USER MOD reduce.3.24.130724 H: found=0, std=0, add=294, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 301 hydrogens (51 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 4 G O2' : rot -19:sc= 0.0416 USER MOD Single : A 4 G O5' : rot 180:sc= 0 USER MOD Single : A 5 G O2' : rot -18:sc= 0.0329 USER MOD Single : A 6 A O2' : rot -14:sc= 0.124 USER MOD Single : A 7 C O2' : rot 180:sc= 0 USER MOD Single : A 8 U O2' : rot -15:sc= 0.0524 USER MOD Single : A 9 G O2' : rot 180:sc= 0 USER MOD Single : A 10 G O2' : rot -7:sc= 0.134 USER MOD Single : A 11 G O2' : rot -6:sc= 0.132 USER MOD Single : A 12 C O2' : rot -24:sc= 0.0792 USER MOD Single : A 13 G O2' : rot 180:sc= 0 USER MOD Single : A 14 A O2' : rot -27:sc= 0.0504 USER MOD Single : A 15 G O2' : rot -14:sc= 0.0402 USER MOD Single : A 16 A O2' : rot 25:sc= 0.0626 USER MOD Single : A 17 A O2' : rot -22:sc=0.000317 USER MOD Single : A 18 G O2' : rot -18:sc= 0.088 USER MOD Single : A 19 U O2' : rot -17:sc= 0.0357 USER MOD Single : A 20 U O2' : rot -15:sc= 0.0631 USER MOD Single : A 21 U O2' : rot -60:sc= 0.152 USER MOD Single : A 22 A O2' : rot -17:sc= 0.037 USER MOD Single : A 23 G O2' : rot -20:sc= 0.0817 USER MOD Single : A 24 U O2' : rot -16:sc= 0.0656 USER MOD Single : A 25 C O2' : rot -20:sc= 0.042 USER MOD Single : A 26 C O2' : rot -17:sc= 0.0559 USER MOD Single : A 26 C O3' : rot 180:sc= 0.0699 USER MOD Single : A 27 BDG O3 : rot -92:sc= 0.394 USER MOD Single : A 27 BDG O4 : rot 178:sc= 0.308 USER MOD Single : A 28 NEB N1 :NH3+ -163:sc= 1.99 (180deg=1.6) USER MOD Single : A 28 NEB O6 : rot 140:sc= 0 USER MOD Single : A 29 BDR O2 : rot -136:sc=0.000164 USER MOD Single : A 29 BDR O5 : rot -2:sc= 1.21 USER MOD Single : A 30 IDG O3 : rot -61:sc= 0.033 USER MOD Single : A 30 IDG O4 : rot -159:sc= 0.0886 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 4 6.564 11.983 -7.943 1.00 0.81 O ATOM 2 C5' G A 4 6.206 11.266 -6.764 1.00 0.66 C ATOM 3 C4' G A 4 6.891 11.863 -5.523 1.00 0.44 C ATOM 4 O4' G A 4 6.417 13.230 -5.275 1.00 0.43 O ATOM 5 C3' G A 4 6.547 11.125 -4.228 1.00 0.35 C ATOM 6 O3' G A 4 7.322 9.932 -4.058 1.00 0.41 O ATOM 7 C2' G A 4 6.811 12.189 -3.156 1.00 0.33 C ATOM 8 O2' G A 4 8.187 12.276 -2.779 1.00 0.40 O ATOM 9 C1' G A 4 6.341 13.482 -3.857 1.00 0.36 C ATOM 10 N9 G A 4 4.957 13.950 -3.504 1.00 0.38 N ATOM 11 C8 G A 4 3.815 13.872 -4.251 1.00 0.43 C ATOM 12 N7 G A 4 2.746 14.378 -3.689 1.00 0.46 N ATOM 13 C5 G A 4 3.181 14.827 -2.469 1.00 0.40 C ATOM 14 C6 G A 4 2.442 15.456 -1.452 1.00 0.41 C ATOM 15 O6 G A 4 1.232 15.718 -1.489 1.00 0.46 O ATOM 16 N1 G A 4 3.259 15.773 -0.344 1.00 0.38 N ATOM 17 C2 G A 4 4.627 15.514 -0.228 1.00 0.36 C ATOM 18 N2 G A 4 5.143 15.935 0.951 1.00 0.40 N ATOM 19 N3 G A 4 5.310 14.905 -1.224 1.00 0.34 N ATOM 20 C4 G A 4 4.550 14.586 -2.308 1.00 0.36 C ATOM 0 H5' G A 4 6.490 10.219 -6.871 1.00 0.66 H new ATOM 0 H5'' G A 4 5.124 11.292 -6.634 1.00 0.66 H new ATOM 0 H4' G A 4 7.956 11.798 -5.747 1.00 0.44 H new ATOM 0 H3' G A 4 5.524 10.750 -4.197 1.00 0.35 H new ATOM 0 H2' G A 4 6.299 11.974 -2.218 1.00 0.33 H new ATOM 0 HO2' G A 4 8.650 11.452 -3.039 1.00 0.40 H new ATOM 0 HO5' G A 4 6.117 11.583 -8.718 1.00 0.81 H new ATOM 0 H1' G A 4 6.990 14.289 -3.518 1.00 0.36 H new ATOM 0 H8 G A 4 3.796 13.425 -5.234 1.00 0.43 H new ATOM 0 H1 G A 4 2.808 16.234 0.446 1.00 0.38 H new ATOM 0 H21 G A 4 6.134 15.800 1.151 1.00 0.40 H new ATOM 0 H22 G A 4 4.541 16.387 1.639 1.00 0.40 H new ATOM 33 P G A 5 6.719 8.518 -3.645 1.00 0.36 P ATOM 34 OP1 G A 5 7.254 7.504 -4.575 1.00 0.48 O ATOM 35 OP2 G A 5 5.242 8.619 -3.519 1.00 0.44 O ATOM 36 O5' G A 5 7.399 8.318 -2.221 1.00 0.40 O ATOM 37 C5' G A 5 6.667 8.025 -1.032 1.00 0.43 C ATOM 38 C4' G A 5 7.005 9.015 0.103 1.00 0.30 C ATOM 39 O4' G A 5 6.800 10.400 -0.340 1.00 0.29 O ATOM 40 C3' G A 5 6.086 8.863 1.322 1.00 0.27 C ATOM 41 O3' G A 5 6.588 7.898 2.261 1.00 0.27 O ATOM 42 C2' G A 5 5.998 10.289 1.883 1.00 0.25 C ATOM 43 O2' G A 5 7.117 10.640 2.696 1.00 0.29 O ATOM 44 C1' G A 5 5.985 11.122 0.588 1.00 0.25 C ATOM 45 N9 G A 5 4.646 11.393 -0.035 1.00 0.23 N ATOM 46 C8 G A 5 4.158 11.009 -1.256 1.00 0.27 C ATOM 47 N7 G A 5 2.944 11.425 -1.516 1.00 0.28 N ATOM 48 C5 G A 5 2.578 12.134 -0.403 1.00 0.24 C ATOM 49 C6 G A 5 1.367 12.799 -0.136 1.00 0.26 C ATOM 50 O6 G A 5 0.390 12.854 -0.892 1.00 0.29 O ATOM 51 N1 G A 5 1.387 13.418 1.135 1.00 0.24 N ATOM 52 C2 G A 5 2.452 13.390 2.037 1.00 0.23 C ATOM 53 N2 G A 5 2.197 14.056 3.177 1.00 0.26 N ATOM 54 N3 G A 5 3.599 12.746 1.752 1.00 0.21 N ATOM 55 C4 G A 5 3.609 12.143 0.539 1.00 0.22 C ATOM 0 H5' G A 5 6.891 7.009 -0.708 1.00 0.43 H new ATOM 0 H5'' G A 5 5.598 8.064 -1.243 1.00 0.43 H new ATOM 0 H4' G A 5 8.040 8.796 0.365 1.00 0.30 H new ATOM 0 H3' G A 5 5.101 8.469 1.074 1.00 0.27 H new ATOM 0 H2' G A 5 5.140 10.435 2.539 1.00 0.25 H new ATOM 0 HO2' G A 5 7.584 9.826 2.979 1.00 0.29 H new ATOM 0 H1' G A 5 6.346 12.118 0.844 1.00 0.25 H new ATOM 0 H8 G A 5 4.730 10.410 -1.950 1.00 0.27 H new ATOM 0 H1 G A 5 0.551 13.929 1.417 1.00 0.24 H new ATOM 0 H21 G A 5 2.905 14.102 3.910 1.00 0.26 H new ATOM 0 H22 G A 5 1.296 14.515 3.309 1.00 0.26 H new ATOM 67 P A A 6 5.588 6.947 3.063 1.00 0.25 P ATOM 68 OP1 A A 6 6.348 5.919 3.820 1.00 0.28 O ATOM 69 OP2 A A 6 4.546 6.419 2.151 1.00 0.27 O ATOM 70 O5' A A 6 4.867 7.941 4.070 1.00 0.26 O ATOM 71 C5' A A 6 5.567 8.586 5.135 1.00 0.24 C ATOM 72 C4' A A 6 4.718 9.679 5.830 1.00 0.24 C ATOM 73 O4' A A 6 4.162 10.626 4.861 1.00 0.28 O ATOM 74 C3' A A 6 3.508 9.141 6.596 1.00 0.22 C ATOM 75 O3' A A 6 3.886 8.781 7.925 1.00 0.23 O ATOM 76 C2' A A 6 2.507 10.302 6.567 1.00 0.32 C ATOM 77 O2' A A 6 2.729 11.218 7.645 1.00 0.50 O ATOM 78 C1' A A 6 2.816 10.981 5.213 1.00 0.24 C ATOM 79 N9 A A 6 1.913 10.774 4.035 1.00 0.22 N ATOM 80 C8 A A 6 2.182 10.177 2.829 1.00 0.24 C ATOM 81 N7 A A 6 1.194 10.208 1.968 1.00 0.25 N ATOM 82 C5 A A 6 0.194 10.884 2.626 1.00 0.23 C ATOM 83 C6 A A 6 -1.108 11.217 2.199 1.00 0.24 C ATOM 84 N6 A A 6 -1.540 10.859 0.958 1.00 0.27 N ATOM 85 N1 A A 6 -1.868 11.897 3.104 1.00 0.25 N ATOM 86 C2 A A 6 -1.367 12.209 4.303 1.00 0.24 C ATOM 87 N3 A A 6 -0.160 11.943 4.801 1.00 0.23 N ATOM 88 C4 A A 6 0.591 11.258 3.901 1.00 0.22 C ATOM 0 H5' A A 6 6.481 9.034 4.745 1.00 0.24 H new ATOM 0 H5'' A A 6 5.867 7.841 5.872 1.00 0.24 H new ATOM 0 H4' A A 6 5.422 10.144 6.520 1.00 0.24 H new ATOM 0 H3' A A 6 3.083 8.236 6.162 1.00 0.22 H new ATOM 0 H2' A A 6 1.474 9.972 6.674 1.00 0.32 H new ATOM 0 HO2' A A 6 3.323 10.806 8.307 1.00 0.50 H new ATOM 0 H1' A A 6 2.643 12.039 5.412 1.00 0.24 H new ATOM 0 H8 A A 6 3.134 9.717 2.607 1.00 0.24 H new ATOM 0 H61 A A 6 -2.483 11.103 0.656 1.00 0.27 H new ATOM 0 H62 A A 6 -0.920 10.347 0.330 1.00 0.27 H new ATOM 0 H2 A A 6 -2.032 12.751 4.959 1.00 0.24 H new ATOM 100 P C A 7 3.793 7.334 8.536 1.00 0.23 P ATOM 101 OP1 C A 7 4.533 7.334 9.815 1.00 0.34 O ATOM 102 OP2 C A 7 4.227 6.333 7.530 1.00 0.29 O ATOM 103 O5' C A 7 2.249 7.196 8.864 1.00 0.25 O ATOM 104 C5' C A 7 1.276 6.625 7.999 1.00 0.21 C ATOM 105 C4' C A 7 -0.102 7.268 8.215 1.00 0.19 C ATOM 106 O4' C A 7 -0.243 8.496 7.420 1.00 0.21 O ATOM 107 C3' C A 7 -1.279 6.414 7.735 1.00 0.17 C ATOM 108 O3' C A 7 -1.599 5.349 8.632 1.00 0.22 O ATOM 109 C2' C A 7 -2.379 7.483 7.591 1.00 0.19 C ATOM 110 O2' C A 7 -2.886 7.950 8.848 1.00 0.23 O ATOM 111 C1' C A 7 -1.571 8.588 6.855 1.00 0.21 C ATOM 112 N1 C A 7 -1.573 8.411 5.340 1.00 0.21 N ATOM 113 C2 C A 7 -2.821 8.575 4.617 1.00 0.22 C ATOM 114 O2 C A 7 -3.889 8.881 5.182 1.00 0.26 O ATOM 115 N3 C A 7 -2.820 8.379 3.253 1.00 0.24 N ATOM 116 C4 C A 7 -1.694 8.040 2.586 1.00 0.23 C ATOM 117 N4 C A 7 -1.732 7.859 1.241 1.00 0.27 N ATOM 118 C5 C A 7 -0.448 7.870 3.295 1.00 0.24 C ATOM 119 C6 C A 7 -0.434 8.055 4.621 1.00 0.23 C ATOM 0 H5' C A 7 1.212 5.552 8.177 1.00 0.21 H new ATOM 0 H5'' C A 7 1.584 6.758 6.962 1.00 0.21 H new ATOM 0 H4' C A 7 -0.137 7.421 9.294 1.00 0.19 H new ATOM 0 H3' C A 7 -1.095 5.863 6.813 1.00 0.17 H new ATOM 0 H2' C A 7 -3.278 7.133 7.084 1.00 0.19 H new ATOM 0 HO2' C A 7 -3.578 8.626 8.691 1.00 0.23 H new ATOM 0 H1' C A 7 -2.011 9.575 6.998 1.00 0.21 H new ATOM 0 H41 C A 7 -0.883 7.603 0.737 1.00 0.27 H new ATOM 0 H42 C A 7 -2.609 7.979 0.735 1.00 0.27 H new ATOM 0 H5 C A 7 0.454 7.599 2.767 1.00 0.24 H new ATOM 0 H6 C A 7 0.496 7.923 5.154 1.00 0.23 H new ATOM 131 P U A 8 -2.103 3.920 8.123 1.00 0.26 P ATOM 132 OP1 U A 8 -2.047 2.974 9.262 1.00 0.38 O ATOM 133 OP2 U A 8 -1.345 3.515 6.910 1.00 0.40 O ATOM 134 O5' U A 8 -3.606 4.174 7.706 1.00 0.21 O ATOM 135 C5' U A 8 -4.568 4.625 8.665 1.00 0.22 C ATOM 136 C4' U A 8 -5.906 5.015 8.003 1.00 0.21 C ATOM 137 O4' U A 8 -5.712 6.047 6.977 1.00 0.22 O ATOM 138 C3' U A 8 -6.570 3.855 7.270 1.00 0.21 C ATOM 139 O3' U A 8 -7.317 3.039 8.177 1.00 0.24 O ATOM 140 C2' U A 8 -7.406 4.553 6.195 1.00 0.25 C ATOM 141 O2' U A 8 -8.705 4.931 6.645 1.00 0.33 O ATOM 142 C1' U A 8 -6.558 5.798 5.842 1.00 0.22 C ATOM 143 N1 U A 8 -5.749 5.658 4.570 1.00 0.20 N ATOM 144 C2 U A 8 -6.446 5.822 3.325 1.00 0.23 C ATOM 145 O2 U A 8 -7.648 6.073 3.203 1.00 0.30 O ATOM 146 N3 U A 8 -5.639 5.669 2.185 1.00 0.22 N ATOM 147 C4 U A 8 -4.263 5.371 2.141 1.00 0.21 C ATOM 148 O4 U A 8 -3.671 5.256 1.063 1.00 0.22 O ATOM 149 C5 U A 8 -3.641 5.214 3.441 1.00 0.23 C ATOM 150 C6 U A 8 -4.379 5.354 4.561 1.00 0.22 C ATOM 0 H5' U A 8 -4.167 5.483 9.205 1.00 0.22 H new ATOM 0 H5'' U A 8 -4.743 3.839 9.400 1.00 0.22 H new ATOM 0 H4' U A 8 -6.527 5.358 8.830 1.00 0.21 H new ATOM 0 H3' U A 8 -5.876 3.146 6.818 1.00 0.21 H new ATOM 0 H2' U A 8 -7.602 3.895 5.348 1.00 0.25 H new ATOM 0 HO2' U A 8 -8.909 4.465 7.483 1.00 0.33 H new ATOM 0 H1' U A 8 -7.224 6.636 5.636 1.00 0.22 H new ATOM 0 H3 U A 8 -6.104 5.787 1.285 1.00 0.22 H new ATOM 0 H5 U A 8 -2.588 4.985 3.512 1.00 0.23 H new ATOM 0 H6 U A 8 -3.884 5.224 5.512 1.00 0.22 H new ATOM 161 P G A 9 -7.330 1.456 8.133 1.00 0.21 P ATOM 162 OP1 G A 9 -7.860 0.970 9.425 1.00 0.27 O ATOM 163 OP2 G A 9 -6.011 0.927 7.700 1.00 0.31 O ATOM 164 O5' G A 9 -8.416 1.192 7.006 1.00 0.23 O ATOM 165 C5' G A 9 -8.100 0.990 5.631 1.00 0.24 C ATOM 166 C4' G A 9 -9.314 1.331 4.742 1.00 0.22 C ATOM 167 O4' G A 9 -9.203 2.673 4.141 1.00 0.24 O ATOM 168 C3' G A 9 -9.454 0.450 3.508 1.00 0.22 C ATOM 169 O3' G A 9 -9.888 -0.872 3.802 1.00 0.23 O ATOM 170 C2' G A 9 -10.427 1.282 2.655 1.00 0.22 C ATOM 171 O2' G A 9 -11.775 1.298 3.135 1.00 0.26 O ATOM 172 C1' G A 9 -9.748 2.662 2.798 1.00 0.23 C ATOM 173 N9 G A 9 -8.651 2.821 1.781 1.00 0.22 N ATOM 174 C8 G A 9 -7.298 2.851 1.965 1.00 0.24 C ATOM 175 N7 G A 9 -6.596 2.950 0.865 1.00 0.25 N ATOM 176 C5 G A 9 -7.531 2.973 -0.135 1.00 0.22 C ATOM 177 C6 G A 9 -7.333 3.069 -1.517 1.00 0.24 C ATOM 178 O6 G A 9 -6.240 3.161 -2.084 1.00 0.25 O ATOM 179 N1 G A 9 -8.560 3.068 -2.216 1.00 0.24 N ATOM 180 C2 G A 9 -9.831 2.975 -1.658 1.00 0.23 C ATOM 181 N2 G A 9 -10.823 2.986 -2.581 1.00 0.26 N ATOM 182 N3 G A 9 -9.986 2.879 -0.321 1.00 0.22 N ATOM 183 C4 G A 9 -8.821 2.887 0.385 1.00 0.22 C ATOM 0 H5' G A 9 -7.802 -0.046 5.469 1.00 0.24 H new ATOM 0 H5'' G A 9 -7.251 1.613 5.352 1.00 0.24 H new ATOM 0 H4' G A 9 -10.146 1.212 5.436 1.00 0.22 H new ATOM 0 H3' G A 9 -8.516 0.239 2.995 1.00 0.22 H new ATOM 0 H2' G A 9 -10.561 0.906 1.641 1.00 0.22 H new ATOM 0 HO2' G A 9 -12.327 1.848 2.541 1.00 0.26 H new ATOM 0 H1' G A 9 -10.447 3.482 2.632 1.00 0.23 H new ATOM 0 H8 G A 9 -6.843 2.797 2.943 1.00 0.24 H new ATOM 0 H1 G A 9 -8.509 3.143 -3.232 1.00 0.24 H new ATOM 0 H21 G A 9 -11.797 2.923 -2.284 1.00 0.26 H new ATOM 0 H22 G A 9 -10.596 3.058 -3.573 1.00 0.26 H new ATOM 195 P G A 10 -9.247 -2.148 3.088 1.00 0.18 P ATOM 196 OP1 G A 10 -9.402 -3.302 3.995 1.00 0.22 O ATOM 197 OP2 G A 10 -7.855 -1.856 2.655 1.00 0.20 O ATOM 198 O5' G A 10 -10.134 -2.339 1.776 1.00 0.18 O ATOM 199 C5' G A 10 -11.565 -2.404 1.849 1.00 0.22 C ATOM 200 C4' G A 10 -12.274 -1.813 0.600 1.00 0.19 C ATOM 201 O4' G A 10 -11.644 -0.569 0.151 1.00 0.20 O ATOM 202 C3' G A 10 -12.272 -2.740 -0.613 1.00 0.20 C ATOM 203 O3' G A 10 -13.510 -3.452 -0.671 1.00 0.24 O ATOM 204 C2' G A 10 -12.062 -1.837 -1.832 1.00 0.21 C ATOM 205 O2' G A 10 -13.286 -1.410 -2.438 1.00 0.28 O ATOM 206 C1' G A 10 -11.310 -0.629 -1.238 1.00 0.19 C ATOM 207 N9 G A 10 -9.838 -0.579 -1.426 1.00 0.18 N ATOM 208 C8 G A 10 -8.855 -0.416 -0.494 1.00 0.20 C ATOM 209 N7 G A 10 -7.648 -0.382 -0.985 1.00 0.20 N ATOM 210 C5 G A 10 -7.818 -0.518 -2.334 1.00 0.18 C ATOM 211 C6 G A 10 -6.845 -0.557 -3.330 1.00 0.18 C ATOM 212 O6 G A 10 -5.634 -0.452 -3.132 1.00 0.20 O ATOM 213 N1 G A 10 -7.412 -0.722 -4.613 1.00 0.19 N ATOM 214 C2 G A 10 -8.771 -0.823 -4.902 1.00 0.20 C ATOM 215 N2 G A 10 -9.027 -0.967 -6.223 1.00 0.24 N ATOM 216 N3 G A 10 -9.687 -0.782 -3.911 1.00 0.18 N ATOM 217 C4 G A 10 -9.161 -0.636 -2.661 1.00 0.17 C ATOM 0 H5' G A 10 -11.901 -1.867 2.736 1.00 0.22 H new ATOM 0 H5'' G A 10 -11.868 -3.444 1.972 1.00 0.22 H new ATOM 0 H4' G A 10 -13.297 -1.653 0.942 1.00 0.19 H new ATOM 0 H3' G A 10 -11.485 -3.493 -0.568 1.00 0.20 H new ATOM 0 H2' G A 10 -11.530 -2.355 -2.630 1.00 0.21 H new ATOM 0 HO2' G A 10 -14.039 -1.875 -2.017 1.00 0.28 H new ATOM 0 H1' G A 10 -11.642 0.242 -1.803 1.00 0.19 H new ATOM 0 H8 G A 10 -9.060 -0.323 0.562 1.00 0.20 H new ATOM 0 H1 G A 10 -6.766 -0.772 -5.401 1.00 0.19 H new ATOM 0 H21 G A 10 -9.990 -1.051 -6.550 1.00 0.24 H new ATOM 0 H22 G A 10 -8.257 -0.992 -6.892 1.00 0.24 H new ATOM 229 P G A 11 -13.607 -5.023 -0.627 1.00 0.28 P ATOM 230 OP1 G A 11 -15.039 -5.378 -0.524 1.00 0.38 O ATOM 231 OP2 G A 11 -12.700 -5.548 0.424 1.00 0.37 O ATOM 232 O5' G A 11 -13.081 -5.394 -2.078 1.00 0.35 O ATOM 233 C5' G A 11 -11.849 -6.056 -2.354 1.00 0.35 C ATOM 234 C4' G A 11 -11.064 -5.356 -3.491 1.00 0.26 C ATOM 235 O4' G A 11 -10.011 -4.495 -2.951 1.00 0.26 O ATOM 236 C3' G A 11 -10.279 -6.331 -4.372 1.00 0.24 C ATOM 237 O3' G A 11 -11.110 -6.870 -5.406 1.00 0.27 O ATOM 238 C2' G A 11 -9.091 -5.499 -4.899 1.00 0.22 C ATOM 239 O2' G A 11 -9.220 -5.105 -6.265 1.00 0.30 O ATOM 240 C1' G A 11 -9.038 -4.254 -3.979 1.00 0.20 C ATOM 241 N9 G A 11 -7.707 -3.930 -3.363 1.00 0.17 N ATOM 242 C8 G A 11 -7.434 -3.530 -2.079 1.00 0.18 C ATOM 243 N7 G A 11 -6.153 -3.315 -1.839 1.00 0.18 N ATOM 244 C5 G A 11 -5.522 -3.564 -3.038 1.00 0.15 C ATOM 245 C6 G A 11 -4.148 -3.484 -3.360 1.00 0.15 C ATOM 246 O6 G A 11 -3.240 -3.153 -2.587 1.00 0.18 O ATOM 247 N1 G A 11 -3.908 -3.838 -4.718 1.00 0.16 N ATOM 248 C2 G A 11 -4.875 -4.214 -5.653 1.00 0.16 C ATOM 249 N2 G A 11 -4.374 -4.502 -6.875 1.00 0.21 N ATOM 250 N3 G A 11 -6.174 -4.269 -5.306 1.00 0.16 N ATOM 251 C4 G A 11 -6.446 -3.946 -4.011 1.00 0.15 C ATOM 0 H5' G A 11 -12.047 -7.091 -2.632 1.00 0.35 H new ATOM 0 H5'' G A 11 -11.238 -6.080 -1.451 1.00 0.35 H new ATOM 0 H4' G A 11 -11.834 -4.825 -4.051 1.00 0.26 H new ATOM 0 H3' G A 11 -9.923 -7.210 -3.835 1.00 0.24 H new ATOM 0 H2' G A 11 -8.179 -6.096 -4.875 1.00 0.22 H new ATOM 0 HO2' G A 11 -10.011 -5.532 -6.655 1.00 0.30 H new ATOM 0 H1' G A 11 -9.240 -3.378 -4.596 1.00 0.20 H new ATOM 0 H8 G A 11 -8.201 -3.402 -1.329 1.00 0.18 H new ATOM 0 H1 G A 11 -2.940 -3.815 -5.038 1.00 0.16 H new ATOM 0 H21 G A 11 -5.000 -4.787 -7.628 1.00 0.21 H new ATOM 0 H22 G A 11 -3.370 -4.434 -7.044 1.00 0.21 H new ATOM 263 P C A 12 -11.432 -8.411 -5.589 1.00 0.32 P ATOM 264 OP1 C A 12 -12.683 -8.524 -6.372 1.00 0.39 O ATOM 265 OP2 C A 12 -11.404 -9.099 -4.274 1.00 0.35 O ATOM 266 O5' C A 12 -10.232 -8.897 -6.511 1.00 0.32 O ATOM 267 C5' C A 12 -9.171 -9.749 -6.090 1.00 0.34 C ATOM 268 C4' C A 12 -7.822 -9.266 -6.655 1.00 0.25 C ATOM 269 O4' C A 12 -7.394 -8.067 -5.945 1.00 0.24 O ATOM 270 C3' C A 12 -6.658 -10.230 -6.423 1.00 0.23 C ATOM 271 O3' C A 12 -6.614 -11.291 -7.388 1.00 0.30 O ATOM 272 C2' C A 12 -5.424 -9.310 -6.498 1.00 0.20 C ATOM 273 O2' C A 12 -4.981 -9.104 -7.847 1.00 0.30 O ATOM 274 C1' C A 12 -5.962 -7.982 -5.898 1.00 0.18 C ATOM 275 N1 C A 12 -5.453 -7.518 -4.546 1.00 0.15 N ATOM 276 C2 C A 12 -4.061 -7.132 -4.412 1.00 0.16 C ATOM 277 O2 C A 12 -3.246 -7.194 -5.354 1.00 0.21 O ATOM 278 N3 C A 12 -3.629 -6.671 -3.191 1.00 0.16 N ATOM 279 C4 C A 12 -4.466 -6.559 -2.133 1.00 0.14 C ATOM 280 N4 C A 12 -4.019 -6.104 -0.934 1.00 0.16 N ATOM 281 C5 C A 12 -5.843 -6.922 -2.260 1.00 0.15 C ATOM 282 C6 C A 12 -6.286 -7.380 -3.437 1.00 0.15 C ATOM 0 H5' C A 12 -9.365 -10.769 -6.422 1.00 0.34 H new ATOM 0 H5'' C A 12 -9.127 -9.771 -5.001 1.00 0.34 H new ATOM 0 H4' C A 12 -8.012 -9.137 -7.721 1.00 0.25 H new ATOM 0 H3' C A 12 -6.734 -10.761 -5.474 1.00 0.23 H new ATOM 0 H2' C A 12 -4.560 -9.724 -5.977 1.00 0.20 H new ATOM 0 HO2' C A 12 -5.279 -9.851 -8.407 1.00 0.30 H new ATOM 0 H1' C A 12 -5.548 -7.185 -6.516 1.00 0.18 H new ATOM 0 H41 C A 12 -4.662 -6.025 -0.146 1.00 0.16 H new ATOM 0 H42 C A 12 -3.040 -5.841 -0.821 1.00 0.16 H new ATOM 0 H5 C A 12 -6.515 -6.828 -1.420 1.00 0.15 H new ATOM 0 H6 C A 12 -7.327 -7.653 -3.531 1.00 0.15 H new ATOM 294 P G A 13 -6.653 -12.837 -7.023 1.00 0.45 P ATOM 295 OP1 G A 13 -6.435 -13.595 -8.275 1.00 0.65 O ATOM 296 OP2 G A 13 -7.891 -13.140 -6.263 1.00 0.54 O ATOM 297 O5' G A 13 -5.358 -13.004 -6.107 1.00 0.41 O ATOM 298 C5' G A 13 -5.394 -12.980 -4.680 1.00 0.30 C ATOM 299 C4' G A 13 -4.027 -12.554 -4.092 1.00 0.21 C ATOM 300 O4' G A 13 -3.941 -11.096 -3.864 1.00 0.20 O ATOM 301 C3' G A 13 -3.765 -13.112 -2.695 1.00 0.17 C ATOM 302 O3' G A 13 -3.489 -14.526 -2.684 1.00 0.22 O ATOM 303 C2' G A 13 -2.602 -12.221 -2.217 1.00 0.19 C ATOM 304 O2' G A 13 -1.338 -12.569 -2.787 1.00 0.28 O ATOM 305 C1' G A 13 -3.101 -10.826 -2.706 1.00 0.17 C ATOM 306 N9 G A 13 -3.892 -10.151 -1.627 1.00 0.16 N ATOM 307 C8 G A 13 -5.241 -9.972 -1.563 1.00 0.16 C ATOM 308 N7 G A 13 -5.664 -9.397 -0.462 1.00 0.16 N ATOM 309 C5 G A 13 -4.531 -9.181 0.281 1.00 0.14 C ATOM 310 C6 G A 13 -4.411 -8.593 1.558 1.00 0.16 C ATOM 311 O6 G A 13 -5.345 -8.146 2.238 1.00 0.20 O ATOM 312 N1 G A 13 -3.061 -8.549 1.979 1.00 0.16 N ATOM 313 C2 G A 13 -1.963 -9.029 1.263 1.00 0.16 C ATOM 314 N2 G A 13 -0.805 -8.852 1.925 1.00 0.18 N ATOM 315 N3 G A 13 -2.104 -9.587 0.039 1.00 0.15 N ATOM 316 C4 G A 13 -3.397 -9.639 -0.399 1.00 0.14 C ATOM 0 H5' G A 13 -5.663 -13.967 -4.304 1.00 0.30 H new ATOM 0 H5'' G A 13 -6.168 -12.290 -4.345 1.00 0.30 H new ATOM 0 H4' G A 13 -3.322 -12.927 -4.835 1.00 0.21 H new ATOM 0 H3' G A 13 -4.628 -13.070 -2.030 1.00 0.17 H new ATOM 0 H2' G A 13 -2.403 -12.297 -1.148 1.00 0.19 H new ATOM 0 HO2' G A 13 -0.647 -11.965 -2.443 1.00 0.28 H new ATOM 0 H1' G A 13 -2.273 -10.163 -2.957 1.00 0.17 H new ATOM 0 H8 G A 13 -5.909 -10.279 -2.355 1.00 0.16 H new ATOM 0 H1 G A 13 -2.873 -8.128 2.889 1.00 0.16 H new ATOM 0 H21 G A 13 0.073 -9.161 1.508 1.00 0.18 H new ATOM 0 H22 G A 13 -0.805 -8.409 2.844 1.00 0.18 H new ATOM 328 P A A 14 -4.353 -15.500 -1.757 1.00 0.23 P ATOM 329 OP1 A A 14 -4.015 -16.904 -2.088 1.00 0.35 O ATOM 330 OP2 A A 14 -5.786 -15.117 -1.806 1.00 0.30 O ATOM 331 O5' A A 14 -3.739 -15.150 -0.336 1.00 0.28 O ATOM 332 C5' A A 14 -4.270 -15.716 0.861 1.00 0.30 C ATOM 333 C4' A A 14 -3.206 -15.855 1.974 1.00 0.30 C ATOM 334 O4' A A 14 -2.096 -16.702 1.532 1.00 0.36 O ATOM 335 C3' A A 14 -2.534 -14.547 2.399 1.00 0.26 C ATOM 336 O3' A A 14 -3.343 -13.826 3.338 1.00 0.27 O ATOM 337 C2' A A 14 -1.191 -15.015 2.976 1.00 0.30 C ATOM 338 O2' A A 14 -1.292 -15.421 4.343 1.00 0.37 O ATOM 339 C1' A A 14 -0.853 -16.225 2.072 1.00 0.33 C ATOM 340 N9 A A 14 0.117 -15.965 0.952 1.00 0.33 N ATOM 341 C8 A A 14 -0.106 -15.911 -0.402 1.00 0.36 C ATOM 342 N7 A A 14 0.965 -15.681 -1.129 1.00 0.37 N ATOM 343 C5 A A 14 1.979 -15.569 -0.204 1.00 0.36 C ATOM 344 C6 A A 14 3.363 -15.325 -0.382 1.00 0.39 C ATOM 345 N6 A A 14 3.890 -15.153 -1.625 1.00 0.44 N ATOM 346 N1 A A 14 4.113 -15.277 0.760 1.00 0.40 N ATOM 347 C2 A A 14 3.525 -15.457 1.944 1.00 0.37 C ATOM 348 N3 A A 14 2.245 -15.697 2.225 1.00 0.34 N ATOM 349 C4 A A 14 1.503 -15.740 1.088 1.00 0.33 C ATOM 0 H5' A A 14 -4.690 -16.697 0.640 1.00 0.30 H new ATOM 0 H5'' A A 14 -5.089 -15.093 1.221 1.00 0.30 H new ATOM 0 H4' A A 14 -3.776 -16.265 2.808 1.00 0.30 H new ATOM 0 H3' A A 14 -2.395 -13.837 1.584 1.00 0.26 H new ATOM 0 H2' A A 14 -0.438 -14.227 2.980 1.00 0.30 H new ATOM 0 HO2' A A 14 -2.040 -14.952 4.769 1.00 0.37 H new ATOM 0 H1' A A 14 -0.340 -16.954 2.700 1.00 0.33 H new ATOM 0 H8 A A 14 -1.086 -16.047 -0.836 1.00 0.36 H new ATOM 0 H61 A A 14 4.889 -14.978 -1.736 1.00 0.44 H new ATOM 0 H62 A A 14 3.286 -15.199 -2.446 1.00 0.44 H new ATOM 0 H2 A A 14 4.182 -15.400 2.799 1.00 0.37 H new ATOM 361 P G A 15 -3.526 -12.249 3.270 1.00 0.25 P ATOM 362 OP1 G A 15 -4.619 -11.873 4.193 1.00 0.33 O ATOM 363 OP2 G A 15 -3.667 -11.829 1.861 1.00 0.27 O ATOM 364 O5' G A 15 -2.137 -11.715 3.817 1.00 0.23 O ATOM 365 C5' G A 15 -1.744 -11.884 5.184 1.00 0.24 C ATOM 366 C4' G A 15 -0.246 -11.556 5.411 1.00 0.22 C ATOM 367 O4' G A 15 0.614 -12.440 4.618 1.00 0.24 O ATOM 368 C3' G A 15 0.134 -10.148 4.959 1.00 0.20 C ATOM 369 O3' G A 15 -0.185 -9.162 5.949 1.00 0.22 O ATOM 370 C2' G A 15 1.616 -10.245 4.584 1.00 0.23 C ATOM 371 O2' G A 15 2.486 -10.041 5.699 1.00 0.29 O ATOM 372 C1' G A 15 1.709 -11.703 4.042 1.00 0.24 C ATOM 373 N9 G A 15 1.659 -11.863 2.549 1.00 0.21 N ATOM 374 C8 G A 15 0.577 -12.002 1.715 1.00 0.24 C ATOM 375 N7 G A 15 0.877 -12.125 0.446 1.00 0.24 N ATOM 376 C5 G A 15 2.245 -12.070 0.406 1.00 0.21 C ATOM 377 C6 G A 15 3.098 -12.152 -0.707 1.00 0.22 C ATOM 378 O6 G A 15 2.743 -12.292 -1.882 1.00 0.25 O ATOM 379 N1 G A 15 4.459 -12.052 -0.328 1.00 0.23 N ATOM 380 C2 G A 15 4.937 -11.895 0.975 1.00 0.24 C ATOM 381 N2 G A 15 6.289 -11.835 1.035 1.00 0.29 N ATOM 382 N3 G A 15 4.087 -11.820 2.022 1.00 0.22 N ATOM 383 C4 G A 15 2.773 -11.908 1.689 1.00 0.21 C ATOM 0 H5' G A 15 -1.939 -12.911 5.491 1.00 0.24 H new ATOM 0 H5'' G A 15 -2.354 -11.240 5.817 1.00 0.24 H new ATOM 0 H4' G A 15 -0.103 -11.674 6.485 1.00 0.22 H new ATOM 0 H3' G A 15 -0.441 -9.803 4.099 1.00 0.20 H new ATOM 0 H2' G A 15 1.930 -9.480 3.874 1.00 0.23 H new ATOM 0 HO2' G A 15 1.978 -9.658 6.445 1.00 0.29 H new ATOM 0 H1' G A 15 2.695 -12.070 4.326 1.00 0.24 H new ATOM 0 H8 G A 15 -0.441 -12.009 2.077 1.00 0.24 H new ATOM 0 H1 G A 15 5.153 -12.099 -1.074 1.00 0.23 H new ATOM 0 H21 G A 15 6.755 -11.721 1.935 1.00 0.29 H new ATOM 0 H22 G A 15 6.841 -11.904 0.180 1.00 0.29 H new ATOM 395 P A A 16 -1.058 -7.881 5.607 1.00 0.18 P ATOM 396 OP1 A A 16 -1.512 -7.258 6.870 1.00 0.27 O ATOM 397 OP2 A A 16 -2.098 -8.194 4.596 1.00 0.18 O ATOM 398 O5' A A 16 0.039 -6.957 4.918 1.00 0.18 O ATOM 399 C5' A A 16 -0.302 -5.593 4.670 1.00 0.20 C ATOM 400 C4' A A 16 0.834 -4.619 5.037 1.00 0.14 C ATOM 401 O4' A A 16 0.321 -3.256 4.897 1.00 0.15 O ATOM 402 C3' A A 16 1.330 -4.708 6.492 1.00 0.15 C ATOM 403 O3' A A 16 2.711 -4.334 6.577 1.00 0.19 O ATOM 404 C2' A A 16 0.419 -3.721 7.229 1.00 0.16 C ATOM 405 O2' A A 16 0.971 -3.234 8.451 1.00 0.21 O ATOM 406 C1' A A 16 0.237 -2.609 6.168 1.00 0.14 C ATOM 407 N9 A A 16 -1.048 -1.847 6.173 1.00 0.15 N ATOM 408 C8 A A 16 -2.187 -2.041 6.913 1.00 0.18 C ATOM 409 N7 A A 16 -3.149 -1.186 6.664 1.00 0.20 N ATOM 410 C5 A A 16 -2.627 -0.360 5.698 1.00 0.18 C ATOM 411 C6 A A 16 -3.195 0.748 5.035 1.00 0.21 C ATOM 412 N6 A A 16 -4.457 1.155 5.317 1.00 0.26 N ATOM 413 N1 A A 16 -2.397 1.359 4.106 1.00 0.20 N ATOM 414 C2 A A 16 -1.177 0.891 3.881 1.00 0.18 C ATOM 415 N3 A A 16 -0.548 -0.132 4.443 1.00 0.17 N ATOM 416 C4 A A 16 -1.340 -0.738 5.361 1.00 0.15 C ATOM 0 H5' A A 16 -1.194 -5.336 5.242 1.00 0.20 H new ATOM 0 H5'' A A 16 -0.553 -5.471 3.616 1.00 0.20 H new ATOM 0 H4' A A 16 1.661 -4.880 4.377 1.00 0.14 H new ATOM 0 H3' A A 16 1.281 -5.712 6.914 1.00 0.15 H new ATOM 0 H2' A A 16 -0.516 -4.171 7.564 1.00 0.16 H new ATOM 0 HO2' A A 16 1.948 -3.296 8.416 1.00 0.21 H new ATOM 0 H1' A A 16 1.004 -1.868 6.393 1.00 0.14 H new ATOM 0 H8 A A 16 -2.283 -2.833 7.641 1.00 0.18 H new ATOM 0 H61 A A 16 -4.855 1.958 4.830 1.00 0.26 H new ATOM 0 H62 A A 16 -5.009 0.658 6.016 1.00 0.26 H new ATOM 0 H2 A A 16 -0.612 1.421 3.129 1.00 0.18 H new ATOM 428 P A A 17 3.899 -5.391 6.651 1.00 0.18 P ATOM 429 OP1 A A 17 3.395 -6.702 7.130 1.00 0.23 O ATOM 430 OP2 A A 17 4.991 -4.779 7.438 1.00 0.27 O ATOM 431 O5' A A 17 4.363 -5.486 5.124 1.00 0.20 O ATOM 432 C5' A A 17 4.025 -6.576 4.263 1.00 0.18 C ATOM 433 C4' A A 17 5.128 -6.860 3.216 1.00 0.18 C ATOM 434 O4' A A 17 4.944 -8.226 2.681 1.00 0.19 O ATOM 435 C3' A A 17 5.101 -5.976 1.951 1.00 0.20 C ATOM 436 O3' A A 17 5.716 -4.684 2.091 1.00 0.21 O ATOM 437 C2' A A 17 5.779 -6.884 0.905 1.00 0.21 C ATOM 438 O2' A A 17 7.207 -6.923 1.012 1.00 0.23 O ATOM 439 C1' A A 17 5.136 -8.244 1.252 1.00 0.19 C ATOM 440 N9 A A 17 3.827 -8.485 0.549 1.00 0.20 N ATOM 441 C8 A A 17 2.555 -8.393 1.045 1.00 0.23 C ATOM 442 N7 A A 17 1.607 -8.639 0.174 1.00 0.25 N ATOM 443 C5 A A 17 2.276 -8.913 -0.991 1.00 0.23 C ATOM 444 C6 A A 17 1.782 -9.246 -2.272 1.00 0.25 C ATOM 445 N6 A A 17 0.447 -9.337 -2.509 1.00 0.29 N ATOM 446 N1 A A 17 2.731 -9.454 -3.233 1.00 0.25 N ATOM 447 C2 A A 17 4.023 -9.347 -2.930 1.00 0.24 C ATOM 448 N3 A A 17 4.591 -9.040 -1.762 1.00 0.23 N ATOM 449 C4 A A 17 3.647 -8.825 -0.810 1.00 0.22 C ATOM 0 H5' A A 17 3.089 -6.355 3.750 1.00 0.18 H new ATOM 0 H5'' A A 17 3.857 -7.471 4.862 1.00 0.18 H new ATOM 0 H4' A A 17 6.054 -6.679 3.762 1.00 0.18 H new ATOM 0 H3' A A 17 4.089 -5.675 1.678 1.00 0.20 H new ATOM 0 H2' A A 17 5.631 -6.549 -0.122 1.00 0.21 H new ATOM 0 HO2' A A 17 7.522 -6.119 1.474 1.00 0.23 H new ATOM 0 H1' A A 17 5.785 -9.055 0.921 1.00 0.19 H new ATOM 0 H8 A A 17 2.348 -8.138 2.074 1.00 0.23 H new ATOM 0 H61 A A 17 0.110 -9.579 -3.441 1.00 0.29 H new ATOM 0 H62 A A 17 -0.218 -9.164 -1.755 1.00 0.29 H new ATOM 0 H2 A A 17 4.708 -9.535 -3.744 1.00 0.24 H new ATOM 461 P G A 18 5.291 -3.473 1.133 1.00 0.18 P ATOM 462 OP1 G A 18 5.746 -2.203 1.742 1.00 0.24 O ATOM 463 OP2 G A 18 3.845 -3.574 0.805 1.00 0.19 O ATOM 464 O5' G A 18 6.145 -3.753 -0.183 1.00 0.20 O ATOM 465 C5' G A 18 5.764 -3.193 -1.448 1.00 0.22 C ATOM 466 C4' G A 18 6.083 -4.145 -2.634 1.00 0.18 C ATOM 467 O4' G A 18 5.584 -5.498 -2.364 1.00 0.18 O ATOM 468 C3' G A 18 5.409 -3.732 -3.958 1.00 0.18 C ATOM 469 O3' G A 18 6.309 -2.997 -4.804 1.00 0.22 O ATOM 470 C2' G A 18 4.915 -5.051 -4.583 1.00 0.19 C ATOM 471 O2' G A 18 5.919 -5.682 -5.388 1.00 0.24 O ATOM 472 C1' G A 18 4.605 -5.897 -3.325 1.00 0.17 C ATOM 473 N9 G A 18 3.238 -5.788 -2.686 1.00 0.16 N ATOM 474 C8 G A 18 2.954 -5.500 -1.375 1.00 0.18 C ATOM 475 N7 G A 18 1.686 -5.490 -1.058 1.00 0.18 N ATOM 476 C5 G A 18 1.051 -5.802 -2.225 1.00 0.16 C ATOM 477 C6 G A 18 -0.323 -5.930 -2.445 1.00 0.16 C ATOM 478 O6 G A 18 -1.194 -5.759 -1.585 1.00 0.19 O ATOM 479 N1 G A 18 -0.604 -6.266 -3.790 1.00 0.18 N ATOM 480 C2 G A 18 0.341 -6.459 -4.805 1.00 0.21 C ATOM 481 N2 G A 18 -0.232 -6.771 -5.996 1.00 0.26 N ATOM 482 N3 G A 18 1.672 -6.326 -4.560 1.00 0.18 N ATOM 483 C4 G A 18 1.967 -6.003 -3.270 1.00 0.16 C ATOM 0 H5' G A 18 6.284 -2.246 -1.595 1.00 0.22 H new ATOM 0 H5'' G A 18 4.697 -2.973 -1.439 1.00 0.22 H new ATOM 0 H4' G A 18 7.168 -4.099 -2.732 1.00 0.18 H new ATOM 0 H3' G A 18 4.576 -3.045 -3.806 1.00 0.18 H new ATOM 0 H2' G A 18 4.071 -4.916 -5.259 1.00 0.19 H new ATOM 0 HO2' G A 18 6.615 -5.030 -5.614 1.00 0.24 H new ATOM 0 H1' G A 18 4.626 -6.937 -3.652 1.00 0.17 H new ATOM 0 H8 G A 18 3.729 -5.295 -0.651 1.00 0.18 H new ATOM 0 H1 G A 18 -1.586 -6.378 -4.044 1.00 0.18 H new ATOM 0 H21 G A 18 0.352 -6.936 -6.816 1.00 0.26 H new ATOM 0 H22 G A 18 -1.247 -6.840 -6.071 1.00 0.26 H new ATOM 495 P U A 19 5.844 -1.724 -5.637 1.00 0.21 P ATOM 496 OP1 U A 19 7.051 -1.014 -6.115 1.00 0.28 O ATOM 497 OP2 U A 19 4.872 -0.945 -4.828 1.00 0.25 O ATOM 498 O5' U A 19 5.115 -2.390 -6.891 1.00 0.23 O ATOM 499 C5' U A 19 4.127 -1.650 -7.617 1.00 0.23 C ATOM 500 C4' U A 19 3.081 -2.566 -8.305 1.00 0.18 C ATOM 501 O4' U A 19 2.639 -3.653 -7.412 1.00 0.20 O ATOM 502 C3' U A 19 1.790 -1.808 -8.674 1.00 0.19 C ATOM 503 O3' U A 19 1.841 -1.284 -10.011 1.00 0.22 O ATOM 504 C2' U A 19 0.671 -2.827 -8.429 1.00 0.19 C ATOM 505 O2' U A 19 0.470 -3.694 -9.550 1.00 0.24 O ATOM 506 C1' U A 19 1.221 -3.608 -7.212 1.00 0.18 C ATOM 507 N1 U A 19 0.884 -3.158 -5.790 1.00 0.18 N ATOM 508 C2 U A 19 -0.445 -3.382 -5.298 1.00 0.19 C ATOM 509 O2 U A 19 -1.371 -3.872 -5.949 1.00 0.25 O ATOM 510 N3 U A 19 -0.664 -2.980 -3.962 1.00 0.20 N ATOM 511 C4 U A 19 0.273 -2.410 -3.079 1.00 0.21 C ATOM 512 O4 U A 19 -0.036 -2.100 -1.922 1.00 0.23 O ATOM 513 C5 U A 19 1.592 -2.232 -3.649 1.00 0.24 C ATOM 514 C6 U A 19 1.835 -2.600 -4.924 1.00 0.22 C ATOM 0 H5' U A 19 4.620 -1.037 -8.372 1.00 0.23 H new ATOM 0 H5'' U A 19 3.616 -0.969 -6.937 1.00 0.23 H new ATOM 0 H4' U A 19 3.588 -2.944 -9.193 1.00 0.18 H new ATOM 0 H3' U A 19 1.628 -0.913 -8.073 1.00 0.19 H new ATOM 0 H2' U A 19 -0.304 -2.367 -8.268 1.00 0.19 H new ATOM 0 HO2' U A 19 0.891 -3.304 -10.345 1.00 0.24 H new ATOM 0 H1' U A 19 0.704 -4.567 -7.217 1.00 0.18 H new ATOM 0 H3 U A 19 -1.606 -3.118 -3.596 1.00 0.20 H new ATOM 0 H5 U A 19 2.383 -1.804 -3.052 1.00 0.24 H new ATOM 0 H6 U A 19 2.835 -2.454 -5.305 1.00 0.22 H new ATOM 525 P U A 20 1.092 0.060 -10.424 1.00 0.24 P ATOM 526 OP1 U A 20 1.755 0.613 -11.626 1.00 0.35 O ATOM 527 OP2 U A 20 0.973 0.949 -9.241 1.00 0.31 O ATOM 528 O5' U A 20 -0.341 -0.483 -10.848 1.00 0.27 O ATOM 529 C5' U A 20 -1.487 0.373 -10.820 1.00 0.29 C ATOM 530 C4' U A 20 -2.802 -0.436 -10.723 1.00 0.20 C ATOM 531 O4' U A 20 -2.691 -1.444 -9.665 1.00 0.20 O ATOM 532 C3' U A 20 -4.022 0.424 -10.337 1.00 0.22 C ATOM 533 O3' U A 20 -4.764 0.873 -11.479 1.00 0.27 O ATOM 534 C2' U A 20 -4.854 -0.468 -9.407 1.00 0.20 C ATOM 535 O2' U A 20 -5.819 -1.281 -10.078 1.00 0.28 O ATOM 536 C1' U A 20 -3.773 -1.354 -8.741 1.00 0.18 C ATOM 537 N1 U A 20 -3.304 -0.960 -7.357 1.00 0.16 N ATOM 538 C2 U A 20 -4.299 -0.961 -6.331 1.00 0.18 C ATOM 539 O2 U A 20 -5.491 -1.223 -6.497 1.00 0.21 O ATOM 540 N3 U A 20 -3.819 -0.637 -5.058 1.00 0.18 N ATOM 541 C4 U A 20 -2.501 -0.314 -4.690 1.00 0.19 C ATOM 542 O4 U A 20 -2.226 -0.043 -3.519 1.00 0.21 O ATOM 543 C5 U A 20 -1.551 -0.343 -5.785 1.00 0.19 C ATOM 544 C6 U A 20 -1.969 -0.656 -7.029 1.00 0.18 C ATOM 0 H5' U A 20 -1.504 0.989 -11.719 1.00 0.29 H new ATOM 0 H5'' U A 20 -1.414 1.052 -9.970 1.00 0.29 H new ATOM 0 H4' U A 20 -2.949 -0.864 -11.715 1.00 0.20 H new ATOM 0 H3' U A 20 -3.721 1.349 -9.844 1.00 0.22 H new ATOM 0 H2' U A 20 -5.456 0.127 -8.720 1.00 0.20 H new ATOM 0 HO2' U A 20 -5.946 -0.951 -10.992 1.00 0.28 H new ATOM 0 H1' U A 20 -4.238 -2.318 -8.536 1.00 0.18 H new ATOM 0 H3 U A 20 -4.508 -0.635 -4.306 1.00 0.18 H new ATOM 0 H5 U A 20 -0.511 -0.115 -5.605 1.00 0.19 H new ATOM 0 H6 U A 20 -1.235 -0.674 -7.821 1.00 0.18 H new ATOM 555 P U A 21 -4.990 2.406 -11.833 1.00 0.27 P ATOM 556 OP1 U A 21 -5.508 2.479 -13.218 1.00 0.36 O ATOM 557 OP2 U A 21 -3.753 3.170 -11.541 1.00 0.36 O ATOM 558 O5' U A 21 -6.108 2.866 -10.798 1.00 0.23 O ATOM 559 C5' U A 21 -7.504 2.721 -11.062 1.00 0.25 C ATOM 560 C4' U A 21 -8.370 2.843 -9.787 1.00 0.21 C ATOM 561 O4' U A 21 -7.979 1.829 -8.811 1.00 0.21 O ATOM 562 C3' U A 21 -8.293 4.166 -9.026 1.00 0.20 C ATOM 563 O3' U A 21 -9.068 5.182 -9.670 1.00 0.28 O ATOM 564 C2' U A 21 -8.782 3.746 -7.627 1.00 0.19 C ATOM 565 O2' U A 21 -10.204 3.680 -7.493 1.00 0.25 O ATOM 566 C1' U A 21 -8.150 2.345 -7.489 1.00 0.19 C ATOM 567 N1 U A 21 -6.850 2.379 -6.745 1.00 0.19 N ATOM 568 C2 U A 21 -6.944 2.265 -5.333 1.00 0.18 C ATOM 569 O2 U A 21 -7.995 2.119 -4.701 1.00 0.21 O ATOM 570 N3 U A 21 -5.713 2.318 -4.671 1.00 0.18 N ATOM 571 C4 U A 21 -4.438 2.499 -5.242 1.00 0.21 C ATOM 572 O4 U A 21 -3.429 2.539 -4.536 1.00 0.24 O ATOM 573 C5 U A 21 -4.438 2.620 -6.682 1.00 0.22 C ATOM 574 C6 U A 21 -5.603 2.566 -7.354 1.00 0.21 C ATOM 0 H5' U A 21 -7.683 1.751 -11.526 1.00 0.25 H new ATOM 0 H5'' U A 21 -7.814 3.480 -11.780 1.00 0.25 H new ATOM 0 H4' U A 21 -9.381 2.736 -10.180 1.00 0.21 H new ATOM 0 H3' U A 21 -7.308 4.630 -8.983 1.00 0.20 H new ATOM 0 H2' U A 21 -8.499 4.467 -6.860 1.00 0.19 H new ATOM 0 HO2' U A 21 -10.591 4.562 -7.676 1.00 0.25 H new ATOM 0 H1' U A 21 -8.804 1.700 -6.903 1.00 0.19 H new ATOM 0 H3 U A 21 -5.742 2.213 -3.657 1.00 0.18 H new ATOM 0 H5 U A 21 -3.509 2.753 -7.216 1.00 0.22 H new ATOM 0 H6 U A 21 -5.574 2.673 -8.428 1.00 0.21 H new ATOM 585 P A A 22 -9.060 6.691 -9.185 1.00 0.33 P ATOM 586 OP1 A A 22 -9.410 7.555 -10.335 1.00 0.52 O ATOM 587 OP2 A A 22 -7.802 6.987 -8.453 1.00 0.46 O ATOM 588 O5' A A 22 -10.283 6.673 -8.165 1.00 0.24 O ATOM 589 C5' A A 22 -10.418 7.737 -7.223 1.00 0.24 C ATOM 590 C4' A A 22 -11.364 7.362 -6.060 1.00 0.20 C ATOM 591 O4' A A 22 -10.922 6.124 -5.397 1.00 0.22 O ATOM 592 C3' A A 22 -11.363 8.433 -4.957 1.00 0.22 C ATOM 593 O3' A A 22 -12.391 9.410 -5.172 1.00 0.28 O ATOM 594 C2' A A 22 -11.500 7.637 -3.651 1.00 0.23 C ATOM 595 O2' A A 22 -12.856 7.361 -3.295 1.00 0.30 O ATOM 596 C1' A A 22 -10.759 6.329 -3.991 1.00 0.21 C ATOM 597 N9 A A 22 -9.308 6.256 -3.640 1.00 0.20 N ATOM 598 C8 A A 22 -8.201 6.176 -4.455 1.00 0.21 C ATOM 599 N7 A A 22 -7.059 6.114 -3.796 1.00 0.23 N ATOM 600 C5 A A 22 -7.427 6.153 -2.465 1.00 0.23 C ATOM 601 C6 A A 22 -6.644 6.113 -1.286 1.00 0.27 C ATOM 602 N6 A A 22 -5.291 6.025 -1.341 1.00 0.31 N ATOM 603 N1 A A 22 -7.335 6.155 -0.111 1.00 0.29 N ATOM 604 C2 A A 22 -8.664 6.239 -0.118 1.00 0.28 C ATOM 605 N3 A A 22 -9.491 6.282 -1.161 1.00 0.25 N ATOM 606 C4 A A 22 -8.801 6.236 -2.330 1.00 0.22 C ATOM 0 H5' A A 22 -10.799 8.624 -7.729 1.00 0.24 H new ATOM 0 H5'' A A 22 -9.437 7.995 -6.824 1.00 0.24 H new ATOM 0 H4' A A 22 -12.351 7.256 -6.509 1.00 0.20 H new ATOM 0 H3' A A 22 -10.454 9.035 -4.938 1.00 0.22 H new ATOM 0 H2' A A 22 -11.105 8.183 -2.794 1.00 0.23 H new ATOM 0 HO2' A A 22 -13.453 7.953 -3.799 1.00 0.30 H new ATOM 0 H1' A A 22 -11.203 5.553 -3.367 1.00 0.21 H new ATOM 0 H8 A A 22 -8.262 6.165 -5.533 1.00 0.21 H new ATOM 0 H61 A A 22 -4.746 5.998 -0.479 1.00 0.31 H new ATOM 0 H62 A A 22 -4.819 5.986 -2.244 1.00 0.31 H new ATOM 0 H2 A A 22 -9.135 6.277 0.853 1.00 0.28 H new ATOM 618 P G A 23 -12.292 10.883 -4.580 1.00 0.34 P ATOM 619 OP1 G A 23 -13.370 11.698 -5.178 1.00 0.50 O ATOM 620 OP2 G A 23 -10.901 11.384 -4.721 1.00 0.44 O ATOM 621 O5' G A 23 -12.645 10.607 -3.051 1.00 0.27 O ATOM 622 C5' G A 23 -12.126 11.438 -2.018 1.00 0.31 C ATOM 623 C4' G A 23 -12.219 10.754 -0.635 1.00 0.24 C ATOM 624 O4' G A 23 -11.368 9.560 -0.580 1.00 0.23 O ATOM 625 C3' G A 23 -11.700 11.659 0.487 1.00 0.25 C ATOM 626 O3' G A 23 -12.752 12.504 0.987 1.00 0.33 O ATOM 627 C2' G A 23 -11.129 10.683 1.525 1.00 0.24 C ATOM 628 O2' G A 23 -12.118 10.232 2.452 1.00 0.33 O ATOM 629 C1' G A 23 -10.630 9.501 0.654 1.00 0.19 C ATOM 630 N9 G A 23 -9.162 9.406 0.343 1.00 0.17 N ATOM 631 C8 G A 23 -8.548 9.330 -0.883 1.00 0.18 C ATOM 632 N7 G A 23 -7.239 9.217 -0.835 1.00 0.18 N ATOM 633 C5 G A 23 -6.940 9.203 0.505 1.00 0.19 C ATOM 634 C6 G A 23 -5.681 9.095 1.127 1.00 0.21 C ATOM 635 O6 G A 23 -4.585 8.992 0.560 1.00 0.24 O ATOM 636 N1 G A 23 -5.799 9.125 2.537 1.00 0.21 N ATOM 637 C2 G A 23 -6.987 9.236 3.266 1.00 0.21 C ATOM 638 N2 G A 23 -6.795 9.236 4.604 1.00 0.24 N ATOM 639 N3 G A 23 -8.178 9.327 2.635 1.00 0.20 N ATOM 640 C4 G A 23 -8.102 9.310 1.275 1.00 0.18 C ATOM 0 H5' G A 23 -12.676 12.379 -1.997 1.00 0.31 H new ATOM 0 H5'' G A 23 -11.086 11.682 -2.235 1.00 0.31 H new ATOM 0 H4' G A 23 -13.274 10.517 -0.500 1.00 0.24 H new ATOM 0 H3' G A 23 -10.932 12.363 0.166 1.00 0.25 H new ATOM 0 H2' G A 23 -10.355 11.144 2.139 1.00 0.24 H new ATOM 0 HO2' G A 23 -12.874 10.855 2.452 1.00 0.33 H new ATOM 0 H1' G A 23 -10.801 8.610 1.259 1.00 0.19 H new ATOM 0 H8 G A 23 -9.097 9.361 -1.813 1.00 0.18 H new ATOM 0 H1 G A 23 -4.934 9.059 3.073 1.00 0.21 H new ATOM 0 H21 G A 23 -7.594 9.312 5.234 1.00 0.24 H new ATOM 0 H22 G A 23 -5.851 9.160 4.984 1.00 0.24 H new ATOM 652 P U A 24 -12.552 14.057 1.257 1.00 0.37 P ATOM 653 OP1 U A 24 -13.883 14.671 1.460 1.00 0.51 O ATOM 654 OP2 U A 24 -11.693 14.632 0.192 1.00 0.44 O ATOM 655 O5' U A 24 -11.794 14.019 2.649 1.00 0.40 O ATOM 656 C5' U A 24 -10.716 14.886 2.983 1.00 0.36 C ATOM 657 C4' U A 24 -9.797 14.214 4.022 1.00 0.30 C ATOM 658 O4' U A 24 -9.168 13.029 3.442 1.00 0.28 O ATOM 659 C3' U A 24 -8.613 15.080 4.458 1.00 0.29 C ATOM 660 O3' U A 24 -8.987 16.016 5.485 1.00 0.39 O ATOM 661 C2' U A 24 -7.579 14.038 4.917 1.00 0.26 C ATOM 662 O2' U A 24 -7.770 13.645 6.278 1.00 0.36 O ATOM 663 C1' U A 24 -7.841 12.843 3.951 1.00 0.24 C ATOM 664 N1 U A 24 -6.843 12.649 2.817 1.00 0.20 N ATOM 665 C2 U A 24 -5.465 12.414 3.159 1.00 0.21 C ATOM 666 O2 U A 24 -5.010 12.365 4.306 1.00 0.25 O ATOM 667 N3 U A 24 -4.609 12.228 2.059 1.00 0.23 N ATOM 668 C4 U A 24 -4.960 12.239 0.695 1.00 0.24 C ATOM 669 O4 U A 24 -4.103 12.060 -0.174 1.00 0.27 O ATOM 670 C5 U A 24 -6.364 12.474 0.435 1.00 0.23 C ATOM 671 C6 U A 24 -7.219 12.658 1.462 1.00 0.22 C ATOM 0 H5' U A 24 -11.103 15.824 3.381 1.00 0.36 H new ATOM 0 H5'' U A 24 -10.146 15.132 2.087 1.00 0.36 H new ATOM 0 H4' U A 24 -10.452 14.008 4.869 1.00 0.30 H new ATOM 0 H3' U A 24 -8.221 15.723 3.670 1.00 0.29 H new ATOM 0 H2' U A 24 -6.559 14.419 4.881 1.00 0.26 H new ATOM 0 HO2' U A 24 -8.353 14.293 6.727 1.00 0.36 H new ATOM 0 H1' U A 24 -7.719 11.924 4.524 1.00 0.24 H new ATOM 0 H3 U A 24 -3.625 12.067 2.273 1.00 0.23 H new ATOM 0 H5 U A 24 -6.727 12.502 -0.582 1.00 0.23 H new ATOM 0 H6 U A 24 -8.260 12.823 1.228 1.00 0.22 H new ATOM 682 P C A 25 -8.417 17.499 5.539 1.00 0.44 P ATOM 683 OP1 C A 25 -9.159 18.241 6.583 1.00 0.61 O ATOM 684 OP2 C A 25 -8.420 18.067 4.168 1.00 0.49 O ATOM 685 O5' C A 25 -6.935 17.244 6.055 1.00 0.37 O ATOM 686 C5' C A 25 -5.823 17.979 5.555 1.00 0.38 C ATOM 687 C4' C A 25 -4.499 17.307 5.969 1.00 0.28 C ATOM 688 O4' C A 25 -4.307 16.040 5.253 1.00 0.33 O ATOM 689 C3' C A 25 -3.260 18.122 5.598 1.00 0.32 C ATOM 690 O3' C A 25 -3.018 19.174 6.545 1.00 0.42 O ATOM 691 C2' C A 25 -2.158 17.054 5.547 1.00 0.29 C ATOM 692 O2' C A 25 -1.647 16.730 6.841 1.00 0.35 O ATOM 693 C1' C A 25 -2.912 15.829 4.955 1.00 0.28 C ATOM 694 N1 C A 25 -2.688 15.538 3.478 1.00 0.26 N ATOM 695 C2 C A 25 -1.350 15.212 3.024 1.00 0.27 C ATOM 696 O2 C A 25 -0.368 15.175 3.790 1.00 0.34 O ATOM 697 N3 C A 25 -1.163 14.933 1.688 1.00 0.28 N ATOM 698 C4 C A 25 -2.183 14.953 0.805 1.00 0.26 C ATOM 699 N4 C A 25 -1.957 14.680 -0.506 1.00 0.28 N ATOM 700 C5 C A 25 -3.516 15.270 1.238 1.00 0.29 C ATOM 701 C6 C A 25 -3.722 15.543 2.536 1.00 0.30 C ATOM 0 H5' C A 25 -5.854 19.000 5.936 1.00 0.38 H new ATOM 0 H5'' C A 25 -5.881 18.042 4.468 1.00 0.38 H new ATOM 0 H4' C A 25 -4.588 17.192 7.049 1.00 0.28 H new ATOM 0 H3' C A 25 -3.342 18.661 4.654 1.00 0.32 H new ATOM 0 H2' C A 25 -1.291 17.381 4.974 1.00 0.29 H new ATOM 0 HO2' C A 25 -1.863 17.452 7.468 1.00 0.35 H new ATOM 0 H1' C A 25 -2.506 14.930 5.419 1.00 0.28 H new ATOM 0 H41 C A 25 -2.730 14.696 -1.171 1.00 0.28 H new ATOM 0 H42 C A 25 -1.014 14.459 -0.826 1.00 0.28 H new ATOM 0 H5 C A 25 -4.335 15.288 0.534 1.00 0.29 H new ATOM 0 H6 C A 25 -4.724 15.775 2.865 1.00 0.30 H new ATOM 713 P C A 26 -2.546 20.636 6.119 1.00 0.52 P ATOM 714 OP1 C A 26 -2.897 21.586 7.199 1.00 0.71 O ATOM 715 OP2 C A 26 -3.040 20.947 4.758 1.00 0.70 O ATOM 716 O5' C A 26 -0.974 20.492 6.036 1.00 0.36 O ATOM 717 C5' C A 26 -0.143 20.264 7.172 1.00 0.31 C ATOM 718 C4' C A 26 1.286 19.831 6.767 1.00 0.33 C ATOM 719 O4' C A 26 1.256 18.560 6.037 1.00 0.36 O ATOM 720 C3' C A 26 2.004 20.794 5.819 1.00 0.42 C ATOM 721 O3' C A 26 2.606 21.896 6.502 1.00 0.50 O ATOM 722 C2' C A 26 3.006 19.905 5.080 1.00 0.57 C ATOM 723 O2' C A 26 4.229 19.740 5.802 1.00 0.78 O ATOM 724 C1' C A 26 2.232 18.559 4.976 1.00 0.41 C ATOM 725 N1 C A 26 1.535 18.306 3.655 1.00 0.33 N ATOM 726 C2 C A 26 2.130 17.397 2.705 1.00 0.34 C ATOM 727 O2 C A 26 3.206 16.807 2.924 1.00 0.44 O ATOM 728 N3 C A 26 1.481 17.188 1.508 1.00 0.32 N ATOM 729 C4 C A 26 0.316 17.808 1.213 1.00 0.33 C ATOM 730 N4 C A 26 -0.321 17.602 0.035 1.00 0.40 N ATOM 731 C5 C A 26 -0.284 18.714 2.148 1.00 0.37 C ATOM 732 C6 C A 26 0.338 18.930 3.313 1.00 0.34 C ATOM 0 H5' C A 26 -0.591 19.494 7.800 1.00 0.31 H new ATOM 0 H5'' C A 26 -0.090 21.173 7.771 1.00 0.31 H new ATOM 0 H4' C A 26 1.814 19.784 7.719 1.00 0.33 H new ATOM 0 H3' C A 26 1.321 21.288 5.128 1.00 0.42 H new ATOM 0 H2' C A 26 3.315 20.321 4.121 1.00 0.57 H new ATOM 0 HO2' C A 26 4.298 20.434 6.491 1.00 0.78 H new ATOM 0 HO3' C A 26 3.052 22.479 5.853 1.00 0.50 H new ATOM 0 H1' C A 26 2.966 17.757 5.055 1.00 0.41 H new ATOM 0 H41 C A 26 -1.199 18.083 -0.161 1.00 0.40 H new ATOM 0 H42 C A 26 0.077 16.966 -0.656 1.00 0.40 H new ATOM 0 H5 C A 26 -1.215 19.210 1.918 1.00 0.37 H new ATOM 0 H6 C A 26 -0.107 19.617 4.017 1.00 0.34 H new TER 745 C A 26 HETATM 746 C4 BDR A 29 2.538 -0.579 1.946 1.00 0.21 C HETATM 747 O BDR A 29 1.427 -0.987 1.135 1.00 0.22 O HETATM 748 C1 BDR A 29 0.955 0.170 0.420 1.00 0.21 C HETATM 749 C2 BDR A 29 1.970 1.275 0.717 1.00 0.24 C HETATM 750 O2 BDR A 29 3.140 1.175 -0.112 1.00 0.31 O HETATM 751 C3 BDR A 29 2.256 0.898 2.154 1.00 0.21 C HETATM 752 O3 BDR A 29 3.297 1.724 2.690 1.00 0.24 O HETATM 753 C5 BDR A 29 2.620 -1.353 3.259 1.00 0.22 C HETATM 754 O5 BDR A 29 2.807 -2.756 3.093 1.00 0.25 O HETATM 0 HO2 BDR A 29 3.941 1.323 0.433 1.00 0.31 H new HETATM 0 H52 BDR A 29 3.443 -0.955 3.853 1.00 0.22 H new HETATM 0 H51 BDR A 29 1.705 -1.183 3.827 1.00 0.22 H new HETATM 0 H5 BDR A 29 2.820 -2.974 2.138 1.00 0.25 H new HETATM 0 H4 BDR A 29 3.506 -0.773 1.485 1.00 0.21 H new HETATM 0 H3 BDR A 29 1.488 1.055 2.911 1.00 0.21 H new HETATM 0 H2 BDR A 29 1.637 2.298 0.541 1.00 0.24 H new HETATM 763 C5 IDG A 30 2.011 2.963 5.856 1.00 0.21 C HETATM 764 O5 IDG A 30 2.538 2.048 4.878 1.00 0.21 O HETATM 765 C1 IDG A 30 2.878 2.659 3.642 1.00 0.21 C HETATM 766 C2 IDG A 30 3.966 3.712 3.847 1.00 0.23 C HETATM 767 N2 IDG A 30 5.238 3.070 4.254 1.00 0.27 N HETATM 768 C3 IDG A 30 3.504 4.742 4.881 1.00 0.22 C HETATM 769 O3 IDG A 30 2.446 5.522 4.343 1.00 0.24 O HETATM 770 C4 IDG A 30 3.038 4.053 6.167 1.00 0.22 C HETATM 771 O4 IDG A 30 4.149 3.499 6.859 1.00 0.27 O HETATM 772 C6 IDG A 30 1.625 2.149 7.080 1.00 0.26 C HETATM 773 N6 IDG A 30 0.348 1.429 6.879 1.00 0.27 N HETATM 0 HN62 IDG A 30 -0.030 0.843 7.623 1.00 0.27 H new HETATM 0 HN61 IDG A 30 -0.155 1.519 5.996 1.00 0.27 H new HETATM 0 HN22 IDG A 30 6.064 3.642 4.430 1.00 0.27 H new HETATM 0 HN21 IDG A 30 5.287 2.057 4.358 1.00 0.27 H new HETATM 0 HO4 IDG A 30 4.624 4.210 7.338 1.00 0.27 H new HETATM 0 HO3 IDG A 30 2.765 6.004 3.552 1.00 0.24 H new HETATM 0 H62 IDG A 30 2.415 1.432 7.304 1.00 0.26 H new HETATM 0 H61 IDG A 30 1.539 2.809 7.943 1.00 0.26 H new HETATM 0 H5 IDG A 30 1.127 3.481 5.485 1.00 0.21 H new HETATM 0 H4 IDG A 30 2.564 4.800 6.804 1.00 0.22 H new HETATM 0 H3 IDG A 30 4.347 5.389 5.123 1.00 0.22 H new HETATM 0 H2 IDG A 30 4.145 4.231 2.905 1.00 0.23 H new HETATM 789 C5 BDG A 27 -3.621 -3.039 2.707 1.00 0.19 C HETATM 790 O5 BDG A 27 -2.524 -2.126 2.906 1.00 0.19 O HETATM 791 C1 BDG A 27 -1.573 -2.111 1.849 1.00 0.18 C HETATM 792 C2 BDG A 27 -0.946 -3.491 1.683 1.00 0.17 C HETATM 793 N2 BDG A 27 0.063 -3.462 0.592 1.00 0.21 N HETATM 794 C3 BDG A 27 -2.049 -4.517 1.418 1.00 0.16 C HETATM 795 O3 BDG A 27 -1.490 -5.822 1.350 1.00 0.17 O HETATM 796 C4 BDG A 27 -3.095 -4.462 2.534 1.00 0.17 C HETATM 797 O4 BDG A 27 -4.174 -5.336 2.226 1.00 0.20 O HETATM 798 C6 BDG A 27 -4.533 -2.907 3.916 1.00 0.22 C HETATM 799 N6 BDG A 27 -5.882 -3.487 3.713 1.00 0.24 N HETATM 0 HN62 BDG A 27 -6.571 -3.451 4.464 1.00 0.24 H new HETATM 0 HN61 BDG A 27 -6.121 -3.923 2.822 1.00 0.24 H new HETATM 0 HN22 BDG A 27 0.578 -4.309 0.351 1.00 0.21 H new HETATM 0 HN21 BDG A 27 0.241 -2.595 0.084 1.00 0.21 H new HETATM 0 HO4 BDG A 27 -3.831 -6.244 2.090 1.00 0.20 H new HETATM 0 HO3 BDG A 27 -1.265 -6.033 0.420 1.00 0.17 H new HETATM 0 H62 BDG A 27 -4.062 -3.395 4.770 1.00 0.22 H new HETATM 0 H61 BDG A 27 -4.636 -1.852 4.169 1.00 0.22 H new HETATM 0 H5 BDG A 27 -4.180 -2.805 1.801 1.00 0.19 H new HETATM 0 H4 BDG A 27 -2.625 -4.777 3.466 1.00 0.17 H new HETATM 0 H3 BDG A 27 -2.528 -4.282 0.468 1.00 0.16 H new HETATM 0 H2 BDG A 27 -0.427 -3.781 2.597 1.00 0.17 H new HETATM 815 C1 NEB A 28 -3.120 2.071 -1.022 1.00 0.23 C HETATM 816 N1 NEB A 28 -3.575 3.474 -1.111 1.00 0.28 N HETATM 817 C2 NEB A 28 -4.240 1.236 -0.417 1.00 0.23 C HETATM 818 C3 NEB A 28 -3.811 -0.219 -0.308 1.00 0.21 C HETATM 819 N3 NEB A 28 -4.934 -0.938 0.276 1.00 0.26 N HETATM 820 C4 NEB A 28 -2.568 -0.330 0.575 1.00 0.18 C HETATM 821 O4 NEB A 28 -2.142 -1.706 0.636 1.00 0.18 O HETATM 822 C5 NEB A 28 -1.421 0.528 0.028 1.00 0.19 C HETATM 823 O5 NEB A 28 -0.324 0.495 0.964 1.00 0.20 O HETATM 824 C6 NEB A 28 -1.854 1.980 -0.170 1.00 0.21 C HETATM 825 O6 NEB A 28 -0.809 2.712 -0.797 1.00 0.25 O HETATM 0 HO6 NEB A 28 -0.296 3.196 -0.117 1.00 0.25 H new HETATM 0 H6 NEB A 28 -2.069 2.404 0.811 1.00 0.21 H new HETATM 0 H5 NEB A 28 -1.122 0.122 -0.939 1.00 0.19 H new HETATM 0 H4 NEB A 28 -2.825 0.030 1.571 1.00 0.18 H new HETATM 0 H32 NEB A 28 -4.866 -1.942 0.442 1.00 0.26 H new HETATM 0 H31 NEB A 28 -5.789 -0.438 0.519 1.00 0.26 H new HETATM 0 H3 NEB A 28 -3.553 -0.637 -1.281 1.00 0.21 H new HETATM 0 H22 NEB A 28 -4.498 1.621 0.569 1.00 0.23 H new HETATM 0 H21 NEB A 28 -5.135 1.313 -1.034 1.00 0.23 H new HETATM 0 H13 NEB A 28 -2.973 3.987 -1.756 1.00 0.28 H new HETATM 0 H12 NEB A 28 -4.536 3.499 -1.451 1.00 0.28 H new HETATM 0 H11 NEB A 28 -3.530 3.906 -0.188 1.00 0.28 H new HETATM 0 H1 NEB A 28 -2.881 1.692 -2.015 1.00 0.23 H new