USER MOD reduce.3.24.130724 H: found=0, std=0, add=172, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 172 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 42 G O2' : rot -5:sc= -0.41 USER MOD Single : A 42 G O5' : rot 180:sc= 0 USER MOD Single : A 43 A O2' : rot 180:sc= -0.16 USER MOD Single : A 44 U O2' : rot -11:sc= -0.0356 USER MOD Single : A 45 C O2' : rot -5:sc= -0.528 USER MOD Single : A 46 U O2' : rot -10:sc= 0.0685 USER MOD Single : A 47 C O2' : rot -167:sc= -1.84! USER MOD Single : A 48 U O2' : rot -108:sc= -6.78! USER MOD Single : A 49 U O2' : rot -42:sc= -0.924! USER MOD Single : A 50 G O2' : rot -85:sc= -6.2! USER MOD Single : A 51 U O2' : rot 180:sc= -4.74! USER MOD Single : A 52 A O2' : rot 0:sc= -0.793 USER MOD Single : A 53 G O2' : rot -5:sc= -0.319 USER MOD Single : A 54 A O2' : rot -1:sc= -1.86! USER MOD Single : A 55 U O2' : rot 0:sc= -0.781 USER MOD Single : A 56 C O2' : rot 180:sc= -1.34 USER MOD Single : A 57 A O2' : rot -15:sc= 0.199 USER MOD Single : A 57 A O3' : rot 180:sc= 0.205 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 42 6.569 -3.826 8.194 1.00 0.00 O ATOM 2 C5' G A 42 7.481 -3.331 9.175 1.00 0.00 C ATOM 3 C4' G A 42 8.240 -2.115 8.664 1.00 0.00 C ATOM 4 O4' G A 42 9.114 -2.471 7.596 1.00 0.00 O ATOM 5 C3' G A 42 7.358 -1.004 8.126 1.00 0.00 C ATOM 6 O3' G A 42 6.860 -0.189 9.193 1.00 0.00 O ATOM 7 C2' G A 42 8.346 -0.239 7.278 1.00 0.00 C ATOM 8 O2' G A 42 9.167 0.624 8.074 1.00 0.00 O ATOM 9 C1' G A 42 9.157 -1.374 6.669 1.00 0.00 C ATOM 10 N9 G A 42 8.627 -1.868 5.390 1.00 0.00 N ATOM 11 C8 G A 42 7.826 -2.953 5.166 1.00 0.00 C ATOM 12 N7 G A 42 7.524 -3.137 3.912 1.00 0.00 N ATOM 13 C5 G A 42 8.172 -2.095 3.256 1.00 0.00 C ATOM 14 C6 G A 42 8.207 -1.775 1.874 1.00 0.00 C ATOM 15 O6 G A 42 7.667 -2.372 0.948 1.00 0.00 O ATOM 16 N1 G A 42 8.976 -0.639 1.631 1.00 0.00 N ATOM 17 C2 G A 42 9.631 0.093 2.605 1.00 0.00 C ATOM 18 N2 G A 42 10.326 1.153 2.191 1.00 0.00 N ATOM 19 N3 G A 42 9.597 -0.212 3.905 1.00 0.00 N ATOM 20 C4 G A 42 8.851 -1.312 4.155 1.00 0.00 C ATOM 0 H5' G A 42 8.188 -4.116 9.446 1.00 0.00 H new ATOM 0 H5'' G A 42 6.935 -3.067 10.081 1.00 0.00 H new ATOM 0 H4' G A 42 8.774 -1.753 9.543 1.00 0.00 H new ATOM 0 H3' G A 42 6.473 -1.346 7.590 1.00 0.00 H new ATOM 0 H2' G A 42 7.885 0.424 6.546 1.00 0.00 H new ATOM 0 HO2' G A 42 8.864 0.596 9.006 1.00 0.00 H new ATOM 0 HO5' G A 42 6.098 -4.608 8.550 1.00 0.00 H new ATOM 0 H1' G A 42 10.159 -0.990 6.479 1.00 0.00 H new ATOM 0 H8 G A 42 7.475 -3.599 5.957 1.00 0.00 H new ATOM 0 H1 G A 42 9.062 -0.324 0.665 1.00 0.00 H new ATOM 0 H21 G A 42 10.829 1.729 2.866 1.00 0.00 H new ATOM 0 H22 G A 42 10.355 1.388 1.199 1.00 0.00 H new ATOM 33 P A A 43 5.463 0.608 9.041 1.00 0.00 P ATOM 34 OP1 A A 43 5.156 1.256 10.335 1.00 0.00 O ATOM 35 OP2 A A 43 4.476 -0.305 8.422 1.00 0.00 O ATOM 36 O5' A A 43 5.815 1.762 7.973 1.00 0.00 O ATOM 37 C5' A A 43 6.756 2.784 8.301 1.00 0.00 C ATOM 38 C4' A A 43 7.052 3.692 7.109 1.00 0.00 C ATOM 39 O4' A A 43 7.707 2.958 6.066 1.00 0.00 O ATOM 40 C3' A A 43 5.830 4.313 6.451 1.00 0.00 C ATOM 41 O3' A A 43 5.399 5.469 7.185 1.00 0.00 O ATOM 42 C2' A A 43 6.398 4.698 5.105 1.00 0.00 C ATOM 43 O2' A A 43 7.174 5.900 5.181 1.00 0.00 O ATOM 44 C1' A A 43 7.267 3.488 4.799 1.00 0.00 C ATOM 45 N9 A A 43 6.548 2.419 4.078 1.00 0.00 N ATOM 46 C8 A A 43 5.961 1.283 4.575 1.00 0.00 C ATOM 47 N7 A A 43 5.399 0.537 3.664 1.00 0.00 N ATOM 48 C5 A A 43 5.628 1.229 2.481 1.00 0.00 C ATOM 49 C6 A A 43 5.282 0.968 1.146 1.00 0.00 C ATOM 50 N6 A A 43 4.606 -0.118 0.760 1.00 0.00 N ATOM 51 N1 A A 43 5.663 1.870 0.230 1.00 0.00 N ATOM 52 C2 A A 43 6.342 2.944 0.611 1.00 0.00 C ATOM 53 N3 A A 43 6.727 3.297 1.824 1.00 0.00 N ATOM 54 C4 A A 43 6.328 2.377 2.726 1.00 0.00 C ATOM 0 H5' A A 43 7.683 2.326 8.647 1.00 0.00 H new ATOM 0 H5'' A A 43 6.369 3.383 9.126 1.00 0.00 H new ATOM 0 H4' A A 43 7.665 4.484 7.540 1.00 0.00 H new ATOM 0 H3' A A 43 4.955 3.665 6.398 1.00 0.00 H new ATOM 0 H2' A A 43 5.645 4.914 4.347 1.00 0.00 H new ATOM 0 HO2' A A 43 7.527 6.118 4.293 1.00 0.00 H new ATOM 0 H1' A A 43 8.086 3.810 4.156 1.00 0.00 H new ATOM 0 H8 A A 43 5.964 1.029 5.625 1.00 0.00 H new ATOM 0 H61 A A 43 4.382 -0.256 -0.226 1.00 0.00 H new ATOM 0 H62 A A 43 4.314 -0.809 1.451 1.00 0.00 H new ATOM 0 H2 A A 43 6.618 3.624 -0.181 1.00 0.00 H new ATOM 66 P U A 44 3.853 5.935 7.155 1.00 0.00 P ATOM 67 OP1 U A 44 3.693 7.056 8.108 1.00 0.00 O ATOM 68 OP2 U A 44 3.004 4.730 7.287 1.00 0.00 O ATOM 69 O5' U A 44 3.668 6.519 5.664 1.00 0.00 O ATOM 70 C5' U A 44 4.367 7.701 5.268 1.00 0.00 C ATOM 71 C4' U A 44 4.179 8.015 3.785 1.00 0.00 C ATOM 72 O4' U A 44 4.784 7.006 2.979 1.00 0.00 O ATOM 73 C3' U A 44 2.739 8.081 3.319 1.00 0.00 C ATOM 74 O3' U A 44 2.157 9.351 3.628 1.00 0.00 O ATOM 75 C2' U A 44 2.934 7.940 1.823 1.00 0.00 C ATOM 76 O2' U A 44 3.363 9.172 1.233 1.00 0.00 O ATOM 77 C1' U A 44 4.023 6.879 1.763 1.00 0.00 C ATOM 78 N1 U A 44 3.487 5.510 1.707 1.00 0.00 N ATOM 79 C2 U A 44 3.144 5.021 0.467 1.00 0.00 C ATOM 80 O2 U A 44 3.303 5.678 -0.560 1.00 0.00 O ATOM 81 N3 U A 44 2.611 3.748 0.445 1.00 0.00 N ATOM 82 C4 U A 44 2.396 2.932 1.540 1.00 0.00 C ATOM 83 O4 U A 44 1.916 1.809 1.396 1.00 0.00 O ATOM 84 C5 U A 44 2.782 3.525 2.799 1.00 0.00 C ATOM 85 C6 U A 44 3.303 4.775 2.845 1.00 0.00 C ATOM 0 H5' U A 44 5.429 7.581 5.480 1.00 0.00 H new ATOM 0 H5'' U A 44 4.017 8.544 5.863 1.00 0.00 H new ATOM 0 H4' U A 44 4.635 8.999 3.674 1.00 0.00 H new ATOM 0 H3' U A 44 2.078 7.343 3.775 1.00 0.00 H new ATOM 0 H2' U A 44 2.028 7.678 1.276 1.00 0.00 H new ATOM 0 HO2' U A 44 3.267 9.898 1.884 1.00 0.00 H new ATOM 0 H1' U A 44 4.612 7.034 0.859 1.00 0.00 H new ATOM 0 H3 U A 44 2.351 3.373 -0.467 1.00 0.00 H new ATOM 0 H5 U A 44 2.654 2.966 3.714 1.00 0.00 H new ATOM 0 H6 U A 44 3.578 5.199 3.799 1.00 0.00 H new ATOM 96 P C A 45 0.567 9.469 3.879 1.00 0.00 P ATOM 97 OP1 C A 45 0.271 10.859 4.292 1.00 0.00 O ATOM 98 OP2 C A 45 0.153 8.341 4.743 1.00 0.00 O ATOM 99 O5' C A 45 -0.058 9.239 2.411 1.00 0.00 O ATOM 100 C5' C A 45 0.174 10.191 1.373 1.00 0.00 C ATOM 101 C4' C A 45 -0.360 9.713 0.022 1.00 0.00 C ATOM 102 O4' C A 45 0.367 8.570 -0.421 1.00 0.00 O ATOM 103 C3' C A 45 -1.815 9.281 0.003 1.00 0.00 C ATOM 104 O3' C A 45 -2.687 10.411 -0.102 1.00 0.00 O ATOM 105 C2' C A 45 -1.856 8.461 -1.270 1.00 0.00 C ATOM 106 O2' C A 45 -1.955 9.289 -2.435 1.00 0.00 O ATOM 107 C1' C A 45 -0.514 7.747 -1.211 1.00 0.00 C ATOM 108 N1 C A 45 -0.594 6.422 -0.575 1.00 0.00 N ATOM 109 C2 C A 45 -0.982 5.368 -1.374 1.00 0.00 C ATOM 110 O2 C A 45 -1.270 5.574 -2.553 1.00 0.00 O ATOM 111 N3 C A 45 -1.043 4.125 -0.818 1.00 0.00 N ATOM 112 C4 C A 45 -0.731 3.929 0.469 1.00 0.00 C ATOM 113 N4 C A 45 -0.784 2.696 0.974 1.00 0.00 N ATOM 114 C5 C A 45 -0.338 5.024 1.302 1.00 0.00 C ATOM 115 C6 C A 45 -0.289 6.248 0.742 1.00 0.00 C ATOM 0 H5' C A 45 1.244 10.384 1.291 1.00 0.00 H new ATOM 0 H5'' C A 45 -0.301 11.136 1.636 1.00 0.00 H new ATOM 0 H4' C A 45 -0.247 10.591 -0.614 1.00 0.00 H new ATOM 0 H3' C A 45 -2.136 8.751 0.900 1.00 0.00 H new ATOM 0 H2' C A 45 -2.716 7.795 -1.338 1.00 0.00 H new ATOM 0 HO2' C A 45 -2.056 10.225 -2.163 1.00 0.00 H new ATOM 0 H1' C A 45 -0.161 7.595 -2.231 1.00 0.00 H new ATOM 0 H41 C A 45 -0.548 2.535 1.953 1.00 0.00 H new ATOM 0 H42 C A 45 -1.060 1.913 0.381 1.00 0.00 H new ATOM 0 H5 C A 45 -0.090 4.874 2.342 1.00 0.00 H new ATOM 0 H6 C A 45 -0.005 7.100 1.342 1.00 0.00 H new ATOM 127 P U A 46 -4.190 10.338 0.486 1.00 0.00 P ATOM 128 OP1 U A 46 -4.802 11.679 0.359 1.00 0.00 O ATOM 129 OP2 U A 46 -4.133 9.677 1.809 1.00 0.00 O ATOM 130 O5' U A 46 -4.937 9.341 -0.541 1.00 0.00 O ATOM 131 C5' U A 46 -5.126 9.718 -1.906 1.00 0.00 C ATOM 132 C4' U A 46 -5.788 8.610 -2.731 1.00 0.00 C ATOM 133 O4' U A 46 -4.927 7.471 -2.816 1.00 0.00 O ATOM 134 C3' U A 46 -7.091 8.072 -2.169 1.00 0.00 C ATOM 135 O3' U A 46 -8.179 8.944 -2.517 1.00 0.00 O ATOM 136 C2' U A 46 -7.195 6.753 -2.909 1.00 0.00 C ATOM 137 O2' U A 46 -7.704 6.931 -4.236 1.00 0.00 O ATOM 138 C1' U A 46 -5.742 6.286 -2.924 1.00 0.00 C ATOM 139 N1 U A 46 -5.408 5.395 -1.795 1.00 0.00 N ATOM 140 C2 U A 46 -5.701 4.052 -1.937 1.00 0.00 C ATOM 141 O2 U A 46 -6.201 3.595 -2.961 1.00 0.00 O ATOM 142 N3 U A 46 -5.406 3.249 -0.855 1.00 0.00 N ATOM 143 C4 U A 46 -4.854 3.661 0.342 1.00 0.00 C ATOM 144 O4 U A 46 -4.634 2.852 1.238 1.00 0.00 O ATOM 145 C5 U A 46 -4.582 5.077 0.408 1.00 0.00 C ATOM 146 C6 U A 46 -4.861 5.888 -0.642 1.00 0.00 C ATOM 0 H5' U A 46 -4.162 9.969 -2.348 1.00 0.00 H new ATOM 0 H5'' U A 46 -5.741 10.617 -1.950 1.00 0.00 H new ATOM 0 H4' U A 46 -5.986 9.092 -3.688 1.00 0.00 H new ATOM 0 H3' U A 46 -7.123 7.982 -1.083 1.00 0.00 H new ATOM 0 H2' U A 46 -7.881 6.043 -2.447 1.00 0.00 H new ATOM 0 HO2' U A 46 -8.034 7.848 -4.340 1.00 0.00 H new ATOM 0 H1' U A 46 -5.569 5.721 -3.840 1.00 0.00 H new ATOM 0 H3 U A 46 -5.616 2.255 -0.948 1.00 0.00 H new ATOM 0 H5 U A 46 -4.151 5.496 1.305 1.00 0.00 H new ATOM 0 H6 U A 46 -4.647 6.944 -0.567 1.00 0.00 H new ATOM 157 P C A 47 -9.489 9.053 -1.573 1.00 0.00 P ATOM 158 OP1 C A 47 -10.341 10.139 -2.106 1.00 0.00 O ATOM 159 OP2 C A 47 -9.031 9.107 -0.167 1.00 0.00 O ATOM 160 O5' C A 47 -10.269 7.655 -1.791 1.00 0.00 O ATOM 161 C5' C A 47 -10.854 7.338 -3.059 1.00 0.00 C ATOM 162 C4' C A 47 -11.414 5.913 -3.103 1.00 0.00 C ATOM 163 O4' C A 47 -10.369 4.968 -3.025 1.00 0.00 O ATOM 164 C3' C A 47 -12.387 5.539 -1.998 1.00 0.00 C ATOM 165 O3' C A 47 -13.697 6.021 -2.334 1.00 0.00 O ATOM 166 C2' C A 47 -12.334 4.017 -2.041 1.00 0.00 C ATOM 167 O2' C A 47 -13.269 3.501 -2.992 1.00 0.00 O ATOM 168 C1' C A 47 -10.887 3.741 -2.483 1.00 0.00 C ATOM 169 N1 C A 47 -9.978 3.366 -1.395 1.00 0.00 N ATOM 170 C2 C A 47 -9.921 2.037 -1.032 1.00 0.00 C ATOM 171 O2 C A 47 -10.645 1.216 -1.595 1.00 0.00 O ATOM 172 N3 C A 47 -9.041 1.679 -0.053 1.00 0.00 N ATOM 173 C4 C A 47 -8.258 2.595 0.537 1.00 0.00 C ATOM 174 N4 C A 47 -7.396 2.213 1.479 1.00 0.00 N ATOM 175 C5 C A 47 -8.333 3.973 0.167 1.00 0.00 C ATOM 176 C6 C A 47 -9.208 4.309 -0.795 1.00 0.00 C ATOM 0 H5' C A 47 -10.104 7.455 -3.842 1.00 0.00 H new ATOM 0 H5'' C A 47 -11.654 8.047 -3.275 1.00 0.00 H new ATOM 0 H4' C A 47 -11.956 5.896 -4.048 1.00 0.00 H new ATOM 0 H3' C A 47 -12.152 5.952 -1.017 1.00 0.00 H new ATOM 0 H2' C A 47 -12.593 3.546 -1.093 1.00 0.00 H new ATOM 0 HO2' C A 47 -13.369 2.535 -2.862 1.00 0.00 H new ATOM 0 H1' C A 47 -10.929 2.907 -3.183 1.00 0.00 H new ATOM 0 H41 C A 47 -6.797 2.903 1.932 1.00 0.00 H new ATOM 0 H42 C A 47 -7.335 1.231 1.746 1.00 0.00 H new ATOM 0 H5 C A 47 -7.710 4.716 0.643 1.00 0.00 H new ATOM 0 H6 C A 47 -9.300 5.342 -1.095 1.00 0.00 H new ATOM 188 P U A 48 -14.794 6.397 -1.208 1.00 0.00 P ATOM 189 OP1 U A 48 -15.958 7.005 -1.891 1.00 0.00 O ATOM 190 OP2 U A 48 -14.105 7.146 -0.133 1.00 0.00 O ATOM 191 O5' U A 48 -15.263 4.974 -0.602 1.00 0.00 O ATOM 192 C5' U A 48 -16.591 4.842 -0.067 1.00 0.00 C ATOM 193 C4' U A 48 -16.907 3.416 0.389 1.00 0.00 C ATOM 194 O4' U A 48 -17.002 2.531 -0.743 1.00 0.00 O ATOM 195 C3' U A 48 -15.862 2.828 1.341 1.00 0.00 C ATOM 196 O3' U A 48 -16.545 2.036 2.332 1.00 0.00 O ATOM 197 C2' U A 48 -15.060 1.934 0.409 1.00 0.00 C ATOM 198 O2' U A 48 -14.401 0.879 1.109 1.00 0.00 O ATOM 199 C1' U A 48 -16.144 1.416 -0.503 1.00 0.00 C ATOM 200 N1 U A 48 -15.675 0.884 -1.807 1.00 0.00 N ATOM 201 C2 U A 48 -16.000 -0.426 -2.129 1.00 0.00 C ATOM 202 O2 U A 48 -16.645 -1.144 -1.369 1.00 0.00 O ATOM 203 N3 U A 48 -15.552 -0.882 -3.355 1.00 0.00 N ATOM 204 C4 U A 48 -14.820 -0.157 -4.278 1.00 0.00 C ATOM 205 O4 U A 48 -14.465 -0.668 -5.338 1.00 0.00 O ATOM 206 C5 U A 48 -14.530 1.197 -3.864 1.00 0.00 C ATOM 207 C6 U A 48 -14.957 1.667 -2.666 1.00 0.00 C ATOM 0 H5' U A 48 -17.315 5.145 -0.824 1.00 0.00 H new ATOM 0 H5'' U A 48 -16.707 5.523 0.776 1.00 0.00 H new ATOM 0 H4' U A 48 -17.855 3.493 0.921 1.00 0.00 H new ATOM 0 H3' U A 48 -15.252 3.559 1.872 1.00 0.00 H new ATOM 0 H2' U A 48 -14.248 2.446 -0.107 1.00 0.00 H new ATOM 0 HO2' U A 48 -13.438 1.057 1.138 1.00 0.00 H new ATOM 0 H1' U A 48 -16.624 0.568 -0.014 1.00 0.00 H new ATOM 0 H3 U A 48 -15.783 -1.844 -3.602 1.00 0.00 H new ATOM 0 H5 U A 48 -13.965 1.844 -4.519 1.00 0.00 H new ATOM 0 H6 U A 48 -14.724 2.683 -2.384 1.00 0.00 H new ATOM 218 P U A 49 -16.010 1.830 3.849 1.00 0.00 P ATOM 219 OP1 U A 49 -17.041 1.080 4.602 1.00 0.00 O ATOM 220 OP2 U A 49 -15.548 3.143 4.352 1.00 0.00 O ATOM 221 O5' U A 49 -14.722 0.881 3.691 1.00 0.00 O ATOM 222 C5' U A 49 -14.840 -0.440 3.167 1.00 0.00 C ATOM 223 C4' U A 49 -13.467 -1.079 2.993 1.00 0.00 C ATOM 224 O4' U A 49 -12.667 -0.243 2.137 1.00 0.00 O ATOM 225 C3' U A 49 -12.671 -1.256 4.284 1.00 0.00 C ATOM 226 O3' U A 49 -11.991 -2.500 4.183 1.00 0.00 O ATOM 227 C2' U A 49 -11.672 -0.125 4.304 1.00 0.00 C ATOM 228 O2' U A 49 -10.441 -0.522 4.918 1.00 0.00 O ATOM 229 C1' U A 49 -11.483 0.189 2.838 1.00 0.00 C ATOM 230 N1 U A 49 -11.282 1.626 2.592 1.00 0.00 N ATOM 231 C2 U A 49 -10.005 2.125 2.752 1.00 0.00 C ATOM 232 O2 U A 49 -9.059 1.409 3.074 1.00 0.00 O ATOM 233 N3 U A 49 -9.851 3.482 2.530 1.00 0.00 N ATOM 234 C4 U A 49 -10.850 4.365 2.160 1.00 0.00 C ATOM 235 O4 U A 49 -10.600 5.555 1.983 1.00 0.00 O ATOM 236 C5 U A 49 -12.150 3.753 2.015 1.00 0.00 C ATOM 237 C6 U A 49 -12.322 2.429 2.236 1.00 0.00 C ATOM 0 H5' U A 49 -15.356 -0.410 2.208 1.00 0.00 H new ATOM 0 H5'' U A 49 -15.447 -1.049 3.837 1.00 0.00 H new ATOM 0 H4' U A 49 -13.665 -2.070 2.584 1.00 0.00 H new ATOM 0 H3' U A 49 -13.287 -1.246 5.183 1.00 0.00 H new ATOM 0 H2' U A 49 -12.010 0.733 4.885 1.00 0.00 H new ATOM 0 HO2' U A 49 -10.631 -1.062 5.714 1.00 0.00 H new ATOM 0 H1' U A 49 -10.590 -0.329 2.488 1.00 0.00 H new ATOM 0 H3 U A 49 -8.914 3.867 2.650 1.00 0.00 H new ATOM 0 H5 U A 49 -12.996 4.360 1.727 1.00 0.00 H new ATOM 0 H6 U A 49 -13.307 2.000 2.127 1.00 0.00 H new ATOM 248 P G A 50 -11.384 -3.281 5.444 1.00 0.00 P ATOM 249 OP1 G A 50 -12.472 -3.530 6.416 1.00 0.00 O ATOM 250 OP2 G A 50 -10.137 -2.607 5.868 1.00 0.00 O ATOM 251 O5' G A 50 -11.004 -4.665 4.729 1.00 0.00 O ATOM 252 C5' G A 50 -12.043 -5.539 4.288 1.00 0.00 C ATOM 253 C4' G A 50 -11.531 -6.573 3.303 1.00 0.00 C ATOM 254 O4' G A 50 -11.246 -5.912 2.076 1.00 0.00 O ATOM 255 C3' G A 50 -10.264 -7.292 3.744 1.00 0.00 C ATOM 256 O3' G A 50 -10.545 -8.647 4.055 1.00 0.00 O ATOM 257 C2' G A 50 -9.375 -7.249 2.507 1.00 0.00 C ATOM 258 O2' G A 50 -9.581 -8.401 1.681 1.00 0.00 O ATOM 259 C1' G A 50 -9.850 -5.988 1.814 1.00 0.00 C ATOM 260 N9 G A 50 -9.226 -4.746 2.310 1.00 0.00 N ATOM 261 C8 G A 50 -8.441 -4.551 3.418 1.00 0.00 C ATOM 262 N7 G A 50 -7.962 -3.346 3.524 1.00 0.00 N ATOM 263 C5 G A 50 -8.460 -2.691 2.407 1.00 0.00 C ATOM 264 C6 G A 50 -8.279 -1.347 1.989 1.00 0.00 C ATOM 265 O6 G A 50 -7.608 -0.469 2.531 1.00 0.00 O ATOM 266 N1 G A 50 -8.968 -1.086 0.807 1.00 0.00 N ATOM 267 C2 G A 50 -9.729 -2.011 0.114 1.00 0.00 C ATOM 268 N2 G A 50 -10.322 -1.586 -1.001 1.00 0.00 N ATOM 269 N3 G A 50 -9.890 -3.274 0.508 1.00 0.00 N ATOM 270 C4 G A 50 -9.233 -3.540 1.658 1.00 0.00 C ATOM 0 H5' G A 50 -12.836 -4.954 3.822 1.00 0.00 H new ATOM 0 H5'' G A 50 -12.483 -6.043 5.148 1.00 0.00 H new ATOM 0 H4' G A 50 -12.311 -7.329 3.217 1.00 0.00 H new ATOM 0 H3' G A 50 -9.816 -6.837 4.627 1.00 0.00 H new ATOM 0 H2' G A 50 -8.309 -7.249 2.735 1.00 0.00 H new ATOM 0 HO2' G A 50 -9.028 -9.141 2.008 1.00 0.00 H new ATOM 0 H1' G A 50 -9.585 -6.056 0.759 1.00 0.00 H new ATOM 0 H8 G A 50 -8.238 -5.329 4.139 1.00 0.00 H new ATOM 0 H1 G A 50 -8.907 -0.143 0.424 1.00 0.00 H new ATOM 0 H21 G A 50 -10.895 -2.227 -1.550 1.00 0.00 H new ATOM 0 H22 G A 50 -10.203 -0.620 -1.305 1.00 0.00 H new ATOM 282 P U A 51 -9.353 -9.571 4.590 1.00 0.00 P ATOM 283 OP1 U A 51 -9.922 -10.876 4.995 1.00 0.00 O ATOM 284 OP2 U A 51 -8.543 -8.785 5.547 1.00 0.00 O ATOM 285 O5' U A 51 -8.492 -9.788 3.252 1.00 0.00 O ATOM 286 C5' U A 51 -7.112 -10.137 3.319 1.00 0.00 C ATOM 287 C4' U A 51 -6.595 -10.546 1.951 1.00 0.00 C ATOM 288 O4' U A 51 -7.274 -11.736 1.545 1.00 0.00 O ATOM 289 C3' U A 51 -6.796 -9.512 0.846 1.00 0.00 C ATOM 290 O3' U A 51 -5.657 -9.575 -0.015 1.00 0.00 O ATOM 291 C2' U A 51 -8.044 -9.966 0.113 1.00 0.00 C ATOM 292 O2' U A 51 -7.931 -9.736 -1.295 1.00 0.00 O ATOM 293 C1' U A 51 -8.116 -11.463 0.417 1.00 0.00 C ATOM 294 N1 U A 51 -9.478 -11.979 0.732 1.00 0.00 N ATOM 295 C2 U A 51 -9.896 -13.124 0.070 1.00 0.00 C ATOM 296 O2 U A 51 -9.192 -13.685 -0.767 1.00 0.00 O ATOM 297 N3 U A 51 -11.152 -13.599 0.398 1.00 0.00 N ATOM 298 C4 U A 51 -12.022 -13.041 1.316 1.00 0.00 C ATOM 299 O4 U A 51 -13.117 -13.554 1.533 1.00 0.00 O ATOM 300 C5 U A 51 -11.513 -11.851 1.961 1.00 0.00 C ATOM 301 C6 U A 51 -10.283 -11.364 1.661 1.00 0.00 C ATOM 0 H5' U A 51 -6.973 -10.955 4.026 1.00 0.00 H new ATOM 0 H5'' U A 51 -6.536 -9.291 3.693 1.00 0.00 H new ATOM 0 H4' U A 51 -5.520 -10.675 2.073 1.00 0.00 H new ATOM 0 H3' U A 51 -6.902 -8.490 1.208 1.00 0.00 H new ATOM 0 H2' U A 51 -8.936 -9.424 0.428 1.00 0.00 H new ATOM 0 HO2' U A 51 -8.748 -10.039 -1.743 1.00 0.00 H new ATOM 0 H1' U A 51 -7.797 -11.968 -0.495 1.00 0.00 H new ATOM 0 H3 U A 51 -11.467 -14.441 -0.083 1.00 0.00 H new ATOM 0 H5 U A 51 -12.122 -11.342 2.693 1.00 0.00 H new ATOM 0 H6 U A 51 -9.929 -10.475 2.162 1.00 0.00 H new ATOM 312 P A A 52 -4.588 -8.379 -0.150 1.00 0.00 P ATOM 313 OP1 A A 52 -3.442 -8.876 -0.944 1.00 0.00 O ATOM 314 OP2 A A 52 -4.358 -7.808 1.195 1.00 0.00 O ATOM 315 O5' A A 52 -5.366 -7.285 -1.033 1.00 0.00 O ATOM 316 C5' A A 52 -6.291 -7.707 -2.032 1.00 0.00 C ATOM 317 C4' A A 52 -6.736 -6.554 -2.916 1.00 0.00 C ATOM 318 O4' A A 52 -7.475 -5.567 -2.184 1.00 0.00 O ATOM 319 C3' A A 52 -5.577 -5.810 -3.548 1.00 0.00 C ATOM 320 O3' A A 52 -5.144 -6.522 -4.711 1.00 0.00 O ATOM 321 C2' A A 52 -6.222 -4.493 -3.919 1.00 0.00 C ATOM 322 O2' A A 52 -6.962 -4.596 -5.142 1.00 0.00 O ATOM 323 C1' A A 52 -7.140 -4.270 -2.724 1.00 0.00 C ATOM 324 N9 A A 52 -6.521 -3.488 -1.645 1.00 0.00 N ATOM 325 C8 A A 52 -6.003 -3.921 -0.449 1.00 0.00 C ATOM 326 N7 A A 52 -5.552 -2.956 0.305 1.00 0.00 N ATOM 327 C5 A A 52 -5.789 -1.807 -0.448 1.00 0.00 C ATOM 328 C6 A A 52 -5.536 -0.447 -0.213 1.00 0.00 C ATOM 329 N6 A A 52 -4.968 0.005 0.900 1.00 0.00 N ATOM 330 N1 A A 52 -5.894 0.423 -1.172 1.00 0.00 N ATOM 331 C2 A A 52 -6.461 -0.034 -2.281 1.00 0.00 C ATOM 332 N3 A A 52 -6.751 -1.279 -2.617 1.00 0.00 N ATOM 333 C4 A A 52 -6.380 -2.126 -1.635 1.00 0.00 C ATOM 0 H5' A A 52 -7.162 -8.155 -1.554 1.00 0.00 H new ATOM 0 H5'' A A 52 -5.832 -8.481 -2.648 1.00 0.00 H new ATOM 0 H4' A A 52 -7.350 -7.030 -3.680 1.00 0.00 H new ATOM 0 H3' A A 52 -4.698 -5.693 -2.914 1.00 0.00 H new ATOM 0 H2' A A 52 -5.516 -3.682 -4.099 1.00 0.00 H new ATOM 0 HO2' A A 52 -6.899 -5.511 -5.486 1.00 0.00 H new ATOM 0 H1' A A 52 -8.006 -3.710 -3.078 1.00 0.00 H new ATOM 0 H8 A A 52 -5.972 -4.961 -0.160 1.00 0.00 H new ATOM 0 H61 A A 52 -4.806 1.005 1.020 1.00 0.00 H new ATOM 0 H62 A A 52 -4.694 -0.648 1.634 1.00 0.00 H new ATOM 0 H2 A A 52 -6.722 0.717 -3.012 1.00 0.00 H new ATOM 345 P G A 53 -3.627 -6.422 -5.240 1.00 0.00 P ATOM 346 OP1 G A 53 -3.468 -7.357 -6.376 1.00 0.00 O ATOM 347 OP2 G A 53 -2.720 -6.516 -4.073 1.00 0.00 O ATOM 348 O5' G A 53 -3.564 -4.923 -5.806 1.00 0.00 O ATOM 349 C5' G A 53 -4.360 -4.545 -6.927 1.00 0.00 C ATOM 350 C4' G A 53 -4.256 -3.050 -7.188 1.00 0.00 C ATOM 351 O4' G A 53 -4.810 -2.319 -6.095 1.00 0.00 O ATOM 352 C3' G A 53 -2.838 -2.536 -7.331 1.00 0.00 C ATOM 353 O3' G A 53 -2.350 -2.770 -8.655 1.00 0.00 O ATOM 354 C2' G A 53 -3.044 -1.054 -7.082 1.00 0.00 C ATOM 355 O2' G A 53 -3.542 -0.388 -8.248 1.00 0.00 O ATOM 356 C1' G A 53 -4.084 -1.084 -5.963 1.00 0.00 C ATOM 357 N9 G A 53 -3.484 -1.038 -4.618 1.00 0.00 N ATOM 358 C8 G A 53 -3.151 -2.069 -3.778 1.00 0.00 C ATOM 359 N7 G A 53 -2.583 -1.684 -2.669 1.00 0.00 N ATOM 360 C5 G A 53 -2.534 -0.299 -2.783 1.00 0.00 C ATOM 361 C6 G A 53 -2.018 0.673 -1.883 1.00 0.00 C ATOM 362 O6 G A 53 -1.505 0.490 -0.776 1.00 0.00 O ATOM 363 N1 G A 53 -2.162 1.962 -2.392 1.00 0.00 N ATOM 364 C2 G A 53 -2.738 2.272 -3.613 1.00 0.00 C ATOM 365 N2 G A 53 -2.799 3.562 -3.941 1.00 0.00 N ATOM 366 N3 G A 53 -3.221 1.357 -4.450 1.00 0.00 N ATOM 367 C4 G A 53 -3.085 0.102 -3.974 1.00 0.00 C ATOM 0 H5' G A 53 -5.401 -4.815 -6.747 1.00 0.00 H new ATOM 0 H5'' G A 53 -4.036 -5.096 -7.810 1.00 0.00 H new ATOM 0 H4' G A 53 -4.790 -2.904 -8.127 1.00 0.00 H new ATOM 0 H3' G A 53 -2.112 -3.007 -6.668 1.00 0.00 H new ATOM 0 H2' G A 53 -2.133 -0.511 -6.831 1.00 0.00 H new ATOM 0 HO2' G A 53 -3.578 -1.021 -8.996 1.00 0.00 H new ATOM 0 H1' G A 53 -4.720 -0.204 -6.060 1.00 0.00 H new ATOM 0 H8 G A 53 -3.342 -3.106 -4.013 1.00 0.00 H new ATOM 0 H1 G A 53 -1.817 2.735 -1.823 1.00 0.00 H new ATOM 0 H21 G A 53 -3.214 3.843 -4.829 1.00 0.00 H new ATOM 0 H22 G A 53 -2.431 4.268 -3.304 1.00 0.00 H new ATOM 379 P A A 54 -0.772 -2.971 -8.914 1.00 0.00 P ATOM 380 OP1 A A 54 -0.574 -3.297 -10.344 1.00 0.00 O ATOM 381 OP2 A A 54 -0.243 -3.876 -7.870 1.00 0.00 O ATOM 382 O5' A A 54 -0.185 -1.500 -8.647 1.00 0.00 O ATOM 383 C5' A A 54 -0.532 -0.411 -9.498 1.00 0.00 C ATOM 384 C4' A A 54 -0.007 0.907 -8.945 1.00 0.00 C ATOM 385 O4' A A 54 -0.640 1.220 -7.701 1.00 0.00 O ATOM 386 C3' A A 54 1.478 0.938 -8.636 1.00 0.00 C ATOM 387 O3' A A 54 2.245 1.179 -9.814 1.00 0.00 O ATOM 388 C2' A A 54 1.559 2.140 -7.726 1.00 0.00 C ATOM 389 O2' A A 54 1.591 3.365 -8.467 1.00 0.00 O ATOM 390 C1' A A 54 0.280 2.009 -6.921 1.00 0.00 C ATOM 391 N9 A A 54 0.490 1.351 -5.623 1.00 0.00 N ATOM 392 C8 A A 54 0.291 0.044 -5.262 1.00 0.00 C ATOM 393 N7 A A 54 0.580 -0.207 -4.014 1.00 0.00 N ATOM 394 C5 A A 54 1.004 1.023 -3.521 1.00 0.00 C ATOM 395 C6 A A 54 1.455 1.436 -2.259 1.00 0.00 C ATOM 396 N6 A A 54 1.552 0.617 -1.211 1.00 0.00 N ATOM 397 N1 A A 54 1.801 2.728 -2.123 1.00 0.00 N ATOM 398 C2 A A 54 1.703 3.541 -3.168 1.00 0.00 C ATOM 399 N3 A A 54 1.291 3.273 -4.393 1.00 0.00 N ATOM 400 C4 A A 54 0.953 1.973 -4.497 1.00 0.00 C ATOM 0 H5' A A 54 -1.616 -0.359 -9.603 1.00 0.00 H new ATOM 0 H5'' A A 54 -0.123 -0.579 -10.494 1.00 0.00 H new ATOM 0 H4' A A 54 -0.223 1.614 -9.746 1.00 0.00 H new ATOM 0 H3' A A 54 1.860 0.008 -8.216 1.00 0.00 H new ATOM 0 H2' A A 54 2.463 2.168 -7.117 1.00 0.00 H new ATOM 0 HO2' A A 54 1.576 3.167 -9.427 1.00 0.00 H new ATOM 0 H1' A A 54 -0.102 3.008 -6.713 1.00 0.00 H new ATOM 0 H8 A A 54 -0.071 -0.709 -5.947 1.00 0.00 H new ATOM 0 H61 A A 54 1.887 0.972 -0.315 1.00 0.00 H new ATOM 0 H62 A A 54 1.291 -0.365 -1.305 1.00 0.00 H new ATOM 0 H2 A A 54 2.002 4.564 -2.991 1.00 0.00 H new ATOM 412 P U A 55 3.768 0.666 -9.920 1.00 0.00 P ATOM 413 OP1 U A 55 4.283 0.996 -11.267 1.00 0.00 O ATOM 414 OP2 U A 55 3.833 -0.724 -9.417 1.00 0.00 O ATOM 415 O5' U A 55 4.486 1.628 -8.850 1.00 0.00 O ATOM 416 C5' U A 55 4.518 3.036 -9.058 1.00 0.00 C ATOM 417 C4' U A 55 5.071 3.770 -7.840 1.00 0.00 C ATOM 418 O4' U A 55 4.215 3.557 -6.721 1.00 0.00 O ATOM 419 C3' U A 55 6.431 3.305 -7.359 1.00 0.00 C ATOM 420 O3' U A 55 7.473 3.898 -8.142 1.00 0.00 O ATOM 421 C2' U A 55 6.453 3.862 -5.948 1.00 0.00 C ATOM 422 O2' U A 55 6.872 5.231 -5.927 1.00 0.00 O ATOM 423 C1' U A 55 4.993 3.719 -5.519 1.00 0.00 C ATOM 424 N1 U A 55 4.770 2.551 -4.650 1.00 0.00 N ATOM 425 C2 U A 55 5.027 2.722 -3.309 1.00 0.00 C ATOM 426 O2 U A 55 5.401 3.800 -2.852 1.00 0.00 O ATOM 427 N3 U A 55 4.838 1.614 -2.509 1.00 0.00 N ATOM 428 C4 U A 55 4.416 0.366 -2.922 1.00 0.00 C ATOM 429 O4 U A 55 4.267 -0.543 -2.103 1.00 0.00 O ATOM 430 C5 U A 55 4.173 0.272 -4.348 1.00 0.00 C ATOM 431 C6 U A 55 4.359 1.346 -5.154 1.00 0.00 C ATOM 0 H5' U A 55 3.512 3.396 -9.275 1.00 0.00 H new ATOM 0 H5'' U A 55 5.132 3.262 -9.930 1.00 0.00 H new ATOM 0 H4' U A 55 5.144 4.804 -8.176 1.00 0.00 H new ATOM 0 H3' U A 55 6.585 2.228 -7.424 1.00 0.00 H new ATOM 0 H2' U A 55 7.155 3.349 -5.290 1.00 0.00 H new ATOM 0 HO2' U A 55 7.060 5.529 -6.841 1.00 0.00 H new ATOM 0 H1' U A 55 4.706 4.602 -4.948 1.00 0.00 H new ATOM 0 H3 U A 55 5.029 1.728 -1.514 1.00 0.00 H new ATOM 0 H5 U A 55 3.840 -0.664 -4.773 1.00 0.00 H new ATOM 0 H6 U A 55 4.179 1.249 -6.215 1.00 0.00 H new ATOM 442 P C A 56 8.891 3.148 -8.323 1.00 0.00 P ATOM 443 OP1 C A 56 9.708 3.932 -9.275 1.00 0.00 O ATOM 444 OP2 C A 56 8.625 1.717 -8.588 1.00 0.00 O ATOM 445 O5' C A 56 9.568 3.270 -6.864 1.00 0.00 O ATOM 446 C5' C A 56 9.943 4.544 -6.340 1.00 0.00 C ATOM 447 C4' C A 56 10.502 4.436 -4.921 1.00 0.00 C ATOM 448 O4' C A 56 9.497 3.993 -4.019 1.00 0.00 O ATOM 449 C3' C A 56 11.634 3.446 -4.757 1.00 0.00 C ATOM 450 O3' C A 56 12.865 4.041 -5.180 1.00 0.00 O ATOM 451 C2' C A 56 11.631 3.224 -3.253 1.00 0.00 C ATOM 452 O2' C A 56 12.428 4.204 -2.577 1.00 0.00 O ATOM 453 C1' C A 56 10.147 3.369 -2.896 1.00 0.00 C ATOM 454 N1 C A 56 9.478 2.079 -2.641 1.00 0.00 N ATOM 455 C2 C A 56 9.606 1.544 -1.372 1.00 0.00 C ATOM 456 O2 C A 56 10.243 2.154 -0.515 1.00 0.00 O ATOM 457 N3 C A 56 9.018 0.341 -1.113 1.00 0.00 N ATOM 458 C4 C A 56 8.336 -0.307 -2.069 1.00 0.00 C ATOM 459 N4 C A 56 7.771 -1.481 -1.791 1.00 0.00 N ATOM 460 C5 C A 56 8.205 0.244 -3.382 1.00 0.00 C ATOM 461 C6 C A 56 8.789 1.433 -3.623 1.00 0.00 C ATOM 0 H5' C A 56 9.077 5.205 -6.339 1.00 0.00 H new ATOM 0 H5'' C A 56 10.690 4.998 -6.991 1.00 0.00 H new ATOM 0 H4' C A 56 10.866 5.442 -4.713 1.00 0.00 H new ATOM 0 H3' C A 56 11.525 2.530 -5.337 1.00 0.00 H new ATOM 0 H2' C A 56 12.056 2.265 -2.958 1.00 0.00 H new ATOM 0 HO2' C A 56 12.405 4.035 -1.612 1.00 0.00 H new ATOM 0 H1' C A 56 10.078 3.954 -1.979 1.00 0.00 H new ATOM 0 H41 C A 56 7.251 -1.980 -2.512 1.00 0.00 H new ATOM 0 H42 C A 56 7.859 -1.881 -0.857 1.00 0.00 H new ATOM 0 H5 C A 56 7.657 -0.276 -4.154 1.00 0.00 H new ATOM 0 H6 C A 56 8.711 1.879 -4.604 1.00 0.00 H new ATOM 473 P A A 57 14.066 3.129 -5.748 1.00 0.00 P ATOM 474 OP1 A A 57 15.137 4.029 -6.233 1.00 0.00 O ATOM 475 OP2 A A 57 13.485 2.119 -6.661 1.00 0.00 O ATOM 476 O5' A A 57 14.604 2.370 -4.433 1.00 0.00 O ATOM 477 C5' A A 57 15.216 3.117 -3.381 1.00 0.00 C ATOM 478 C4' A A 57 15.609 2.234 -2.196 1.00 0.00 C ATOM 479 O4' A A 57 14.451 1.704 -1.561 1.00 0.00 O ATOM 480 C3' A A 57 16.466 1.035 -2.551 1.00 0.00 C ATOM 481 O3' A A 57 17.846 1.394 -2.694 1.00 0.00 O ATOM 482 C2' A A 57 16.236 0.117 -1.361 1.00 0.00 C ATOM 483 O2' A A 57 17.194 0.363 -0.325 1.00 0.00 O ATOM 484 C1' A A 57 14.816 0.477 -0.906 1.00 0.00 C ATOM 485 N9 A A 57 13.807 -0.538 -1.262 1.00 0.00 N ATOM 486 C8 A A 57 13.009 -0.599 -2.375 1.00 0.00 C ATOM 487 N7 A A 57 12.257 -1.662 -2.429 1.00 0.00 N ATOM 488 C5 A A 57 12.577 -2.357 -1.268 1.00 0.00 C ATOM 489 C6 A A 57 12.120 -3.574 -0.734 1.00 0.00 C ATOM 490 N6 A A 57 11.209 -4.338 -1.337 1.00 0.00 N ATOM 491 N1 A A 57 12.644 -3.969 0.438 1.00 0.00 N ATOM 492 C2 A A 57 13.555 -3.205 1.030 1.00 0.00 C ATOM 493 N3 A A 57 14.065 -2.049 0.630 1.00 0.00 N ATOM 494 C4 A A 57 13.519 -1.679 -0.548 1.00 0.00 C ATOM 0 H5' A A 57 14.529 3.892 -3.042 1.00 0.00 H new ATOM 0 H5'' A A 57 16.102 3.622 -3.765 1.00 0.00 H new ATOM 0 H4' A A 57 16.185 2.901 -1.555 1.00 0.00 H new ATOM 0 H3' A A 57 16.209 0.579 -3.507 1.00 0.00 H new ATOM 0 H2' A A 57 16.346 -0.939 -1.609 1.00 0.00 H new ATOM 0 HO2' A A 57 17.934 0.896 -0.684 1.00 0.00 H new ATOM 0 HO3' A A 57 18.369 0.597 -2.921 1.00 0.00 H new ATOM 0 H1' A A 57 14.829 0.553 0.181 1.00 0.00 H new ATOM 0 H8 A A 57 13.004 0.165 -3.138 1.00 0.00 H new ATOM 0 H61 A A 57 10.912 -5.213 -0.906 1.00 0.00 H new ATOM 0 H62 A A 57 10.809 -4.047 -2.229 1.00 0.00 H new ATOM 0 H2 A A 57 13.934 -3.578 1.970 1.00 0.00 H new TER 507 A A 57