USER MOD reduce.3.24.130724 H: found=0, std=0, add=154, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 156 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 7:sc= -1.23 USER MOD Single : A 2 G O2' : rot 180:sc= -1.85! USER MOD Single : A 3 G O2' : rot 180:sc= -1.8! USER MOD Single : A 4 U O2' : rot 8:sc= -1.69! USER MOD Single : A 5 G O2' : rot 5:sc= -3.2! USER MOD Single : A 6 U O2' : rot 163:sc= -3.31! USER MOD Single : A 7 A O2' : rot 24:sc= 0.273 USER MOD Single : A 7 A O3' : rot -174:sc= 0.254 USER MOD Single : B 17 A O2' : rot 5:sc= -3.39! USER MOD Single : B 18 G O2' : rot -1:sc= -1.22 USER MOD Single : B 19 C O2' : rot 3:sc= -0.891 USER MOD Single : B 20 A O2' : rot -1:sc= -0.989 USER MOD Single : B 21 C O2' : rot 180:sc= -1.47! USER MOD Single : B 22 C O2' : rot -124:sc= -0.858 USER MOD Single : B 23 C O2' : rot 34:sc= 0.211 USER MOD Single : B 23 C O3' : rot 38:sc= 0.172 USER MOD ----------------------------------------------------------------- ATOM 1 OP3 G A 1 -37.471 39.034-197.746 1.00 0.00 O ATOM 2 P G A 1 -37.146 37.478-197.489 1.00 0.00 P ATOM 3 OP1 G A 1 -37.862 36.681-198.510 1.00 0.00 O ATOM 4 OP2 G A 1 -35.682 37.331-197.332 1.00 0.00 O ATOM 5 O5' G A 1 -37.836 37.206-196.060 1.00 0.00 O ATOM 6 C5' G A 1 -38.577 36.005-195.830 1.00 0.00 C ATOM 7 C4' G A 1 -39.026 35.889-194.376 1.00 0.00 C ATOM 8 O4' G A 1 -37.882 35.723-193.542 1.00 0.00 O ATOM 9 C3' G A 1 -39.812 37.109-193.801 1.00 0.00 C ATOM 10 O3' G A 1 -41.223 37.014-194.012 1.00 0.00 O ATOM 11 C2' G A 1 -39.511 36.950-192.313 1.00 0.00 C ATOM 12 O2' G A 1 -40.481 36.113-191.675 1.00 0.00 O ATOM 13 C1' G A 1 -38.126 36.319-192.270 1.00 0.00 C ATOM 14 N9 G A 1 -37.039 37.280-192.015 1.00 0.00 N ATOM 15 C8 G A 1 -36.235 37.925-192.918 1.00 0.00 C ATOM 16 N7 G A 1 -35.359 38.721-192.373 1.00 0.00 N ATOM 17 C5 G A 1 -35.598 38.597-191.008 1.00 0.00 C ATOM 18 C6 G A 1 -34.953 39.227-189.910 1.00 0.00 C ATOM 19 O6 G A 1 -34.025 40.033-189.930 1.00 0.00 O ATOM 20 N1 G A 1 -35.500 38.826-188.699 1.00 0.00 N ATOM 21 C2 G A 1 -36.540 37.930-188.559 1.00 0.00 C ATOM 22 N2 G A 1 -36.930 37.668-187.311 1.00 0.00 N ATOM 23 N3 G A 1 -37.148 37.336-189.590 1.00 0.00 N ATOM 24 C4 G A 1 -36.626 37.717-190.779 1.00 0.00 C ATOM 0 H5' G A 1 -37.963 35.143-196.091 1.00 0.00 H new ATOM 0 H5'' G A 1 -39.449 35.985-196.483 1.00 0.00 H new ATOM 0 H4' G A 1 -39.707 35.038-194.377 1.00 0.00 H new ATOM 0 H3' G A 1 -39.527 38.057-194.258 1.00 0.00 H new ATOM 0 H2' G A 1 -39.548 37.901-191.781 1.00 0.00 H new ATOM 0 HO2' G A 1 -41.079 35.732-192.351 1.00 0.00 H new ATOM 0 H1' G A 1 -38.125 35.604-191.447 1.00 0.00 H new ATOM 0 H8 G A 1 -36.320 37.786-193.986 1.00 0.00 H new ATOM 0 H1 G A 1 -35.103 39.224-187.848 1.00 0.00 H new ATOM 0 H21 G A 1 -37.694 37.014-187.142 1.00 0.00 H new ATOM 0 H22 G A 1 -36.464 38.122-186.525 1.00 0.00 H new ATOM 37 P G A 2 -42.118 38.345-194.152 1.00 0.00 P ATOM 38 OP1 G A 2 -43.497 37.941-194.506 1.00 0.00 O ATOM 39 OP2 G A 2 -41.388 39.305-195.010 1.00 0.00 O ATOM 40 O5' G A 2 -42.131 38.920-192.648 1.00 0.00 O ATOM 41 C5' G A 2 -42.762 38.183-191.598 1.00 0.00 C ATOM 42 C4' G A 2 -42.528 38.830-190.234 1.00 0.00 C ATOM 43 O4' G A 2 -41.137 38.790-189.914 1.00 0.00 O ATOM 44 C3' G A 2 -42.923 40.351-190.056 1.00 0.00 C ATOM 45 O3' G A 2 -44.304 40.542-189.740 1.00 0.00 O ATOM 46 C2' G A 2 -42.067 40.733-188.859 1.00 0.00 C ATOM 47 O2' G A 2 -42.746 40.457-187.628 1.00 0.00 O ATOM 48 C1' G A 2 -40.822 39.863-189.013 1.00 0.00 C ATOM 49 N9 G A 2 -39.660 40.584-189.563 1.00 0.00 N ATOM 50 C8 G A 2 -39.216 40.632-190.858 1.00 0.00 C ATOM 51 N7 G A 2 -38.162 41.377-191.030 1.00 0.00 N ATOM 52 C5 G A 2 -37.881 41.860-189.755 1.00 0.00 C ATOM 53 C6 G A 2 -36.843 42.726-189.319 1.00 0.00 C ATOM 54 O6 G A 2 -35.952 43.246-189.987 1.00 0.00 O ATOM 55 N1 G A 2 -36.919 42.964-187.953 1.00 0.00 N ATOM 56 C2 G A 2 -37.874 42.436-187.110 1.00 0.00 C ATOM 57 N2 G A 2 -37.783 42.781-185.825 1.00 0.00 N ATOM 58 N3 G A 2 -38.853 41.622-187.519 1.00 0.00 N ATOM 59 C4 G A 2 -38.793 41.379-188.849 1.00 0.00 C ATOM 0 H5' G A 2 -42.378 37.163-191.588 1.00 0.00 H new ATOM 0 H5'' G A 2 -43.833 38.118-191.791 1.00 0.00 H new ATOM 0 H4' G A 2 -43.186 38.242-189.594 1.00 0.00 H new ATOM 0 H3' G A 2 -42.768 40.935-190.963 1.00 0.00 H new ATOM 0 H2' G A 2 -41.834 41.797-188.829 1.00 0.00 H new ATOM 0 HO2' G A 2 -42.173 40.711-186.874 1.00 0.00 H new ATOM 0 H1' G A 2 -40.549 39.517-188.016 1.00 0.00 H new ATOM 0 H8 G A 2 -39.697 40.099-191.665 1.00 0.00 H new ATOM 0 H1 G A 2 -36.214 43.576-187.542 1.00 0.00 H new ATOM 0 H21 G A 2 -38.460 42.423-185.152 1.00 0.00 H new ATOM 0 H22 G A 2 -37.036 43.403-185.516 1.00 0.00 H new ATOM 71 P G A 3 -45.027 41.943-190.069 1.00 0.00 P ATOM 72 OP1 G A 3 -46.475 41.790-189.806 1.00 0.00 O ATOM 73 OP2 G A 3 -44.562 42.402-191.396 1.00 0.00 O ATOM 74 O5' G A 3 -44.412 42.925-188.952 1.00 0.00 O ATOM 75 C5' G A 3 -44.683 42.708-187.565 1.00 0.00 C ATOM 76 C4' G A 3 -43.907 43.681-186.683 1.00 0.00 C ATOM 77 O4' G A 3 -42.502 43.457-186.846 1.00 0.00 O ATOM 78 C3' G A 3 -44.027 45.210-186.944 1.00 0.00 C ATOM 79 O3' G A 3 -45.193 45.759-186.323 1.00 0.00 O ATOM 80 C2' G A 3 -42.783 45.749-186.259 1.00 0.00 C ATOM 81 O2' G A 3 -43.024 46.011-184.871 1.00 0.00 O ATOM 82 C1' G A 3 -41.775 44.625-186.444 1.00 0.00 C ATOM 83 N9 G A 3 -40.764 44.899-187.481 1.00 0.00 N ATOM 84 C8 G A 3 -40.765 44.522-188.799 1.00 0.00 C ATOM 85 N7 G A 3 -39.724 44.932-189.467 1.00 0.00 N ATOM 86 C5 G A 3 -38.976 45.632-188.526 1.00 0.00 C ATOM 87 C6 G A 3 -37.734 46.307-188.670 1.00 0.00 C ATOM 88 O6 G A 3 -37.041 46.421-189.678 1.00 0.00 O ATOM 89 N1 G A 3 -37.326 46.882-187.474 1.00 0.00 N ATOM 90 C2 G A 3 -38.023 46.819-186.287 1.00 0.00 C ATOM 91 N2 G A 3 -37.469 47.434-185.243 1.00 0.00 N ATOM 92 N3 G A 3 -39.192 46.184-186.149 1.00 0.00 N ATOM 93 C4 G A 3 -39.605 45.616-187.306 1.00 0.00 C ATOM 0 H5' G A 3 -44.420 41.685-187.298 1.00 0.00 H new ATOM 0 H5'' G A 3 -45.751 42.821-187.380 1.00 0.00 H new ATOM 0 H4' G A 3 -44.354 43.468-185.712 1.00 0.00 H new ATOM 0 H3' G A 3 -44.109 45.456-188.003 1.00 0.00 H new ATOM 0 H2' G A 3 -42.445 46.699-186.672 1.00 0.00 H new ATOM 0 HO2' G A 3 -42.206 46.356-184.456 1.00 0.00 H new ATOM 0 H1' G A 3 -41.245 44.505-185.499 1.00 0.00 H new ATOM 0 H8 G A 3 -41.557 43.938-189.244 1.00 0.00 H new ATOM 0 H1 G A 3 -36.442 47.390-187.474 1.00 0.00 H new ATOM 0 H21 G A 3 -37.937 47.423-184.337 1.00 0.00 H new ATOM 0 H22 G A 3 -36.577 47.916-185.350 1.00 0.00 H new ATOM 105 P U A 4 -45.867 47.098-186.904 1.00 0.00 P ATOM 106 OP1 U A 4 -47.149 47.318-186.196 1.00 0.00 O ATOM 107 OP2 U A 4 -45.844 47.028-188.382 1.00 0.00 O ATOM 108 O5' U A 4 -44.833 48.241-186.437 1.00 0.00 O ATOM 109 C5' U A 4 -44.645 48.523-185.049 1.00 0.00 C ATOM 110 C4' U A 4 -43.583 49.598-184.831 1.00 0.00 C ATOM 111 O4' U A 4 -42.314 49.121-185.284 1.00 0.00 O ATOM 112 C3' U A 4 -43.733 50.972-185.583 1.00 0.00 C ATOM 113 O3' U A 4 -44.601 51.873-184.890 1.00 0.00 O ATOM 114 C2' U A 4 -42.311 51.501-185.548 1.00 0.00 C ATOM 115 O2' U A 4 -42.062 52.246-184.351 1.00 0.00 O ATOM 116 C1' U A 4 -41.463 50.234-185.599 1.00 0.00 C ATOM 117 N1 U A 4 -40.861 49.975-186.920 1.00 0.00 N ATOM 118 C2 U A 4 -39.676 50.621-187.217 1.00 0.00 C ATOM 119 O2 U A 4 -39.124 51.374-186.418 1.00 0.00 O ATOM 120 N3 U A 4 -39.143 50.369-188.467 1.00 0.00 N ATOM 121 C4 U A 4 -39.686 49.539-189.434 1.00 0.00 C ATOM 122 O4 U A 4 -39.126 49.390-190.517 1.00 0.00 O ATOM 123 C5 U A 4 -40.924 48.906-189.037 1.00 0.00 C ATOM 124 C6 U A 4 -41.464 49.137-187.817 1.00 0.00 C ATOM 0 H5' U A 4 -44.352 47.611-184.529 1.00 0.00 H new ATOM 0 H5'' U A 4 -45.589 48.850-184.613 1.00 0.00 H new ATOM 0 H4' U A 4 -43.693 49.786-183.763 1.00 0.00 H new ATOM 0 H3' U A 4 -44.163 50.866-186.579 1.00 0.00 H new ATOM 0 H2' U A 4 -42.094 52.190-186.364 1.00 0.00 H new ATOM 0 HO2' U A 4 -42.825 52.152-183.743 1.00 0.00 H new ATOM 0 H1' U A 4 -40.646 50.367-184.889 1.00 0.00 H new ATOM 0 H3 U A 4 -38.268 50.838-188.699 1.00 0.00 H new ATOM 0 H5 U A 4 -41.425 48.239-189.723 1.00 0.00 H new ATOM 0 H6 U A 4 -42.389 48.650-187.547 1.00 0.00 H new ATOM 135 P G A 5 -45.399 53.016-185.695 1.00 0.00 P ATOM 136 OP1 G A 5 -46.322 53.688-184.754 1.00 0.00 O ATOM 137 OP2 G A 5 -45.922 52.422-186.946 1.00 0.00 O ATOM 138 O5' G A 5 -44.229 54.052-186.082 1.00 0.00 O ATOM 139 C5' G A 5 -43.528 54.765-185.060 1.00 0.00 C ATOM 140 C4' G A 5 -42.384 55.595-185.636 1.00 0.00 C ATOM 141 O4' G A 5 -41.416 54.728-186.230 1.00 0.00 O ATOM 142 C3' G A 5 -42.685 56.621-186.799 1.00 0.00 C ATOM 143 O3' G A 5 -43.132 57.881-186.291 1.00 0.00 O ATOM 144 C2' G A 5 -41.320 56.787-187.448 1.00 0.00 C ATOM 145 O2' G A 5 -40.593 57.874-186.862 1.00 0.00 O ATOM 146 C1' G A 5 -40.631 55.453-187.186 1.00 0.00 C ATOM 147 N9 G A 5 -40.497 54.604-188.384 1.00 0.00 N ATOM 148 C8 G A 5 -41.306 53.584-188.807 1.00 0.00 C ATOM 149 N7 G A 5 -40.918 53.026-189.921 1.00 0.00 N ATOM 150 C5 G A 5 -39.765 53.728-190.261 1.00 0.00 C ATOM 151 C6 G A 5 -38.900 53.569-191.378 1.00 0.00 C ATOM 152 O6 G A 5 -38.987 52.762-192.301 1.00 0.00 O ATOM 153 N1 G A 5 -37.853 54.480-191.343 1.00 0.00 N ATOM 154 C2 G A 5 -37.659 55.426-190.359 1.00 0.00 C ATOM 155 N2 G A 5 -36.593 56.214-190.498 1.00 0.00 N ATOM 156 N3 G A 5 -38.472 55.577-189.308 1.00 0.00 N ATOM 157 C4 G A 5 -39.500 54.696-189.326 1.00 0.00 C ATOM 0 H5' G A 5 -43.134 54.059-184.329 1.00 0.00 H new ATOM 0 H5'' G A 5 -44.221 55.418-184.531 1.00 0.00 H new ATOM 0 H4' G A 5 -42.086 56.165-184.756 1.00 0.00 H new ATOM 0 H3' G A 5 -43.470 56.276-187.472 1.00 0.00 H new ATOM 0 H2' G A 5 -41.385 57.025-188.510 1.00 0.00 H new ATOM 0 HO2' G A 5 -41.102 58.239-186.108 1.00 0.00 H new ATOM 0 H1' G A 5 -39.625 55.681-186.834 1.00 0.00 H new ATOM 0 H8 G A 5 -42.187 53.269-188.267 1.00 0.00 H new ATOM 0 H1 G A 5 -37.175 54.447-192.104 1.00 0.00 H new ATOM 0 H21 G A 5 -36.396 56.933-189.802 1.00 0.00 H new ATOM 0 H22 G A 5 -35.974 56.098-191.300 1.00 0.00 H new ATOM 169 P U A 6 -44.094 58.823-187.173 1.00 0.00 P ATOM 170 OP1 U A 6 -44.487 59.987-186.348 1.00 0.00 O ATOM 171 OP2 U A 6 -45.134 57.972-187.793 1.00 0.00 O ATOM 172 O5' U A 6 -43.107 59.337-188.336 1.00 0.00 O ATOM 173 C5' U A 6 -41.969 60.142-188.020 1.00 0.00 C ATOM 174 C4' U A 6 -41.231 60.583-189.280 1.00 0.00 C ATOM 175 O4' U A 6 -40.633 59.442-189.905 1.00 0.00 O ATOM 176 C3' U A 6 -42.146 61.265-190.330 1.00 0.00 C ATOM 177 O3' U A 6 -41.463 62.407-190.859 1.00 0.00 O ATOM 178 C2' U A 6 -42.309 60.219-191.422 1.00 0.00 C ATOM 179 O2' U A 6 -42.355 60.824-192.719 1.00 0.00 O ATOM 180 C1' U A 6 -41.075 59.340-191.263 1.00 0.00 C ATOM 181 N1 U A 6 -41.317 57.913-191.546 1.00 0.00 N ATOM 182 C2 U A 6 -40.501 57.302-192.480 1.00 0.00 C ATOM 183 O2 U A 6 -39.607 57.910-193.065 1.00 0.00 O ATOM 184 N3 U A 6 -40.750 55.963-192.721 1.00 0.00 N ATOM 185 C4 U A 6 -41.731 55.194-192.118 1.00 0.00 C ATOM 186 O4 U A 6 -41.862 54.007-192.409 1.00 0.00 O ATOM 187 C5 U A 6 -42.535 55.913-191.156 1.00 0.00 C ATOM 188 C6 U A 6 -42.309 57.225-190.903 1.00 0.00 C ATOM 0 H5' U A 6 -41.291 59.580-187.378 1.00 0.00 H new ATOM 0 H5'' U A 6 -42.287 61.020-187.457 1.00 0.00 H new ATOM 0 H4' U A 6 -40.490 61.313-188.955 1.00 0.00 H new ATOM 0 H3' U A 6 -43.102 61.594-189.921 1.00 0.00 H new ATOM 0 H2' U A 6 -43.240 59.658-191.334 1.00 0.00 H new ATOM 0 HO2' U A 6 -42.186 60.144-193.404 1.00 0.00 H new ATOM 0 H1' U A 6 -40.339 59.693-191.985 1.00 0.00 H new ATOM 0 H3 U A 6 -40.155 55.498-193.407 1.00 0.00 H new ATOM 0 H5 U A 6 -43.326 55.398-190.632 1.00 0.00 H new ATOM 0 H6 U A 6 -42.925 57.738-190.179 1.00 0.00 H new ATOM 199 P A A 7 -42.219 63.423-191.852 1.00 0.00 P ATOM 200 OP1 A A 7 -41.614 64.764-191.690 1.00 0.00 O ATOM 201 OP2 A A 7 -43.677 63.247-191.677 1.00 0.00 O ATOM 202 O5' A A 7 -41.813 62.859-193.306 1.00 0.00 O ATOM 203 C5' A A 7 -40.448 62.859-193.729 1.00 0.00 C ATOM 204 C4' A A 7 -40.278 62.167-195.079 1.00 0.00 C ATOM 205 O4' A A 7 -40.530 60.771-194.929 1.00 0.00 O ATOM 206 C3' A A 7 -41.221 62.690-196.175 1.00 0.00 C ATOM 207 O3' A A 7 -40.489 63.361-197.206 1.00 0.00 O ATOM 208 C2' A A 7 -41.926 61.449-196.721 1.00 0.00 C ATOM 209 O2' A A 7 -41.865 61.407-198.151 1.00 0.00 O ATOM 210 C1' A A 7 -41.166 60.284-196.105 1.00 0.00 C ATOM 211 N9 A A 7 -42.019 59.147-195.714 1.00 0.00 N ATOM 212 C8 A A 7 -43.162 59.150-194.959 1.00 0.00 C ATOM 213 N7 A A 7 -43.689 57.968-194.793 1.00 0.00 N ATOM 214 C5 A A 7 -42.833 57.121-195.491 1.00 0.00 C ATOM 215 C6 A A 7 -42.836 55.733-195.704 1.00 0.00 C ATOM 216 N6 A A 7 -43.772 54.921-195.213 1.00 0.00 N ATOM 217 N1 A A 7 -41.837 55.221-196.443 1.00 0.00 N ATOM 218 C2 A A 7 -40.909 56.036-196.931 1.00 0.00 C ATOM 219 N3 A A 7 -40.798 57.349-196.800 1.00 0.00 N ATOM 220 C4 A A 7 -41.813 57.832-196.055 1.00 0.00 C ATOM 0 H5' A A 7 -39.835 62.355-192.982 1.00 0.00 H new ATOM 0 H5'' A A 7 -40.088 63.885-193.798 1.00 0.00 H new ATOM 0 H4' A A 7 -39.256 62.377-195.393 1.00 0.00 H new ATOM 0 H3' A A 7 -41.930 63.420-195.785 1.00 0.00 H new ATOM 0 H2' A A 7 -42.987 61.431-196.471 1.00 0.00 H new ATOM 0 HO2' A A 7 -41.102 61.938-198.462 1.00 0.00 H new ATOM 0 HO3' A A 7 -41.116 63.765-197.842 1.00 0.00 H new ATOM 0 H1' A A 7 -40.472 59.914-196.860 1.00 0.00 H new ATOM 0 H8 A A 7 -43.588 60.049-194.539 1.00 0.00 H new ATOM 0 H61 A A 7 -43.726 53.919-195.398 1.00 0.00 H new ATOM 0 H62 A A 7 -44.534 55.302-194.652 1.00 0.00 H new ATOM 0 H2 A A 7 -40.136 55.561-197.517 1.00 0.00 H new TER 233 A A 7 ATOM 234 OP3 A B 17 -40.149 48.064-203.042 1.00 0.00 O ATOM 235 P A B 17 -41.163 49.314-202.982 1.00 0.00 P ATOM 236 OP1 A B 17 -41.976 49.311-204.218 1.00 0.00 O ATOM 237 OP2 A B 17 -41.827 49.309-201.660 1.00 0.00 O ATOM 238 O5' A B 17 -40.165 50.578-203.039 1.00 0.00 O ATOM 239 C5' A B 17 -39.475 50.903-204.248 1.00 0.00 C ATOM 240 C4' A B 17 -38.693 52.207-204.115 1.00 0.00 C ATOM 241 O4' A B 17 -39.605 53.290-203.920 1.00 0.00 O ATOM 242 C3' A B 17 -37.713 52.336-202.919 1.00 0.00 C ATOM 243 O3' A B 17 -36.422 51.834-203.276 1.00 0.00 O ATOM 244 C2' A B 17 -37.629 53.836-202.686 1.00 0.00 C ATOM 245 O2' A B 17 -36.524 54.411-203.391 1.00 0.00 O ATOM 246 C1' A B 17 -38.959 54.358-203.218 1.00 0.00 C ATOM 247 N9 A B 17 -39.882 54.821-202.166 1.00 0.00 N ATOM 248 C8 A B 17 -40.926 54.150-201.584 1.00 0.00 C ATOM 249 N7 A B 17 -41.555 54.841-200.674 1.00 0.00 N ATOM 250 C5 A B 17 -40.879 56.056-200.651 1.00 0.00 C ATOM 251 C6 A B 17 -41.054 57.228-199.897 1.00 0.00 C ATOM 252 N6 A B 17 -42.011 57.368-198.978 1.00 0.00 N ATOM 253 N1 A B 17 -40.206 58.244-200.128 1.00 0.00 N ATOM 254 C2 A B 17 -39.257 58.098-201.044 1.00 0.00 C ATOM 255 N3 A B 17 -38.991 57.054-201.814 1.00 0.00 N ATOM 256 C4 A B 17 -39.858 56.053-201.558 1.00 0.00 C ATOM 0 H5' A B 17 -40.192 50.989-205.065 1.00 0.00 H new ATOM 0 H5'' A B 17 -38.793 50.094-204.507 1.00 0.00 H new ATOM 0 H4' A B 17 -38.110 52.222-205.036 1.00 0.00 H new ATOM 0 H3' A B 17 -38.043 51.778-202.043 1.00 0.00 H new ATOM 0 H2' A B 17 -37.465 54.091-201.639 1.00 0.00 H new ATOM 0 HO2' A B 17 -36.091 53.723-203.938 1.00 0.00 H new ATOM 0 H1' A B 17 -38.732 55.215-203.852 1.00 0.00 H new ATOM 0 H8 A B 17 -41.202 53.142-201.854 1.00 0.00 H new ATOM 0 H61 A B 17 -42.095 58.241-198.458 1.00 0.00 H new ATOM 0 H62 A B 17 -42.659 56.602-198.796 1.00 0.00 H new ATOM 0 H2 A B 17 -38.610 58.952-201.181 1.00 0.00 H new ATOM 269 P G B 18 -35.449 51.219-202.152 1.00 0.00 P ATOM 270 OP1 G B 18 -34.255 50.661-202.826 1.00 0.00 O ATOM 271 OP2 G B 18 -36.259 50.361-201.259 1.00 0.00 O ATOM 272 O5' G B 18 -34.999 52.524-201.325 1.00 0.00 O ATOM 273 C5' G B 18 -34.231 53.553-201.954 1.00 0.00 C ATOM 274 C4' G B 18 -33.925 54.697-200.990 1.00 0.00 C ATOM 275 O4' G B 18 -35.144 55.322-200.583 1.00 0.00 O ATOM 276 C3' G B 18 -33.232 54.314-199.630 1.00 0.00 C ATOM 277 O3' G B 18 -31.808 54.249-199.753 1.00 0.00 O ATOM 278 C2' G B 18 -33.615 55.489-198.747 1.00 0.00 C ATOM 279 O2' G B 18 -32.665 56.555-198.855 1.00 0.00 O ATOM 280 C1' G B 18 -34.980 55.906-199.283 1.00 0.00 C ATOM 281 N9 G B 18 -36.108 55.457-198.448 1.00 0.00 N ATOM 282 C8 G B 18 -36.915 54.362-198.612 1.00 0.00 C ATOM 283 N7 G B 18 -37.827 54.234-197.690 1.00 0.00 N ATOM 284 C5 G B 18 -37.610 55.323-196.851 1.00 0.00 C ATOM 285 C6 G B 18 -38.297 55.713-195.669 1.00 0.00 C ATOM 286 O6 G B 18 -39.249 55.160-195.123 1.00 0.00 O ATOM 287 N1 G B 18 -37.760 56.873-195.128 1.00 0.00 N ATOM 288 C2 G B 18 -36.696 57.574-195.656 1.00 0.00 C ATOM 289 N2 G B 18 -36.322 58.669-194.994 1.00 0.00 N ATOM 290 N3 G B 18 -36.049 57.209-196.767 1.00 0.00 N ATOM 291 C4 G B 18 -36.559 56.078-197.308 1.00 0.00 C ATOM 0 H5' G B 18 -34.776 53.939-202.816 1.00 0.00 H new ATOM 0 H5'' G B 18 -33.298 53.133-202.329 1.00 0.00 H new ATOM 0 H4' G B 18 -33.240 55.317-201.568 1.00 0.00 H new ATOM 0 H3' G B 18 -33.537 53.336-199.259 1.00 0.00 H new ATOM 0 H2' G B 18 -33.636 55.232-197.688 1.00 0.00 H new ATOM 0 HO2' G B 18 -31.952 56.296-199.475 1.00 0.00 H new ATOM 0 H1' G B 18 -34.997 56.996-199.296 1.00 0.00 H new ATOM 0 H8 G B 18 -36.805 53.667-199.432 1.00 0.00 H new ATOM 0 H1 G B 18 -38.185 57.235-194.274 1.00 0.00 H new ATOM 0 H21 G B 18 -35.541 59.230-195.335 1.00 0.00 H new ATOM 0 H22 G B 18 -36.817 58.946-194.146 1.00 0.00 H new ATOM 303 P C B 19 -30.956 53.249-198.823 1.00 0.00 P ATOM 304 OP1 C B 19 -29.542 53.310-199.252 1.00 0.00 O ATOM 305 OP2 C B 19 -31.659 51.947-198.778 1.00 0.00 O ATOM 306 O5' C B 19 -31.072 53.934-197.370 1.00 0.00 O ATOM 307 C5' C B 19 -30.485 55.214-197.125 1.00 0.00 C ATOM 308 C4' C B 19 -30.831 55.736-195.733 1.00 0.00 C ATOM 309 O4' C B 19 -32.239 55.955-195.635 1.00 0.00 O ATOM 310 C3' C B 19 -30.500 54.800-194.507 1.00 0.00 C ATOM 311 O3' C B 19 -29.152 54.929-194.050 1.00 0.00 O ATOM 312 C2' C B 19 -31.451 55.348-193.456 1.00 0.00 C ATOM 313 O2' C B 19 -30.864 56.444-192.745 1.00 0.00 O ATOM 314 C1' C B 19 -32.659 55.798-194.272 1.00 0.00 C ATOM 315 N1 C B 19 -33.777 54.836-194.256 1.00 0.00 N ATOM 316 C2 C B 19 -34.656 54.898-193.186 1.00 0.00 C ATOM 317 O2 C B 19 -34.495 55.741-192.306 1.00 0.00 O ATOM 318 N3 C B 19 -35.687 54.010-193.146 1.00 0.00 N ATOM 319 C4 C B 19 -35.847 53.099-194.114 1.00 0.00 C ATOM 320 N4 C B 19 -36.866 52.243-194.044 1.00 0.00 N ATOM 321 C5 C B 19 -34.941 53.032-195.220 1.00 0.00 C ATOM 322 C6 C B 19 -33.925 53.916-195.251 1.00 0.00 C ATOM 0 H5' C B 19 -30.832 55.923-197.876 1.00 0.00 H new ATOM 0 H5'' C B 19 -29.402 55.144-197.229 1.00 0.00 H new ATOM 0 H4' C B 19 -30.206 56.626-195.658 1.00 0.00 H new ATOM 0 H3' C B 19 -30.609 53.742-194.744 1.00 0.00 H new ATOM 0 H2' C B 19 -31.707 54.615-192.691 1.00 0.00 H new ATOM 0 HO2' C B 19 -29.982 56.644-193.123 1.00 0.00 H new ATOM 0 H1' C B 19 -33.020 56.724-193.825 1.00 0.00 H new ATOM 0 H41 C B 19 -36.997 51.545-194.776 1.00 0.00 H new ATOM 0 H42 C B 19 -37.515 52.286-193.258 1.00 0.00 H new ATOM 0 H5 C B 19 -35.067 52.298-196.002 1.00 0.00 H new ATOM 0 H6 C B 19 -33.222 53.896-196.071 1.00 0.00 H new ATOM 334 P A B 20 -28.425 53.702-193.304 1.00 0.00 P ATOM 335 OP1 A B 20 -27.001 54.054-193.109 1.00 0.00 O ATOM 336 OP2 A B 20 -28.787 52.452-194.010 1.00 0.00 O ATOM 337 O5' A B 20 -29.145 53.691-191.863 1.00 0.00 O ATOM 338 C5' A B 20 -28.960 54.777-190.952 1.00 0.00 C ATOM 339 C4' A B 20 -29.837 54.624-189.712 1.00 0.00 C ATOM 340 O4' A B 20 -31.216 54.682-190.092 1.00 0.00 O ATOM 341 C3' A B 20 -29.765 53.289-188.905 1.00 0.00 C ATOM 342 O3' A B 20 -28.674 53.275-187.980 1.00 0.00 O ATOM 343 C2' A B 20 -31.078 53.311-188.143 1.00 0.00 C ATOM 344 O2' A B 20 -30.953 54.022-186.906 1.00 0.00 O ATOM 345 C1' A B 20 -32.020 54.026-189.102 1.00 0.00 C ATOM 346 N9 A B 20 -32.947 53.124-189.807 1.00 0.00 N ATOM 347 C8 A B 20 -32.818 52.560-191.051 1.00 0.00 C ATOM 348 N7 A B 20 -33.814 51.789-191.387 1.00 0.00 N ATOM 349 C5 A B 20 -34.664 51.845-190.287 1.00 0.00 C ATOM 350 C6 A B 20 -35.903 51.241-190.012 1.00 0.00 C ATOM 351 N6 A B 20 -36.522 50.427-190.866 1.00 0.00 N ATOM 352 N1 A B 20 -36.471 51.512-188.825 1.00 0.00 N ATOM 353 C2 A B 20 -35.847 52.324-187.980 1.00 0.00 C ATOM 354 N3 A B 20 -34.687 52.948-188.121 1.00 0.00 N ATOM 355 C4 A B 20 -34.143 52.657-189.321 1.00 0.00 C ATOM 0 H5' A B 20 -29.196 55.716-191.452 1.00 0.00 H new ATOM 0 H5'' A B 20 -27.913 54.829-190.654 1.00 0.00 H new ATOM 0 H4' A B 20 -29.452 55.426-189.082 1.00 0.00 H new ATOM 0 H3' A B 20 -29.615 52.419-189.544 1.00 0.00 H new ATOM 0 H2' A B 20 -31.426 52.317-187.863 1.00 0.00 H new ATOM 0 HO2' A B 20 -30.029 54.329-186.797 1.00 0.00 H new ATOM 0 H1' A B 20 -32.625 54.713-188.509 1.00 0.00 H new ATOM 0 H8 A B 20 -31.968 52.739-191.694 1.00 0.00 H new ATOM 0 H61 A B 20 -37.421 50.014-190.617 1.00 0.00 H new ATOM 0 H62 A B 20 -36.097 50.216-191.769 1.00 0.00 H new ATOM 0 H2 A B 20 -36.358 52.501-187.045 1.00 0.00 H new ATOM 367 P C B 21 -27.981 51.883-187.559 1.00 0.00 P ATOM 368 OP1 C B 21 -26.797 52.189-186.726 1.00 0.00 O ATOM 369 OP2 C B 21 -27.835 51.053-188.775 1.00 0.00 O ATOM 370 O5' C B 21 -29.098 51.207-186.617 1.00 0.00 O ATOM 371 C5' C B 21 -29.429 51.792-185.355 1.00 0.00 C ATOM 372 C4' C B 21 -30.545 51.025-184.649 1.00 0.00 C ATOM 373 O4' C B 21 -31.751 51.120-185.408 1.00 0.00 O ATOM 374 C3' C B 21 -30.364 49.487-184.452 1.00 0.00 C ATOM 375 O3' C B 21 -29.611 49.189-183.273 1.00 0.00 O ATOM 376 C2' C B 21 -31.795 49.006-184.280 1.00 0.00 C ATOM 377 O2' C B 21 -32.185 49.015-182.901 1.00 0.00 O ATOM 378 C1' C B 21 -32.607 50.011-185.092 1.00 0.00 C ATOM 379 N1 C B 21 -33.121 49.469-186.362 1.00 0.00 N ATOM 380 C2 C B 21 -34.303 48.747-186.315 1.00 0.00 C ATOM 381 O2 C B 21 -34.889 48.596-185.244 1.00 0.00 O ATOM 382 N3 C B 21 -34.787 48.226-187.474 1.00 0.00 N ATOM 383 C4 C B 21 -34.139 48.405-188.633 1.00 0.00 C ATOM 384 N4 C B 21 -34.640 47.878-189.750 1.00 0.00 N ATOM 385 C5 C B 21 -32.919 49.150-188.686 1.00 0.00 C ATOM 386 C6 C B 21 -32.448 49.663-187.533 1.00 0.00 C ATOM 0 H5' C B 21 -29.737 52.827-185.504 1.00 0.00 H new ATOM 0 H5'' C B 21 -28.543 51.811-184.720 1.00 0.00 H new ATOM 0 H4' C B 21 -30.548 51.497-183.666 1.00 0.00 H new ATOM 0 H3' C B 21 -29.825 49.020-185.276 1.00 0.00 H new ATOM 0 H2' C B 21 -31.939 47.978-184.612 1.00 0.00 H new ATOM 0 HO2' C B 21 -33.110 48.702-182.821 1.00 0.00 H new ATOM 0 H1' C B 21 -33.468 50.292-184.485 1.00 0.00 H new ATOM 0 H41 C B 21 -34.155 48.008-190.638 1.00 0.00 H new ATOM 0 H42 C B 21 -35.509 47.344-189.717 1.00 0.00 H new ATOM 0 H5 C B 21 -32.394 49.296-189.618 1.00 0.00 H new ATOM 0 H6 C B 21 -31.530 50.232-187.535 1.00 0.00 H new ATOM 398 P C B 22 -28.741 47.838-183.182 1.00 0.00 P ATOM 399 OP1 C B 22 -27.930 47.892-181.945 1.00 0.00 O ATOM 400 OP2 C B 22 -28.079 47.624-184.490 1.00 0.00 O ATOM 401 O5' C B 22 -29.870 46.705-182.997 1.00 0.00 O ATOM 402 C5' C B 22 -30.662 46.662-181.807 1.00 0.00 C ATOM 403 C4' C B 22 -31.760 45.606-181.897 1.00 0.00 C ATOM 404 O4' C B 22 -32.682 45.954-182.930 1.00 0.00 O ATOM 405 C3' C B 22 -31.360 44.137-182.258 1.00 0.00 C ATOM 406 O3' C B 22 -30.973 43.398-181.095 1.00 0.00 O ATOM 407 C2' C B 22 -32.644 43.557-182.829 1.00 0.00 C ATOM 408 O2' C B 22 -33.402 42.878-181.821 1.00 0.00 O ATOM 409 C1' C B 22 -33.390 44.781-183.357 1.00 0.00 C ATOM 410 N1 C B 22 -33.486 44.827-184.826 1.00 0.00 N ATOM 411 C2 C B 22 -34.523 44.125-185.419 1.00 0.00 C ATOM 412 O2 C B 22 -35.322 43.503-184.723 1.00 0.00 O ATOM 413 N3 C B 22 -34.619 44.139-186.777 1.00 0.00 N ATOM 414 C4 C B 22 -33.734 44.815-187.521 1.00 0.00 C ATOM 415 N4 C B 22 -33.855 44.805-188.849 1.00 0.00 N ATOM 416 C5 C B 22 -32.662 45.543-186.912 1.00 0.00 C ATOM 417 C6 C B 22 -32.576 45.522-185.569 1.00 0.00 C ATOM 0 H5' C B 22 -31.111 47.640-181.633 1.00 0.00 H new ATOM 0 H5'' C B 22 -30.021 46.449-180.951 1.00 0.00 H new ATOM 0 H4' C B 22 -32.136 45.610-180.874 1.00 0.00 H new ATOM 0 H3' C B 22 -30.511 44.095-182.941 1.00 0.00 H new ATOM 0 H2' C B 22 -32.462 42.810-183.602 1.00 0.00 H new ATOM 0 HO2' C B 22 -33.570 41.955-182.104 1.00 0.00 H new ATOM 0 H1' C B 22 -34.406 44.729-182.965 1.00 0.00 H new ATOM 0 H41 C B 22 -33.187 45.316-189.426 1.00 0.00 H new ATOM 0 H42 C B 22 -34.616 44.286-189.288 1.00 0.00 H new ATOM 0 H5 C B 22 -31.947 46.090-187.509 1.00 0.00 H new ATOM 0 H6 C B 22 -31.780 46.060-185.075 1.00 0.00 H new ATOM 429 P C B 23 -30.017 42.110-181.225 1.00 0.00 P ATOM 430 OP1 C B 23 -29.362 41.887-179.917 1.00 0.00 O ATOM 431 OP2 C B 23 -29.195 42.265-182.447 1.00 0.00 O ATOM 432 O5' C B 23 -31.068 40.917-181.473 1.00 0.00 O ATOM 433 C5' C B 23 -32.020 40.567-180.465 1.00 0.00 C ATOM 434 C4' C B 23 -32.850 39.354-180.874 1.00 0.00 C ATOM 435 O4' C B 23 -33.730 39.721-181.938 1.00 0.00 O ATOM 436 C3' C B 23 -32.020 38.151-181.328 1.00 0.00 C ATOM 437 O3' C B 23 -32.398 36.979-180.597 1.00 0.00 O ATOM 438 C2' C B 23 -32.316 37.996-182.814 1.00 0.00 C ATOM 439 O2' C B 23 -32.531 36.623-183.154 1.00 0.00 O ATOM 440 C1' C B 23 -33.580 38.820-183.039 1.00 0.00 C ATOM 441 N1 C B 23 -33.557 39.628-184.276 1.00 0.00 N ATOM 442 C2 C B 23 -34.553 39.391-185.210 1.00 0.00 C ATOM 443 O2 C B 23 -35.389 38.514-185.009 1.00 0.00 O ATOM 444 N3 C B 23 -34.550 40.125-186.358 1.00 0.00 N ATOM 445 C4 C B 23 -33.608 41.052-186.579 1.00 0.00 C ATOM 446 N4 C B 23 -33.632 41.754-187.713 1.00 0.00 N ATOM 447 C5 C B 23 -32.579 41.299-185.617 1.00 0.00 C ATOM 448 C6 C B 23 -32.591 40.569-184.484 1.00 0.00 C ATOM 0 H5' C B 23 -32.680 41.414-180.277 1.00 0.00 H new ATOM 0 H5'' C B 23 -31.500 40.355-179.531 1.00 0.00 H new ATOM 0 H4' C B 23 -33.394 39.047-179.981 1.00 0.00 H new ATOM 0 H3' C B 23 -30.954 38.294-181.149 1.00 0.00 H new ATOM 0 H2' C B 23 -31.487 38.332-183.438 1.00 0.00 H new ATOM 0 HO2' C B 23 -32.969 36.166-182.406 1.00 0.00 H new ATOM 0 HO3' C B 23 -33.367 36.981-180.454 1.00 0.00 H new ATOM 0 H1' C B 23 -34.403 38.111-183.128 1.00 0.00 H new ATOM 0 H41 C B 23 -32.919 42.462-187.890 1.00 0.00 H new ATOM 0 H42 C B 23 -34.363 41.583-188.403 1.00 0.00 H new ATOM 0 H5 C B 23 -31.818 42.045-185.792 1.00 0.00 H new ATOM 0 H6 C B 23 -31.830 40.730-183.735 1.00 0.00 H new TER 461 C B 23