USER MOD reduce.3.24.130724 H: found=0, std=0, add=155, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 155 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 13 G O2' : rot -3:sc= -4.26! USER MOD Single : A 13 G O5' : rot 18:sc= -1.2! USER MOD Single : A 14 G O2' : rot -16:sc= -0.0108 USER MOD Single : A 15 C O2' : rot -15:sc= -0.139 USER MOD Single : A 16 A O2' : rot -1:sc= -5.22! USER MOD Single : A 17 C O2' : rot -0:sc= -3.35! USER MOD Single : A 18 U O2' : rot 173:sc= -7.13! USER MOD Single : A 19 G O2' : rot -21:sc= 0.193 USER MOD Single : A 19 G O3' : rot 180:sc= 0.184 USER MOD Single : B 59 C O2' : rot -12:sc= -2.17! USER MOD Single : B 59 C O5' : rot 41:sc= -3.12! USER MOD Single : B 60 A O2' : rot -18:sc= 0.222 USER MOD Single : B 61 G O2' : rot -148:sc= -1.64 USER MOD Single : B 62 U O2' : rot -20:sc= -1.46! USER MOD Single : B 63 G O2' : rot -3:sc= -0.202 USER MOD Single : B 64 U O2' : rot -5:sc= 0.0941 USER MOD Single : B 65 C O2' : rot -24:sc= 0.149 USER MOD Single : B 65 C O3' : rot 180:sc= 0.154 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 13 5.054 -6.725 -5.521 1.00 0.00 O ATOM 2 C5' G A 13 5.303 -7.465 -6.720 1.00 0.00 C ATOM 3 C4' G A 13 4.104 -8.330 -7.102 1.00 0.00 C ATOM 4 O4' G A 13 3.895 -9.378 -6.143 1.00 0.00 O ATOM 5 C3' G A 13 2.818 -7.510 -7.114 1.00 0.00 C ATOM 6 O3' G A 13 2.518 -7.142 -8.461 1.00 0.00 O ATOM 7 C2' G A 13 1.775 -8.503 -6.646 1.00 0.00 C ATOM 8 O2' G A 13 1.318 -9.336 -7.718 1.00 0.00 O ATOM 9 C1' G A 13 2.562 -9.294 -5.620 1.00 0.00 C ATOM 10 N9 G A 13 2.546 -8.611 -4.314 1.00 0.00 N ATOM 11 C8 G A 13 3.241 -7.524 -3.899 1.00 0.00 C ATOM 12 N7 G A 13 3.030 -7.101 -2.699 1.00 0.00 N ATOM 13 C5 G A 13 2.074 -8.012 -2.240 1.00 0.00 C ATOM 14 C6 G A 13 1.422 -8.091 -0.981 1.00 0.00 C ATOM 15 O6 G A 13 1.562 -7.362 0.000 1.00 0.00 O ATOM 16 N1 G A 13 0.532 -9.155 -0.936 1.00 0.00 N ATOM 17 C2 G A 13 0.292 -10.038 -1.970 1.00 0.00 C ATOM 18 N2 G A 13 -0.606 -10.995 -1.735 1.00 0.00 N ATOM 19 N3 G A 13 0.901 -9.970 -3.158 1.00 0.00 N ATOM 20 C4 G A 13 1.773 -8.940 -3.226 1.00 0.00 C ATOM 0 H5' G A 13 6.180 -8.097 -6.583 1.00 0.00 H new ATOM 0 H5'' G A 13 5.530 -6.776 -7.534 1.00 0.00 H new ATOM 0 H4' G A 13 4.325 -8.736 -8.089 1.00 0.00 H new ATOM 0 H3' G A 13 2.872 -6.605 -6.509 1.00 0.00 H new ATOM 0 H2' G A 13 0.866 -8.045 -6.257 1.00 0.00 H new ATOM 0 HO2' G A 13 1.743 -9.054 -8.555 1.00 0.00 H new ATOM 0 HO5' G A 13 4.304 -7.129 -5.037 1.00 0.00 H new ATOM 0 H1' G A 13 2.136 -10.283 -5.454 1.00 0.00 H new ATOM 0 H8 G A 13 3.947 -7.029 -4.550 1.00 0.00 H new ATOM 0 H1 G A 13 0.013 -9.296 -0.069 1.00 0.00 H new ATOM 0 H21 G A 13 -0.826 -11.677 -2.461 1.00 0.00 H new ATOM 0 H22 G A 13 -1.073 -11.045 -0.830 1.00 0.00 H new ATOM 33 P G A 14 1.520 -5.916 -8.758 1.00 0.00 P ATOM 34 OP1 G A 14 1.353 -5.799 -10.224 1.00 0.00 O ATOM 35 OP2 G A 14 1.974 -4.746 -7.973 1.00 0.00 O ATOM 36 O5' G A 14 0.129 -6.434 -8.133 1.00 0.00 O ATOM 37 C5' G A 14 -0.561 -7.532 -8.732 1.00 0.00 C ATOM 38 C4' G A 14 -1.973 -7.695 -8.172 1.00 0.00 C ATOM 39 O4' G A 14 -1.987 -8.390 -6.913 1.00 0.00 O ATOM 40 C3' G A 14 -2.613 -6.356 -7.864 1.00 0.00 C ATOM 41 O3' G A 14 -3.201 -5.815 -9.048 1.00 0.00 O ATOM 42 C2' G A 14 -3.716 -6.782 -6.920 1.00 0.00 C ATOM 43 O2' G A 14 -4.797 -7.408 -7.623 1.00 0.00 O ATOM 44 C1' G A 14 -2.968 -7.777 -6.048 1.00 0.00 C ATOM 45 N9 G A 14 -2.330 -7.108 -4.905 1.00 0.00 N ATOM 46 C8 G A 14 -1.120 -6.501 -4.804 1.00 0.00 C ATOM 47 N7 G A 14 -0.785 -6.032 -3.650 1.00 0.00 N ATOM 48 C5 G A 14 -1.904 -6.357 -2.877 1.00 0.00 C ATOM 49 C6 G A 14 -2.163 -6.112 -1.506 1.00 0.00 C ATOM 50 O6 G A 14 -1.438 -5.555 -0.687 1.00 0.00 O ATOM 51 N1 G A 14 -3.410 -6.601 -1.127 1.00 0.00 N ATOM 52 C2 G A 14 -4.298 -7.245 -1.960 1.00 0.00 C ATOM 53 N2 G A 14 -5.449 -7.629 -1.409 1.00 0.00 N ATOM 54 N3 G A 14 -4.060 -7.481 -3.251 1.00 0.00 N ATOM 55 C4 G A 14 -2.852 -7.013 -3.641 1.00 0.00 C ATOM 0 H5' G A 14 0.003 -8.449 -8.565 1.00 0.00 H new ATOM 0 H5'' G A 14 -0.614 -7.382 -9.810 1.00 0.00 H new ATOM 0 H4' G A 14 -2.508 -8.246 -8.946 1.00 0.00 H new ATOM 0 H3' G A 14 -1.926 -5.605 -7.474 1.00 0.00 H new ATOM 0 H2' G A 14 -4.187 -5.965 -6.374 1.00 0.00 H new ATOM 0 HO2' G A 14 -4.721 -7.213 -8.580 1.00 0.00 H new ATOM 0 H1' G A 14 -3.641 -8.520 -5.620 1.00 0.00 H new ATOM 0 H8 G A 14 -0.463 -6.414 -5.657 1.00 0.00 H new ATOM 0 H1 G A 14 -3.689 -6.472 -0.154 1.00 0.00 H new ATOM 0 H21 G A 14 -6.149 -8.111 -1.973 1.00 0.00 H new ATOM 0 H22 G A 14 -5.630 -7.441 -0.423 1.00 0.00 H new ATOM 67 P C A 15 -3.372 -4.218 -9.185 1.00 0.00 P ATOM 68 OP1 C A 15 -4.116 -3.933 -10.432 1.00 0.00 O ATOM 69 OP2 C A 15 -2.057 -3.586 -8.944 1.00 0.00 O ATOM 70 O5' C A 15 -4.331 -3.888 -7.935 1.00 0.00 O ATOM 71 C5' C A 15 -5.698 -4.290 -7.964 1.00 0.00 C ATOM 72 C4' C A 15 -6.339 -4.238 -6.581 1.00 0.00 C ATOM 73 O4' C A 15 -5.627 -5.041 -5.635 1.00 0.00 O ATOM 74 C3' C A 15 -6.298 -2.856 -5.964 1.00 0.00 C ATOM 75 O3' C A 15 -7.358 -2.057 -6.493 1.00 0.00 O ATOM 76 C2' C A 15 -6.617 -3.196 -4.525 1.00 0.00 C ATOM 77 O2' C A 15 -8.013 -3.464 -4.343 1.00 0.00 O ATOM 78 C1' C A 15 -5.775 -4.452 -4.327 1.00 0.00 C ATOM 79 N1 C A 15 -4.471 -4.107 -3.720 1.00 0.00 N ATOM 80 C2 C A 15 -4.456 -3.883 -2.354 1.00 0.00 C ATOM 81 O2 C A 15 -5.502 -3.940 -1.710 1.00 0.00 O ATOM 82 N3 C A 15 -3.269 -3.588 -1.760 1.00 0.00 N ATOM 83 C4 C A 15 -2.141 -3.516 -2.477 1.00 0.00 C ATOM 84 N4 C A 15 -0.996 -3.228 -1.859 1.00 0.00 N ATOM 85 C5 C A 15 -2.151 -3.742 -3.888 1.00 0.00 C ATOM 86 C6 C A 15 -3.331 -4.029 -4.467 1.00 0.00 C ATOM 0 H5' C A 15 -5.769 -5.304 -8.359 1.00 0.00 H new ATOM 0 H5'' C A 15 -6.252 -3.643 -8.645 1.00 0.00 H new ATOM 0 H4' C A 15 -7.359 -4.581 -6.756 1.00 0.00 H new ATOM 0 H3' C A 15 -5.370 -2.308 -6.128 1.00 0.00 H new ATOM 0 H2' C A 15 -6.402 -2.395 -3.817 1.00 0.00 H new ATOM 0 HO2' C A 15 -8.512 -3.147 -5.125 1.00 0.00 H new ATOM 0 H1' C A 15 -6.246 -5.159 -3.644 1.00 0.00 H new ATOM 0 H41 C A 15 -0.129 -3.170 -2.393 1.00 0.00 H new ATOM 0 H42 C A 15 -0.987 -3.066 -0.852 1.00 0.00 H new ATOM 0 H5 C A 15 -1.243 -3.684 -4.469 1.00 0.00 H new ATOM 0 H6 C A 15 -3.377 -4.199 -5.533 1.00 0.00 H new ATOM 98 P A A 16 -7.252 -0.449 -6.442 1.00 0.00 P ATOM 99 OP1 A A 16 -8.480 0.114 -7.048 1.00 0.00 O ATOM 100 OP2 A A 16 -5.925 -0.056 -6.965 1.00 0.00 O ATOM 101 O5' A A 16 -7.284 -0.137 -4.859 1.00 0.00 O ATOM 102 C5' A A 16 -8.504 -0.271 -4.126 1.00 0.00 C ATOM 103 C4' A A 16 -8.304 -0.064 -2.623 1.00 0.00 C ATOM 104 O4' A A 16 -7.380 -1.005 -2.064 1.00 0.00 O ATOM 105 C3' A A 16 -7.690 1.286 -2.307 1.00 0.00 C ATOM 106 O3' A A 16 -8.718 2.274 -2.242 1.00 0.00 O ATOM 107 C2' A A 16 -7.163 1.053 -0.908 1.00 0.00 C ATOM 108 O2' A A 16 -8.207 1.140 0.069 1.00 0.00 O ATOM 109 C1' A A 16 -6.621 -0.361 -1.019 1.00 0.00 C ATOM 110 N9 A A 16 -5.181 -0.344 -1.327 1.00 0.00 N ATOM 111 C8 A A 16 -4.538 -0.609 -2.481 1.00 0.00 C ATOM 112 N7 A A 16 -3.249 -0.628 -2.464 1.00 0.00 N ATOM 113 C5 A A 16 -2.991 -0.324 -1.129 1.00 0.00 C ATOM 114 C6 A A 16 -1.808 -0.176 -0.407 1.00 0.00 C ATOM 115 N6 A A 16 -0.602 -0.371 -0.945 1.00 0.00 N ATOM 116 N1 A A 16 -1.921 0.139 0.898 1.00 0.00 N ATOM 117 C2 A A 16 -3.132 0.289 1.449 1.00 0.00 C ATOM 118 N3 A A 16 -4.305 0.163 0.857 1.00 0.00 N ATOM 119 C4 A A 16 -4.164 -0.145 -0.436 1.00 0.00 C ATOM 0 H5' A A 16 -8.924 -1.262 -4.301 1.00 0.00 H new ATOM 0 H5'' A A 16 -9.230 0.453 -4.497 1.00 0.00 H new ATOM 0 H4' A A 16 -9.305 -0.171 -2.205 1.00 0.00 H new ATOM 0 H3' A A 16 -6.950 1.622 -3.033 1.00 0.00 H new ATOM 0 H2' A A 16 -6.425 1.787 -0.585 1.00 0.00 H new ATOM 0 HO2' A A 16 -9.055 1.346 -0.376 1.00 0.00 H new ATOM 0 H1' A A 16 -6.725 -0.904 -0.079 1.00 0.00 H new ATOM 0 H8 A A 16 -5.086 -0.800 -3.392 1.00 0.00 H new ATOM 0 H61 A A 16 0.236 -0.250 -0.376 1.00 0.00 H new ATOM 0 H62 A A 16 -0.518 -0.641 -1.925 1.00 0.00 H new ATOM 0 H2 A A 16 -3.151 0.542 2.499 1.00 0.00 H new ATOM 131 P C A 17 -8.333 3.834 -2.323 1.00 0.00 P ATOM 132 OP1 C A 17 -9.572 4.628 -2.165 1.00 0.00 O ATOM 133 OP2 C A 17 -7.472 4.038 -3.510 1.00 0.00 O ATOM 134 O5' C A 17 -7.432 4.035 -1.002 1.00 0.00 O ATOM 135 C5' C A 17 -7.988 3.789 0.291 1.00 0.00 C ATOM 136 C4' C A 17 -6.946 3.906 1.401 1.00 0.00 C ATOM 137 O4' C A 17 -5.934 2.906 1.314 1.00 0.00 O ATOM 138 C3' C A 17 -6.195 5.215 1.329 1.00 0.00 C ATOM 139 O3' C A 17 -6.957 6.213 2.013 1.00 0.00 O ATOM 140 C2' C A 17 -4.953 4.911 2.143 1.00 0.00 C ATOM 141 O2' C A 17 -5.191 5.085 3.544 1.00 0.00 O ATOM 142 C1' C A 17 -4.691 3.449 1.799 1.00 0.00 C ATOM 143 N1 C A 17 -3.646 3.326 0.777 1.00 0.00 N ATOM 144 C2 C A 17 -2.333 3.278 1.201 1.00 0.00 C ATOM 145 O2 C A 17 -2.073 3.369 2.398 1.00 0.00 O ATOM 146 N3 C A 17 -1.359 3.133 0.260 1.00 0.00 N ATOM 147 C4 C A 17 -1.676 3.041 -1.042 1.00 0.00 C ATOM 148 N4 C A 17 -0.709 2.880 -1.945 1.00 0.00 N ATOM 149 C5 C A 17 -3.037 3.097 -1.467 1.00 0.00 C ATOM 150 C6 C A 17 -3.975 3.239 -0.534 1.00 0.00 C ATOM 0 H5' C A 17 -8.427 2.792 0.312 1.00 0.00 H new ATOM 0 H5'' C A 17 -8.796 4.497 0.478 1.00 0.00 H new ATOM 0 H4' C A 17 -7.523 3.809 2.320 1.00 0.00 H new ATOM 0 H3' C A 17 -5.994 5.566 0.317 1.00 0.00 H new ATOM 0 H2' C A 17 -4.113 5.569 1.920 1.00 0.00 H new ATOM 0 HO2' C A 17 -6.118 5.369 3.685 1.00 0.00 H new ATOM 0 H1' C A 17 -4.340 2.907 2.677 1.00 0.00 H new ATOM 0 H41 C A 17 -0.943 2.809 -2.935 1.00 0.00 H new ATOM 0 H42 C A 17 0.265 2.827 -1.646 1.00 0.00 H new ATOM 0 H5 C A 17 -3.297 3.026 -2.513 1.00 0.00 H new ATOM 0 H6 C A 17 -5.014 3.286 -0.826 1.00 0.00 H new ATOM 162 P U A 18 -6.852 7.758 1.580 1.00 0.00 P ATOM 163 OP1 U A 18 -7.694 8.555 2.499 1.00 0.00 O ATOM 164 OP2 U A 18 -7.065 7.846 0.118 1.00 0.00 O ATOM 165 O5' U A 18 -5.310 8.099 1.886 1.00 0.00 O ATOM 166 C5' U A 18 -4.777 7.953 3.205 1.00 0.00 C ATOM 167 C4' U A 18 -3.282 8.243 3.231 1.00 0.00 C ATOM 168 O4' U A 18 -2.534 7.172 2.660 1.00 0.00 O ATOM 169 C3' U A 18 -2.970 9.467 2.388 1.00 0.00 C ATOM 170 O3' U A 18 -2.723 10.569 3.266 1.00 0.00 O ATOM 171 C2' U A 18 -1.679 9.153 1.656 1.00 0.00 C ATOM 172 O2' U A 18 -0.606 9.984 2.102 1.00 0.00 O ATOM 173 C1' U A 18 -1.399 7.689 1.955 1.00 0.00 C ATOM 174 N1 U A 18 -1.171 6.964 0.699 1.00 0.00 N ATOM 175 C2 U A 18 0.137 6.766 0.310 1.00 0.00 C ATOM 176 O2 U A 18 1.086 7.160 0.984 1.00 0.00 O ATOM 177 N3 U A 18 0.321 6.103 -0.887 1.00 0.00 N ATOM 178 C4 U A 18 -0.680 5.623 -1.716 1.00 0.00 C ATOM 179 O4 U A 18 -0.396 5.048 -2.764 1.00 0.00 O ATOM 180 C5 U A 18 -2.022 5.875 -1.227 1.00 0.00 C ATOM 181 C6 U A 18 -2.222 6.530 -0.057 1.00 0.00 C ATOM 0 H5' U A 18 -4.960 6.940 3.564 1.00 0.00 H new ATOM 0 H5'' U A 18 -5.293 8.630 3.886 1.00 0.00 H new ATOM 0 H4' U A 18 -3.012 8.389 4.277 1.00 0.00 H new ATOM 0 H3' U A 18 -3.784 9.708 1.705 1.00 0.00 H new ATOM 0 H2' U A 18 -1.770 9.341 0.586 1.00 0.00 H new ATOM 0 HO2' U A 18 0.233 9.681 1.696 1.00 0.00 H new ATOM 0 H1' U A 18 -0.504 7.571 2.566 1.00 0.00 H new ATOM 0 H3 U A 18 1.284 5.953 -1.189 1.00 0.00 H new ATOM 0 H5 U A 18 -2.872 5.537 -1.802 1.00 0.00 H new ATOM 0 H6 U A 18 -3.231 6.712 0.283 1.00 0.00 H new ATOM 192 P G A 19 -2.579 12.063 2.682 1.00 0.00 P ATOM 193 OP1 G A 19 -2.833 13.021 3.781 1.00 0.00 O ATOM 194 OP2 G A 19 -3.356 12.152 1.427 1.00 0.00 O ATOM 195 O5' G A 19 -1.008 12.121 2.313 1.00 0.00 O ATOM 196 C5' G A 19 -0.034 12.048 3.360 1.00 0.00 C ATOM 197 C4' G A 19 1.383 11.797 2.837 1.00 0.00 C ATOM 198 O4' G A 19 1.532 10.488 2.303 1.00 0.00 O ATOM 199 C3' G A 19 1.744 12.708 1.684 1.00 0.00 C ATOM 200 O3' G A 19 2.093 14.023 2.135 1.00 0.00 O ATOM 201 C2' G A 19 2.944 11.974 1.097 1.00 0.00 C ATOM 202 O2' G A 19 4.160 12.345 1.756 1.00 0.00 O ATOM 203 C1' G A 19 2.600 10.504 1.343 1.00 0.00 C ATOM 204 N9 G A 19 2.204 9.853 0.083 1.00 0.00 N ATOM 205 C8 G A 19 0.971 9.586 -0.392 1.00 0.00 C ATOM 206 N7 G A 19 0.879 8.969 -1.520 1.00 0.00 N ATOM 207 C5 G A 19 2.223 8.800 -1.858 1.00 0.00 C ATOM 208 C6 G A 19 2.802 8.185 -2.998 1.00 0.00 C ATOM 209 O6 G A 19 2.233 7.653 -3.949 1.00 0.00 O ATOM 210 N1 G A 19 4.188 8.230 -2.950 1.00 0.00 N ATOM 211 C2 G A 19 4.932 8.798 -1.936 1.00 0.00 C ATOM 212 N2 G A 19 6.257 8.759 -2.084 1.00 0.00 N ATOM 213 N3 G A 19 4.395 9.376 -0.857 1.00 0.00 N ATOM 214 C4 G A 19 3.044 9.343 -0.881 1.00 0.00 C ATOM 0 H5' G A 19 -0.308 11.250 4.050 1.00 0.00 H new ATOM 0 H5'' G A 19 -0.047 12.978 3.928 1.00 0.00 H new ATOM 0 H4' G A 19 2.019 11.966 3.706 1.00 0.00 H new ATOM 0 H3' G A 19 0.933 12.878 0.976 1.00 0.00 H new ATOM 0 H2' G A 19 3.114 12.204 0.045 1.00 0.00 H new ATOM 0 HO2' G A 19 4.042 13.212 2.197 1.00 0.00 H new ATOM 0 HO3' G A 19 2.322 14.583 1.364 1.00 0.00 H new ATOM 0 H1' G A 19 3.459 9.950 1.722 1.00 0.00 H new ATOM 0 H8 G A 19 0.088 9.880 0.156 1.00 0.00 H new ATOM 0 H1 G A 19 4.698 7.809 -3.727 1.00 0.00 H new ATOM 0 H21 G A 19 6.862 9.162 -1.369 1.00 0.00 H new ATOM 0 H22 G A 19 6.665 8.326 -2.912 1.00 0.00 H new TER 227 G A 19 ATOM 228 O5' C B 59 8.373 4.294 -8.026 1.00 0.00 O ATOM 229 C5' C B 59 9.791 4.163 -8.085 1.00 0.00 C ATOM 230 C4' C B 59 10.501 5.065 -7.070 1.00 0.00 C ATOM 231 O4' C B 59 10.110 6.444 -7.226 1.00 0.00 O ATOM 232 C3' C B 59 10.125 4.702 -5.636 1.00 0.00 C ATOM 233 O3' C B 59 11.138 3.846 -5.097 1.00 0.00 O ATOM 234 C2' C B 59 10.201 6.038 -4.926 1.00 0.00 C ATOM 235 O2' C B 59 11.553 6.404 -4.625 1.00 0.00 O ATOM 236 C1' C B 59 9.598 6.942 -5.976 1.00 0.00 C ATOM 237 N1 C B 59 8.127 6.857 -5.941 1.00 0.00 N ATOM 238 C2 C B 59 7.459 7.484 -4.903 1.00 0.00 C ATOM 239 O2 C B 59 8.088 8.111 -4.052 1.00 0.00 O ATOM 240 N3 C B 59 6.101 7.371 -4.855 1.00 0.00 N ATOM 241 C4 C B 59 5.437 6.671 -5.787 1.00 0.00 C ATOM 242 N4 C B 59 4.109 6.584 -5.720 1.00 0.00 N ATOM 243 C5 C B 59 6.137 6.026 -6.854 1.00 0.00 C ATOM 244 C6 C B 59 7.465 6.152 -6.888 1.00 0.00 C ATOM 0 H5' C B 59 10.135 4.409 -9.090 1.00 0.00 H new ATOM 0 H5'' C B 59 10.066 3.125 -7.900 1.00 0.00 H new ATOM 0 H4' C B 59 11.566 4.924 -7.253 1.00 0.00 H new ATOM 0 H3' C B 59 9.161 4.201 -5.545 1.00 0.00 H new ATOM 0 H2' C B 59 9.699 6.067 -3.959 1.00 0.00 H new ATOM 0 HO2' C B 59 12.141 5.633 -4.769 1.00 0.00 H new ATOM 0 HO5' C B 59 8.136 5.239 -7.919 1.00 0.00 H new ATOM 0 H1' C B 59 9.853 7.990 -5.819 1.00 0.00 H new ATOM 0 H41 C B 59 3.596 6.054 -6.425 1.00 0.00 H new ATOM 0 H42 C B 59 3.605 7.048 -4.964 1.00 0.00 H new ATOM 0 H5 C B 59 5.610 5.457 -7.606 1.00 0.00 H new ATOM 0 H6 C B 59 8.022 5.683 -7.686 1.00 0.00 H new ATOM 257 P A B 60 10.764 2.772 -3.959 1.00 0.00 P ATOM 258 OP1 A B 60 12.008 2.084 -3.545 1.00 0.00 O ATOM 259 OP2 A B 60 9.606 1.982 -4.430 1.00 0.00 O ATOM 260 O5' A B 60 10.276 3.707 -2.742 1.00 0.00 O ATOM 261 C5' A B 60 11.165 4.670 -2.168 1.00 0.00 C ATOM 262 C4' A B 60 10.486 5.480 -1.067 1.00 0.00 C ATOM 263 O4' A B 60 9.557 6.438 -1.596 1.00 0.00 O ATOM 264 C3' A B 60 9.652 4.593 -0.163 1.00 0.00 C ATOM 265 O3' A B 60 10.492 4.058 0.865 1.00 0.00 O ATOM 266 C2' A B 60 8.701 5.603 0.445 1.00 0.00 C ATOM 267 O2' A B 60 9.332 6.360 1.484 1.00 0.00 O ATOM 268 C1' A B 60 8.380 6.474 -0.763 1.00 0.00 C ATOM 269 N9 A B 60 7.194 5.968 -1.487 1.00 0.00 N ATOM 270 C8 A B 60 7.111 5.203 -2.607 1.00 0.00 C ATOM 271 N7 A B 60 5.931 4.901 -3.037 1.00 0.00 N ATOM 272 C5 A B 60 5.116 5.539 -2.096 1.00 0.00 C ATOM 273 C6 A B 60 3.726 5.632 -1.950 1.00 0.00 C ATOM 274 N6 A B 60 2.866 5.052 -2.792 1.00 0.00 N ATOM 275 N1 A B 60 3.261 6.346 -0.908 1.00 0.00 N ATOM 276 C2 A B 60 4.109 6.935 -0.059 1.00 0.00 C ATOM 277 N3 A B 60 5.435 6.908 -0.103 1.00 0.00 N ATOM 278 C4 A B 60 5.878 6.190 -1.151 1.00 0.00 C ATOM 0 H5' A B 60 11.524 5.343 -2.946 1.00 0.00 H new ATOM 0 H5'' A B 60 12.038 4.161 -1.760 1.00 0.00 H new ATOM 0 H4' A B 60 11.302 5.966 -0.532 1.00 0.00 H new ATOM 0 H3' A B 60 9.166 3.755 -0.663 1.00 0.00 H new ATOM 0 H2' A B 60 7.827 5.161 0.923 1.00 0.00 H new ATOM 0 HO2' A B 60 10.139 5.893 1.785 1.00 0.00 H new ATOM 0 H1' A B 60 8.136 7.494 -0.465 1.00 0.00 H new ATOM 0 H8 A B 60 7.998 4.860 -3.118 1.00 0.00 H new ATOM 0 H61 A B 60 1.862 5.149 -2.642 1.00 0.00 H new ATOM 0 H62 A B 60 3.214 4.512 -3.584 1.00 0.00 H new ATOM 0 H2 A B 60 3.666 7.494 0.752 1.00 0.00 H new ATOM 290 P G B 61 10.324 2.521 1.329 1.00 0.00 P ATOM 291 OP1 G B 61 11.486 2.162 2.172 1.00 0.00 O ATOM 292 OP2 G B 61 10.001 1.710 0.134 1.00 0.00 O ATOM 293 O5' G B 61 9.019 2.577 2.268 1.00 0.00 O ATOM 294 C5' G B 61 9.096 3.148 3.576 1.00 0.00 C ATOM 295 C4' G B 61 7.712 3.381 4.169 1.00 0.00 C ATOM 296 O4' G B 61 6.945 4.256 3.341 1.00 0.00 O ATOM 297 C3' G B 61 6.904 2.096 4.250 1.00 0.00 C ATOM 298 O3' G B 61 7.073 1.521 5.549 1.00 0.00 O ATOM 299 C2' G B 61 5.467 2.560 4.129 1.00 0.00 C ATOM 300 O2' G B 61 4.874 2.780 5.414 1.00 0.00 O ATOM 301 C1' G B 61 5.568 3.849 3.331 1.00 0.00 C ATOM 302 N9 G B 61 5.074 3.620 1.964 1.00 0.00 N ATOM 303 C8 G B 61 5.750 3.361 0.818 1.00 0.00 C ATOM 304 N7 G B 61 5.056 3.169 -0.253 1.00 0.00 N ATOM 305 C5 G B 61 3.752 3.309 0.227 1.00 0.00 C ATOM 306 C6 G B 61 2.512 3.209 -0.457 1.00 0.00 C ATOM 307 O6 G B 61 2.314 2.976 -1.647 1.00 0.00 O ATOM 308 N1 G B 61 1.442 3.415 0.404 1.00 0.00 N ATOM 309 C2 G B 61 1.544 3.685 1.751 1.00 0.00 C ATOM 310 N2 G B 61 0.400 3.836 2.411 1.00 0.00 N ATOM 311 N3 G B 61 2.703 3.783 2.399 1.00 0.00 N ATOM 312 C4 G B 61 3.759 3.586 1.584 1.00 0.00 C ATOM 0 H5' G B 61 9.636 4.093 3.530 1.00 0.00 H new ATOM 0 H5'' G B 61 9.666 2.487 4.229 1.00 0.00 H new ATOM 0 H4' G B 61 7.886 3.799 5.161 1.00 0.00 H new ATOM 0 H3' G B 61 7.195 1.366 3.495 1.00 0.00 H new ATOM 0 H2' G B 61 4.827 1.820 3.648 1.00 0.00 H new ATOM 0 HO2' G B 61 3.917 2.571 5.373 1.00 0.00 H new ATOM 0 H1' G B 61 4.957 4.640 3.766 1.00 0.00 H new ATOM 0 H8 G B 61 6.829 3.317 0.802 1.00 0.00 H new ATOM 0 H1 G B 61 0.504 3.362 0.007 1.00 0.00 H new ATOM 0 H21 G B 61 0.411 4.037 3.411 1.00 0.00 H new ATOM 0 H22 G B 61 -0.489 3.750 1.918 1.00 0.00 H new ATOM 324 P U B 62 6.534 0.032 5.855 1.00 0.00 P ATOM 325 OP1 U B 62 7.239 -0.483 7.050 1.00 0.00 O ATOM 326 OP2 U B 62 6.553 -0.740 4.593 1.00 0.00 O ATOM 327 O5' U B 62 4.997 0.317 6.255 1.00 0.00 O ATOM 328 C5' U B 62 4.706 1.009 7.472 1.00 0.00 C ATOM 329 C4' U B 62 3.264 1.513 7.541 1.00 0.00 C ATOM 330 O4' U B 62 2.945 2.347 6.419 1.00 0.00 O ATOM 331 C3' U B 62 2.231 0.400 7.479 1.00 0.00 C ATOM 332 O3' U B 62 1.999 -0.123 8.788 1.00 0.00 O ATOM 333 C2' U B 62 1.007 1.185 7.063 1.00 0.00 C ATOM 334 O2' U B 62 0.485 1.969 8.143 1.00 0.00 O ATOM 335 C1' U B 62 1.605 2.054 5.978 1.00 0.00 C ATOM 336 N1 U B 62 1.614 1.331 4.701 1.00 0.00 N ATOM 337 C2 U B 62 0.431 1.255 3.989 1.00 0.00 C ATOM 338 O2 U B 62 -0.621 1.725 4.417 1.00 0.00 O ATOM 339 N3 U B 62 0.497 0.598 2.774 1.00 0.00 N ATOM 340 C4 U B 62 1.631 0.026 2.221 1.00 0.00 C ATOM 341 O4 U B 62 1.586 -0.516 1.119 1.00 0.00 O ATOM 342 C5 U B 62 2.815 0.151 3.046 1.00 0.00 C ATOM 343 C6 U B 62 2.765 0.782 4.237 1.00 0.00 C ATOM 0 H5' U B 62 5.386 1.855 7.575 1.00 0.00 H new ATOM 0 H5'' U B 62 4.894 0.345 8.315 1.00 0.00 H new ATOM 0 H4' U B 62 3.219 2.040 8.494 1.00 0.00 H new ATOM 0 H3' U B 62 2.507 -0.435 6.835 1.00 0.00 H new ATOM 0 H2' U B 62 0.159 0.577 6.748 1.00 0.00 H new ATOM 0 HO2' U B 62 0.809 1.609 8.995 1.00 0.00 H new ATOM 0 H1' U B 62 1.033 2.967 5.816 1.00 0.00 H new ATOM 0 H3 U B 62 -0.367 0.528 2.237 1.00 0.00 H new ATOM 0 H5 U B 62 3.750 -0.267 2.703 1.00 0.00 H new ATOM 0 H6 U B 62 3.662 0.852 4.835 1.00 0.00 H new ATOM 354 P G B 63 1.428 -1.619 8.961 1.00 0.00 P ATOM 355 OP1 G B 63 1.175 -1.855 10.399 1.00 0.00 O ATOM 356 OP2 G B 63 2.306 -2.540 8.205 1.00 0.00 O ATOM 357 O5' G B 63 0.004 -1.544 8.204 1.00 0.00 O ATOM 358 C5' G B 63 -1.036 -0.692 8.690 1.00 0.00 C ATOM 359 C4' G B 63 -2.334 -0.862 7.900 1.00 0.00 C ATOM 360 O4' G B 63 -2.297 -0.183 6.641 1.00 0.00 O ATOM 361 C3' G B 63 -2.590 -2.313 7.546 1.00 0.00 C ATOM 362 O3' G B 63 -3.270 -2.927 8.642 1.00 0.00 O ATOM 363 C2' G B 63 -3.551 -2.177 6.378 1.00 0.00 C ATOM 364 O2' G B 63 -4.890 -1.930 6.822 1.00 0.00 O ATOM 365 C1' G B 63 -2.975 -0.982 5.648 1.00 0.00 C ATOM 366 N9 G B 63 -2.045 -1.416 4.589 1.00 0.00 N ATOM 367 C8 G B 63 -0.692 -1.436 4.588 1.00 0.00 C ATOM 368 N7 G B 63 -0.097 -1.792 3.504 1.00 0.00 N ATOM 369 C5 G B 63 -1.178 -2.054 2.663 1.00 0.00 C ATOM 370 C6 G B 63 -1.188 -2.490 1.316 1.00 0.00 C ATOM 371 O6 G B 63 -0.230 -2.727 0.586 1.00 0.00 O ATOM 372 N1 G B 63 -2.483 -2.638 0.841 1.00 0.00 N ATOM 373 C2 G B 63 -3.632 -2.399 1.567 1.00 0.00 C ATOM 374 N2 G B 63 -4.785 -2.624 0.938 1.00 0.00 N ATOM 375 N3 G B 63 -3.630 -1.982 2.837 1.00 0.00 N ATOM 376 C4 G B 63 -2.377 -1.831 3.321 1.00 0.00 C ATOM 0 H5' G B 63 -0.710 0.347 8.632 1.00 0.00 H new ATOM 0 H5'' G B 63 -1.221 -0.910 9.742 1.00 0.00 H new ATOM 0 H4' G B 63 -3.106 -0.455 8.553 1.00 0.00 H new ATOM 0 H3' G B 63 -1.698 -2.899 7.326 1.00 0.00 H new ATOM 0 H2' G B 63 -3.631 -3.074 5.764 1.00 0.00 H new ATOM 0 HO2' G B 63 -4.920 -1.955 7.801 1.00 0.00 H new ATOM 0 H1' G B 63 -3.758 -0.405 5.156 1.00 0.00 H new ATOM 0 H8 G B 63 -0.130 -1.162 5.468 1.00 0.00 H new ATOM 0 H1 G B 63 -2.595 -2.949 -0.124 1.00 0.00 H new ATOM 0 H21 G B 63 -5.669 -2.466 1.422 1.00 0.00 H new ATOM 0 H22 G B 63 -4.783 -2.954 -0.027 1.00 0.00 H new ATOM 388 P U B 64 -2.911 -4.429 9.081 1.00 0.00 P ATOM 389 OP1 U B 64 -3.529 -4.690 10.400 1.00 0.00 O ATOM 390 OP2 U B 64 -1.457 -4.634 8.893 1.00 0.00 O ATOM 391 O5' U B 64 -3.689 -5.299 7.979 1.00 0.00 O ATOM 392 C5' U B 64 -5.097 -5.137 7.801 1.00 0.00 C ATOM 393 C4' U B 64 -5.586 -5.864 6.556 1.00 0.00 C ATOM 394 O4' U B 64 -5.361 -5.105 5.367 1.00 0.00 O ATOM 395 C3' U B 64 -4.819 -7.154 6.348 1.00 0.00 C ATOM 396 O3' U B 64 -5.470 -8.197 7.074 1.00 0.00 O ATOM 397 C2' U B 64 -5.007 -7.397 4.866 1.00 0.00 C ATOM 398 O2' U B 64 -6.253 -8.050 4.595 1.00 0.00 O ATOM 399 C1' U B 64 -4.981 -5.990 4.297 1.00 0.00 C ATOM 400 N1 U B 64 -3.650 -5.642 3.759 1.00 0.00 N ATOM 401 C2 U B 64 -3.464 -5.807 2.400 1.00 0.00 C ATOM 402 O2 U B 64 -4.344 -6.259 1.670 1.00 0.00 O ATOM 403 N3 U B 64 -2.227 -5.443 1.905 1.00 0.00 N ATOM 404 C4 U B 64 -1.170 -4.938 2.646 1.00 0.00 C ATOM 405 O4 U B 64 -0.108 -4.644 2.101 1.00 0.00 O ATOM 406 C5 U B 64 -1.453 -4.803 4.059 1.00 0.00 C ATOM 407 C6 U B 64 -2.658 -5.150 4.564 1.00 0.00 C ATOM 0 H5' U B 64 -5.336 -4.076 7.722 1.00 0.00 H new ATOM 0 H5'' U B 64 -5.622 -5.518 8.677 1.00 0.00 H new ATOM 0 H4' U B 64 -6.650 -6.034 6.720 1.00 0.00 H new ATOM 0 H3' U B 64 -3.778 -7.116 6.668 1.00 0.00 H new ATOM 0 H2' U B 64 -4.251 -8.053 4.435 1.00 0.00 H new ATOM 0 HO2' U B 64 -6.691 -8.282 5.440 1.00 0.00 H new ATOM 0 H1' U B 64 -5.671 -5.905 3.458 1.00 0.00 H new ATOM 0 H3 U B 64 -2.078 -5.556 0.902 1.00 0.00 H new ATOM 0 H5 U B 64 -0.690 -4.419 4.720 1.00 0.00 H new ATOM 0 H6 U B 64 -2.842 -5.037 5.622 1.00 0.00 H new ATOM 418 P C B 65 -4.601 -9.319 7.834 1.00 0.00 P ATOM 419 OP1 C B 65 -5.497 -10.062 8.747 1.00 0.00 O ATOM 420 OP2 C B 65 -3.375 -8.677 8.361 1.00 0.00 O ATOM 421 O5' C B 65 -4.178 -10.302 6.631 1.00 0.00 O ATOM 422 C5' C B 65 -5.181 -10.990 5.883 1.00 0.00 C ATOM 423 C4' C B 65 -4.596 -11.708 4.672 1.00 0.00 C ATOM 424 O4' C B 65 -4.393 -10.816 3.578 1.00 0.00 O ATOM 425 C3' C B 65 -3.232 -12.296 4.975 1.00 0.00 C ATOM 426 O3' C B 65 -3.338 -13.574 5.612 1.00 0.00 O ATOM 427 C2' C B 65 -2.633 -12.411 3.584 1.00 0.00 C ATOM 428 O2' C B 65 -3.045 -13.621 2.935 1.00 0.00 O ATOM 429 C1' C B 65 -3.196 -11.179 2.879 1.00 0.00 C ATOM 430 N1 C B 65 -2.232 -10.074 2.910 1.00 0.00 N ATOM 431 C2 C B 65 -1.424 -9.892 1.804 1.00 0.00 C ATOM 432 O2 C B 65 -1.504 -10.661 0.849 1.00 0.00 O ATOM 433 N3 C B 65 -0.554 -8.846 1.810 1.00 0.00 N ATOM 434 C4 C B 65 -0.489 -8.013 2.858 1.00 0.00 C ATOM 435 N4 C B 65 0.395 -7.014 2.845 1.00 0.00 N ATOM 436 C5 C B 65 -1.335 -8.204 3.998 1.00 0.00 C ATOM 437 C6 C B 65 -2.176 -9.246 3.981 1.00 0.00 C ATOM 0 H5' C B 65 -5.939 -10.279 5.553 1.00 0.00 H new ATOM 0 H5'' C B 65 -5.682 -11.713 6.527 1.00 0.00 H new ATOM 0 H4' C B 65 -5.318 -12.485 4.423 1.00 0.00 H new ATOM 0 H3' C B 65 -2.636 -11.699 5.665 1.00 0.00 H new ATOM 0 H2' C B 65 -1.544 -12.451 3.583 1.00 0.00 H new ATOM 0 HO2' C B 65 -3.287 -14.289 3.611 1.00 0.00 H new ATOM 0 HO3' C B 65 -2.441 -13.925 5.792 1.00 0.00 H new ATOM 0 H1' C B 65 -3.402 -11.395 1.831 1.00 0.00 H new ATOM 0 H41 C B 65 0.453 -6.374 3.637 1.00 0.00 H new ATOM 0 H42 C B 65 1.013 -6.890 2.043 1.00 0.00 H new ATOM 0 H5 C B 65 -1.296 -7.531 4.842 1.00 0.00 H new ATOM 0 H6 C B 65 -2.817 -9.428 4.831 1.00 0.00 H new TER 450 C B 65