USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 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 -13:sc= 0.143 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 A O2' : rot -18:sc= 0.094 USER MOD Single : A 3 G O2' : rot 180:sc= -0.233 USER MOD Single : A 4 G O2' : rot -14:sc= -0.262 USER MOD Single : A 5 U O2' : rot 180:sc= -0.295 USER MOD Single : A 6 C O2' : rot 180:sc= -0.384 USER MOD Single : A 7 U O2' : rot 180:sc= -0.452 USER MOD Single : A 8 C O2' : rot -39:sc= 0.133 USER MOD Single : A 8 C O3' : rot 180:sc= 0.117 USER MOD Single : B 9 G O2' : rot 180:sc= -0.403 USER MOD Single : B 9 G O5' : rot 180:sc= 0 USER MOD Single : B 10 A O2' : rot 180:sc= -0.215 USER MOD Single : B 11 G O2' : rot 180:sc= -0.438 USER MOD Single : B 12 G O2' : rot -23:sc= -0.282 USER MOD Single : B 13 U O2' : rot 180:sc= -0.462 USER MOD Single : B 14 C O2' : rot -25:sc= 0.162 USER MOD Single : B 15 U O2' : rot -16:sc= -0.12 USER MOD Single : B 16 C O2' : rot -17:sc= 0.12 USER MOD Single : B 16 C O3' : rot 180:sc= 0.132 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.104 -10.102 1.966 1.00 0.00 O ATOM 2 C5' G A 1 6.002 -9.229 3.071 1.00 0.00 C ATOM 3 C4' G A 1 7.042 -8.116 2.943 1.00 0.00 C ATOM 4 O4' G A 1 6.785 -7.296 1.807 1.00 0.00 O ATOM 5 C3' G A 1 7.022 -7.187 4.143 1.00 0.00 C ATOM 6 O3' G A 1 7.770 -7.727 5.215 1.00 0.00 O ATOM 7 C2' G A 1 7.667 -5.955 3.565 1.00 0.00 C ATOM 8 O2' G A 1 9.068 -6.128 3.505 1.00 0.00 O ATOM 9 C1' G A 1 7.106 -5.942 2.147 1.00 0.00 C ATOM 10 N9 G A 1 5.876 -5.131 2.082 1.00 0.00 N ATOM 11 C8 G A 1 4.573 -5.525 2.250 1.00 0.00 C ATOM 12 N7 G A 1 3.703 -4.575 2.050 1.00 0.00 N ATOM 13 C5 G A 1 4.484 -3.469 1.732 1.00 0.00 C ATOM 14 C6 G A 1 4.097 -2.137 1.405 1.00 0.00 C ATOM 15 O6 G A 1 2.963 -1.672 1.316 1.00 0.00 O ATOM 16 N1 G A 1 5.201 -1.327 1.171 1.00 0.00 N ATOM 17 C2 G A 1 6.514 -1.743 1.227 1.00 0.00 C ATOM 18 N2 G A 1 7.449 -0.822 0.974 1.00 0.00 N ATOM 19 N3 G A 1 6.881 -2.994 1.517 1.00 0.00 N ATOM 20 C4 G A 1 5.817 -3.799 1.761 1.00 0.00 C ATOM 0 H5' G A 1 6.157 -9.780 3.998 1.00 0.00 H new ATOM 0 H5'' G A 1 5.001 -8.801 3.118 1.00 0.00 H new ATOM 0 H4' G A 1 8.004 -8.622 2.858 1.00 0.00 H new ATOM 0 H3' G A 1 6.034 -7.008 4.567 1.00 0.00 H new ATOM 0 H2' G A 1 7.477 -5.048 4.138 1.00 0.00 H new ATOM 0 HO2' G A 1 9.325 -6.906 4.042 1.00 0.00 H new ATOM 0 HO5' G A 1 5.438 -10.816 2.050 1.00 0.00 H new ATOM 0 H1' G A 1 7.837 -5.514 1.461 1.00 0.00 H new ATOM 0 H8 G A 1 4.293 -6.532 2.523 1.00 0.00 H new ATOM 0 H1 G A 1 5.027 -0.349 0.940 1.00 0.00 H new ATOM 0 H21 G A 1 8.436 -1.077 1.002 1.00 0.00 H new ATOM 0 H22 G A 1 7.175 0.135 0.753 1.00 0.00 H new ATOM 33 P A A 2 7.761 -7.027 6.659 1.00 0.00 P ATOM 34 OP1 A A 2 8.667 -7.784 7.550 1.00 0.00 O ATOM 35 OP2 A A 2 6.350 -6.814 7.052 1.00 0.00 O ATOM 36 O5' A A 2 8.425 -5.595 6.363 1.00 0.00 O ATOM 37 C5' A A 2 8.031 -4.470 7.107 1.00 0.00 C ATOM 38 C4' A A 2 8.689 -3.206 6.556 1.00 0.00 C ATOM 39 O4' A A 2 8.339 -2.995 5.187 1.00 0.00 O ATOM 40 C3' A A 2 8.160 -2.013 7.319 1.00 0.00 C ATOM 41 O3' A A 2 8.917 -1.767 8.492 1.00 0.00 O ATOM 42 C2' A A 2 8.279 -0.908 6.311 1.00 0.00 C ATOM 43 O2' A A 2 9.607 -0.433 6.260 1.00 0.00 O ATOM 44 C1' A A 2 7.951 -1.628 5.016 1.00 0.00 C ATOM 45 N9 A A 2 6.499 -1.561 4.765 1.00 0.00 N ATOM 46 C8 A A 2 5.580 -2.572 4.817 1.00 0.00 C ATOM 47 N7 A A 2 4.360 -2.195 4.545 1.00 0.00 N ATOM 48 C5 A A 2 4.483 -0.832 4.284 1.00 0.00 C ATOM 49 C6 A A 2 3.550 0.160 3.919 1.00 0.00 C ATOM 50 N6 A A 2 2.244 -0.083 3.758 1.00 0.00 N ATOM 51 N1 A A 2 4.010 1.412 3.722 1.00 0.00 N ATOM 52 C2 A A 2 5.310 1.651 3.882 1.00 0.00 C ATOM 53 N3 A A 2 6.280 0.810 4.221 1.00 0.00 N ATOM 54 C4 A A 2 5.786 -0.438 4.410 1.00 0.00 C ATOM 0 H5' A A 2 8.307 -4.604 8.153 1.00 0.00 H new ATOM 0 H5'' A A 2 6.946 -4.366 7.074 1.00 0.00 H new ATOM 0 H4' A A 2 9.768 -3.321 6.654 1.00 0.00 H new ATOM 0 H3' A A 2 7.142 -2.141 7.688 1.00 0.00 H new ATOM 0 H2' A A 2 7.644 -0.048 6.525 1.00 0.00 H new ATOM 0 HO2' A A 2 10.084 -0.707 7.071 1.00 0.00 H new ATOM 0 H1' A A 2 8.472 -1.172 4.174 1.00 0.00 H new ATOM 0 H8 A A 2 5.840 -3.591 5.061 1.00 0.00 H new ATOM 0 H61 A A 2 1.613 0.674 3.493 1.00 0.00 H new ATOM 0 H62 A A 2 1.879 -1.025 3.900 1.00 0.00 H new ATOM 0 H2 A A 2 5.619 2.672 3.712 1.00 0.00 H new ATOM 66 P G A 3 8.279 -0.981 9.747 1.00 0.00 P ATOM 67 OP1 G A 3 9.327 -0.837 10.781 1.00 0.00 O ATOM 68 OP2 G A 3 6.998 -1.638 10.088 1.00 0.00 O ATOM 69 O5' G A 3 7.948 0.477 9.164 1.00 0.00 O ATOM 70 C5' G A 3 8.963 1.443 8.970 1.00 0.00 C ATOM 71 C4' G A 3 8.309 2.709 8.423 1.00 0.00 C ATOM 72 O4' G A 3 7.654 2.433 7.191 1.00 0.00 O ATOM 73 C3' G A 3 7.242 3.233 9.345 1.00 0.00 C ATOM 74 O3' G A 3 7.786 3.969 10.430 1.00 0.00 O ATOM 75 C2' G A 3 6.496 4.121 8.380 1.00 0.00 C ATOM 76 O2' G A 3 7.210 5.323 8.182 1.00 0.00 O ATOM 77 C1' G A 3 6.537 3.312 7.090 1.00 0.00 C ATOM 78 N9 G A 3 5.284 2.546 6.971 1.00 0.00 N ATOM 79 C8 G A 3 5.039 1.223 7.236 1.00 0.00 C ATOM 80 N7 G A 3 3.795 0.870 7.056 1.00 0.00 N ATOM 81 C5 G A 3 3.171 2.047 6.648 1.00 0.00 C ATOM 82 C6 G A 3 1.810 2.296 6.304 1.00 0.00 C ATOM 83 O6 G A 3 0.870 1.505 6.283 1.00 0.00 O ATOM 84 N1 G A 3 1.606 3.627 5.960 1.00 0.00 N ATOM 85 C2 G A 3 2.585 4.597 5.939 1.00 0.00 C ATOM 86 N2 G A 3 2.209 5.827 5.582 1.00 0.00 N ATOM 87 N3 G A 3 3.860 4.366 6.250 1.00 0.00 N ATOM 88 C4 G A 3 4.079 3.074 6.596 1.00 0.00 C ATOM 0 H5' G A 3 9.715 1.071 8.274 1.00 0.00 H new ATOM 0 H5'' G A 3 9.474 1.653 9.910 1.00 0.00 H new ATOM 0 H4' G A 3 9.110 3.439 8.309 1.00 0.00 H new ATOM 0 H3' G A 3 6.640 2.469 9.837 1.00 0.00 H new ATOM 0 H2' G A 3 5.494 4.383 8.719 1.00 0.00 H new ATOM 0 HO2' G A 3 6.721 5.894 7.554 1.00 0.00 H new ATOM 0 H1' G A 3 6.635 3.948 6.211 1.00 0.00 H new ATOM 0 H8 G A 3 5.805 0.536 7.564 1.00 0.00 H new ATOM 0 H1 G A 3 0.659 3.907 5.703 1.00 0.00 H new ATOM 0 H21 G A 3 2.895 6.581 5.550 1.00 0.00 H new ATOM 0 H22 G A 3 1.236 6.013 5.341 1.00 0.00 H new ATOM 100 P G A 4 6.835 4.576 11.590 1.00 0.00 P ATOM 101 OP1 G A 4 7.705 5.070 12.680 1.00 0.00 O ATOM 102 OP2 G A 4 5.790 3.572 11.888 1.00 0.00 O ATOM 103 O5' G A 4 6.117 5.857 10.907 1.00 0.00 O ATOM 104 C5' G A 4 6.825 7.066 10.687 1.00 0.00 C ATOM 105 C4' G A 4 5.855 8.152 10.193 1.00 0.00 C ATOM 106 O4' G A 4 5.227 7.778 8.963 1.00 0.00 O ATOM 107 C3' G A 4 4.728 8.391 11.181 1.00 0.00 C ATOM 108 O3' G A 4 5.109 9.271 12.222 1.00 0.00 O ATOM 109 C2' G A 4 3.698 9.026 10.281 1.00 0.00 C ATOM 110 O2' G A 4 4.054 10.369 10.025 1.00 0.00 O ATOM 111 C1' G A 4 3.862 8.230 8.997 1.00 0.00 C ATOM 112 N9 G A 4 2.963 7.062 8.993 1.00 0.00 N ATOM 113 C8 G A 4 3.282 5.749 9.184 1.00 0.00 C ATOM 114 N7 G A 4 2.274 4.931 9.061 1.00 0.00 N ATOM 115 C5 G A 4 1.201 5.767 8.767 1.00 0.00 C ATOM 116 C6 G A 4 -0.166 5.448 8.519 1.00 0.00 C ATOM 117 O6 G A 4 -0.698 4.342 8.499 1.00 0.00 O ATOM 118 N1 G A 4 -0.924 6.589 8.281 1.00 0.00 N ATOM 119 C2 G A 4 -0.430 7.876 8.262 1.00 0.00 C ATOM 120 N2 G A 4 -1.310 8.852 8.017 1.00 0.00 N ATOM 121 N3 G A 4 0.856 8.179 8.480 1.00 0.00 N ATOM 122 C4 G A 4 1.612 7.078 8.729 1.00 0.00 C ATOM 0 H5' G A 4 7.614 6.908 9.952 1.00 0.00 H new ATOM 0 H5'' G A 4 7.308 7.389 11.609 1.00 0.00 H new ATOM 0 H4' G A 4 6.464 9.048 10.069 1.00 0.00 H new ATOM 0 H3' G A 4 4.394 7.493 11.701 1.00 0.00 H new ATOM 0 H2' G A 4 2.690 9.020 10.696 1.00 0.00 H new ATOM 0 HO2' G A 4 4.752 10.648 10.654 1.00 0.00 H new ATOM 0 H1' G A 4 3.618 8.846 8.132 1.00 0.00 H new ATOM 0 H8 G A 4 4.283 5.416 9.417 1.00 0.00 H new ATOM 0 H1 G A 4 -1.921 6.464 8.107 1.00 0.00 H new ATOM 0 H21 G A 4 -1.000 9.823 7.991 1.00 0.00 H new ATOM 0 H22 G A 4 -2.291 8.625 7.856 1.00 0.00 H new ATOM 134 P U A 5 4.305 9.296 13.619 1.00 0.00 P ATOM 135 OP1 U A 5 4.726 10.497 14.373 1.00 0.00 O ATOM 136 OP2 U A 5 4.436 7.959 14.239 1.00 0.00 O ATOM 137 O5' U A 5 2.766 9.487 13.182 1.00 0.00 O ATOM 138 C5' U A 5 2.260 10.741 12.776 1.00 0.00 C ATOM 139 C4' U A 5 0.756 10.613 12.481 1.00 0.00 C ATOM 140 O4' U A 5 0.465 9.830 11.315 1.00 0.00 O ATOM 141 C3' U A 5 0.003 9.970 13.612 1.00 0.00 C ATOM 142 O3' U A 5 -0.209 10.855 14.696 1.00 0.00 O ATOM 143 C2' U A 5 -1.273 9.648 12.883 1.00 0.00 C ATOM 144 O2' U A 5 -2.017 10.826 12.653 1.00 0.00 O ATOM 145 C1' U A 5 -0.765 9.120 11.565 1.00 0.00 C ATOM 146 N1 U A 5 -0.479 7.669 11.656 1.00 0.00 N ATOM 147 C2 U A 5 -1.506 6.767 11.393 1.00 0.00 C ATOM 148 O2 U A 5 -2.653 7.127 11.128 1.00 0.00 O ATOM 149 N3 U A 5 -1.163 5.425 11.444 1.00 0.00 N ATOM 150 C4 U A 5 0.093 4.915 11.734 1.00 0.00 C ATOM 151 O4 U A 5 0.287 3.703 11.752 1.00 0.00 O ATOM 152 C5 U A 5 1.093 5.925 11.995 1.00 0.00 C ATOM 153 C6 U A 5 0.778 7.240 11.946 1.00 0.00 C ATOM 0 H5' U A 5 2.788 11.088 11.888 1.00 0.00 H new ATOM 0 H5'' U A 5 2.427 11.483 13.557 1.00 0.00 H new ATOM 0 H4' U A 5 0.438 11.645 12.329 1.00 0.00 H new ATOM 0 H3' U A 5 0.503 9.126 14.086 1.00 0.00 H new ATOM 0 H2' U A 5 -1.921 8.961 13.427 1.00 0.00 H new ATOM 0 HO2' U A 5 -2.844 10.603 12.177 1.00 0.00 H new ATOM 0 H1' U A 5 -1.501 9.262 10.774 1.00 0.00 H new ATOM 0 H3 U A 5 -1.903 4.750 11.250 1.00 0.00 H new ATOM 0 H5 U A 5 2.104 5.627 12.232 1.00 0.00 H new ATOM 0 H6 U A 5 1.548 7.971 12.143 1.00 0.00 H new ATOM 164 P C A 6 -0.665 10.295 16.139 1.00 0.00 P ATOM 165 OP1 C A 6 -0.928 11.453 17.023 1.00 0.00 O ATOM 166 OP2 C A 6 0.306 9.259 16.554 1.00 0.00 O ATOM 167 O5' C A 6 -2.066 9.569 15.833 1.00 0.00 O ATOM 168 C5' C A 6 -3.237 10.316 15.597 1.00 0.00 C ATOM 169 C4' C A 6 -4.381 9.364 15.245 1.00 0.00 C ATOM 170 O4' C A 6 -4.099 8.611 14.064 1.00 0.00 O ATOM 171 C3' C A 6 -4.632 8.334 16.326 1.00 0.00 C ATOM 172 O3' C A 6 -5.354 8.856 17.423 1.00 0.00 O ATOM 173 C2' C A 6 -5.441 7.331 15.544 1.00 0.00 C ATOM 174 O2' C A 6 -6.753 7.817 15.342 1.00 0.00 O ATOM 175 C1' C A 6 -4.712 7.320 14.206 1.00 0.00 C ATOM 176 N1 C A 6 -3.686 6.246 14.206 1.00 0.00 N ATOM 177 C2 C A 6 -4.135 4.949 14.009 1.00 0.00 C ATOM 178 O2 C A 6 -5.326 4.734 13.802 1.00 0.00 O ATOM 179 N3 C A 6 -3.227 3.935 14.053 1.00 0.00 N ATOM 180 C4 C A 6 -1.932 4.181 14.290 1.00 0.00 C ATOM 181 N4 C A 6 -1.078 3.155 14.334 1.00 0.00 N ATOM 182 C5 C A 6 -1.451 5.516 14.486 1.00 0.00 C ATOM 183 C6 C A 6 -2.362 6.512 14.430 1.00 0.00 C ATOM 0 H5' C A 6 -3.073 11.023 14.784 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.494 10.900 16.481 1.00 0.00 H new ATOM 0 H4' C A 6 -5.247 10.013 15.115 1.00 0.00 H new ATOM 0 H3' C A 6 -3.729 7.941 16.793 1.00 0.00 H new ATOM 0 H2' C A 6 -5.525 6.359 16.031 1.00 0.00 H new ATOM 0 HO2' C A 6 -7.271 7.159 14.832 1.00 0.00 H new ATOM 0 H1' C A 6 -5.392 7.125 13.377 1.00 0.00 H new ATOM 0 H41 C A 6 -0.088 3.323 14.513 1.00 0.00 H new ATOM 0 H42 C A 6 -1.416 2.204 14.188 1.00 0.00 H new ATOM 0 H5 C A 6 -0.406 5.717 14.670 1.00 0.00 H new ATOM 0 H6 C A 6 -2.041 7.534 14.564 1.00 0.00 H new ATOM 195 P U A 7 -5.420 8.052 18.823 1.00 0.00 P ATOM 196 OP1 U A 7 -6.285 8.815 19.751 1.00 0.00 O ATOM 197 OP2 U A 7 -4.035 7.719 19.220 1.00 0.00 O ATOM 198 O5' U A 7 -6.175 6.675 18.454 1.00 0.00 O ATOM 199 C5' U A 7 -7.570 6.646 18.231 1.00 0.00 C ATOM 200 C4' U A 7 -8.021 5.203 17.985 1.00 0.00 C ATOM 201 O4' U A 7 -7.378 4.626 16.843 1.00 0.00 O ATOM 202 C3' U A 7 -7.661 4.287 19.137 1.00 0.00 C ATOM 203 O3' U A 7 -8.527 4.425 20.248 1.00 0.00 O ATOM 204 C2' U A 7 -7.827 2.953 18.463 1.00 0.00 C ATOM 205 O2' U A 7 -9.200 2.650 18.324 1.00 0.00 O ATOM 206 C1' U A 7 -7.247 3.210 17.080 1.00 0.00 C ATOM 207 N1 U A 7 -5.821 2.786 17.022 1.00 0.00 N ATOM 208 C2 U A 7 -5.571 1.426 16.895 1.00 0.00 C ATOM 209 O2 U A 7 -6.475 0.595 16.852 1.00 0.00 O ATOM 210 N3 U A 7 -4.242 1.050 16.815 1.00 0.00 N ATOM 211 C4 U A 7 -3.151 1.900 16.856 1.00 0.00 C ATOM 212 O4 U A 7 -2.009 1.451 16.789 1.00 0.00 O ATOM 213 C5 U A 7 -3.497 3.301 16.976 1.00 0.00 C ATOM 214 C6 U A 7 -4.792 3.696 17.051 1.00 0.00 C ATOM 0 H5' U A 7 -7.824 7.268 17.373 1.00 0.00 H new ATOM 0 H5'' U A 7 -8.095 7.060 19.092 1.00 0.00 H new ATOM 0 H4' U A 7 -9.100 5.275 17.849 1.00 0.00 H new ATOM 0 H3' U A 7 -6.679 4.476 19.570 1.00 0.00 H new ATOM 0 H2' U A 7 -7.359 2.133 19.008 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.300 1.780 17.883 1.00 0.00 H new ATOM 0 H1' U A 7 -7.773 2.638 16.316 1.00 0.00 H new ATOM 0 H3 U A 7 -4.048 0.053 16.717 1.00 0.00 H new ATOM 0 H5 U A 7 -2.712 4.042 17.006 1.00 0.00 H new ATOM 0 H6 U A 7 -5.019 4.748 17.135 1.00 0.00 H new ATOM 225 P C A 8 -8.163 3.737 21.666 1.00 0.00 P ATOM 226 OP1 C A 8 -9.260 4.032 22.615 1.00 0.00 O ATOM 227 OP2 C A 8 -6.775 4.115 22.011 1.00 0.00 O ATOM 228 O5' C A 8 -8.184 2.153 21.357 1.00 0.00 O ATOM 229 C5' C A 8 -9.403 1.452 21.221 1.00 0.00 C ATOM 230 C4' C A 8 -9.120 -0.034 20.975 1.00 0.00 C ATOM 231 O4' C A 8 -8.362 -0.244 19.789 1.00 0.00 O ATOM 232 C3' C A 8 -8.282 -0.653 22.070 1.00 0.00 C ATOM 233 O3' C A 8 -9.017 -0.896 23.250 1.00 0.00 O ATOM 234 C2' C A 8 -7.862 -1.928 21.400 1.00 0.00 C ATOM 235 O2' C A 8 -8.940 -2.839 21.405 1.00 0.00 O ATOM 236 C1' C A 8 -7.601 -1.453 19.970 1.00 0.00 C ATOM 237 N1 C A 8 -6.147 -1.191 19.791 1.00 0.00 N ATOM 238 C2 C A 8 -5.314 -2.290 19.614 1.00 0.00 C ATOM 239 O2 C A 8 -5.785 -3.425 19.580 1.00 0.00 O ATOM 240 N3 C A 8 -3.975 -2.073 19.482 1.00 0.00 N ATOM 241 C4 C A 8 -3.472 -0.830 19.525 1.00 0.00 C ATOM 242 N4 C A 8 -2.154 -0.660 19.381 1.00 0.00 N ATOM 243 C5 C A 8 -4.317 0.309 19.715 1.00 0.00 C ATOM 244 C6 C A 8 -5.641 0.077 19.839 1.00 0.00 C ATOM 0 H5' C A 8 -9.980 1.864 20.393 1.00 0.00 H new ATOM 0 H5'' C A 8 -10.006 1.573 22.121 1.00 0.00 H new ATOM 0 H4' C A 8 -10.110 -0.487 20.918 1.00 0.00 H new ATOM 0 H3' C A 8 -7.463 -0.022 22.415 1.00 0.00 H new ATOM 0 H2' C A 8 -7.015 -2.428 21.870 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.417 -2.777 22.259 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.430 -1.297 23.924 1.00 0.00 H new ATOM 0 H1' C A 8 -7.897 -2.203 19.237 1.00 0.00 H new ATOM 0 H41 C A 8 -1.754 0.278 19.411 1.00 0.00 H new ATOM 0 H42 C A 8 -1.548 -1.468 19.241 1.00 0.00 H new ATOM 0 H5 C A 8 -3.913 1.310 19.757 1.00 0.00 H new ATOM 0 H6 C A 8 -6.314 0.910 19.979 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.747 -10.977 17.787 1.00 0.00 O ATOM 259 C5' G B 9 3.090 -10.252 16.772 1.00 0.00 C ATOM 260 C4' G B 9 1.594 -10.191 17.076 1.00 0.00 C ATOM 261 O4' G B 9 1.342 -9.453 18.272 1.00 0.00 O ATOM 262 C3' G B 9 0.828 -9.460 15.992 1.00 0.00 C ATOM 263 O3' G B 9 0.584 -10.270 14.858 1.00 0.00 O ATOM 264 C2' G B 9 -0.440 -9.131 16.737 1.00 0.00 C ATOM 265 O2' G B 9 -1.247 -10.285 16.857 1.00 0.00 O ATOM 266 C1' G B 9 0.093 -8.762 18.113 1.00 0.00 C ATOM 267 N9 G B 9 0.318 -7.305 18.173 1.00 0.00 N ATOM 268 C8 G B 9 1.463 -6.599 17.916 1.00 0.00 C ATOM 269 N7 G B 9 1.335 -5.310 18.058 1.00 0.00 N ATOM 270 C5 G B 9 0.003 -5.146 18.427 1.00 0.00 C ATOM 271 C6 G B 9 -0.731 -3.957 18.710 1.00 0.00 C ATOM 272 O6 G B 9 -0.330 -2.795 18.708 1.00 0.00 O ATOM 273 N1 G B 9 -2.058 -4.235 19.017 1.00 0.00 N ATOM 274 C2 G B 9 -2.614 -5.496 19.053 1.00 0.00 C ATOM 275 N2 G B 9 -3.912 -5.574 19.361 1.00 0.00 N ATOM 276 N3 G B 9 -1.927 -6.614 18.796 1.00 0.00 N ATOM 277 C4 G B 9 -0.629 -6.364 18.490 1.00 0.00 C ATOM 0 H5' G B 9 3.256 -10.727 15.805 1.00 0.00 H new ATOM 0 H5'' G B 9 3.500 -9.244 16.707 1.00 0.00 H new ATOM 0 H4' G B 9 1.272 -11.229 17.159 1.00 0.00 H new ATOM 0 H3' G B 9 1.350 -8.600 15.573 1.00 0.00 H new ATOM 0 H2' G B 9 -1.043 -8.361 16.256 1.00 0.00 H new ATOM 0 HO2' G B 9 -2.068 -10.061 17.343 1.00 0.00 H new ATOM 0 HO5' G B 9 4.706 -11.018 17.591 1.00 0.00 H new ATOM 0 H1' G B 9 -0.609 -9.038 18.900 1.00 0.00 H new ATOM 0 H8 G B 9 2.390 -7.069 17.622 1.00 0.00 H new ATOM 0 H1 G B 9 -2.667 -3.446 19.232 1.00 0.00 H new ATOM 0 H21 G B 9 -4.373 -6.483 19.401 1.00 0.00 H new ATOM 0 H22 G B 9 -4.442 -4.724 19.556 1.00 0.00 H new ATOM 290 P A B 10 0.098 -9.613 13.464 1.00 0.00 P ATOM 291 OP1 A B 10 -0.132 -10.708 12.496 1.00 0.00 O ATOM 292 OP2 A B 10 1.039 -8.522 13.127 1.00 0.00 O ATOM 293 O5' A B 10 -1.327 -8.950 13.820 1.00 0.00 O ATOM 294 C5' A B 10 -2.484 -9.745 13.978 1.00 0.00 C ATOM 295 C4' A B 10 -3.674 -8.844 14.316 1.00 0.00 C ATOM 296 O4' A B 10 -3.432 -8.088 15.497 1.00 0.00 O ATOM 297 C3' A B 10 -3.929 -7.811 13.240 1.00 0.00 C ATOM 298 O3' A B 10 -4.589 -8.363 12.113 1.00 0.00 O ATOM 299 C2' A B 10 -4.793 -6.834 13.993 1.00 0.00 C ATOM 300 O2' A B 10 -6.110 -7.337 14.094 1.00 0.00 O ATOM 301 C1' A B 10 -4.152 -6.852 15.381 1.00 0.00 C ATOM 302 N9 A B 10 -3.227 -5.705 15.529 1.00 0.00 N ATOM 303 C8 A B 10 -1.859 -5.674 15.419 1.00 0.00 C ATOM 304 N7 A B 10 -1.339 -4.491 15.608 1.00 0.00 N ATOM 305 C5 A B 10 -2.441 -3.679 15.862 1.00 0.00 C ATOM 306 C6 A B 10 -2.570 -2.305 16.145 1.00 0.00 C ATOM 307 N6 A B 10 -1.528 -1.468 16.220 1.00 0.00 N ATOM 308 N1 A B 10 -3.810 -1.822 16.348 1.00 0.00 N ATOM 309 C2 A B 10 -4.846 -2.654 16.275 1.00 0.00 C ATOM 310 N3 A B 10 -4.856 -3.956 16.018 1.00 0.00 N ATOM 311 C4 A B 10 -3.596 -4.411 15.818 1.00 0.00 C ATOM 0 H5' A B 10 -2.331 -10.477 14.771 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.684 -10.303 13.063 1.00 0.00 H new ATOM 0 H4' A B 10 -4.520 -9.523 14.427 1.00 0.00 H new ATOM 0 H3' A B 10 -3.028 -7.373 12.809 1.00 0.00 H new ATOM 0 H2' A B 10 -4.852 -5.850 13.529 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.667 -6.698 14.586 1.00 0.00 H new ATOM 0 H1' A B 10 -4.910 -6.772 16.160 1.00 0.00 H new ATOM 0 H8 A B 10 -1.266 -6.549 15.196 1.00 0.00 H new ATOM 0 H61 A B 10 -1.680 -0.481 16.428 1.00 0.00 H new ATOM 0 H62 A B 10 -0.582 -1.817 16.069 1.00 0.00 H new ATOM 0 H2 A B 10 -5.814 -2.207 16.449 1.00 0.00 H new ATOM 323 P G B 11 -4.636 -7.573 10.704 1.00 0.00 P ATOM 324 OP1 G B 11 -5.421 -8.384 9.747 1.00 0.00 O ATOM 325 OP2 G B 11 -3.253 -7.172 10.362 1.00 0.00 O ATOM 326 O5' G B 11 -5.472 -6.239 11.032 1.00 0.00 O ATOM 327 C5' G B 11 -6.879 -6.271 11.176 1.00 0.00 C ATOM 328 C4' G B 11 -7.361 -4.865 11.534 1.00 0.00 C ATOM 329 O4' G B 11 -6.739 -4.413 12.729 1.00 0.00 O ATOM 330 C3' G B 11 -6.991 -3.846 10.491 1.00 0.00 C ATOM 331 O3' G B 11 -7.843 -3.908 9.358 1.00 0.00 O ATOM 332 C2' G B 11 -7.205 -2.585 11.295 1.00 0.00 C ATOM 333 O2' G B 11 -8.582 -2.288 11.364 1.00 0.00 O ATOM 334 C1' G B 11 -6.729 -2.988 12.688 1.00 0.00 C ATOM 335 N9 G B 11 -5.368 -2.464 12.899 1.00 0.00 N ATOM 336 C8 G B 11 -4.159 -3.102 12.795 1.00 0.00 C ATOM 337 N7 G B 11 -3.132 -2.323 13.000 1.00 0.00 N ATOM 338 C5 G B 11 -3.703 -1.078 13.253 1.00 0.00 C ATOM 339 C6 G B 11 -3.088 0.176 13.540 1.00 0.00 C ATOM 340 O6 G B 11 -1.891 0.435 13.639 1.00 0.00 O ATOM 341 N1 G B 11 -4.034 1.180 13.716 1.00 0.00 N ATOM 342 C2 G B 11 -5.399 1.003 13.636 1.00 0.00 C ATOM 343 N2 G B 11 -6.162 2.079 13.842 1.00 0.00 N ATOM 344 N3 G B 11 -5.976 -0.169 13.373 1.00 0.00 N ATOM 345 C4 G B 11 -5.071 -1.161 13.192 1.00 0.00 C ATOM 0 H5' G B 11 -7.164 -6.979 11.954 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.347 -6.608 10.251 1.00 0.00 H new ATOM 0 H4' G B 11 -8.444 -4.947 11.628 1.00 0.00 H new ATOM 0 H3' G B 11 -5.996 -3.960 10.061 1.00 0.00 H new ATOM 0 H2' G B 11 -6.695 -1.718 10.876 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.714 -1.470 11.887 1.00 0.00 H new ATOM 0 H1' G B 11 -7.370 -2.586 13.473 1.00 0.00 H new ATOM 0 H8 G B 11 -4.065 -4.153 12.565 1.00 0.00 H new ATOM 0 H1 G B 11 -3.692 2.119 13.920 1.00 0.00 H new ATOM 0 H21 G B 11 -7.178 2.001 13.794 1.00 0.00 H new ATOM 0 H22 G B 11 -5.729 2.979 14.048 1.00 0.00 H new ATOM 357 P G B 12 -7.627 -2.921 8.094 1.00 0.00 P ATOM 358 OP1 G B 12 -8.489 -3.397 6.990 1.00 0.00 O ATOM 359 OP2 G B 12 -6.170 -2.777 7.875 1.00 0.00 O ATOM 360 O5' G B 12 -8.201 -1.493 8.593 1.00 0.00 O ATOM 361 C5' G B 12 -9.595 -1.273 8.733 1.00 0.00 C ATOM 362 C4' G B 12 -9.851 0.194 9.106 1.00 0.00 C ATOM 363 O4' G B 12 -9.200 0.545 10.331 1.00 0.00 O ATOM 364 C3' G B 12 -9.306 1.146 8.059 1.00 0.00 C ATOM 365 O3' G B 12 -10.195 1.302 6.969 1.00 0.00 O ATOM 366 C2' G B 12 -9.205 2.414 8.870 1.00 0.00 C ATOM 367 O2' G B 12 -10.491 2.973 9.040 1.00 0.00 O ATOM 368 C1' G B 12 -8.724 1.897 10.216 1.00 0.00 C ATOM 369 N9 G B 12 -7.250 1.908 10.282 1.00 0.00 N ATOM 370 C8 G B 12 -6.389 0.849 10.224 1.00 0.00 C ATOM 371 N7 G B 12 -5.134 1.173 10.370 1.00 0.00 N ATOM 372 C5 G B 12 -5.164 2.555 10.537 1.00 0.00 C ATOM 373 C6 G B 12 -4.094 3.477 10.744 1.00 0.00 C ATOM 374 O6 G B 12 -2.892 3.243 10.831 1.00 0.00 O ATOM 375 N1 G B 12 -4.556 4.784 10.846 1.00 0.00 N ATOM 376 C2 G B 12 -5.880 5.161 10.779 1.00 0.00 C ATOM 377 N2 G B 12 -6.137 6.468 10.897 1.00 0.00 N ATOM 378 N3 G B 12 -6.888 4.299 10.597 1.00 0.00 N ATOM 379 C4 G B 12 -6.457 3.016 10.481 1.00 0.00 C ATOM 0 H5' G B 12 -10.002 -1.930 9.502 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.107 -1.517 7.802 1.00 0.00 H new ATOM 0 H4' G B 12 -10.934 0.285 9.191 1.00 0.00 H new ATOM 0 H3' G B 12 -8.375 0.819 7.596 1.00 0.00 H new ATOM 0 H2' G B 12 -8.566 3.173 8.417 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.083 2.653 8.328 1.00 0.00 H new ATOM 0 H1' G B 12 -9.097 2.526 11.024 1.00 0.00 H new ATOM 0 H8 G B 12 -6.719 -0.168 10.071 1.00 0.00 H new ATOM 0 H1 G B 12 -3.863 5.520 10.981 1.00 0.00 H new ATOM 0 H21 G B 12 -7.099 6.804 10.855 1.00 0.00 H new ATOM 0 H22 G B 12 -5.371 7.128 11.029 1.00 0.00 H new ATOM 391 P U B 13 -9.674 1.852 5.546 1.00 0.00 P ATOM 392 OP1 U B 13 -10.855 2.157 4.708 1.00 0.00 O ATOM 393 OP2 U B 13 -8.645 0.913 5.048 1.00 0.00 O ATOM 394 O5' U B 13 -8.941 3.240 5.908 1.00 0.00 O ATOM 395 C5' U B 13 -9.672 4.409 6.204 1.00 0.00 C ATOM 396 C4' U B 13 -8.699 5.570 6.463 1.00 0.00 C ATOM 397 O4' U B 13 -7.933 5.421 7.667 1.00 0.00 O ATOM 398 C3' U B 13 -7.702 5.746 5.351 1.00 0.00 C ATOM 399 O3' U B 13 -8.264 6.389 4.224 1.00 0.00 O ATOM 400 C2' U B 13 -6.703 6.618 6.065 1.00 0.00 C ATOM 401 O2' U B 13 -7.199 7.934 6.205 1.00 0.00 O ATOM 402 C1' U B 13 -6.624 5.975 7.425 1.00 0.00 C ATOM 403 N1 U B 13 -5.622 4.884 7.433 1.00 0.00 N ATOM 404 C2 U B 13 -4.298 5.197 7.719 1.00 0.00 C ATOM 405 O2 U B 13 -3.918 6.350 7.922 1.00 0.00 O ATOM 406 N3 U B 13 -3.418 4.127 7.768 1.00 0.00 N ATOM 407 C4 U B 13 -3.741 2.795 7.557 1.00 0.00 C ATOM 408 O4 U B 13 -2.879 1.924 7.626 1.00 0.00 O ATOM 409 C5 U B 13 -5.138 2.568 7.265 1.00 0.00 C ATOM 410 C6 U B 13 -6.012 3.600 7.216 1.00 0.00 C ATOM 0 H5' U B 13 -10.301 4.246 7.079 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.336 4.655 5.375 1.00 0.00 H new ATOM 0 H4' U B 13 -9.356 6.436 6.543 1.00 0.00 H new ATOM 0 H3' U B 13 -7.302 4.823 4.932 1.00 0.00 H new ATOM 0 H2' U B 13 -5.750 6.692 5.542 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.537 8.485 6.672 1.00 0.00 H new ATOM 0 H1' U B 13 -6.328 6.698 8.185 1.00 0.00 H new ATOM 0 H3 U B 13 -2.443 4.339 7.979 1.00 0.00 H new ATOM 0 H5 U B 13 -5.489 1.563 7.084 1.00 0.00 H new ATOM 0 H6 U B 13 -7.050 3.397 6.998 1.00 0.00 H new ATOM 421 P C B 14 -7.506 6.367 2.799 1.00 0.00 P ATOM 422 OP1 C B 14 -8.266 7.218 1.857 1.00 0.00 O ATOM 423 OP2 C B 14 -7.227 4.956 2.453 1.00 0.00 O ATOM 424 O5' C B 14 -6.104 7.088 3.109 1.00 0.00 O ATOM 425 C5' C B 14 -6.029 8.484 3.294 1.00 0.00 C ATOM 426 C4' C B 14 -4.592 8.864 3.654 1.00 0.00 C ATOM 427 O4' C B 14 -4.160 8.230 4.853 1.00 0.00 O ATOM 428 C3' C B 14 -3.605 8.443 2.587 1.00 0.00 C ATOM 429 O3' C B 14 -3.612 9.341 1.495 1.00 0.00 O ATOM 430 C2' C B 14 -2.318 8.500 3.367 1.00 0.00 C ATOM 431 O2' C B 14 -1.900 9.843 3.499 1.00 0.00 O ATOM 432 C1' C B 14 -2.752 7.979 4.738 1.00 0.00 C ATOM 433 N1 C B 14 -2.484 6.523 4.840 1.00 0.00 N ATOM 434 C2 C B 14 -1.180 6.140 5.112 1.00 0.00 C ATOM 435 O2 C B 14 -0.309 6.991 5.275 1.00 0.00 O ATOM 436 N3 C B 14 -0.898 4.810 5.188 1.00 0.00 N ATOM 437 C4 C B 14 -1.854 3.892 4.993 1.00 0.00 C ATOM 438 N4 C B 14 -1.532 2.597 5.069 1.00 0.00 N ATOM 439 C5 C B 14 -3.207 4.272 4.718 1.00 0.00 C ATOM 440 C6 C B 14 -3.474 5.594 4.660 1.00 0.00 C ATOM 0 H5' C B 14 -6.710 8.796 4.086 1.00 0.00 H new ATOM 0 H5'' C B 14 -6.338 9.001 2.386 1.00 0.00 H new ATOM 0 H4' C B 14 -4.610 9.948 3.764 1.00 0.00 H new ATOM 0 H3' C B 14 -3.806 7.475 2.128 1.00 0.00 H new ATOM 0 H2' C B 14 -1.500 7.944 2.909 1.00 0.00 H new ATOM 0 HO2' C B 14 -2.274 10.376 2.766 1.00 0.00 H new ATOM 0 H1' C B 14 -2.200 8.476 5.536 1.00 0.00 H new ATOM 0 H41 C B 14 -2.247 1.884 4.923 1.00 0.00 H new ATOM 0 H42 C B 14 -0.571 2.322 5.273 1.00 0.00 H new ATOM 0 H5 C B 14 -3.980 3.533 4.564 1.00 0.00 H new ATOM 0 H6 C B 14 -4.484 5.924 4.469 1.00 0.00 H new ATOM 452 P U B 15 -2.764 9.032 0.167 1.00 0.00 P ATOM 453 OP1 U B 15 -3.017 10.114 -0.810 1.00 0.00 O ATOM 454 OP2 U B 15 -3.013 7.624 -0.215 1.00 0.00 O ATOM 455 O5' U B 15 -1.241 9.155 0.668 1.00 0.00 O ATOM 456 C5' U B 15 -0.225 8.426 0.024 1.00 0.00 C ATOM 457 C4' U B 15 1.125 8.676 0.696 1.00 0.00 C ATOM 458 O4' U B 15 1.123 8.249 2.069 1.00 0.00 O ATOM 459 C3' U B 15 2.188 7.857 -0.011 1.00 0.00 C ATOM 460 O3' U B 15 2.773 8.564 -1.088 1.00 0.00 O ATOM 461 C2' U B 15 3.167 7.605 1.102 1.00 0.00 C ATOM 462 O2' U B 15 3.927 8.770 1.349 1.00 0.00 O ATOM 463 C1' U B 15 2.236 7.368 2.278 1.00 0.00 C ATOM 464 N1 U B 15 1.755 5.958 2.350 1.00 0.00 N ATOM 465 C2 U B 15 2.686 4.974 2.665 1.00 0.00 C ATOM 466 O2 U B 15 3.877 5.226 2.828 1.00 0.00 O ATOM 467 N3 U B 15 2.194 3.683 2.799 1.00 0.00 N ATOM 468 C4 U B 15 0.867 3.300 2.673 1.00 0.00 C ATOM 469 O4 U B 15 0.543 2.122 2.800 1.00 0.00 O ATOM 470 C5 U B 15 -0.042 4.395 2.401 1.00 0.00 C ATOM 471 C6 U B 15 0.416 5.659 2.255 1.00 0.00 C ATOM 0 H5' U B 15 -0.173 8.714 -1.026 1.00 0.00 H new ATOM 0 H5'' U B 15 -0.460 7.362 0.052 1.00 0.00 H new ATOM 0 H4' U B 15 1.322 9.747 0.643 1.00 0.00 H new ATOM 0 H3' U B 15 1.808 6.947 -0.476 1.00 0.00 H new ATOM 0 H2' U B 15 3.869 6.796 0.900 1.00 0.00 H new ATOM 0 HO2' U B 15 3.835 9.387 0.593 1.00 0.00 H new ATOM 0 H1' U B 15 2.758 7.557 3.216 1.00 0.00 H new ATOM 0 H3 U B 15 2.870 2.949 3.009 1.00 0.00 H new ATOM 0 H5 U B 15 -1.100 4.199 2.314 1.00 0.00 H new ATOM 0 H6 U B 15 -0.288 6.454 2.059 1.00 0.00 H new ATOM 482 P C B 16 3.519 7.779 -2.283 1.00 0.00 P ATOM 483 OP1 C B 16 4.128 8.781 -3.185 1.00 0.00 O ATOM 484 OP2 C B 16 2.574 6.780 -2.829 1.00 0.00 O ATOM 485 O5' C B 16 4.705 6.985 -1.543 1.00 0.00 O ATOM 486 C5' C B 16 5.863 7.652 -1.092 1.00 0.00 C ATOM 487 C4' C B 16 6.817 6.626 -0.480 1.00 0.00 C ATOM 488 O4' C B 16 6.240 5.988 0.658 1.00 0.00 O ATOM 489 C3' C B 16 7.127 5.502 -1.444 1.00 0.00 C ATOM 490 O3' C B 16 8.089 5.862 -2.412 1.00 0.00 O ATOM 491 C2' C B 16 7.646 4.461 -0.503 1.00 0.00 C ATOM 492 O2' C B 16 8.964 4.784 -0.115 1.00 0.00 O ATOM 493 C1' C B 16 6.707 4.627 0.685 1.00 0.00 C ATOM 494 N1 C B 16 5.569 3.680 0.542 1.00 0.00 N ATOM 495 C2 C B 16 5.817 2.338 0.799 1.00 0.00 C ATOM 496 O2 C B 16 6.937 1.970 1.145 1.00 0.00 O ATOM 497 N3 C B 16 4.791 1.453 0.656 1.00 0.00 N ATOM 498 C4 C B 16 3.574 1.862 0.275 1.00 0.00 C ATOM 499 N4 C B 16 2.593 0.960 0.163 1.00 0.00 N ATOM 500 C5 C B 16 3.306 3.240 -0.005 1.00 0.00 C ATOM 501 C6 C B 16 4.333 4.105 0.145 1.00 0.00 C ATOM 0 H5' C B 16 5.599 8.409 -0.354 1.00 0.00 H new ATOM 0 H5'' C B 16 6.347 8.170 -1.920 1.00 0.00 H new ATOM 0 H4' C B 16 7.712 7.190 -0.219 1.00 0.00 H new ATOM 0 H3' C B 16 6.274 5.189 -2.045 1.00 0.00 H new ATOM 0 H2' C B 16 7.675 3.454 -0.918 1.00 0.00 H new ATOM 0 HO2' C B 16 9.337 5.441 -0.739 1.00 0.00 H new ATOM 0 HO3' C B 16 8.254 5.102 -3.008 1.00 0.00 H new ATOM 0 H1' C B 16 7.207 4.416 1.630 1.00 0.00 H new ATOM 0 H41 C B 16 1.660 1.254 -0.126 1.00 0.00 H new ATOM 0 H42 C B 16 2.778 -0.022 0.367 1.00 0.00 H new ATOM 0 H5 C B 16 2.328 3.573 -0.321 1.00 0.00 H new ATOM 0 H6 C B 16 4.173 5.155 -0.053 1.00 0.00 H new TER 514 C B 16