USER MOD reduce.3.24.130724 H: found=0, std=0, add=163, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 163 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 1 G O2' : rot -29:sc= 0.104 USER MOD Single : A 1 G O5' : rot 180:sc= -0.159 USER MOD Single : A 2 A O2' : rot -11:sc= -0.705 USER MOD Single : A 3 G O2' : rot -17:sc= 0.0685 USER MOD Single : A 4 A O2' : rot 180:sc= -2.19! USER MOD Single : A 5 G O2' : rot -22:sc= 0.0612 USER MOD Single : A 6 U O2' : rot -160:sc= -4.13! USER MOD Single : A 7 U O2' : rot 180:sc= -0.909! USER MOD Single : A 8 G O2' : rot 15:sc= 0.225 USER MOD Single : A 9 G O2' : rot 180:sc= -0.905 USER MOD Single : A 10 G O2' : rot 135:sc= -2.9! USER MOD Single : A 11 C O2' : rot -138:sc= 1.04 USER MOD Single : A 12 U O2' : rot 6:sc= -3.66! USER MOD Single : A 13 C O2' : rot 180:sc= -0.811 USER MOD Single : A 14 U O2' : rot -15:sc= 0.0839 USER MOD Single : A 15 C O2' : rot -16:sc= 0.114 USER MOD Single : A 15 C O3' : rot 180:sc= 0.139 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 -3.545 -9.288 -7.434 1.00 0.00 O ATOM 2 C5' G A 1 -3.576 -10.696 -7.179 1.00 0.00 C ATOM 3 C4' G A 1 -4.383 -11.008 -5.939 1.00 0.00 C ATOM 4 O4' G A 1 -3.518 -11.669 -4.977 1.00 0.00 O ATOM 5 C3' G A 1 -4.936 -9.799 -5.198 1.00 0.00 C ATOM 6 O3' G A 1 -6.205 -9.414 -5.718 1.00 0.00 O ATOM 7 C2' G A 1 -5.025 -10.296 -3.759 1.00 0.00 C ATOM 8 O2' G A 1 -6.176 -11.094 -3.562 1.00 0.00 O ATOM 9 C1' G A 1 -3.792 -11.193 -3.672 1.00 0.00 C ATOM 10 N9 G A 1 -2.594 -10.524 -3.174 1.00 0.00 N ATOM 11 C8 G A 1 -2.103 -9.294 -3.543 1.00 0.00 C ATOM 12 N7 G A 1 -0.973 -8.996 -2.961 1.00 0.00 N ATOM 13 C5 G A 1 -0.720 -10.081 -2.131 1.00 0.00 C ATOM 14 C6 G A 1 0.357 -10.328 -1.240 1.00 0.00 C ATOM 15 O6 G A 1 1.343 -9.621 -1.004 1.00 0.00 O ATOM 16 N1 G A 1 0.211 -11.547 -0.589 1.00 0.00 N ATOM 17 C2 G A 1 -0.832 -12.417 -0.772 1.00 0.00 C ATOM 18 N2 G A 1 -0.795 -13.535 -0.049 1.00 0.00 N ATOM 19 N3 G A 1 -1.837 -12.204 -1.601 1.00 0.00 N ATOM 20 C4 G A 1 -1.718 -11.025 -2.243 1.00 0.00 C ATOM 0 H5' G A 1 -2.559 -11.069 -7.058 1.00 0.00 H new ATOM 0 H5'' G A 1 -4.006 -11.214 -8.036 1.00 0.00 H new ATOM 0 H4' G A 1 -5.221 -11.605 -6.299 1.00 0.00 H new ATOM 0 H3' G A 1 -4.320 -8.905 -5.294 1.00 0.00 H new ATOM 0 H2' G A 1 -5.076 -9.489 -3.028 1.00 0.00 H new ATOM 0 HO2' G A 1 -6.884 -10.804 -4.175 1.00 0.00 H new ATOM 0 HO5' G A 1 -3.016 -9.113 -8.240 1.00 0.00 H new ATOM 0 H1' G A 1 -4.023 -11.985 -2.960 1.00 0.00 H new ATOM 0 H8 G A 1 -2.602 -8.640 -4.243 1.00 0.00 H new ATOM 0 H1 G A 1 0.936 -11.815 0.076 1.00 0.00 H new ATOM 0 H21 G A 1 -1.541 -14.225 -0.138 1.00 0.00 H new ATOM 0 H22 G A 1 -0.020 -13.701 0.594 1.00 0.00 H new ATOM 33 P A A 2 -6.720 -7.902 -5.529 1.00 0.00 P ATOM 34 OP1 A A 2 -8.064 -7.815 -6.154 1.00 0.00 O ATOM 35 OP2 A A 2 -5.641 -6.984 -5.977 1.00 0.00 O ATOM 36 O5' A A 2 -6.898 -7.751 -3.953 1.00 0.00 O ATOM 37 C5' A A 2 -5.836 -7.268 -3.138 1.00 0.00 C ATOM 38 C4' A A 2 -5.941 -7.851 -1.749 1.00 0.00 C ATOM 39 O4' A A 2 -4.862 -8.807 -1.544 1.00 0.00 O ATOM 40 C3' A A 2 -5.779 -6.837 -0.629 1.00 0.00 C ATOM 41 O3' A A 2 -7.027 -6.233 -0.299 1.00 0.00 O ATOM 42 C2' A A 2 -5.211 -7.684 0.502 1.00 0.00 C ATOM 43 O2' A A 2 -6.210 -8.478 1.114 1.00 0.00 O ATOM 44 C1' A A 2 -4.270 -8.595 -0.275 1.00 0.00 C ATOM 45 N9 A A 2 -2.946 -8.012 -0.476 1.00 0.00 N ATOM 46 C8 A A 2 -2.566 -7.157 -1.475 1.00 0.00 C ATOM 47 N7 A A 2 -1.314 -6.780 -1.402 1.00 0.00 N ATOM 48 C5 A A 2 -0.835 -7.439 -0.278 1.00 0.00 C ATOM 49 C6 A A 2 0.425 -7.461 0.337 1.00 0.00 C ATOM 50 N6 A A 2 1.478 -6.773 -0.109 1.00 0.00 N ATOM 51 N1 A A 2 0.571 -8.225 1.442 1.00 0.00 N ATOM 52 C2 A A 2 -0.487 -8.912 1.892 1.00 0.00 C ATOM 53 N3 A A 2 -1.722 -8.968 1.401 1.00 0.00 N ATOM 54 C4 A A 2 -1.830 -8.202 0.302 1.00 0.00 C ATOM 0 H5' A A 2 -5.872 -6.180 -3.088 1.00 0.00 H new ATOM 0 H5'' A A 2 -4.877 -7.535 -3.581 1.00 0.00 H new ATOM 0 H4' A A 2 -6.940 -8.283 -1.703 1.00 0.00 H new ATOM 0 H3' A A 2 -5.136 -5.993 -0.879 1.00 0.00 H new ATOM 0 H2' A A 2 -4.761 -7.096 1.302 1.00 0.00 H new ATOM 0 HO2' A A 2 -7.094 -8.186 0.807 1.00 0.00 H new ATOM 0 H1' A A 2 -4.130 -9.515 0.293 1.00 0.00 H new ATOM 0 H8 A A 2 -3.237 -6.824 -2.253 1.00 0.00 H new ATOM 0 H61 A A 2 2.370 -6.830 0.383 1.00 0.00 H new ATOM 0 H62 A A 2 1.391 -6.190 -0.942 1.00 0.00 H new ATOM 0 H2 A A 2 -0.313 -9.504 2.778 1.00 0.00 H new ATOM 66 P G A 3 -7.109 -4.650 -0.020 1.00 0.00 P ATOM 67 OP1 G A 3 -8.439 -4.192 -0.494 1.00 0.00 O ATOM 68 OP2 G A 3 -5.881 -3.998 -0.545 1.00 0.00 O ATOM 69 O5' G A 3 -7.092 -4.537 1.570 1.00 0.00 O ATOM 70 C5' G A 3 -7.056 -5.703 2.393 1.00 0.00 C ATOM 71 C4' G A 3 -6.416 -5.383 3.724 1.00 0.00 C ATOM 72 O4' G A 3 -5.145 -6.090 3.816 1.00 0.00 O ATOM 73 C3' G A 3 -6.074 -3.913 3.937 1.00 0.00 C ATOM 74 O3' G A 3 -7.157 -3.210 4.540 1.00 0.00 O ATOM 75 C2' G A 3 -4.846 -3.980 4.836 1.00 0.00 C ATOM 76 O2' G A 3 -5.210 -4.245 6.178 1.00 0.00 O ATOM 77 C1' G A 3 -4.136 -5.204 4.266 1.00 0.00 C ATOM 78 N9 G A 3 -3.249 -4.916 3.145 1.00 0.00 N ATOM 79 C8 G A 3 -3.621 -4.613 1.861 1.00 0.00 C ATOM 80 N7 G A 3 -2.608 -4.431 1.060 1.00 0.00 N ATOM 81 C5 G A 3 -1.494 -4.614 1.869 1.00 0.00 C ATOM 82 C6 G A 3 -0.109 -4.539 1.564 1.00 0.00 C ATOM 83 O6 G A 3 0.428 -4.291 0.477 1.00 0.00 O ATOM 84 N1 G A 3 0.677 -4.791 2.682 1.00 0.00 N ATOM 85 C2 G A 3 0.195 -5.076 3.936 1.00 0.00 C ATOM 86 N2 G A 3 1.114 -5.289 4.887 1.00 0.00 N ATOM 87 N3 G A 3 -1.091 -5.149 4.235 1.00 0.00 N ATOM 88 C4 G A 3 -1.873 -4.909 3.162 1.00 0.00 C ATOM 0 H5' G A 3 -6.496 -6.493 1.893 1.00 0.00 H new ATOM 0 H5'' G A 3 -8.067 -6.079 2.549 1.00 0.00 H new ATOM 0 H4' G A 3 -7.155 -5.677 4.469 1.00 0.00 H new ATOM 0 H3' G A 3 -5.885 -3.368 3.012 1.00 0.00 H new ATOM 0 H2' G A 3 -4.264 -3.059 4.851 1.00 0.00 H new ATOM 0 HO2' G A 3 -6.165 -4.063 6.300 1.00 0.00 H new ATOM 0 H1' G A 3 -3.506 -5.618 5.054 1.00 0.00 H new ATOM 0 H8 G A 3 -4.650 -4.533 1.544 1.00 0.00 H new ATOM 0 H1 G A 3 1.690 -4.762 2.562 1.00 0.00 H new ATOM 0 H21 G A 3 0.821 -5.505 5.840 1.00 0.00 H new ATOM 0 H22 G A 3 2.107 -5.235 4.658 1.00 0.00 H new ATOM 100 P A A 4 -7.516 -1.722 4.049 1.00 0.00 P ATOM 101 OP1 A A 4 -8.712 -1.266 4.804 1.00 0.00 O ATOM 102 OP2 A A 4 -7.548 -1.732 2.563 1.00 0.00 O ATOM 103 O5' A A 4 -6.265 -0.855 4.523 1.00 0.00 O ATOM 104 C5' A A 4 -5.064 -0.807 3.751 1.00 0.00 C ATOM 105 C4' A A 4 -3.863 -0.880 4.663 1.00 0.00 C ATOM 106 O4' A A 4 -2.986 -1.940 4.199 1.00 0.00 O ATOM 107 C3' A A 4 -2.990 0.367 4.707 1.00 0.00 C ATOM 108 O3' A A 4 -3.473 1.293 5.680 1.00 0.00 O ATOM 109 C2' A A 4 -1.615 -0.196 5.058 1.00 0.00 C ATOM 110 O2' A A 4 -1.495 -0.451 6.444 1.00 0.00 O ATOM 111 C1' A A 4 -1.634 -1.536 4.323 1.00 0.00 C ATOM 112 N9 A A 4 -1.054 -1.498 2.982 1.00 0.00 N ATOM 113 C8 A A 4 -1.741 -1.555 1.798 1.00 0.00 C ATOM 114 N7 A A 4 -0.974 -1.513 0.737 1.00 0.00 N ATOM 115 C5 A A 4 0.309 -1.424 1.258 1.00 0.00 C ATOM 116 C6 A A 4 1.573 -1.352 0.649 1.00 0.00 C ATOM 117 N6 A A 4 1.755 -1.357 -0.672 1.00 0.00 N ATOM 118 N1 A A 4 2.655 -1.274 1.453 1.00 0.00 N ATOM 119 C2 A A 4 2.467 -1.267 2.780 1.00 0.00 C ATOM 120 N3 A A 4 1.328 -1.329 3.470 1.00 0.00 N ATOM 121 C4 A A 4 0.275 -1.409 2.641 1.00 0.00 C ATOM 0 H5' A A 4 -5.033 0.113 3.168 1.00 0.00 H new ATOM 0 H5'' A A 4 -5.044 -1.635 3.042 1.00 0.00 H new ATOM 0 H4' A A 4 -4.287 -1.032 5.656 1.00 0.00 H new ATOM 0 H3' A A 4 -2.978 0.935 3.777 1.00 0.00 H new ATOM 0 H2' A A 4 -0.802 0.480 4.794 1.00 0.00 H new ATOM 0 HO2' A A 4 -0.604 -0.812 6.634 1.00 0.00 H new ATOM 0 H1' A A 4 -1.025 -2.225 4.908 1.00 0.00 H new ATOM 0 H8 A A 4 -2.817 -1.628 1.744 1.00 0.00 H new ATOM 0 H61 A A 4 2.698 -1.302 -1.057 1.00 0.00 H new ATOM 0 H62 A A 4 0.951 -1.415 -1.297 1.00 0.00 H new ATOM 0 H2 A A 4 3.366 -1.202 3.375 1.00 0.00 H new ATOM 133 P G A 5 -3.253 2.873 5.466 1.00 0.00 P ATOM 134 OP1 G A 5 -4.168 3.597 6.385 1.00 0.00 O ATOM 135 OP2 G A 5 -3.309 3.149 4.007 1.00 0.00 O ATOM 136 O5' G A 5 -1.759 3.123 5.953 1.00 0.00 O ATOM 137 C5' G A 5 -1.256 2.497 7.131 1.00 0.00 C ATOM 138 C4' G A 5 0.253 2.531 7.130 1.00 0.00 C ATOM 139 O4' G A 5 0.752 1.496 6.236 1.00 0.00 O ATOM 140 C3' G A 5 0.870 3.818 6.600 1.00 0.00 C ATOM 141 O3' G A 5 0.974 4.811 7.619 1.00 0.00 O ATOM 142 C2' G A 5 2.228 3.342 6.102 1.00 0.00 C ATOM 143 O2' G A 5 3.119 3.119 7.178 1.00 0.00 O ATOM 144 C1' G A 5 1.851 1.995 5.492 1.00 0.00 C ATOM 145 N9 G A 5 1.461 2.070 4.087 1.00 0.00 N ATOM 146 C8 G A 5 0.198 2.275 3.584 1.00 0.00 C ATOM 147 N7 G A 5 0.152 2.245 2.282 1.00 0.00 N ATOM 148 C5 G A 5 1.468 2.035 1.897 1.00 0.00 C ATOM 149 C6 G A 5 2.037 1.927 0.606 1.00 0.00 C ATOM 150 O6 G A 5 1.472 1.967 -0.490 1.00 0.00 O ATOM 151 N1 G A 5 3.411 1.743 0.665 1.00 0.00 N ATOM 152 C2 G A 5 4.144 1.648 1.822 1.00 0.00 C ATOM 153 N2 G A 5 5.460 1.450 1.674 1.00 0.00 N ATOM 154 N3 G A 5 3.625 1.739 3.035 1.00 0.00 N ATOM 155 C4 G A 5 2.291 1.935 2.998 1.00 0.00 C ATOM 0 H5' G A 5 -1.605 1.465 7.182 1.00 0.00 H new ATOM 0 H5'' G A 5 -1.639 3.007 8.015 1.00 0.00 H new ATOM 0 H4' G A 5 0.527 2.409 8.178 1.00 0.00 H new ATOM 0 H3' G A 5 0.280 4.305 5.824 1.00 0.00 H new ATOM 0 H2' G A 5 2.722 4.048 5.435 1.00 0.00 H new ATOM 0 HO2' G A 5 2.822 3.630 7.960 1.00 0.00 H new ATOM 0 H1' G A 5 2.730 1.352 5.534 1.00 0.00 H new ATOM 0 H8 G A 5 -0.669 2.444 4.205 1.00 0.00 H new ATOM 0 H1 G A 5 3.915 1.673 -0.219 1.00 0.00 H new ATOM 0 H21 G A 5 6.059 1.371 2.496 1.00 0.00 H new ATOM 0 H22 G A 5 5.863 1.378 0.740 1.00 0.00 H new ATOM 167 P U A 6 0.016 6.107 7.578 1.00 0.00 P ATOM 168 OP1 U A 6 0.013 6.714 8.932 1.00 0.00 O ATOM 169 OP2 U A 6 -1.270 5.702 6.952 1.00 0.00 O ATOM 170 O5' U A 6 0.750 7.114 6.582 1.00 0.00 O ATOM 171 C5' U A 6 1.826 6.679 5.751 1.00 0.00 C ATOM 172 C4' U A 6 1.785 7.395 4.423 1.00 0.00 C ATOM 173 O4' U A 6 2.009 6.439 3.361 1.00 0.00 O ATOM 174 C3' U A 6 0.460 8.045 4.054 1.00 0.00 C ATOM 175 O3' U A 6 0.374 9.362 4.590 1.00 0.00 O ATOM 176 C2' U A 6 0.468 8.062 2.523 1.00 0.00 C ATOM 177 O2' U A 6 0.980 9.286 2.038 1.00 0.00 O ATOM 178 C1' U A 6 1.452 6.945 2.166 1.00 0.00 C ATOM 179 N1 U A 6 0.802 5.853 1.428 1.00 0.00 N ATOM 180 C2 U A 6 1.438 5.367 0.298 1.00 0.00 C ATOM 181 O2 U A 6 2.529 5.761 -0.076 1.00 0.00 O ATOM 182 N3 U A 6 0.746 4.397 -0.380 1.00 0.00 N ATOM 183 C4 U A 6 -0.488 3.877 -0.058 1.00 0.00 C ATOM 184 O4 U A 6 -1.005 3.040 -0.798 1.00 0.00 O ATOM 185 C5 U A 6 -1.066 4.414 1.134 1.00 0.00 C ATOM 186 C6 U A 6 -0.418 5.354 1.826 1.00 0.00 C ATOM 0 H5' U A 6 1.761 5.602 5.594 1.00 0.00 H new ATOM 0 H5'' U A 6 2.778 6.871 6.246 1.00 0.00 H new ATOM 0 H4' U A 6 2.541 8.173 4.529 1.00 0.00 H new ATOM 0 H3' U A 6 -0.400 7.509 4.456 1.00 0.00 H new ATOM 0 H2' U A 6 -0.529 7.937 2.101 1.00 0.00 H new ATOM 0 HO2' U A 6 0.697 9.414 1.109 1.00 0.00 H new ATOM 0 H1' U A 6 2.225 7.361 1.520 1.00 0.00 H new ATOM 0 H3 U A 6 1.194 4.019 -1.215 1.00 0.00 H new ATOM 0 H5 U A 6 -2.027 4.059 1.475 1.00 0.00 H new ATOM 0 H6 U A 6 -0.867 5.737 2.731 1.00 0.00 H new ATOM 197 P U A 7 -1.035 9.921 5.133 1.00 0.00 P ATOM 198 OP1 U A 7 -0.870 10.226 6.577 1.00 0.00 O ATOM 199 OP2 U A 7 -2.120 9.007 4.694 1.00 0.00 O ATOM 200 O5' U A 7 -1.194 11.298 4.345 1.00 0.00 O ATOM 201 C5' U A 7 -0.980 11.356 2.935 1.00 0.00 C ATOM 202 C4' U A 7 -0.299 12.651 2.558 1.00 0.00 C ATOM 203 O4' U A 7 0.538 13.097 3.665 1.00 0.00 O ATOM 204 C3' U A 7 0.658 12.529 1.379 1.00 0.00 C ATOM 205 O3' U A 7 0.782 13.750 0.658 1.00 0.00 O ATOM 206 C2' U A 7 1.963 12.138 2.057 1.00 0.00 C ATOM 207 O2' U A 7 3.087 12.513 1.282 1.00 0.00 O ATOM 208 C1' U A 7 1.903 13.026 3.293 1.00 0.00 C ATOM 209 N1 U A 7 2.675 12.523 4.439 1.00 0.00 N ATOM 210 C2 U A 7 3.774 13.256 4.847 1.00 0.00 C ATOM 211 O2 U A 7 4.121 14.288 4.302 1.00 0.00 O ATOM 212 N3 U A 7 4.452 12.735 5.919 1.00 0.00 N ATOM 213 C4 U A 7 4.151 11.584 6.611 1.00 0.00 C ATOM 214 O4 U A 7 4.861 11.244 7.559 1.00 0.00 O ATOM 215 C5 U A 7 3.002 10.884 6.129 1.00 0.00 C ATOM 216 C6 U A 7 2.318 11.362 5.086 1.00 0.00 C ATOM 0 H5' U A 7 -1.933 11.273 2.413 1.00 0.00 H new ATOM 0 H5'' U A 7 -0.369 10.511 2.619 1.00 0.00 H new ATOM 0 H4' U A 7 -1.111 13.333 2.304 1.00 0.00 H new ATOM 0 H3' U A 7 0.325 11.812 0.628 1.00 0.00 H new ATOM 0 H2' U A 7 2.063 11.067 2.233 1.00 0.00 H new ATOM 0 HO2' U A 7 3.908 12.249 1.747 1.00 0.00 H new ATOM 0 H1' U A 7 2.343 13.990 3.039 1.00 0.00 H new ATOM 0 H3 U A 7 5.268 13.257 6.238 1.00 0.00 H new ATOM 0 H5 U A 7 2.687 9.969 6.608 1.00 0.00 H new ATOM 0 H6 U A 7 1.453 10.817 4.738 1.00 0.00 H new ATOM 227 P G A 8 0.912 13.723 -0.945 1.00 0.00 P ATOM 228 OP1 G A 8 2.298 14.112 -1.311 1.00 0.00 O ATOM 229 OP2 G A 8 -0.234 14.495 -1.490 1.00 0.00 O ATOM 230 O5' G A 8 0.700 12.191 -1.334 1.00 0.00 O ATOM 231 C5' G A 8 1.716 11.216 -1.091 1.00 0.00 C ATOM 232 C4' G A 8 1.223 9.842 -1.488 1.00 0.00 C ATOM 233 O4' G A 8 0.132 9.479 -0.600 1.00 0.00 O ATOM 234 C3' G A 8 0.643 9.731 -2.894 1.00 0.00 C ATOM 235 O3' G A 8 0.787 8.413 -3.424 1.00 0.00 O ATOM 236 C2' G A 8 -0.820 10.106 -2.687 1.00 0.00 C ATOM 237 O2' G A 8 -1.650 9.458 -3.630 1.00 0.00 O ATOM 238 C1' G A 8 -1.094 9.512 -1.304 1.00 0.00 C ATOM 239 N9 G A 8 -2.059 10.271 -0.515 1.00 0.00 N ATOM 240 C8 G A 8 -2.088 11.630 -0.322 1.00 0.00 C ATOM 241 N7 G A 8 -3.074 12.022 0.438 1.00 0.00 N ATOM 242 C5 G A 8 -3.740 10.849 0.766 1.00 0.00 C ATOM 243 C6 G A 8 -4.892 10.638 1.568 1.00 0.00 C ATOM 244 O6 G A 8 -5.579 11.474 2.167 1.00 0.00 O ATOM 245 N1 G A 8 -5.228 9.290 1.636 1.00 0.00 N ATOM 246 C2 G A 8 -4.546 8.275 1.014 1.00 0.00 C ATOM 247 N2 G A 8 -5.029 7.040 1.197 1.00 0.00 N ATOM 248 N3 G A 8 -3.470 8.456 0.267 1.00 0.00 N ATOM 249 C4 G A 8 -3.125 9.759 0.186 1.00 0.00 C ATOM 0 H5' G A 8 1.991 11.221 -0.036 1.00 0.00 H new ATOM 0 H5'' G A 8 2.614 11.466 -1.656 1.00 0.00 H new ATOM 0 H4' G A 8 2.104 9.202 -1.435 1.00 0.00 H new ATOM 0 H3' G A 8 1.148 10.369 -3.619 1.00 0.00 H new ATOM 0 H2' G A 8 -1.009 11.175 -2.786 1.00 0.00 H new ATOM 0 HO2' G A 8 -1.152 8.731 -4.059 1.00 0.00 H new ATOM 0 H1' G A 8 -1.524 8.522 -1.454 1.00 0.00 H new ATOM 0 H8 G A 8 -1.367 12.307 -0.756 1.00 0.00 H new ATOM 0 H1 G A 8 -6.045 9.036 2.192 1.00 0.00 H new ATOM 0 H21 G A 8 -4.567 6.242 0.761 1.00 0.00 H new ATOM 0 H22 G A 8 -5.859 6.897 1.772 1.00 0.00 H new ATOM 261 P G A 9 2.139 7.999 -4.193 1.00 0.00 P ATOM 262 OP1 G A 9 3.085 7.473 -3.176 1.00 0.00 O ATOM 263 OP2 G A 9 2.553 9.130 -5.065 1.00 0.00 O ATOM 264 O5' G A 9 1.699 6.781 -5.123 1.00 0.00 O ATOM 265 C5' G A 9 2.342 6.540 -6.374 1.00 0.00 C ATOM 266 C4' G A 9 1.349 5.985 -7.370 1.00 0.00 C ATOM 267 O4' G A 9 0.500 7.073 -7.828 1.00 0.00 O ATOM 268 C3' G A 9 1.948 5.396 -8.643 1.00 0.00 C ATOM 269 O3' G A 9 1.090 4.395 -9.191 1.00 0.00 O ATOM 270 C2' G A 9 2.074 6.623 -9.541 1.00 0.00 C ATOM 271 O2' G A 9 2.017 6.280 -10.913 1.00 0.00 O ATOM 272 C1' G A 9 0.799 7.379 -9.178 1.00 0.00 C ATOM 273 N9 G A 9 0.911 8.829 -9.304 1.00 0.00 N ATOM 274 C8 G A 9 1.734 9.664 -8.590 1.00 0.00 C ATOM 275 N7 G A 9 1.613 10.918 -8.925 1.00 0.00 N ATOM 276 C5 G A 9 0.648 10.913 -9.924 1.00 0.00 C ATOM 277 C6 G A 9 0.094 11.981 -10.674 1.00 0.00 C ATOM 278 O6 G A 9 0.354 13.188 -10.605 1.00 0.00 O ATOM 279 N1 G A 9 -0.857 11.531 -11.583 1.00 0.00 N ATOM 280 C2 G A 9 -1.228 10.220 -11.748 1.00 0.00 C ATOM 281 N2 G A 9 -2.163 9.983 -12.675 1.00 0.00 N ATOM 282 N3 G A 9 -0.721 9.214 -11.058 1.00 0.00 N ATOM 283 C4 G A 9 0.204 9.630 -10.168 1.00 0.00 C ATOM 0 H5' G A 9 3.165 5.838 -6.239 1.00 0.00 H new ATOM 0 H5'' G A 9 2.772 7.466 -6.755 1.00 0.00 H new ATOM 0 H4' G A 9 0.839 5.186 -6.832 1.00 0.00 H new ATOM 0 H3' G A 9 2.900 4.885 -8.499 1.00 0.00 H new ATOM 0 H2' G A 9 3.011 7.162 -9.401 1.00 0.00 H new ATOM 0 HO2' G A 9 2.100 7.091 -11.457 1.00 0.00 H new ATOM 0 H1' G A 9 0.022 7.067 -9.875 1.00 0.00 H new ATOM 0 H8 G A 9 2.414 9.317 -7.826 1.00 0.00 H new ATOM 0 H1 G A 9 -1.313 12.228 -12.172 1.00 0.00 H new ATOM 0 H21 G A 9 -2.482 9.029 -12.846 1.00 0.00 H new ATOM 0 H22 G A 9 -2.557 10.756 -13.211 1.00 0.00 H new ATOM 295 P G A 10 1.624 3.429 -10.363 1.00 0.00 P ATOM 296 OP1 G A 10 1.009 3.887 -11.635 1.00 0.00 O ATOM 297 OP2 G A 10 1.436 2.023 -9.924 1.00 0.00 O ATOM 298 O5' G A 10 3.187 3.736 -10.438 1.00 0.00 O ATOM 299 C5' G A 10 4.153 2.684 -10.396 1.00 0.00 C ATOM 300 C4' G A 10 5.371 3.133 -9.624 1.00 0.00 C ATOM 301 O4' G A 10 4.925 3.929 -8.491 1.00 0.00 O ATOM 302 C3' G A 10 6.206 2.015 -9.008 1.00 0.00 C ATOM 303 O3' G A 10 7.565 2.411 -8.838 1.00 0.00 O ATOM 304 C2' G A 10 5.497 1.772 -7.683 1.00 0.00 C ATOM 305 O2' G A 10 6.374 1.263 -6.696 1.00 0.00 O ATOM 306 C1' G A 10 5.105 3.195 -7.294 1.00 0.00 C ATOM 307 N9 G A 10 3.871 3.249 -6.522 1.00 0.00 N ATOM 308 C8 G A 10 2.626 2.822 -6.914 1.00 0.00 C ATOM 309 N7 G A 10 1.719 2.968 -5.990 1.00 0.00 N ATOM 310 C5 G A 10 2.406 3.534 -4.925 1.00 0.00 C ATOM 311 C6 G A 10 1.951 3.921 -3.644 1.00 0.00 C ATOM 312 O6 G A 10 0.809 3.850 -3.181 1.00 0.00 O ATOM 313 N1 G A 10 2.984 4.444 -2.870 1.00 0.00 N ATOM 314 C2 G A 10 4.281 4.589 -3.285 1.00 0.00 C ATOM 315 N2 G A 10 5.126 5.120 -2.397 1.00 0.00 N ATOM 316 N3 G A 10 4.717 4.242 -4.480 1.00 0.00 N ATOM 317 C4 G A 10 3.733 3.721 -5.242 1.00 0.00 C ATOM 0 H5' G A 10 4.438 2.400 -11.409 1.00 0.00 H new ATOM 0 H5'' G A 10 3.720 1.800 -9.927 1.00 0.00 H new ATOM 0 H4' G A 10 5.986 3.658 -10.354 1.00 0.00 H new ATOM 0 H3' G A 10 6.269 1.119 -9.625 1.00 0.00 H new ATOM 0 H2' G A 10 4.682 1.052 -7.764 1.00 0.00 H new ATOM 0 HO2' G A 10 6.225 1.736 -5.851 1.00 0.00 H new ATOM 0 H1' G A 10 5.894 3.609 -6.667 1.00 0.00 H new ATOM 0 H8 G A 10 2.420 2.407 -7.890 1.00 0.00 H new ATOM 0 H1 G A 10 2.757 4.742 -1.921 1.00 0.00 H new ATOM 0 H21 G A 10 6.107 5.255 -2.644 1.00 0.00 H new ATOM 0 H22 G A 10 4.791 5.390 -1.472 1.00 0.00 H new ATOM 329 P C A 11 8.697 1.297 -8.580 1.00 0.00 P ATOM 330 OP1 C A 11 9.953 1.788 -9.203 1.00 0.00 O ATOM 331 OP2 C A 11 8.155 -0.030 -8.971 1.00 0.00 O ATOM 332 O5' C A 11 8.892 1.300 -6.998 1.00 0.00 O ATOM 333 C5' C A 11 9.449 2.428 -6.328 1.00 0.00 C ATOM 334 C4' C A 11 9.502 2.182 -4.836 1.00 0.00 C ATOM 335 O4' C A 11 8.345 2.778 -4.202 1.00 0.00 O ATOM 336 C3' C A 11 9.420 0.733 -4.380 1.00 0.00 C ATOM 337 O3' C A 11 10.666 0.053 -4.507 1.00 0.00 O ATOM 338 C2' C A 11 8.991 0.873 -2.922 1.00 0.00 C ATOM 339 O2' C A 11 10.095 1.163 -2.084 1.00 0.00 O ATOM 340 C1' C A 11 8.095 2.113 -2.976 1.00 0.00 C ATOM 341 N1 C A 11 6.658 1.802 -2.884 1.00 0.00 N ATOM 342 C2 C A 11 6.082 1.673 -1.616 1.00 0.00 C ATOM 343 O2 C A 11 6.795 1.822 -0.613 1.00 0.00 O ATOM 344 N3 C A 11 4.765 1.390 -1.514 1.00 0.00 N ATOM 345 C4 C A 11 4.031 1.232 -2.615 1.00 0.00 C ATOM 346 N4 C A 11 2.740 0.935 -2.468 1.00 0.00 N ATOM 347 C5 C A 11 4.587 1.364 -3.918 1.00 0.00 C ATOM 348 C6 C A 11 5.895 1.641 -4.007 1.00 0.00 C ATOM 0 H5' C A 11 8.850 3.315 -6.536 1.00 0.00 H new ATOM 0 H5'' C A 11 10.452 2.625 -6.706 1.00 0.00 H new ATOM 0 H4' C A 11 10.473 2.596 -4.564 1.00 0.00 H new ATOM 0 H3' C A 11 8.735 0.133 -4.979 1.00 0.00 H new ATOM 0 H2' C A 11 8.525 -0.032 -2.531 1.00 0.00 H new ATOM 0 HO2' C A 11 10.025 0.641 -1.258 1.00 0.00 H new ATOM 0 H1' C A 11 8.335 2.734 -2.113 1.00 0.00 H new ATOM 0 H41 C A 11 2.149 0.807 -3.290 1.00 0.00 H new ATOM 0 H42 C A 11 2.343 0.835 -1.534 1.00 0.00 H new ATOM 0 H5 C A 11 3.978 1.245 -4.802 1.00 0.00 H new ATOM 0 H6 C A 11 6.353 1.739 -4.980 1.00 0.00 H new ATOM 360 P U A 12 10.756 -1.516 -4.162 1.00 0.00 P ATOM 361 OP1 U A 12 12.155 -1.949 -4.409 1.00 0.00 O ATOM 362 OP2 U A 12 9.640 -2.208 -4.858 1.00 0.00 O ATOM 363 O5' U A 12 10.476 -1.588 -2.594 1.00 0.00 O ATOM 364 C5' U A 12 11.540 -1.461 -1.651 1.00 0.00 C ATOM 365 C4' U A 12 11.006 -1.566 -0.240 1.00 0.00 C ATOM 366 O4' U A 12 9.828 -0.727 -0.107 1.00 0.00 O ATOM 367 C3' U A 12 10.519 -2.944 0.184 1.00 0.00 C ATOM 368 O3' U A 12 11.598 -3.772 0.612 1.00 0.00 O ATOM 369 C2' U A 12 9.550 -2.617 1.315 1.00 0.00 C ATOM 370 O2' U A 12 10.236 -2.346 2.524 1.00 0.00 O ATOM 371 C1' U A 12 8.927 -1.311 0.819 1.00 0.00 C ATOM 372 N1 U A 12 7.627 -1.487 0.154 1.00 0.00 N ATOM 373 C2 U A 12 6.487 -1.407 0.937 1.00 0.00 C ATOM 374 O2 U A 12 6.522 -1.214 2.139 1.00 0.00 O ATOM 375 N3 U A 12 5.306 -1.561 0.256 1.00 0.00 N ATOM 376 C4 U A 12 5.151 -1.785 -1.094 1.00 0.00 C ATOM 377 O4 U A 12 4.018 -1.889 -1.564 1.00 0.00 O ATOM 378 C5 U A 12 6.374 -1.863 -1.829 1.00 0.00 C ATOM 379 C6 U A 12 7.542 -1.718 -1.199 1.00 0.00 C ATOM 0 H5' U A 12 12.043 -0.503 -1.787 1.00 0.00 H new ATOM 0 H5'' U A 12 12.284 -2.239 -1.825 1.00 0.00 H new ATOM 0 H4' U A 12 11.859 -1.283 0.377 1.00 0.00 H new ATOM 0 H3' U A 12 10.054 -3.513 -0.621 1.00 0.00 H new ATOM 0 H2' U A 12 8.853 -3.429 1.523 1.00 0.00 H new ATOM 0 HO2' U A 12 11.202 -2.333 2.357 1.00 0.00 H new ATOM 0 H1' U A 12 8.749 -0.683 1.692 1.00 0.00 H new ATOM 0 H3 U A 12 4.451 -1.503 0.809 1.00 0.00 H new ATOM 0 H5 U A 12 6.353 -2.039 -2.894 1.00 0.00 H new ATOM 0 H6 U A 12 8.454 -1.785 -1.773 1.00 0.00 H new ATOM 390 P C A 13 11.345 -5.335 0.891 1.00 0.00 P ATOM 391 OP1 C A 13 12.624 -5.914 1.377 1.00 0.00 O ATOM 392 OP2 C A 13 10.682 -5.923 -0.300 1.00 0.00 O ATOM 393 O5' C A 13 10.301 -5.353 2.096 1.00 0.00 O ATOM 394 C5' C A 13 10.679 -4.927 3.403 1.00 0.00 C ATOM 395 C4' C A 13 9.537 -5.130 4.374 1.00 0.00 C ATOM 396 O4' C A 13 8.428 -4.263 4.028 1.00 0.00 O ATOM 397 C3' C A 13 8.899 -6.508 4.373 1.00 0.00 C ATOM 398 O3' C A 13 9.683 -7.450 5.099 1.00 0.00 O ATOM 399 C2' C A 13 7.547 -6.240 5.029 1.00 0.00 C ATOM 400 O2' C A 13 7.667 -6.174 6.436 1.00 0.00 O ATOM 401 C1' C A 13 7.222 -4.838 4.504 1.00 0.00 C ATOM 402 N1 C A 13 6.232 -4.831 3.413 1.00 0.00 N ATOM 403 C2 C A 13 4.872 -4.754 3.733 1.00 0.00 C ATOM 404 O2 C A 13 4.535 -4.708 4.925 1.00 0.00 O ATOM 405 N3 C A 13 3.959 -4.732 2.736 1.00 0.00 N ATOM 406 C4 C A 13 4.358 -4.783 1.464 1.00 0.00 C ATOM 407 N4 C A 13 3.422 -4.745 0.514 1.00 0.00 N ATOM 408 C5 C A 13 5.736 -4.874 1.109 1.00 0.00 C ATOM 409 C6 C A 13 6.630 -4.894 2.106 1.00 0.00 C ATOM 0 H5' C A 13 10.964 -3.875 3.381 1.00 0.00 H new ATOM 0 H5'' C A 13 11.553 -5.487 3.737 1.00 0.00 H new ATOM 0 H4' C A 13 10.008 -4.938 5.338 1.00 0.00 H new ATOM 0 H3' C A 13 8.810 -6.953 3.382 1.00 0.00 H new ATOM 0 H2' C A 13 6.806 -7.009 4.811 1.00 0.00 H new ATOM 0 HO2' C A 13 6.787 -6.000 6.832 1.00 0.00 H new ATOM 0 H1' C A 13 6.784 -4.272 5.326 1.00 0.00 H new ATOM 0 H41 C A 13 3.691 -4.782 -0.469 1.00 0.00 H new ATOM 0 H42 C A 13 2.437 -4.679 0.771 1.00 0.00 H new ATOM 0 H5 C A 13 6.047 -4.925 0.076 1.00 0.00 H new ATOM 0 H6 C A 13 7.683 -4.961 1.874 1.00 0.00 H new ATOM 421 P U A 14 9.548 -9.018 4.774 1.00 0.00 P ATOM 422 OP1 U A 14 10.488 -9.761 5.650 1.00 0.00 O ATOM 423 OP2 U A 14 9.636 -9.179 3.299 1.00 0.00 O ATOM 424 O5' U A 14 8.059 -9.373 5.215 1.00 0.00 O ATOM 425 C5' U A 14 7.686 -9.393 6.592 1.00 0.00 C ATOM 426 C4' U A 14 6.346 -10.070 6.757 1.00 0.00 C ATOM 427 O4' U A 14 5.300 -9.145 6.361 1.00 0.00 O ATOM 428 C3' U A 14 6.127 -11.293 5.880 1.00 0.00 C ATOM 429 O3' U A 14 6.661 -12.466 6.487 1.00 0.00 O ATOM 430 C2' U A 14 4.609 -11.340 5.745 1.00 0.00 C ATOM 431 O2' U A 14 4.003 -11.908 6.889 1.00 0.00 O ATOM 432 C1' U A 14 4.263 -9.850 5.701 1.00 0.00 C ATOM 433 N1 U A 14 4.131 -9.312 4.339 1.00 0.00 N ATOM 434 C2 U A 14 2.895 -9.414 3.725 1.00 0.00 C ATOM 435 O2 U A 14 1.931 -9.940 4.254 1.00 0.00 O ATOM 436 N3 U A 14 2.830 -8.878 2.464 1.00 0.00 N ATOM 437 C4 U A 14 3.850 -8.265 1.770 1.00 0.00 C ATOM 438 O4 U A 14 3.634 -7.822 0.642 1.00 0.00 O ATOM 439 C5 U A 14 5.093 -8.206 2.469 1.00 0.00 C ATOM 440 C6 U A 14 5.195 -8.719 3.697 1.00 0.00 C ATOM 0 H5' U A 14 7.638 -8.375 6.979 1.00 0.00 H new ATOM 0 H5'' U A 14 8.442 -9.920 7.174 1.00 0.00 H new ATOM 0 H4' U A 14 6.321 -10.377 7.803 1.00 0.00 H new ATOM 0 H3' U A 14 6.630 -11.240 4.915 1.00 0.00 H new ATOM 0 H2' U A 14 4.275 -11.931 4.893 1.00 0.00 H new ATOM 0 HO2' U A 14 4.682 -12.372 7.422 1.00 0.00 H new ATOM 0 H1' U A 14 3.293 -9.727 6.183 1.00 0.00 H new ATOM 0 H3 U A 14 1.929 -8.940 1.989 1.00 0.00 H new ATOM 0 H5 U A 14 5.952 -7.746 2.004 1.00 0.00 H new ATOM 0 H6 U A 14 6.146 -8.667 4.205 1.00 0.00 H new ATOM 451 P C A 15 7.252 -13.647 5.568 1.00 0.00 P ATOM 452 OP1 C A 15 8.085 -14.511 6.442 1.00 0.00 O ATOM 453 OP2 C A 15 7.847 -13.051 4.345 1.00 0.00 O ATOM 454 O5' C A 15 5.963 -14.479 5.138 1.00 0.00 O ATOM 455 C5' C A 15 5.180 -15.172 6.107 1.00 0.00 C ATOM 456 C4' C A 15 3.938 -15.738 5.462 1.00 0.00 C ATOM 457 O4' C A 15 3.042 -14.642 5.138 1.00 0.00 O ATOM 458 C3' C A 15 4.161 -16.461 4.141 1.00 0.00 C ATOM 459 O3' C A 15 4.505 -17.837 4.329 1.00 0.00 O ATOM 460 C2' C A 15 2.821 -16.294 3.435 1.00 0.00 C ATOM 461 O2' C A 15 1.875 -17.234 3.908 1.00 0.00 O ATOM 462 C1' C A 15 2.399 -14.899 3.903 1.00 0.00 C ATOM 463 N1 C A 15 2.754 -13.822 2.962 1.00 0.00 N ATOM 464 C2 C A 15 1.784 -13.371 2.067 1.00 0.00 C ATOM 465 O2 C A 15 0.661 -13.892 2.090 1.00 0.00 O ATOM 466 N3 C A 15 2.091 -12.379 1.201 1.00 0.00 N ATOM 467 C4 C A 15 3.313 -11.842 1.211 1.00 0.00 C ATOM 468 N4 C A 15 3.571 -10.865 0.340 1.00 0.00 N ATOM 469 C5 C A 15 4.324 -12.283 2.114 1.00 0.00 C ATOM 470 C6 C A 15 4.005 -13.269 2.962 1.00 0.00 C ATOM 0 H5' C A 15 4.903 -14.494 6.914 1.00 0.00 H new ATOM 0 H5'' C A 15 5.766 -15.976 6.552 1.00 0.00 H new ATOM 0 H4' C A 15 3.553 -16.454 6.188 1.00 0.00 H new ATOM 0 H3' C A 15 4.998 -16.059 3.570 1.00 0.00 H new ATOM 0 H2' C A 15 2.884 -16.428 2.355 1.00 0.00 H new ATOM 0 HO2' C A 15 2.338 -17.945 4.399 1.00 0.00 H new ATOM 0 HO3' C A 15 4.637 -18.263 3.457 1.00 0.00 H new ATOM 0 H1' C A 15 1.312 -14.900 3.984 1.00 0.00 H new ATOM 0 H41 C A 15 4.494 -10.431 0.319 1.00 0.00 H new ATOM 0 H42 C A 15 2.845 -10.552 -0.305 1.00 0.00 H new ATOM 0 H5 C A 15 5.309 -11.839 2.114 1.00 0.00 H new ATOM 0 H6 C A 15 4.747 -13.633 3.657 1.00 0.00 H new TER 483 C A 15