713 1.090 -3.338 1.00 0.00 H new ATOM 0 H6 U A 39 1.388 -0.477 -5.144 1.00 0.00 H new HETATM 429 P 5MC A 40 -3.562 -2.880 -7.577 1.00 34.43 P HETATM 430 OP1 5MC A 40 -4.167 -3.480 -8.788 1.00 30.68 O HETATM 431 OP2 5MC A 40 -3.727 -1.431 -7.328 1.00 28.93 O HETATM 432 O5' 5MC A 40 -4.146 -3.667 -6.291 1.00 28.81 O HETATM 433 C5' 5MC A 40 -4.509 -5.036 -6.316 1.00 28.35 C HETATM 434 C4' 5MC A 40 -4.959 -5.493 -4.919 1.00 29.61 C HETATM 435 O4' 5MC A 40 -3.941 -5.258 -3.959 1.00 29.56 O HETATM 436 C3' 5MC A 40 -6.208 -4.786 -4.385 1.00 31.68 C HETATM 437 O3' 5MC A 40 -7.411 -5.350 -4.890 1.00 35.29 O HETATM 438 C2' 5MC A 40 -6.046 -5.046 -2.890 1.00 27.14 C HETATM 439 O2' 5MC A 40 -6.487 -6.344 -2.546 1.00 23.50 O HETATM 440 C1' 5MC A 40 -4.533 -4.967 -2.699 1.00 25.42 C HETATM 441 N1 5MC A 40 -4.142 -3.616 -2.204 1.00 19.88 N HETATM 442 C2 5MC A 40 -4.095 -3.396 -0.825 1.00 20.27 C HETATM 443 O2 5MC A 40 -4.509 -4.242 -0.035 1.00 20.75 O HETATM 444 N3 5MC A 40 -3.574 -2.218 -0.375 1.00 20.93 N HETATM 445 C4 5MC A 40 -3.109 -1.283 -1.222 1.00 18.76 C HETATM 446 N4 5MC A 40 -2.591 -0.156 -0.722 1.00 17.83 N HETATM 447 C5 5MC A 40 -3.260 -1.446 -2.643 1.00 18.58 C HETATM 448 C6 5MC A 40 -3.789 -2.614 -3.074 1.00 19.25 C HETATM 449 CM5 5MC A 40 -2.786 -0.391 -3.623 1.00 21.21 C HETATM 0 HO2' 5MC A 40 -7.031 -6.708 -3.275 1.00 23.50 H new HETATM 0 HN42 5MC A 40 -2.234 0.564 -1.350 1.00 17.83 H new HETATM 0 HN41 5MC A 40 -2.553 -0.016 0.288 1.00 17.83 H new HETATM 0 HM53 5MC A 40 -3.306 0.547 -3.427 1.00 21.21 H new HETATM 0 HM52 5MC A 40 -1.713 -0.242 -3.506 1.00 21.21 H new HETATM 0 HM51 5MC A 40 -2.998 -0.718 -4.641 1.00 21.21 H new HETATM 0 H5'' 5MC A 40 -5.314 -5.193 -7.034 1.00 28.35 H new HETATM 0 H6 5MC A 40 -3.939 -2.764 -4.143 1.00 19.25 H new HETATM 0 H5' 5MC A 40 -3.663 -5.638 -6.648 1.00 28.35 H new HETATM 0 H4' 5MC A 40 -5.182 -6.552 -5.052 1.00 29.61 H new HETATM 0 H3' 5MC A 40 -6.285 -3.736 -4.666 1.00 31.68 H new HETATM 0 H2' 5MC A 40 -6.619 -4.349 -2.278 1.00 27.14 H new HETATM 0 H1' 5MC A 40 -4.189 -5.682 -1.952 1.00 25.42 H new ATOM 463 P U A 41 -8.831 -4.568 -4.843 1.00 35.32 P ATOM 464 OP1 U A 41 -9.878 -5.503 -5.315 1.00 26.86 O ATOM 465 OP2 U A 41 -8.650 -3.273 -5.537 1.00 33.21 O ATOM 466 O5' U A 41 -9.116 -4.245 -3.284 1.00 26.80 O ATOM 467 C5' U A 41 -9.649 -5.194 -2.378 1.00 27.18 C ATOM 468 C4' U A 41 -9.673 -4.588 -0.967 1.00 23.05 C ATOM 469 O4' U A 41 -8.399 -4.077 -0.618 1.00 20.17 O ATOM 470 C3' U A 41 -10.654 -3.425 -0.824 1.00 24.93 C ATOM 471 O3' U A 41 -11.970 -3.909 -0.588 1.00 27.91 O ATOM 472 C2' U A 41 -10.057 -2.697 0.378 1.00 27.05 C ATOM 473 O2' U A 41 -10.486 -3.301 1.580 1.00 26.81 O ATOM 474 C1' U A 41 -8.550 -2.933 0.209 1.00 23.28 C ATOM 475 N1 U A 41 -7.848 -1.737 -0.344 1.00 24.30 N ATOM 476 C2 U A 41 -7.504 -0.733 0.560 1.00 28.89 C ATOM 477 O2 U A 41 -7.870 -0.736 1.734 1.00 29.05 O ATOM 478 N3 U A 41 -6.701 0.288 0.067 1.00 24.96 N ATOM 479 C4 U A 41 -6.188 0.387 -1.217 1.00 22.40 C ATOM 480 O4 U A 41 -5.419 1.301 -1.507 1.00 24.28 O ATOM 481 C5 U A 41 -6.668 -0.644 -2.116 1.00 22.17 C ATOM 482 C6 U A 41 -7.463 -1.645 -1.665 1.00 23.91 C ATOM 0 H5' U A 41 -9.045 -6.102 -2.387 1.00 27.18 H new ATOM 0 H5'' U A 41 -10.656 -5.478 -2.682 1.00 27.18 H new ATOM 0 H4' U A 41 -9.980 -5.406 -0.316 1.00 23.05 H new ATOM 0 H3' U A 41 -10.764 -2.788 -1.701 1.00 24.93 H new ATOM 0 H2' U A 41 -10.342 -1.646 0.424 1.00 27.05 H new ATOM 0 HO2' U A 41 -11.267 -3.865 1.402 1.00 26.81 H new ATOM 0 H1' U A 41 -8.083 -3.105 1.179 1.00 23.28 H new ATOM 0 H3 U A 41 -6.465 1.040 0.715 1.00 24.96 H new ATOM 0 H5 U A 41 -6.389 -0.614 -3.159 1.00 22.17 H new ATOM 0 H6 U A 41 -7.806 -2.395 -2.363 1.00 23.91 H new ATOM 493 P G A 42 -13.298 -3.036 -0.897 1.00 31.63 P ATOM 494 OP1 G A 42 -14.473 -3.899 -0.642 1.00 28.12 O ATOM 495 OP2 G A 42 -13.133 -2.409 -2.227 1.00 22.68 O ATOM 496 O5' G A 42 -13.294 -1.857 0.206 1.00 19.53 O ATOM 497 C5' G A 42 -13.852 -2.018 1.499 1.00 19.97 C ATOM 498 C4' G A 42 -13.684 -0.709 2.275 1.00 22.10 C ATOM 499 O4' G A 42 -12.327 -0.312 2.259 1.00 26.60 O ATOM 500 C3' G A 42 -14.471 0.450 1.662 1.00 19.91 C ATOM 501 O3' G A 42 -15.817 0.448 2.111 1.00 20.68 O ATOM 502 C2' G A 42 -13.687 1.652 2.179 1.00 21.26 C ATOM 503 O2' G A 42 -14.151 2.027 3.459 1.00 21.51 O ATOM 504 C1' G A 42 -12.262 1.102 2.299 1.00 23.91 C ATOM 505 N9 G A 42 -11.386 1.598 1.213 1.00 18.48 N ATOM 506 C8 G A 42 -11.070 1.030 0.004 1.00 18.18 C ATOM 507 N7 G A 42 -10.133 1.658 -0.651 1.00 18.52 N ATOM 508 C5 G A 42 -9.831 2.746 0.160 1.00 16.12 C ATOM 509 C6 G A 42 -8.884 3.800 -0.020 1.00 16.98 C ATOM 510 O6 G A 42 -8.044 3.922 -0.909 1.00 18.24 O ATOM 511 N1 G A 42 -8.990 4.778 0.969 1.00 16.87 N ATOM 512 C2 G A 42 -9.833 4.694 2.067 1.00 17.61 C ATOM 513 N2 G A 42 -9.773 5.684 2.964 1.00 17.39 N ATOM 514 N3 G A 42 -10.675 3.670 2.269 1.00 18.80 N ATOM 515 C4 G A 42 -10.635 2.743 1.276 1.00 17.14 C ATOM 0 H5' G A 42 -13.357 -2.835 2.025 1.00 19.97 H new ATOM 0 H5'' G A 42 -14.907 -2.280 1.425 1.00 19.97 H new ATOM 0 H4' G A 42 -14.051 -0.910 3.281 1.00 22.10 H new ATOM 0 H3' G A 42 -14.553 0.421 0.576 1.00 19.91 H new ATOM 0 H2' G A 42 -13.774 2.528 1.537 1.00 21.26 H new ATOM 0 HO2' G A 42 -15.037 1.637 3.613 1.00 21.51 H new ATOM 0 H1' G A 42 -11.831 1.443 3.240 1.00 23.91 H new ATOM 0 H8 G A 42 -11.555 0.141 -0.372 1.00 18.18 H new ATOM 0 H1 G A 42 -8.408 5.611 0.879 1.00 16.87 H new ATOM 0 H21 G A 42 -10.375 5.664 3.787 1.00 17.39 H new ATOM 0 H22 G A 42 -9.125 6.460 2.825 1.00 17.39 H new ATOM 527 P G A 43 -17.003 1.172 1.286 1.00 25.50 P ATOM 528 OP1 G A 43 -18.240 1.069 2.093 1.00 18.73 O ATOM 529 OP2 G A 43 -16.988 0.635 -0.093 1.00 18.55 O ATOM 530 O5' G A 43 -16.566 2.726 1.214 1.00 23.39 O ATOM 531 C5' G A 43 -17.069 3.702 2.109 1.00 22.77 C ATOM 532 C4' G A 43 -16.606 5.096 1.672 1.00 21.17 C ATOM 533 O4' G A 43 -15.202 5.226 1.743 1.00 22.41 O ATOM 534 C3' G A 43 -16.913 5.407 0.211 1.00 19.66 C ATOM 535 O3' G A 43 -18.279 5.667 -0.036 1.00 20.78 O ATOM 536 C2' G A 43 -16.013 6.603 -0.043 1.00 18.90 C ATOM 537 O2' G A 43 -16.629 7.800 0.391 1.00 23.35 O ATOM 538 C1' G A 43 -14.815 6.261 0.851 1.00 17.39 C ATOM 539 N9 G A 43 -13.657 5.821 0.041 1.00 14.19 N ATOM 540 C8 G A 43 -13.449 4.608 -0.565 1.00 14.07 C ATOM 541 N7 G A 43 -12.343 4.536 -1.251 1.00 14.63 N ATOM 542 C5 G A 43 -11.776 5.796 -1.102 1.00 13.86 C ATOM 543 C6 G A 43 -10.579 6.334 -1.667 1.00 17.13 C ATOM 544 O6 G A 43 -9.784 5.768 -2.412 1.00 19.62 O ATOM 545 N1 G A 43 -10.362 7.664 -1.298 1.00 12.99 N ATOM 546 C2 G A 43 -11.231 8.401 -0.505 1.00 12.94 C ATOM 547 N2 G A 43 -10.924 9.688 -0.300 1.00 14.10 N ATOM 548 N3 G A 43 -12.365 7.896 0.014 1.00 14.82 N ATOM 549 C4 G A 43 -12.577 6.593 -0.318 1.00 12.94 C ATOM 0 H5' G A 43 -16.721 3.494 3.121 1.00 22.77 H new ATOM 0 H5'' G A 43 -18.158 3.661 2.131 1.00 22.77 H new ATOM 0 H4' G A 43 -17.140 5.763 2.349 1.00 21.17 H new ATOM 0 H3' G A 43 -16.724 4.570 -0.461 1.00 19.66 H new ATOM 0 H2' G A 43 -15.768 6.766 -1.092 1.00 18.90 H new ATOM 0 HO2' G A 43 -17.598 7.665 0.454 1.00 23.35 H new ATOM 0 HO3' G A 43 -18.408 5.860 -0.988 1.00 20.78 H new ATOM 0 H1' G A 43 -14.515 7.149 1.407 1.00 17.39 H new ATOM 0 H8 G A 43 -14.142 3.784 -0.481 1.00 14.07 H new ATOM 0 H1 G A 43 -9.513 8.121 -1.632 1.00 12.99 H new ATOM 0 H21 G A 43 -11.531 10.272 0.276 1.00 14.10 H new ATOM 0 H22 G A 43 -10.083 10.085 -0.719 1.00 14.10 H new TER 562 G A 43