USER MOD reduce.3.24.130724 H: found=0, std=0, add=152, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 153 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 -100:sc= 0.688 USER MOD Single : A 2 G O2' : rot -21:sc= 0.13 USER MOD Single : A 3 C O2' : rot -67:sc= 0.525 USER MOD Single : A 4 A O2' : rot -118:sc= 0.406 USER MOD Single : A 5 C O2' : rot -30:sc= 0.089 USER MOD Single : A 6 U O2' : rot 166:sc= 1.21 USER MOD Single : A 7 U O2' : rot -80:sc= 0.668 USER MOD Single : A 8 C O2' : rot 22:sc= 0.167 USER MOD Single : A 9 G O2' : rot -18:sc= 0.172 USER MOD Single : A 10 G O2' : rot -24:sc= 0.0253 USER MOD Single : A 11 U O2' : rot -16:sc= 0.191 USER MOD Single : A 12 G O2' : rot -24:sc= 0.122 USER MOD Single : A 13 C O2' : rot -23:sc= 0.23 USER MOD Single : A 14 C O2' : rot -21:sc= 0.264 USER MOD Single : A 14 C O3' : rot 180:sc= 0.269 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -10.637 -4.586 11.116 1.00 10.00 O ATOM 2 P G A 1 -11.860 -5.331 10.426 1.00 10.00 P ATOM 3 OP1 G A 1 -13.048 -4.453 10.550 1.00 10.00 O ATOM 4 OP2 G A 1 -11.927 -6.718 10.945 1.00 10.00 O ATOM 5 O5' G A 1 -11.425 -5.372 8.895 1.00 10.00 O ATOM 6 C5' G A 1 -11.611 -6.542 8.101 1.00 10.00 C ATOM 7 C4' G A 1 -12.065 -6.162 6.711 1.00 10.00 C ATOM 8 O4' G A 1 -12.783 -4.899 6.774 1.00 10.00 O ATOM 9 C3' G A 1 -10.952 -5.934 5.695 1.00 10.00 C ATOM 10 O3' G A 1 -10.587 -7.154 5.053 1.00 10.00 O ATOM 11 C2' G A 1 -11.580 -4.954 4.714 1.00 10.00 C ATOM 12 O2' G A 1 -12.304 -5.616 3.693 1.00 10.00 O ATOM 13 C1' G A 1 -12.547 -4.161 5.591 1.00 10.00 C ATOM 14 N9 G A 1 -12.026 -2.838 5.916 1.00 10.00 N ATOM 15 C8 G A 1 -11.379 -2.426 7.056 1.00 10.00 C ATOM 16 N7 G A 1 -10.960 -1.187 6.991 1.00 10.00 N ATOM 17 C5 G A 1 -11.356 -0.756 5.730 1.00 10.00 C ATOM 18 C6 G A 1 -11.187 0.502 5.077 1.00 10.00 C ATOM 19 O6 G A 1 -10.628 1.526 5.495 1.00 10.00 O ATOM 20 N1 G A 1 -11.749 0.502 3.803 1.00 10.00 N ATOM 21 C2 G A 1 -12.391 -0.574 3.236 1.00 10.00 C ATOM 22 N2 G A 1 -12.893 -0.395 2.010 1.00 10.00 N ATOM 23 N3 G A 1 -12.553 -1.743 3.827 1.00 10.00 N ATOM 24 C4 G A 1 -12.016 -1.764 5.063 1.00 10.00 C ATOM 0 H5' G A 1 -12.350 -7.193 8.568 1.00 10.00 H new ATOM 0 H5'' G A 1 -10.679 -7.105 8.046 1.00 10.00 H new ATOM 0 H4' G A 1 -12.661 -7.013 6.382 1.00 10.00 H new ATOM 0 H3' G A 1 -10.030 -5.559 6.140 1.00 10.00 H new ATOM 0 H2' G A 1 -10.831 -4.348 4.205 1.00 10.00 H new ATOM 0 HO2' G A 1 -11.758 -5.659 2.880 1.00 10.00 H new ATOM 0 H1' G A 1 -13.477 -4.010 5.043 1.00 10.00 H new ATOM 0 H8 G A 1 -11.231 -3.060 7.918 1.00 10.00 H new ATOM 0 H1 G A 1 -11.680 1.358 3.253 1.00 10.00 H new ATOM 0 H21 G A 1 -13.379 -1.159 1.541 1.00 10.00 H new ATOM 0 H22 G A 1 -12.790 0.506 1.543 1.00 10.00 H new ATOM 37 P G A 2 -9.066 -7.455 4.612 1.00 10.00 P ATOM 38 OP1 G A 2 -8.704 -8.784 5.154 1.00 10.00 O ATOM 39 OP2 G A 2 -8.235 -6.277 4.944 1.00 10.00 O ATOM 40 O5' G A 2 -9.120 -7.573 3.024 1.00 10.00 O ATOM 41 C5' G A 2 -10.305 -8.008 2.370 1.00 10.00 C ATOM 42 C4' G A 2 -10.439 -7.406 0.990 1.00 10.00 C ATOM 43 O4' G A 2 -11.059 -6.108 1.136 1.00 10.00 O ATOM 44 C3' G A 2 -9.158 -7.142 0.208 1.00 10.00 C ATOM 45 O3' G A 2 -8.804 -8.277 -0.571 1.00 10.00 O ATOM 46 C2' G A 2 -9.554 -5.968 -0.678 1.00 10.00 C ATOM 47 O2' G A 2 -10.322 -6.392 -1.788 1.00 10.00 O ATOM 48 C1' G A 2 -10.436 -5.171 0.280 1.00 10.00 C ATOM 49 N9 G A 2 -9.715 -4.224 1.122 1.00 10.00 N ATOM 50 C8 G A 2 -9.363 -4.392 2.439 1.00 10.00 C ATOM 51 N7 G A 2 -8.770 -3.348 2.954 1.00 10.00 N ATOM 52 C5 G A 2 -8.725 -2.432 1.912 1.00 10.00 C ATOM 53 C6 G A 2 -8.199 -1.113 1.870 1.00 10.00 C ATOM 54 O6 G A 2 -7.658 -0.469 2.780 1.00 10.00 O ATOM 55 N1 G A 2 -8.355 -0.534 0.612 1.00 10.00 N ATOM 56 C2 G A 2 -8.951 -1.156 -0.465 1.00 10.00 C ATOM 57 N2 G A 2 -9.001 -0.461 -1.609 1.00 10.00 N ATOM 58 N3 G A 2 -9.447 -2.382 -0.436 1.00 10.00 N ATOM 59 C4 G A 2 -9.301 -2.958 0.775 1.00 10.00 C ATOM 0 H5' G A 2 -11.173 -7.736 2.971 1.00 10.00 H new ATOM 0 H5'' G A 2 -10.299 -9.095 2.293 1.00 10.00 H new ATOM 0 H4' G A 2 -10.998 -8.157 0.431 1.00 10.00 H new ATOM 0 H3' G A 2 -8.291 -6.937 0.836 1.00 10.00 H new ATOM 0 H2' G A 2 -8.705 -5.427 -1.097 1.00 10.00 H new ATOM 0 HO2' G A 2 -10.171 -7.348 -1.945 1.00 10.00 H new ATOM 0 H1' G A 2 -11.127 -4.586 -0.327 1.00 10.00 H new ATOM 0 H8 G A 2 -9.557 -5.298 2.994 1.00 10.00 H new ATOM 0 H1 G A 2 -8.004 0.415 0.479 1.00 10.00 H new ATOM 0 H21 G A 2 -9.431 -0.873 -2.437 1.00 10.00 H new ATOM 0 H22 G A 2 -8.609 0.480 -1.652 1.00 10.00 H new ATOM 71 P C A 3 -7.294 -8.463 -1.077 1.00 10.00 P ATOM 72 OP1 C A 3 -7.238 -9.754 -1.804 1.00 10.00 O ATOM 73 OP2 C A 3 -6.379 -8.237 0.066 1.00 10.00 O ATOM 74 O5' C A 3 -7.081 -7.286 -2.126 1.00 10.00 O ATOM 75 C5' C A 3 -7.090 -7.535 -3.528 1.00 10.00 C ATOM 76 C4' C A 3 -6.644 -6.305 -4.283 1.00 10.00 C ATOM 77 O4' C A 3 -7.143 -5.121 -3.612 1.00 10.00 O ATOM 78 C3' C A 3 -5.139 -6.099 -4.350 1.00 10.00 C ATOM 79 O3' C A 3 -4.590 -6.832 -5.440 1.00 10.00 O ATOM 80 C2' C A 3 -5.011 -4.594 -4.558 1.00 10.00 C ATOM 81 O2' C A 3 -5.120 -4.257 -5.930 1.00 10.00 O ATOM 82 C1' C A 3 -6.234 -4.053 -3.807 1.00 10.00 C ATOM 83 N1 C A 3 -5.921 -3.459 -2.495 1.00 10.00 N ATOM 84 C2 C A 3 -5.501 -2.128 -2.450 1.00 10.00 C ATOM 85 O2 C A 3 -5.326 -1.516 -3.514 1.00 10.00 O ATOM 86 N3 C A 3 -5.272 -1.544 -1.250 1.00 10.00 N ATOM 87 C4 C A 3 -5.446 -2.239 -0.125 1.00 10.00 C ATOM 88 N4 C A 3 -5.247 -1.610 1.036 1.00 10.00 N ATOM 89 C5 C A 3 -5.858 -3.602 -0.139 1.00 10.00 C ATOM 90 C6 C A 3 -6.080 -4.166 -1.334 1.00 10.00 C ATOM 0 H5' C A 3 -8.092 -7.822 -3.847 1.00 10.00 H new ATOM 0 H5'' C A 3 -6.430 -8.371 -3.760 1.00 10.00 H new ATOM 0 H4' C A 3 -7.029 -6.457 -5.292 1.00 10.00 H new ATOM 0 H3' C A 3 -4.603 -6.446 -3.466 1.00 10.00 H new ATOM 0 H2' C A 3 -4.055 -4.198 -4.216 1.00 10.00 H new ATOM 0 HO2' C A 3 -4.350 -4.617 -6.417 1.00 10.00 H new ATOM 0 H1' C A 3 -6.652 -3.253 -4.419 1.00 10.00 H new ATOM 0 H41 C A 3 -5.371 -2.111 1.916 1.00 10.00 H new ATOM 0 H42 C A 3 -4.971 -0.628 1.043 1.00 10.00 H new ATOM 0 H5 C A 3 -5.986 -4.159 0.777 1.00 10.00 H new ATOM 0 H6 C A 3 -6.391 -5.199 -1.382 1.00 10.00 H new ATOM 102 P A A 4 -3.003 -6.907 -5.653 1.00 10.00 P ATOM 103 OP1 A A 4 -2.734 -7.905 -6.715 1.00 10.00 O ATOM 104 OP2 A A 4 -2.382 -7.089 -4.321 1.00 10.00 O ATOM 105 O5' A A 4 -2.616 -5.462 -6.198 1.00 10.00 O ATOM 106 C5' A A 4 -2.181 -5.277 -7.540 1.00 10.00 C ATOM 107 C4' A A 4 -1.483 -3.947 -7.696 1.00 10.00 C ATOM 108 O4' A A 4 -2.026 -2.989 -6.746 1.00 10.00 O ATOM 109 C3' A A 4 0.013 -3.955 -7.423 1.00 10.00 C ATOM 110 O3' A A 4 0.733 -4.321 -8.597 1.00 10.00 O ATOM 111 C2' A A 4 0.285 -2.519 -7.007 1.00 10.00 C ATOM 112 O2' A A 4 0.456 -1.687 -8.134 1.00 10.00 O ATOM 113 C1' A A 4 -0.992 -2.144 -6.265 1.00 10.00 C ATOM 114 N9 A A 4 -0.902 -2.305 -4.812 1.00 10.00 N ATOM 115 C8 A A 4 -1.150 -3.435 -4.070 1.00 10.00 C ATOM 116 N7 A A 4 -0.940 -3.282 -2.785 1.00 10.00 N ATOM 117 C5 A A 4 -0.526 -1.964 -2.672 1.00 10.00 C ATOM 118 C6 A A 4 -0.147 -1.193 -1.562 1.00 10.00 C ATOM 119 N6 A A 4 -0.127 -1.658 -0.314 1.00 10.00 N ATOM 120 N1 A A 4 0.210 0.090 -1.784 1.00 10.00 N ATOM 121 C2 A A 4 0.190 0.557 -3.043 1.00 10.00 C ATOM 122 N3 A A 4 -0.146 -0.075 -4.171 1.00 10.00 N ATOM 123 C4 A A 4 -0.495 -1.349 -3.913 1.00 10.00 C ATOM 0 H5' A A 4 -3.036 -5.326 -8.215 1.00 10.00 H new ATOM 0 H5'' A A 4 -1.505 -6.084 -7.823 1.00 10.00 H new ATOM 0 H4' A A 4 -1.649 -3.693 -8.743 1.00 10.00 H new ATOM 0 H3' A A 4 0.324 -4.675 -6.666 1.00 10.00 H new ATOM 0 H2' A A 4 1.193 -2.408 -6.414 1.00 10.00 H new ATOM 0 HO2' A A 4 1.361 -1.311 -8.129 1.00 10.00 H new ATOM 0 H1' A A 4 -1.182 -1.087 -6.450 1.00 10.00 H new ATOM 0 H8 A A 4 -1.487 -4.364 -4.506 1.00 10.00 H new ATOM 0 H61 A A 4 0.158 -1.049 0.453 1.00 10.00 H new ATOM 0 H62 A A 4 -0.397 -2.623 -0.125 1.00 10.00 H new ATOM 0 H2 A A 4 0.487 1.589 -3.160 1.00 10.00 H new ATOM 135 P C A 5 2.200 -4.953 -8.467 1.00 10.00 P ATOM 136 OP1 C A 5 2.716 -5.178 -9.838 1.00 10.00 O ATOM 137 OP2 C A 5 2.150 -6.086 -7.518 1.00 10.00 O ATOM 138 O5' C A 5 3.030 -3.773 -7.804 1.00 10.00 O ATOM 139 C5' C A 5 3.790 -2.883 -8.605 1.00 10.00 C ATOM 140 C4' C A 5 4.024 -1.595 -7.857 1.00 10.00 C ATOM 141 O4' C A 5 2.974 -1.425 -6.869 1.00 10.00 O ATOM 142 C3' C A 5 5.299 -1.519 -7.034 1.00 10.00 C ATOM 143 O3' C A 5 6.404 -1.141 -7.850 1.00 10.00 O ATOM 144 C2' C A 5 4.952 -0.434 -6.023 1.00 10.00 C ATOM 145 O2' C A 5 5.021 0.861 -6.593 1.00 10.00 O ATOM 146 C1' C A 5 3.490 -0.777 -5.722 1.00 10.00 C ATOM 147 N1 C A 5 3.333 -1.634 -4.530 1.00 10.00 N ATOM 148 C2 C A 5 3.575 -1.071 -3.269 1.00 10.00 C ATOM 149 O2 C A 5 3.922 0.116 -3.198 1.00 10.00 O ATOM 150 N3 C A 5 3.415 -1.828 -2.160 1.00 10.00 N ATOM 151 C4 C A 5 3.023 -3.097 -2.264 1.00 10.00 C ATOM 152 N4 C A 5 2.859 -3.789 -1.129 1.00 10.00 N ATOM 153 C5 C A 5 2.769 -3.701 -3.533 1.00 10.00 C ATOM 154 C6 C A 5 2.941 -2.944 -4.628 1.00 10.00 C ATOM 0 H5' C A 5 3.265 -2.682 -9.539 1.00 10.00 H new ATOM 0 H5'' C A 5 4.744 -3.340 -8.868 1.00 10.00 H new ATOM 0 H4' C A 5 4.067 -0.846 -8.648 1.00 10.00 H new ATOM 0 H3' C A 5 5.595 -2.463 -6.576 1.00 10.00 H new ATOM 0 H2' C A 5 5.622 -0.412 -5.164 1.00 10.00 H new ATOM 0 HO2' C A 5 5.696 0.870 -7.304 1.00 10.00 H new ATOM 0 H1' C A 5 2.946 0.140 -5.497 1.00 10.00 H new ATOM 0 H41 C A 5 2.560 -4.763 -1.165 1.00 10.00 H new ATOM 0 H42 C A 5 3.033 -3.341 -0.229 1.00 10.00 H new ATOM 0 H5 C A 5 2.450 -4.730 -3.609 1.00 10.00 H new ATOM 0 H6 C A 5 2.768 -3.374 -5.603 1.00 10.00 H new ATOM 166 P U A 6 7.869 -1.734 -7.572 1.00 10.00 P ATOM 167 OP1 U A 6 8.818 -1.044 -8.478 1.00 10.00 O ATOM 168 OP2 U A 6 7.771 -3.213 -7.626 1.00 10.00 O ATOM 169 O5' U A 6 8.202 -1.303 -6.077 1.00 10.00 O ATOM 170 C5' U A 6 8.895 -0.086 -5.804 1.00 10.00 C ATOM 171 C4' U A 6 9.185 0.046 -4.325 1.00 10.00 C ATOM 172 O4' U A 6 7.972 -0.182 -3.559 1.00 10.00 O ATOM 173 C3' U A 6 10.161 -0.970 -3.752 1.00 10.00 C ATOM 174 O3' U A 6 11.511 -0.598 -4.016 1.00 10.00 O ATOM 175 C2' U A 6 9.836 -0.894 -2.265 1.00 10.00 C ATOM 176 O2' U A 6 10.407 0.255 -1.671 1.00 10.00 O ATOM 177 C1' U A 6 8.312 -0.747 -2.301 1.00 10.00 C ATOM 178 N1 U A 6 7.591 -2.018 -2.130 1.00 10.00 N ATOM 179 C2 U A 6 7.386 -2.475 -0.840 1.00 10.00 C ATOM 180 O2 U A 6 7.797 -1.887 0.144 1.00 10.00 O ATOM 181 N3 U A 6 6.689 -3.653 -0.736 1.00 10.00 N ATOM 182 C4 U A 6 6.183 -4.409 -1.766 1.00 10.00 C ATOM 183 O4 U A 6 5.570 -5.448 -1.511 1.00 10.00 O ATOM 184 C5 U A 6 6.434 -3.878 -3.070 1.00 10.00 C ATOM 185 C6 U A 6 7.111 -2.733 -3.211 1.00 10.00 C ATOM 0 H5' U A 6 8.297 0.761 -6.139 1.00 10.00 H new ATOM 0 H5'' U A 6 9.828 -0.060 -6.366 1.00 10.00 H new ATOM 0 H4' U A 6 9.608 1.047 -4.244 1.00 10.00 H new ATOM 0 H3' U A 6 10.067 -1.970 -4.175 1.00 10.00 H new ATOM 0 H2' U A 6 10.210 -1.743 -1.693 1.00 10.00 H new ATOM 0 HO2' U A 6 10.002 0.404 -0.791 1.00 10.00 H new ATOM 0 H1' U A 6 8.014 -0.116 -1.464 1.00 10.00 H new ATOM 0 H3 U A 6 6.529 -4.005 0.208 1.00 10.00 H new ATOM 0 H5 U A 6 6.076 -4.403 -3.943 1.00 10.00 H new ATOM 0 H6 U A 6 7.289 -2.353 -4.206 1.00 10.00 H new ATOM 196 P U A 7 12.705 -1.648 -3.791 1.00 10.00 P ATOM 197 OP1 U A 7 13.807 -1.297 -4.720 1.00 10.00 O ATOM 198 OP2 U A 7 12.128 -3.015 -3.832 1.00 10.00 O ATOM 199 O5' U A 7 13.197 -1.375 -2.303 1.00 10.00 O ATOM 200 C5' U A 7 14.451 -1.869 -1.835 1.00 10.00 C ATOM 201 C4' U A 7 15.052 -0.891 -0.853 1.00 10.00 C ATOM 202 O4' U A 7 15.247 0.378 -1.537 1.00 10.00 O ATOM 203 C3' U A 7 14.190 -0.584 0.372 1.00 10.00 C ATOM 204 O3' U A 7 14.954 -0.576 1.577 1.00 10.00 O ATOM 205 C2' U A 7 13.607 0.798 0.088 1.00 10.00 C ATOM 206 O2' U A 7 13.444 1.552 1.272 1.00 10.00 O ATOM 207 C1' U A 7 14.720 1.420 -0.749 1.00 10.00 C ATOM 208 N1 U A 7 14.253 2.495 -1.638 1.00 10.00 N ATOM 209 C2 U A 7 14.611 3.799 -1.337 1.00 10.00 C ATOM 210 O2 U A 7 15.304 4.101 -0.377 1.00 10.00 O ATOM 211 N3 U A 7 14.123 4.748 -2.202 1.00 10.00 N ATOM 212 C4 U A 7 13.334 4.533 -3.311 1.00 10.00 C ATOM 213 O4 U A 7 12.969 5.493 -3.992 1.00 10.00 O ATOM 214 C5 U A 7 13.009 3.162 -3.554 1.00 10.00 C ATOM 215 C6 U A 7 13.465 2.211 -2.731 1.00 10.00 C ATOM 0 H5' U A 7 15.130 -2.019 -2.675 1.00 10.00 H new ATOM 0 H5'' U A 7 14.315 -2.840 -1.358 1.00 10.00 H new ATOM 0 H4' U A 7 15.969 -1.363 -0.499 1.00 10.00 H new ATOM 0 H3' U A 7 13.423 -1.343 0.525 1.00 10.00 H new ATOM 0 H2' U A 7 12.624 0.762 -0.381 1.00 10.00 H new ATOM 0 HO2' U A 7 12.622 1.274 1.727 1.00 10.00 H new ATOM 0 H1' U A 7 15.452 1.873 -0.080 1.00 10.00 H new ATOM 0 H3 U A 7 14.372 5.717 -2.002 1.00 10.00 H new ATOM 0 H5 U A 7 12.396 2.894 -4.402 1.00 10.00 H new ATOM 0 H6 U A 7 13.205 1.182 -2.931 1.00 10.00 H new ATOM 226 P C A 8 15.111 -1.918 2.449 1.00 10.00 P ATOM 227 OP1 C A 8 15.864 -1.578 3.678 1.00 10.00 O ATOM 228 OP2 C A 8 15.636 -2.972 1.549 1.00 10.00 O ATOM 229 O5' C A 8 13.627 -2.314 2.866 1.00 10.00 O ATOM 230 C5' C A 8 13.108 -2.007 4.158 1.00 10.00 C ATOM 231 C4' C A 8 11.932 -2.904 4.475 1.00 10.00 C ATOM 232 O4' C A 8 11.075 -3.000 3.303 1.00 10.00 O ATOM 233 C3' C A 8 12.272 -4.349 4.837 1.00 10.00 C ATOM 234 O3' C A 8 11.354 -4.865 5.795 1.00 10.00 O ATOM 235 C2' C A 8 12.121 -5.080 3.508 1.00 10.00 C ATOM 236 O2' C A 8 11.836 -6.455 3.690 1.00 10.00 O ATOM 237 C1' C A 8 10.884 -4.361 2.979 1.00 10.00 C ATOM 238 N1 C A 8 10.705 -4.470 1.523 1.00 10.00 N ATOM 239 C2 C A 8 9.632 -5.197 0.998 1.00 10.00 C ATOM 240 O2 C A 8 8.831 -5.745 1.772 1.00 10.00 O ATOM 241 N3 C A 8 9.487 -5.274 -0.347 1.00 10.00 N ATOM 242 C4 C A 8 10.361 -4.657 -1.148 1.00 10.00 C ATOM 243 N4 C A 8 10.192 -4.730 -2.464 1.00 10.00 N ATOM 244 C5 C A 8 11.456 -3.918 -0.637 1.00 10.00 C ATOM 245 C6 C A 8 11.588 -3.847 0.688 1.00 10.00 C ATOM 0 H5' C A 8 12.798 -0.963 4.195 1.00 10.00 H new ATOM 0 H5'' C A 8 13.886 -2.136 4.910 1.00 10.00 H new ATOM 0 H4' C A 8 11.472 -2.436 5.345 1.00 10.00 H new ATOM 0 H3' C A 8 13.261 -4.455 5.283 1.00 10.00 H new ATOM 0 H2' C A 8 13.007 -5.060 2.874 1.00 10.00 H new ATOM 0 HO2' C A 8 11.451 -6.594 4.581 1.00 10.00 H new ATOM 0 H1' C A 8 9.997 -4.811 3.424 1.00 10.00 H new ATOM 0 H41 C A 8 10.850 -4.265 -3.089 1.00 10.00 H new ATOM 0 H42 C A 8 9.404 -5.251 -2.849 1.00 10.00 H new ATOM 0 H5 C A 8 12.158 -3.430 -1.296 1.00 10.00 H new ATOM 0 H6 C A 8 12.409 -3.286 1.109 1.00 10.00 H new ATOM 257 P G A 9 11.685 -4.834 7.365 1.00 10.00 P ATOM 258 OP1 G A 9 13.101 -5.217 7.559 1.00 10.00 O ATOM 259 OP2 G A 9 10.628 -5.623 8.037 1.00 10.00 O ATOM 260 O5' G A 9 11.498 -3.309 7.780 1.00 10.00 O ATOM 261 C5' G A 9 10.190 -2.751 7.934 1.00 10.00 C ATOM 262 C4' G A 9 10.275 -1.248 8.079 1.00 10.00 C ATOM 263 O4' G A 9 11.196 -0.730 7.093 1.00 10.00 O ATOM 264 C3' G A 9 8.997 -0.465 7.815 1.00 10.00 C ATOM 265 O3' G A 9 8.141 -0.458 8.950 1.00 10.00 O ATOM 266 C2' G A 9 9.538 0.931 7.522 1.00 10.00 C ATOM 267 O2' G A 9 9.782 1.647 8.718 1.00 10.00 O ATOM 268 C1' G A 9 10.870 0.621 6.841 1.00 10.00 C ATOM 269 N9 G A 9 10.857 0.840 5.398 1.00 10.00 N ATOM 270 C8 G A 9 11.633 1.747 4.732 1.00 10.00 C ATOM 271 N7 G A 9 11.471 1.721 3.440 1.00 10.00 N ATOM 272 C5 G A 9 10.520 0.730 3.236 1.00 10.00 C ATOM 273 C6 G A 9 9.944 0.246 2.031 1.00 10.00 C ATOM 274 O6 G A 9 10.166 0.610 0.870 1.00 10.00 O ATOM 275 N1 G A 9 9.023 -0.769 2.263 1.00 10.00 N ATOM 276 C2 G A 9 8.693 -1.246 3.508 1.00 10.00 C ATOM 277 N2 G A 9 7.761 -2.208 3.546 1.00 10.00 N ATOM 278 N3 G A 9 9.222 -0.806 4.641 1.00 10.00 N ATOM 279 C4 G A 9 10.125 0.176 4.435 1.00 10.00 C ATOM 0 H5' G A 9 9.705 -3.181 8.810 1.00 10.00 H new ATOM 0 H5'' G A 9 9.574 -3.006 7.071 1.00 10.00 H new ATOM 0 H4' G A 9 10.559 -1.115 9.123 1.00 10.00 H new ATOM 0 H3' G A 9 8.388 -0.882 7.013 1.00 10.00 H new ATOM 0 H2' G A 9 8.852 1.540 6.933 1.00 10.00 H new ATOM 0 HO2' G A 9 9.299 1.222 9.458 1.00 10.00 H new ATOM 0 H1' G A 9 11.609 1.307 7.255 1.00 10.00 H new ATOM 0 H8 G A 9 12.315 2.421 5.229 1.00 10.00 H new ATOM 0 H1 G A 9 8.562 -1.187 1.455 1.00 10.00 H new ATOM 0 H21 G A 9 7.473 -2.604 4.441 1.00 10.00 H new ATOM 0 H22 G A 9 7.340 -2.545 2.680 1.00 10.00 H new ATOM 291 P G A 10 6.571 -0.164 8.766 1.00 10.00 P ATOM 292 OP1 G A 10 6.111 0.596 9.953 1.00 10.00 O ATOM 293 OP2 G A 10 5.909 -1.443 8.416 1.00 10.00 O ATOM 294 O5' G A 10 6.481 0.797 7.501 1.00 10.00 O ATOM 295 C5' G A 10 6.364 2.202 7.681 1.00 10.00 C ATOM 296 C4' G A 10 6.525 2.975 6.390 1.00 10.00 C ATOM 297 O4' G A 10 7.148 2.123 5.390 1.00 10.00 O ATOM 298 C3' G A 10 5.250 3.444 5.702 1.00 10.00 C ATOM 299 O3' G A 10 4.800 4.671 6.270 1.00 10.00 O ATOM 300 C2' G A 10 5.734 3.626 4.269 1.00 10.00 C ATOM 301 O2' G A 10 6.596 4.744 4.145 1.00 10.00 O ATOM 302 C1' G A 10 6.547 2.345 4.126 1.00 10.00 C ATOM 303 N9 G A 10 5.732 1.177 3.798 1.00 10.00 N ATOM 304 C8 G A 10 5.246 0.256 4.687 1.00 10.00 C ATOM 305 N7 G A 10 4.601 -0.724 4.111 1.00 10.00 N ATOM 306 C5 G A 10 4.660 -0.419 2.754 1.00 10.00 C ATOM 307 C6 G A 10 4.132 -1.111 1.627 1.00 10.00 C ATOM 308 O6 G A 10 3.516 -2.188 1.600 1.00 10.00 O ATOM 309 N1 G A 10 4.413 -0.451 0.434 1.00 10.00 N ATOM 310 C2 G A 10 5.113 0.730 0.343 1.00 10.00 C ATOM 311 N2 G A 10 5.272 1.235 -0.888 1.00 10.00 N ATOM 312 N3 G A 10 5.611 1.384 1.381 1.00 10.00 N ATOM 313 C4 G A 10 5.348 0.759 2.548 1.00 10.00 C ATOM 0 H5' G A 10 7.117 2.536 8.395 1.00 10.00 H new ATOM 0 H5'' G A 10 5.390 2.428 8.115 1.00 10.00 H new ATOM 0 H4' G A 10 7.095 3.848 6.707 1.00 10.00 H new ATOM 0 H3' G A 10 4.402 2.765 5.793 1.00 10.00 H new ATOM 0 H2' G A 10 4.942 3.791 3.539 1.00 10.00 H new ATOM 0 HO2' G A 10 6.411 5.381 4.866 1.00 10.00 H new ATOM 0 H1' G A 10 7.261 2.468 3.311 1.00 10.00 H new ATOM 0 H8 G A 10 5.382 0.332 5.756 1.00 10.00 H new ATOM 0 H1 G A 10 4.077 -0.872 -0.432 1.00 10.00 H new ATOM 0 H21 G A 10 5.782 2.108 -1.019 1.00 10.00 H new ATOM 0 H22 G A 10 4.883 0.746 -1.694 1.00 10.00 H new ATOM 325 P U A 11 3.249 5.075 6.209 1.00 10.00 P ATOM 326 OP1 U A 11 3.078 6.361 6.924 1.00 10.00 O ATOM 327 OP2 U A 11 2.457 3.898 6.645 1.00 10.00 O ATOM 328 O5' U A 11 2.973 5.321 4.661 1.00 10.00 O ATOM 329 C5' U A 11 3.555 6.426 3.970 1.00 10.00 C ATOM 330 C4' U A 11 3.130 6.417 2.518 1.00 10.00 C ATOM 331 O4' U A 11 3.489 5.145 1.917 1.00 10.00 O ATOM 332 C3' U A 11 1.631 6.538 2.284 1.00 10.00 C ATOM 333 O3' U A 11 1.235 7.904 2.253 1.00 10.00 O ATOM 334 C2' U A 11 1.439 5.870 0.927 1.00 10.00 C ATOM 335 O2' U A 11 1.681 6.780 -0.131 1.00 10.00 O ATOM 336 C1' U A 11 2.523 4.790 0.941 1.00 10.00 C ATOM 337 N1 U A 11 2.008 3.447 1.251 1.00 10.00 N ATOM 338 C2 U A 11 1.488 2.707 0.204 1.00 10.00 C ATOM 339 O2 U A 11 1.408 3.134 -0.934 1.00 10.00 O ATOM 340 N3 U A 11 1.045 1.454 0.543 1.00 10.00 N ATOM 341 C4 U A 11 1.073 0.870 1.793 1.00 10.00 C ATOM 342 O4 U A 11 0.654 -0.278 1.938 1.00 10.00 O ATOM 343 C5 U A 11 1.619 1.695 2.819 1.00 10.00 C ATOM 344 C6 U A 11 2.054 2.924 2.529 1.00 10.00 C ATOM 0 H5' U A 11 4.642 6.376 4.039 1.00 10.00 H new ATOM 0 H5'' U A 11 3.249 7.360 4.440 1.00 10.00 H new ATOM 0 H4' U A 11 3.631 7.284 2.088 1.00 10.00 H new ATOM 0 H3' U A 11 1.030 6.080 3.069 1.00 10.00 H new ATOM 0 H2' U A 11 0.428 5.493 0.774 1.00 10.00 H new ATOM 0 HO2' U A 11 1.672 7.696 0.217 1.00 10.00 H new ATOM 0 H1' U A 11 2.948 4.741 -0.061 1.00 10.00 H new ATOM 0 H3 U A 11 0.652 0.892 -0.212 1.00 10.00 H new ATOM 0 H5 U A 11 1.681 1.326 3.832 1.00 10.00 H new ATOM 0 H6 U A 11 2.457 3.533 3.325 1.00 10.00 H new ATOM 355 P G A 12 -0.318 8.296 2.364 1.00 10.00 P ATOM 356 OP1 G A 12 -0.412 9.775 2.401 1.00 10.00 O ATOM 357 OP2 G A 12 -0.907 7.504 3.468 1.00 10.00 O ATOM 358 O5' G A 12 -0.944 7.786 0.995 1.00 10.00 O ATOM 359 C5' G A 12 -1.316 8.707 -0.023 1.00 10.00 C ATOM 360 C4' G A 12 -1.909 7.974 -1.204 1.00 10.00 C ATOM 361 O4' G A 12 -1.374 6.623 -1.267 1.00 10.00 O ATOM 362 C3' G A 12 -3.415 7.770 -1.145 1.00 10.00 C ATOM 363 O3' G A 12 -4.110 8.919 -1.614 1.00 10.00 O ATOM 364 C2' G A 12 -3.609 6.582 -2.076 1.00 10.00 C ATOM 365 O2' G A 12 -3.572 6.984 -3.434 1.00 10.00 O ATOM 366 C1' G A 12 -2.376 5.742 -1.743 1.00 10.00 C ATOM 367 N9 G A 12 -2.648 4.726 -0.731 1.00 10.00 N ATOM 368 C8 G A 12 -2.483 4.821 0.629 1.00 10.00 C ATOM 369 N7 G A 12 -2.853 3.744 1.267 1.00 10.00 N ATOM 370 C5 G A 12 -3.289 2.885 0.267 1.00 10.00 C ATOM 371 C6 G A 12 -3.808 1.566 0.345 1.00 10.00 C ATOM 372 O6 G A 12 -3.993 0.872 1.356 1.00 10.00 O ATOM 373 N1 G A 12 -4.127 1.057 -0.911 1.00 10.00 N ATOM 374 C2 G A 12 -3.966 1.742 -2.093 1.00 10.00 C ATOM 375 N2 G A 12 -4.311 1.089 -3.211 1.00 10.00 N ATOM 376 N3 G A 12 -3.487 2.974 -2.181 1.00 10.00 N ATOM 377 C4 G A 12 -3.170 3.479 -0.972 1.00 10.00 C ATOM 0 H5' G A 12 -0.444 9.278 -0.342 1.00 10.00 H new ATOM 0 H5'' G A 12 -2.039 9.421 0.370 1.00 10.00 H new ATOM 0 H4' G A 12 -1.657 8.607 -2.055 1.00 10.00 H new ATOM 0 H3' G A 12 -3.799 7.604 -0.138 1.00 10.00 H new ATOM 0 H2' G A 12 -4.563 6.070 -1.948 1.00 10.00 H new ATOM 0 HO2' G A 12 -3.805 7.934 -3.501 1.00 10.00 H new ATOM 0 H1' G A 12 -2.059 5.215 -2.643 1.00 10.00 H new ATOM 0 H8 G A 12 -2.087 5.697 1.121 1.00 10.00 H new ATOM 0 H1 G A 12 -4.506 0.111 -0.958 1.00 10.00 H new ATOM 0 H21 G A 12 -4.214 1.545 -4.118 1.00 10.00 H new ATOM 0 H22 G A 12 -4.670 0.136 -3.155 1.00 10.00 H new ATOM 389 P C A 13 -5.595 9.221 -1.088 1.00 10.00 P ATOM 390 OP1 C A 13 -6.059 10.485 -1.707 1.00 10.00 O ATOM 391 OP2 C A 13 -5.585 9.095 0.388 1.00 10.00 O ATOM 392 O5' C A 13 -6.466 8.035 -1.690 1.00 10.00 O ATOM 393 C5' C A 13 -6.964 8.104 -3.023 1.00 10.00 C ATOM 394 C4' C A 13 -7.507 6.758 -3.440 1.00 10.00 C ATOM 395 O4' C A 13 -6.715 5.711 -2.829 1.00 10.00 O ATOM 396 C3' C A 13 -8.926 6.455 -2.984 1.00 10.00 C ATOM 397 O3' C A 13 -9.874 6.997 -3.897 1.00 10.00 O ATOM 398 C2' C A 13 -8.964 4.930 -2.987 1.00 10.00 C ATOM 399 O2' C A 13 -9.291 4.445 -4.272 1.00 10.00 O ATOM 400 C1' C A 13 -7.516 4.557 -2.653 1.00 10.00 C ATOM 401 N1 C A 13 -7.329 4.051 -1.283 1.00 10.00 N ATOM 402 C2 C A 13 -7.670 2.726 -1.014 1.00 10.00 C ATOM 403 O2 C A 13 -8.145 2.036 -1.926 1.00 10.00 O ATOM 404 N3 C A 13 -7.477 2.224 0.228 1.00 10.00 N ATOM 405 C4 C A 13 -6.961 2.995 1.188 1.00 10.00 C ATOM 406 N4 C A 13 -6.793 2.456 2.399 1.00 10.00 N ATOM 407 C5 C A 13 -6.604 4.355 0.945 1.00 10.00 C ATOM 408 C6 C A 13 -6.808 4.837 -0.290 1.00 10.00 C ATOM 0 H5' C A 13 -6.169 8.411 -3.702 1.00 10.00 H new ATOM 0 H5'' C A 13 -7.748 8.858 -3.089 1.00 10.00 H new ATOM 0 H4' C A 13 -7.478 6.792 -4.529 1.00 10.00 H new ATOM 0 H3' C A 13 -9.175 6.886 -2.014 1.00 10.00 H new ATOM 0 H2' C A 13 -9.701 4.518 -2.298 1.00 10.00 H new ATOM 0 HO2' C A 13 -9.773 5.138 -4.770 1.00 10.00 H new ATOM 0 H1' C A 13 -7.229 3.745 -3.321 1.00 10.00 H new ATOM 0 H41 C A 13 -6.401 3.016 3.156 1.00 10.00 H new ATOM 0 H42 C A 13 -7.056 1.485 2.566 1.00 10.00 H new ATOM 0 H5 C A 13 -6.185 4.973 1.726 1.00 10.00 H new ATOM 0 H6 C A 13 -6.556 5.865 -0.505 1.00 10.00 H new ATOM 420 P C A 14 -11.069 7.931 -3.370 1.00 10.00 P ATOM 421 OP1 C A 14 -11.674 8.602 -4.547 1.00 10.00 O ATOM 422 OP2 C A 14 -10.546 8.759 -2.255 1.00 10.00 O ATOM 423 O5' C A 14 -12.128 6.900 -2.784 1.00 10.00 O ATOM 424 C5' C A 14 -13.082 6.275 -3.640 1.00 10.00 C ATOM 425 C4' C A 14 -13.341 4.857 -3.185 1.00 10.00 C ATOM 426 O4' C A 14 -12.169 4.343 -2.509 1.00 10.00 O ATOM 427 C3' C A 14 -14.441 4.687 -2.150 1.00 10.00 C ATOM 428 O3' C A 14 -15.735 4.610 -2.750 1.00 10.00 O ATOM 429 C2' C A 14 -14.086 3.364 -1.485 1.00 10.00 C ATOM 430 O2' C A 14 -14.688 2.275 -2.155 1.00 10.00 O ATOM 431 C1' C A 14 -12.564 3.292 -1.650 1.00 10.00 C ATOM 432 N1 C A 14 -11.857 3.419 -0.366 1.00 10.00 N ATOM 433 C2 C A 14 -11.668 2.281 0.416 1.00 10.00 C ATOM 434 O2 C A 14 -12.084 1.197 -0.006 1.00 10.00 O ATOM 435 N3 C A 14 -11.043 2.389 1.613 1.00 10.00 N ATOM 436 C4 C A 14 -10.610 3.581 2.034 1.00 10.00 C ATOM 437 N4 C A 14 -10.022 3.647 3.231 1.00 10.00 N ATOM 438 C5 C A 14 -10.786 4.762 1.251 1.00 10.00 C ATOM 439 C6 C A 14 -11.414 4.635 0.074 1.00 10.00 C ATOM 0 H5' C A 14 -12.715 6.274 -4.666 1.00 10.00 H new ATOM 0 H5'' C A 14 -14.013 6.842 -3.635 1.00 10.00 H new ATOM 0 H4' C A 14 -13.621 4.345 -4.106 1.00 10.00 H new ATOM 0 H3' C A 14 -14.494 5.529 -1.460 1.00 10.00 H new ATOM 0 H2' C A 14 -14.425 3.312 -0.450 1.00 10.00 H new ATOM 0 HO2' C A 14 -15.457 2.594 -2.672 1.00 10.00 H new ATOM 0 HO3' C A 14 -16.413 4.499 -2.051 1.00 10.00 H new ATOM 0 H1' C A 14 -12.305 2.318 -2.064 1.00 10.00 H new ATOM 0 H41 C A 14 -9.680 4.541 3.583 1.00 10.00 H new ATOM 0 H42 C A 14 -9.915 2.803 3.794 1.00 10.00 H new ATOM 0 H5 C A 14 -10.427 5.721 1.594 1.00 10.00 H new ATOM 0 H6 C A 14 -11.573 5.510 -0.539 1.00 10.00 H new TER 452 C A 14