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 Set 1.1: A 16 A O2' : rot 20:sc= 0.0345 USER MOD Set 1.2: A 30 IDG O4 : rot 180:sc= -0.0569 USER MOD Single : A 4 G O2' : rot -18:sc= 0.0115 USER MOD Single : A 4 G O5' : rot 27:sc= 0.0714 USER MOD Single : A 5 G O2' : rot -18:sc= 0.0331 USER MOD Single : A 6 A O2' : rot -21:sc= 0.0713 USER MOD Single : A 7 C O2' : rot -16:sc= 0.0651 USER MOD Single : A 8 U O2' : rot -66:sc= 0.0143 USER MOD Single : A 9 G O2' : rot -26:sc= 0.0639 USER MOD Single : A 10 G O2' : rot -23:sc= 0.0301 USER MOD Single : A 11 G O2' : rot -15:sc= 0.0821 USER MOD Single : A 12 C O2' : rot -23:sc= 0.0742 USER MOD Single : A 13 G O2' : rot 180:sc= 0 USER MOD Single : A 14 A O2' : rot -17:sc= 0.085 USER MOD Single : A 15 G O2' : rot -17:sc= 0.0403 USER MOD Single : A 17 A O2' : rot -23:sc= 0.113 USER MOD Single : A 18 G O2' : rot -29:sc= 0.0588 USER MOD Single : A 19 U O2' : rot -58:sc= 0.399 USER MOD Single : A 20 U O2' : rot -20:sc= 0.0268 USER MOD Single : A 21 U O2' : rot 180:sc= 0 USER MOD Single : A 22 A O2' : rot -24:sc= 0.0347 USER MOD Single : A 23 G O2' : rot -26:sc= 0.0717 USER MOD Single : A 24 U O2' : rot -17:sc= 0.0784 USER MOD Single : A 25 C O2' : rot -15:sc= 0.0969 USER MOD Single : A 26 C O2' : rot -22:sc= 0.0652 USER MOD Single : A 26 C O3' : rot 180:sc= 0.086 USER MOD Single : A 27 BDG O3 : rot 102:sc= 1.08 USER MOD Single : A 27 BDG O4 : rot 180:sc=-0.00514 USER MOD Single : A 28 NEB N1 :NH3+ 172:sc= 1.11 (180deg=1.07) USER MOD Single : A 28 NEB O6 : rot 180:sc= 0 USER MOD Single : A 29 BDR O2 : rot -136:sc= 0.00855 USER MOD Single : A 29 BDR O5 : rot 17:sc= 0.749 USER MOD Single : A 30 IDG O3 : rot 143:sc= 0.423 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 4 4.746 15.297 -9.507 1.00 0.81 O ATOM 2 C5' G A 4 4.172 16.145 -8.514 1.00 0.70 C ATOM 3 C4' G A 4 4.957 16.066 -7.194 1.00 0.54 C ATOM 4 O4' G A 4 4.425 17.032 -6.229 1.00 0.56 O ATOM 5 C3' G A 4 4.827 14.729 -6.454 1.00 0.42 C ATOM 6 O3' G A 4 5.633 13.698 -7.041 1.00 0.46 O ATOM 7 C2' G A 4 5.195 15.116 -5.013 1.00 0.39 C ATOM 8 O2' G A 4 6.605 15.193 -4.790 1.00 0.46 O ATOM 9 C1' G A 4 4.533 16.507 -4.891 1.00 0.42 C ATOM 10 N9 G A 4 3.177 16.525 -4.252 1.00 0.35 N ATOM 11 C8 G A 4 1.949 16.403 -4.845 1.00 0.40 C ATOM 12 N7 G A 4 0.932 16.463 -4.024 1.00 0.37 N ATOM 13 C5 G A 4 1.499 16.627 -2.788 1.00 0.30 C ATOM 14 C6 G A 4 0.863 16.747 -1.542 1.00 0.28 C ATOM 15 O6 G A 4 -0.358 16.718 -1.350 1.00 0.32 O ATOM 16 N1 G A 4 1.800 16.909 -0.495 1.00 0.28 N ATOM 17 C2 G A 4 3.187 16.949 -0.631 1.00 0.31 C ATOM 18 N2 G A 4 3.830 17.119 0.547 1.00 0.40 N ATOM 19 N3 G A 4 3.771 16.830 -1.848 1.00 0.32 N ATOM 20 C4 G A 4 2.893 16.672 -2.878 1.00 0.30 C ATOM 0 H5' G A 4 3.135 15.857 -8.341 1.00 0.70 H new ATOM 0 H5'' G A 4 4.161 17.174 -8.873 1.00 0.70 H new ATOM 0 H4' G A 4 5.989 16.240 -7.498 1.00 0.54 H new ATOM 0 H3' G A 4 3.837 14.277 -6.505 1.00 0.42 H new ATOM 0 H2' G A 4 4.862 14.382 -4.279 1.00 0.39 H new ATOM 0 HO2' G A 4 7.076 14.714 -5.504 1.00 0.46 H new ATOM 0 HO5' G A 4 5.212 14.553 -9.072 1.00 0.81 H new ATOM 0 H1' G A 4 5.161 17.104 -4.229 1.00 0.42 H new ATOM 0 H8 G A 4 1.829 16.268 -5.910 1.00 0.40 H new ATOM 0 H1 G A 4 1.426 17.006 0.449 1.00 0.28 H new ATOM 0 H21 G A 4 4.849 17.163 0.570 1.00 0.40 H new ATOM 0 H22 G A 4 3.296 17.203 1.412 1.00 0.40 H new ATOM 33 P G A 5 5.383 12.157 -6.719 1.00 0.43 P ATOM 34 OP1 G A 5 5.869 11.355 -7.862 1.00 0.53 O ATOM 35 OP2 G A 5 3.973 11.959 -6.299 1.00 0.46 O ATOM 36 O5' G A 5 6.361 11.945 -5.480 1.00 0.43 O ATOM 37 C5' G A 5 6.108 10.948 -4.487 1.00 0.39 C ATOM 38 C4' G A 5 6.568 11.407 -3.080 1.00 0.30 C ATOM 39 O4' G A 5 6.069 12.757 -2.777 1.00 0.33 O ATOM 40 C3' G A 5 6.017 10.514 -1.953 1.00 0.25 C ATOM 41 O3' G A 5 6.920 9.442 -1.639 1.00 0.26 O ATOM 42 C2' G A 5 5.743 11.494 -0.796 1.00 0.25 C ATOM 43 O2' G A 5 6.887 11.739 0.023 1.00 0.31 O ATOM 44 C1' G A 5 5.333 12.775 -1.553 1.00 0.28 C ATOM 45 N9 G A 5 3.877 12.950 -1.858 1.00 0.26 N ATOM 46 C8 G A 5 3.220 12.828 -3.053 1.00 0.29 C ATOM 47 N7 G A 5 1.934 13.053 -3.000 1.00 0.28 N ATOM 48 C5 G A 5 1.696 13.348 -1.685 1.00 0.25 C ATOM 49 C6 G A 5 0.481 13.667 -1.070 1.00 0.25 C ATOM 50 O6 G A 5 -0.614 13.729 -1.639 1.00 0.29 O ATOM 51 N1 G A 5 0.646 13.913 0.313 1.00 0.23 N ATOM 52 C2 G A 5 1.851 13.850 1.015 1.00 0.23 C ATOM 53 N2 G A 5 1.704 14.126 2.326 1.00 0.24 N ATOM 54 N3 G A 5 3.007 13.540 0.393 1.00 0.23 N ATOM 55 C4 G A 5 2.874 13.301 -0.938 1.00 0.24 C ATOM 0 H5' G A 5 6.626 10.027 -4.756 1.00 0.39 H new ATOM 0 H5'' G A 5 5.042 10.720 -4.464 1.00 0.39 H new ATOM 0 H4' G A 5 7.657 11.361 -3.113 1.00 0.30 H new ATOM 0 H3' G A 5 5.103 9.983 -2.221 1.00 0.25 H new ATOM 0 H2' G A 5 4.998 11.112 -0.098 1.00 0.25 H new ATOM 0 HO2' G A 5 7.550 11.032 -0.121 1.00 0.31 H new ATOM 0 H1' G A 5 5.554 13.614 -0.894 1.00 0.28 H new ATOM 0 H8 G A 5 3.726 12.566 -3.970 1.00 0.29 H new ATOM 0 H1 G A 5 -0.189 14.158 0.844 1.00 0.23 H new ATOM 0 H21 G A 5 2.515 14.112 2.944 1.00 0.24 H new ATOM 0 H22 G A 5 0.782 14.349 2.700 1.00 0.24 H new ATOM 67 P A A 6 6.421 8.078 -0.990 1.00 0.24 P ATOM 68 OP1 A A 6 7.525 7.094 -1.038 1.00 0.32 O ATOM 69 OP2 A A 6 5.127 7.673 -1.601 1.00 0.28 O ATOM 70 O5' A A 6 6.207 8.540 0.522 1.00 0.26 O ATOM 71 C5' A A 6 5.187 7.951 1.323 1.00 0.30 C ATOM 72 C4' A A 6 4.942 8.752 2.622 1.00 0.23 C ATOM 73 O4' A A 6 4.425 10.096 2.329 1.00 0.26 O ATOM 74 C3' A A 6 3.879 8.091 3.509 1.00 0.22 C ATOM 75 O3' A A 6 4.508 7.201 4.444 1.00 0.24 O ATOM 76 C2' A A 6 3.120 9.268 4.146 1.00 0.24 C ATOM 77 O2' A A 6 3.720 9.711 5.365 1.00 0.30 O ATOM 78 C1' A A 6 3.217 10.369 3.059 1.00 0.23 C ATOM 79 N9 A A 6 2.085 10.513 2.074 1.00 0.23 N ATOM 80 C8 A A 6 2.132 10.405 0.705 1.00 0.23 C ATOM 81 N7 A A 6 0.991 10.601 0.095 1.00 0.24 N ATOM 82 C5 A A 6 0.108 10.878 1.108 1.00 0.23 C ATOM 83 C6 A A 6 -1.268 11.173 1.046 1.00 0.25 C ATOM 84 N6 A A 6 -1.891 11.207 -0.168 1.00 0.26 N ATOM 85 N1 A A 6 -1.877 11.406 2.249 1.00 0.26 N ATOM 86 C2 A A 6 -1.162 11.342 3.380 1.00 0.27 C ATOM 87 N3 A A 6 0.135 11.071 3.544 1.00 0.26 N ATOM 88 C4 A A 6 0.733 10.841 2.348 1.00 0.23 C ATOM 0 H5' A A 6 5.468 6.928 1.574 1.00 0.30 H new ATOM 0 H5'' A A 6 4.261 7.896 0.750 1.00 0.30 H new ATOM 0 H4' A A 6 5.908 8.790 3.125 1.00 0.23 H new ATOM 0 H3' A A 6 3.175 7.455 2.972 1.00 0.22 H new ATOM 0 H2' A A 6 2.099 9.001 4.420 1.00 0.24 H new ATOM 0 HO2' A A 6 4.277 8.994 5.735 1.00 0.30 H new ATOM 0 H1' A A 6 3.186 11.315 3.600 1.00 0.23 H new ATOM 0 H8 A A 6 3.043 10.175 0.172 1.00 0.23 H new ATOM 0 H61 A A 6 -2.887 11.420 -0.224 1.00 0.26 H new ATOM 0 H62 A A 6 -1.360 11.020 -1.019 1.00 0.26 H new ATOM 0 H2 A A 6 -1.713 11.537 4.288 1.00 0.27 H new ATOM 100 P C A 7 3.886 5.823 4.911 1.00 0.28 P ATOM 101 OP1 C A 7 4.926 5.008 5.582 1.00 0.37 O ATOM 102 OP2 C A 7 3.191 5.162 3.778 1.00 0.33 O ATOM 103 O5' C A 7 2.842 6.319 6.002 1.00 0.33 O ATOM 104 C5' C A 7 1.583 5.671 6.167 1.00 0.31 C ATOM 105 C4' C A 7 0.551 6.596 6.838 1.00 0.26 C ATOM 106 O4' C A 7 0.393 7.836 6.071 1.00 0.27 O ATOM 107 C3' C A 7 -0.852 5.979 6.878 1.00 0.25 C ATOM 108 O3' C A 7 -1.059 5.220 8.082 1.00 0.28 O ATOM 109 C2' C A 7 -1.786 7.192 6.749 1.00 0.30 C ATOM 110 O2' C A 7 -1.985 7.844 8.006 1.00 0.42 O ATOM 111 C1' C A 7 -0.985 8.104 5.777 1.00 0.27 C ATOM 112 N1 C A 7 -1.265 7.989 4.278 1.00 0.25 N ATOM 113 C2 C A 7 -2.595 8.282 3.775 1.00 0.28 C ATOM 114 O2 C A 7 -3.540 8.598 4.523 1.00 0.33 O ATOM 115 N3 C A 7 -2.813 8.191 2.416 1.00 0.28 N ATOM 116 C4 C A 7 -1.832 7.857 1.549 1.00 0.26 C ATOM 117 N4 C A 7 -2.095 7.778 0.218 1.00 0.31 N ATOM 118 C5 C A 7 -0.506 7.581 2.028 1.00 0.26 C ATOM 119 C6 C A 7 -0.272 7.657 3.346 1.00 0.25 C ATOM 0 H5' C A 7 1.712 4.772 6.770 1.00 0.31 H new ATOM 0 H5'' C A 7 1.208 5.352 5.195 1.00 0.31 H new ATOM 0 H4' C A 7 0.932 6.766 7.845 1.00 0.26 H new ATOM 0 H3' C A 7 -1.030 5.254 6.084 1.00 0.25 H new ATOM 0 H2' C A 7 -2.788 6.935 6.405 1.00 0.30 H new ATOM 0 HO2' C A 7 -1.707 7.247 8.732 1.00 0.42 H new ATOM 0 H1' C A 7 -1.303 9.131 5.959 1.00 0.27 H new ATOM 0 H41 C A 7 -1.353 7.526 -0.434 1.00 0.31 H new ATOM 0 H42 C A 7 -3.035 7.971 -0.128 1.00 0.31 H new ATOM 0 H5 C A 7 0.285 7.318 1.341 1.00 0.26 H new ATOM 0 H6 C A 7 0.726 7.453 3.706 1.00 0.25 H new ATOM 131 P U A 8 -1.620 3.732 8.069 1.00 0.24 P ATOM 132 OP1 U A 8 -1.642 3.240 9.466 1.00 0.29 O ATOM 133 OP2 U A 8 -0.851 2.928 7.084 1.00 0.29 O ATOM 134 O5' U A 8 -3.106 3.927 7.528 1.00 0.21 O ATOM 135 C5' U A 8 -4.145 4.394 8.400 1.00 0.19 C ATOM 136 C4' U A 8 -5.519 4.550 7.702 1.00 0.17 C ATOM 137 O4' U A 8 -5.468 5.589 6.667 1.00 0.21 O ATOM 138 C3' U A 8 -6.007 3.309 6.950 1.00 0.16 C ATOM 139 O3' U A 8 -6.541 2.290 7.809 1.00 0.17 O ATOM 140 C2' U A 8 -6.982 3.887 5.916 1.00 0.19 C ATOM 141 O2' U A 8 -8.300 4.097 6.419 1.00 0.28 O ATOM 142 C1' U A 8 -6.309 5.228 5.551 1.00 0.19 C ATOM 143 N1 U A 8 -5.519 5.193 4.262 1.00 0.18 N ATOM 144 C2 U A 8 -6.263 5.350 3.048 1.00 0.22 C ATOM 145 O2 U A 8 -7.485 5.512 2.968 1.00 0.28 O ATOM 146 N3 U A 8 -5.481 5.302 1.887 1.00 0.23 N ATOM 147 C4 U A 8 -4.094 5.121 1.784 1.00 0.20 C ATOM 148 O4 U A 8 -3.547 5.102 0.675 1.00 0.22 O ATOM 149 C5 U A 8 -3.417 4.964 3.059 1.00 0.20 C ATOM 150 C6 U A 8 -4.128 5.002 4.206 1.00 0.20 C ATOM 0 H5' U A 8 -3.850 5.355 8.821 1.00 0.19 H new ATOM 0 H5'' U A 8 -4.247 3.699 9.234 1.00 0.19 H new ATOM 0 H4' U A 8 -6.189 4.776 8.531 1.00 0.17 H new ATOM 0 H3' U A 8 -5.205 2.752 6.466 1.00 0.16 H new ATOM 0 H2' U A 8 -7.138 3.209 5.077 1.00 0.19 H new ATOM 0 HO2' U A 8 -8.711 3.233 6.631 1.00 0.28 H new ATOM 0 H1' U A 8 -7.085 5.972 5.369 1.00 0.19 H new ATOM 0 H3 U A 8 -5.983 5.413 1.006 1.00 0.23 H new ATOM 0 H5 U A 8 -2.347 4.817 3.090 1.00 0.20 H new ATOM 0 H6 U A 8 -3.595 4.878 5.137 1.00 0.20 H new ATOM 161 P G A 9 -6.761 0.805 7.275 1.00 0.16 P ATOM 162 OP1 G A 9 -6.813 -0.133 8.417 1.00 0.29 O ATOM 163 OP2 G A 9 -5.771 0.496 6.211 1.00 0.23 O ATOM 164 O5' G A 9 -8.210 0.950 6.633 1.00 0.22 O ATOM 165 C5' G A 9 -8.635 0.068 5.597 1.00 0.29 C ATOM 166 C4' G A 9 -9.892 0.600 4.882 1.00 0.20 C ATOM 167 O4' G A 9 -9.639 1.909 4.262 1.00 0.22 O ATOM 168 C3' G A 9 -10.315 -0.291 3.710 1.00 0.17 C ATOM 169 O3' G A 9 -11.138 -1.378 4.137 1.00 0.18 O ATOM 170 C2' G A 9 -11.042 0.681 2.777 1.00 0.19 C ATOM 171 O2' G A 9 -12.402 0.911 3.168 1.00 0.24 O ATOM 172 C1' G A 9 -10.185 1.961 2.934 1.00 0.19 C ATOM 173 N9 G A 9 -9.053 2.158 1.965 1.00 0.19 N ATOM 174 C8 G A 9 -7.710 2.257 2.215 1.00 0.20 C ATOM 175 N7 G A 9 -6.962 2.451 1.156 1.00 0.19 N ATOM 176 C5 G A 9 -7.854 2.493 0.115 1.00 0.17 C ATOM 177 C6 G A 9 -7.604 2.675 -1.255 1.00 0.17 C ATOM 178 O6 G A 9 -6.497 2.847 -1.776 1.00 0.19 O ATOM 179 N1 G A 9 -8.799 2.655 -2.008 1.00 0.18 N ATOM 180 C2 G A 9 -10.087 2.483 -1.501 1.00 0.18 C ATOM 181 N2 G A 9 -11.053 2.503 -2.445 1.00 0.21 N ATOM 182 N3 G A 9 -10.295 2.307 -0.180 1.00 0.18 N ATOM 183 C4 G A 9 -9.164 2.320 0.573 1.00 0.17 C ATOM 0 H5' G A 9 -8.844 -0.916 6.018 1.00 0.29 H new ATOM 0 H5'' G A 9 -7.830 -0.059 4.873 1.00 0.29 H new ATOM 0 H4' G A 9 -10.656 0.639 5.658 1.00 0.20 H new ATOM 0 H3' G A 9 -9.477 -0.784 3.218 1.00 0.17 H new ATOM 0 H2' G A 9 -11.125 0.315 1.754 1.00 0.19 H new ATOM 0 HO2' G A 9 -12.733 0.138 3.672 1.00 0.24 H new ATOM 0 H1' G A 9 -10.850 2.800 2.730 1.00 0.19 H new ATOM 0 H8 G A 9 -7.298 2.181 3.210 1.00 0.20 H new ATOM 0 H1 G A 9 -8.712 2.778 -3.017 1.00 0.18 H new ATOM 0 H21 G A 9 -12.030 2.386 -2.177 1.00 0.21 H new ATOM 0 H22 G A 9 -10.805 2.635 -3.426 1.00 0.21 H new ATOM 195 P G A 10 -10.913 -2.877 3.662 1.00 0.16 P ATOM 196 OP1 G A 10 -11.899 -3.721 4.380 1.00 0.22 O ATOM 197 OP2 G A 10 -9.480 -3.228 3.798 1.00 0.19 O ATOM 198 O5' G A 10 -11.275 -2.816 2.116 1.00 0.18 O ATOM 199 C5' G A 10 -12.635 -2.679 1.694 1.00 0.19 C ATOM 200 C4' G A 10 -12.762 -2.238 0.222 1.00 0.18 C ATOM 201 O4' G A 10 -11.969 -1.033 -0.036 1.00 0.20 O ATOM 202 C3' G A 10 -12.242 -3.236 -0.814 1.00 0.18 C ATOM 203 O3' G A 10 -13.154 -4.318 -1.055 1.00 0.22 O ATOM 204 C2' G A 10 -12.025 -2.335 -2.039 1.00 0.19 C ATOM 205 O2' G A 10 -13.232 -2.057 -2.753 1.00 0.22 O ATOM 206 C1' G A 10 -11.463 -1.057 -1.378 1.00 0.17 C ATOM 207 N9 G A 10 -9.975 -0.920 -1.414 1.00 0.17 N ATOM 208 C8 G A 10 -9.074 -0.780 -0.397 1.00 0.18 C ATOM 209 N7 G A 10 -7.828 -0.650 -0.789 1.00 0.17 N ATOM 210 C5 G A 10 -7.891 -0.704 -2.160 1.00 0.15 C ATOM 211 C6 G A 10 -6.852 -0.624 -3.102 1.00 0.16 C ATOM 212 O6 G A 10 -5.655 -0.472 -2.845 1.00 0.17 O ATOM 213 N1 G A 10 -7.342 -0.729 -4.433 1.00 0.16 N ATOM 214 C2 G A 10 -8.674 -0.884 -4.803 1.00 0.18 C ATOM 215 N2 G A 10 -8.857 -0.948 -6.139 1.00 0.22 N ATOM 216 N3 G A 10 -9.640 -0.956 -3.870 1.00 0.18 N ATOM 217 C4 G A 10 -9.204 -0.865 -2.587 1.00 0.15 C ATOM 0 H5' G A 10 -13.137 -1.951 2.331 1.00 0.19 H new ATOM 0 H5'' G A 10 -13.150 -3.630 1.829 1.00 0.19 H new ATOM 0 H4' G A 10 -13.838 -2.108 0.109 1.00 0.18 H new ATOM 0 H3' G A 10 -11.339 -3.761 -0.502 1.00 0.18 H new ATOM 0 H2' G A 10 -11.380 -2.787 -2.792 1.00 0.19 H new ATOM 0 HO2' G A 10 -13.893 -2.755 -2.562 1.00 0.22 H new ATOM 0 H1' G A 10 -11.797 -0.196 -1.957 1.00 0.17 H new ATOM 0 H8 G A 10 -9.363 -0.777 0.644 1.00 0.18 H new ATOM 0 H1 G A 10 -6.654 -0.687 -5.185 1.00 0.16 H new ATOM 0 H21 G A 10 -9.796 -1.061 -6.520 1.00 0.22 H new ATOM 0 H22 G A 10 -8.056 -0.883 -6.767 1.00 0.22 H new ATOM 229 P G A 11 -12.615 -5.763 -1.452 1.00 0.23 P ATOM 230 OP1 G A 11 -13.774 -6.666 -1.612 1.00 0.33 O ATOM 231 OP2 G A 11 -11.552 -6.173 -0.503 1.00 0.29 O ATOM 232 O5' G A 11 -12.003 -5.470 -2.890 1.00 0.25 O ATOM 233 C5' G A 11 -11.092 -6.380 -3.496 1.00 0.24 C ATOM 234 C4' G A 11 -10.940 -6.106 -5.010 1.00 0.19 C ATOM 235 O4' G A 11 -10.435 -4.739 -5.262 1.00 0.21 O ATOM 236 C3' G A 11 -9.923 -7.054 -5.677 1.00 0.19 C ATOM 237 O3' G A 11 -10.569 -8.179 -6.298 1.00 0.22 O ATOM 238 C2' G A 11 -9.174 -6.156 -6.677 1.00 0.19 C ATOM 239 O2' G A 11 -9.834 -6.074 -7.943 1.00 0.23 O ATOM 240 C1' G A 11 -9.191 -4.779 -5.974 1.00 0.16 C ATOM 241 N9 G A 11 -8.070 -4.424 -5.053 1.00 0.14 N ATOM 242 C8 G A 11 -8.110 -4.028 -3.738 1.00 0.16 C ATOM 243 N7 G A 11 -6.932 -3.757 -3.225 1.00 0.16 N ATOM 244 C5 G A 11 -6.047 -3.961 -4.254 1.00 0.14 C ATOM 245 C6 G A 11 -4.649 -3.821 -4.257 1.00 0.15 C ATOM 246 O6 G A 11 -3.955 -3.469 -3.299 1.00 0.18 O ATOM 247 N1 G A 11 -4.099 -4.139 -5.521 1.00 0.14 N ATOM 248 C2 G A 11 -4.807 -4.540 -6.651 1.00 0.14 C ATOM 249 N2 G A 11 -4.009 -4.774 -7.716 1.00 0.18 N ATOM 250 N3 G A 11 -6.148 -4.660 -6.614 1.00 0.13 N ATOM 251 C4 G A 11 -6.710 -4.370 -5.408 1.00 0.13 C ATOM 0 H5' G A 11 -11.441 -7.401 -3.343 1.00 0.24 H new ATOM 0 H5'' G A 11 -10.119 -6.299 -3.011 1.00 0.24 H new ATOM 0 H4' G A 11 -11.937 -6.252 -5.426 1.00 0.19 H new ATOM 0 H3' G A 11 -9.239 -7.512 -4.963 1.00 0.19 H new ATOM 0 H2' G A 11 -8.178 -6.534 -6.905 1.00 0.19 H new ATOM 0 HO2' G A 11 -10.505 -6.786 -8.009 1.00 0.23 H new ATOM 0 H1' G A 11 -9.065 -4.034 -6.759 1.00 0.16 H new ATOM 0 H8 G A 11 -9.029 -3.947 -3.176 1.00 0.16 H new ATOM 0 H1 G A 11 -3.086 -4.068 -5.614 1.00 0.14 H new ATOM 0 H21 G A 11 -4.416 -5.074 -8.602 1.00 0.18 H new ATOM 0 H22 G A 11 -3.000 -4.651 -7.634 1.00 0.18 H new ATOM 263 P C A 12 -10.226 -9.698 -5.949 1.00 0.21 P ATOM 264 OP1 C A 12 -11.141 -10.563 -6.731 1.00 0.26 O ATOM 265 OP2 C A 12 -10.215 -9.868 -4.479 1.00 0.26 O ATOM 266 O5' C A 12 -8.734 -9.871 -6.463 1.00 0.20 O ATOM 267 C5' C A 12 -8.407 -9.808 -7.851 1.00 0.24 C ATOM 268 C4' C A 12 -6.927 -9.443 -8.088 1.00 0.21 C ATOM 269 O4' C A 12 -6.564 -8.233 -7.353 1.00 0.22 O ATOM 270 C3' C A 12 -5.904 -10.462 -7.593 1.00 0.21 C ATOM 271 O3' C A 12 -5.781 -11.596 -8.462 1.00 0.25 O ATOM 272 C2' C A 12 -4.616 -9.620 -7.514 1.00 0.20 C ATOM 273 O2' C A 12 -3.960 -9.518 -8.785 1.00 0.24 O ATOM 274 C1' C A 12 -5.156 -8.228 -7.066 1.00 0.18 C ATOM 275 N1 C A 12 -4.821 -7.730 -5.667 1.00 0.17 N ATOM 276 C2 C A 12 -3.429 -7.547 -5.293 1.00 0.19 C ATOM 277 O2 C A 12 -2.481 -7.807 -6.061 1.00 0.22 O ATOM 278 N3 C A 12 -3.148 -7.052 -4.040 1.00 0.21 N ATOM 279 C4 C A 12 -4.117 -6.737 -3.158 1.00 0.19 C ATOM 280 N4 C A 12 -3.794 -6.258 -1.927 1.00 0.21 N ATOM 281 C5 C A 12 -5.501 -6.895 -3.523 1.00 0.19 C ATOM 282 C6 C A 12 -5.801 -7.376 -4.739 1.00 0.18 C ATOM 0 H5' C A 12 -9.044 -9.070 -8.339 1.00 0.24 H new ATOM 0 H5'' C A 12 -8.621 -10.770 -8.316 1.00 0.24 H new ATOM 0 H4' C A 12 -6.882 -9.359 -9.174 1.00 0.21 H new ATOM 0 H3' C A 12 -6.176 -10.920 -6.642 1.00 0.21 H new ATOM 0 H2' C A 12 -3.870 -10.050 -6.845 1.00 0.20 H new ATOM 0 HO2' C A 12 -4.224 -10.273 -9.351 1.00 0.24 H new ATOM 0 H1' C A 12 -4.610 -7.476 -7.636 1.00 0.18 H new ATOM 0 H41 C A 12 -4.531 -6.021 -1.263 1.00 0.21 H new ATOM 0 H42 C A 12 -2.815 -6.136 -1.668 1.00 0.21 H new ATOM 0 H5 C A 12 -6.285 -6.631 -2.829 1.00 0.19 H new ATOM 0 H6 C A 12 -6.840 -7.494 -5.010 1.00 0.18 H new ATOM 294 P G A 13 -6.123 -13.086 -8.016 1.00 0.27 P ATOM 295 OP1 G A 13 -5.820 -13.967 -9.166 1.00 0.37 O ATOM 296 OP2 G A 13 -7.506 -13.145 -7.486 1.00 0.33 O ATOM 297 O5' G A 13 -5.054 -13.369 -6.867 1.00 0.28 O ATOM 298 C5' G A 13 -5.324 -13.271 -5.471 1.00 0.26 C ATOM 299 C4' G A 13 -4.055 -12.851 -4.696 1.00 0.20 C ATOM 300 O4' G A 13 -3.913 -11.387 -4.637 1.00 0.21 O ATOM 301 C3' G A 13 -4.062 -13.214 -3.214 1.00 0.17 C ATOM 302 O3' G A 13 -3.904 -14.613 -2.929 1.00 0.21 O ATOM 303 C2' G A 13 -2.913 -12.341 -2.680 1.00 0.18 C ATOM 304 O2' G A 13 -1.603 -12.804 -3.025 1.00 0.25 O ATOM 305 C1' G A 13 -3.257 -11.005 -3.398 1.00 0.18 C ATOM 306 N9 G A 13 -4.157 -10.172 -2.527 1.00 0.15 N ATOM 307 C8 G A 13 -5.487 -9.889 -2.668 1.00 0.16 C ATOM 308 N7 G A 13 -6.000 -9.171 -1.692 1.00 0.16 N ATOM 309 C5 G A 13 -4.953 -8.961 -0.823 1.00 0.14 C ATOM 310 C6 G A 13 -4.933 -8.247 0.402 1.00 0.15 C ATOM 311 O6 G A 13 -5.883 -7.650 0.920 1.00 0.18 O ATOM 312 N1 G A 13 -3.640 -8.275 0.987 1.00 0.14 N ATOM 313 C2 G A 13 -2.513 -8.911 0.469 1.00 0.13 C ATOM 314 N2 G A 13 -1.424 -8.777 1.247 1.00 0.16 N ATOM 315 N3 G A 13 -2.563 -9.576 -0.704 1.00 0.13 N ATOM 316 C4 G A 13 -3.789 -9.573 -1.300 1.00 0.13 C ATOM 0 H5' G A 13 -5.683 -14.230 -5.097 1.00 0.26 H new ATOM 0 H5'' G A 13 -6.118 -12.544 -5.299 1.00 0.26 H new ATOM 0 H4' G A 13 -3.270 -13.372 -5.244 1.00 0.20 H new ATOM 0 H3' G A 13 -5.024 -13.026 -2.738 1.00 0.17 H new ATOM 0 H2' G A 13 -2.858 -12.308 -1.592 1.00 0.18 H new ATOM 0 HO2' G A 13 -0.932 -12.196 -2.651 1.00 0.25 H new ATOM 0 H1' G A 13 -2.373 -10.399 -3.599 1.00 0.18 H new ATOM 0 H8 G A 13 -6.069 -10.227 -3.512 1.00 0.16 H new ATOM 0 H1 G A 13 -3.524 -7.782 1.872 1.00 0.14 H new ATOM 0 H21 G A 13 -0.541 -9.203 0.966 1.00 0.16 H new ATOM 0 H22 G A 13 -1.482 -8.250 2.118 1.00 0.16 H new ATOM 328 P A A 14 -4.912 -15.308 -1.903 1.00 0.22 P ATOM 329 OP1 A A 14 -4.562 -16.741 -1.809 1.00 0.30 O ATOM 330 OP2 A A 14 -6.308 -14.971 -2.266 1.00 0.29 O ATOM 331 O5' A A 14 -4.514 -14.595 -0.534 1.00 0.23 O ATOM 332 C5' A A 14 -5.256 -14.843 0.665 1.00 0.26 C ATOM 333 C4' A A 14 -4.351 -15.064 1.902 1.00 0.23 C ATOM 334 O4' A A 14 -3.381 -16.137 1.653 1.00 0.27 O ATOM 335 C3' A A 14 -3.507 -13.855 2.329 1.00 0.21 C ATOM 336 O3' A A 14 -4.237 -12.981 3.206 1.00 0.19 O ATOM 337 C2' A A 14 -2.285 -14.501 3.002 1.00 0.25 C ATOM 338 O2' A A 14 -2.520 -14.828 4.374 1.00 0.30 O ATOM 339 C1' A A 14 -2.086 -15.789 2.170 1.00 0.25 C ATOM 340 N9 A A 14 -1.086 -15.713 1.046 1.00 0.24 N ATOM 341 C8 A A 14 -1.291 -15.819 -0.309 1.00 0.26 C ATOM 342 N7 A A 14 -0.206 -15.733 -1.043 1.00 0.29 N ATOM 343 C5 A A 14 0.803 -15.549 -0.129 1.00 0.28 C ATOM 344 C6 A A 14 2.194 -15.390 -0.328 1.00 0.35 C ATOM 345 N6 A A 14 2.717 -15.401 -1.585 1.00 0.40 N ATOM 346 N1 A A 14 2.942 -15.232 0.804 1.00 0.39 N ATOM 347 C2 A A 14 2.345 -15.238 1.997 1.00 0.39 C ATOM 348 N3 A A 14 1.054 -15.385 2.297 1.00 0.33 N ATOM 349 C4 A A 14 0.313 -15.536 1.170 1.00 0.27 C ATOM 0 H5' A A 14 -5.886 -15.721 0.521 1.00 0.26 H new ATOM 0 H5'' A A 14 -5.922 -14.001 0.854 1.00 0.26 H new ATOM 0 H4' A A 14 -5.067 -15.292 2.691 1.00 0.23 H new ATOM 0 H3' A A 14 -3.223 -13.208 1.499 1.00 0.21 H new ATOM 0 H2' A A 14 -1.422 -13.835 3.019 1.00 0.25 H new ATOM 0 HO2' A A 14 -3.310 -14.345 4.695 1.00 0.30 H new ATOM 0 H1' A A 14 -1.658 -16.539 2.834 1.00 0.25 H new ATOM 0 H8 A A 14 -2.272 -15.962 -0.738 1.00 0.26 H new ATOM 0 H61 A A 14 3.721 -15.286 -1.721 1.00 0.40 H new ATOM 0 H62 A A 14 2.104 -15.525 -2.391 1.00 0.40 H new ATOM 0 H2 A A 14 3.003 -15.104 2.843 1.00 0.39 H new ATOM 361 P G A 15 -4.340 -11.409 2.971 1.00 0.18 P ATOM 362 OP1 G A 15 -5.332 -10.855 3.922 1.00 0.27 O ATOM 363 OP2 G A 15 -4.584 -11.163 1.534 1.00 0.25 O ATOM 364 O5' G A 15 -2.868 -10.914 3.373 1.00 0.18 O ATOM 365 C5' G A 15 -2.471 -10.906 4.756 1.00 0.20 C ATOM 366 C4' G A 15 -0.936 -10.855 4.996 1.00 0.18 C ATOM 367 O4' G A 15 -0.256 -11.973 4.333 1.00 0.19 O ATOM 368 C3' G A 15 -0.229 -9.610 4.455 1.00 0.17 C ATOM 369 O3' G A 15 -0.321 -8.482 5.345 1.00 0.17 O ATOM 370 C2' G A 15 1.210 -10.083 4.211 1.00 0.18 C ATOM 371 O2' G A 15 2.004 -10.049 5.400 1.00 0.23 O ATOM 372 C1' G A 15 0.978 -11.536 3.729 1.00 0.17 C ATOM 373 N9 G A 15 0.896 -11.742 2.239 1.00 0.17 N ATOM 374 C8 G A 15 -0.214 -11.883 1.451 1.00 0.18 C ATOM 375 N7 G A 15 0.027 -12.072 0.178 1.00 0.20 N ATOM 376 C5 G A 15 1.393 -12.054 0.085 1.00 0.20 C ATOM 377 C6 G A 15 2.196 -12.207 -1.057 1.00 0.24 C ATOM 378 O6 G A 15 1.788 -12.389 -2.209 1.00 0.28 O ATOM 379 N1 G A 15 3.574 -12.130 -0.736 1.00 0.28 N ATOM 380 C2 G A 15 4.108 -11.931 0.539 1.00 0.27 C ATOM 381 N2 G A 15 5.462 -11.902 0.550 1.00 0.35 N ATOM 382 N3 G A 15 3.307 -11.788 1.619 1.00 0.23 N ATOM 383 C4 G A 15 1.977 -11.855 1.341 1.00 0.18 C ATOM 0 H5' G A 15 -2.870 -11.798 5.239 1.00 0.20 H new ATOM 0 H5'' G A 15 -2.929 -10.047 5.246 1.00 0.20 H new ATOM 0 H4' G A 15 -0.866 -10.876 6.084 1.00 0.18 H new ATOM 0 H3' G A 15 -0.691 -9.231 3.544 1.00 0.17 H new ATOM 0 H2' G A 15 1.760 -9.456 3.509 1.00 0.18 H new ATOM 0 HO2' G A 15 1.566 -9.484 6.070 1.00 0.23 H new ATOM 0 H1' G A 15 1.855 -12.111 4.027 1.00 0.17 H new ATOM 0 H8 G A 15 -1.217 -11.841 1.850 1.00 0.18 H new ATOM 0 H1 G A 15 4.236 -12.229 -1.506 1.00 0.28 H new ATOM 0 H21 G A 15 5.962 -11.762 1.428 1.00 0.35 H new ATOM 0 H22 G A 15 5.982 -12.020 -0.320 1.00 0.35 H new ATOM 395 P A A 16 -0.682 -7.058 4.732 1.00 0.15 P ATOM 396 OP1 A A 16 -2.078 -7.087 4.249 1.00 0.21 O ATOM 397 OP2 A A 16 0.334 -6.678 3.718 1.00 0.21 O ATOM 398 O5' A A 16 -0.636 -6.069 5.969 1.00 0.18 O ATOM 399 C5' A A 16 0.534 -5.647 6.658 1.00 0.18 C ATOM 400 C4' A A 16 1.366 -4.575 5.900 1.00 0.19 C ATOM 401 O4' A A 16 0.505 -3.497 5.398 1.00 0.22 O ATOM 402 C3' A A 16 2.417 -3.871 6.778 1.00 0.18 C ATOM 403 O3' A A 16 3.588 -3.610 5.993 1.00 0.20 O ATOM 404 C2' A A 16 1.690 -2.579 7.201 1.00 0.21 C ATOM 405 O2' A A 16 2.577 -1.542 7.613 1.00 0.25 O ATOM 406 C1' A A 16 0.935 -2.240 5.902 1.00 0.20 C ATOM 407 N9 A A 16 -0.289 -1.387 5.944 1.00 0.20 N ATOM 408 C8 A A 16 -1.347 -1.367 6.818 1.00 0.23 C ATOM 409 N7 A A 16 -2.288 -0.501 6.511 1.00 0.24 N ATOM 410 C5 A A 16 -1.836 0.091 5.357 1.00 0.20 C ATOM 411 C6 A A 16 -2.407 1.100 4.549 1.00 0.19 C ATOM 412 N6 A A 16 -3.597 1.664 4.851 1.00 0.24 N ATOM 413 N1 A A 16 -1.690 1.463 3.450 1.00 0.18 N ATOM 414 C2 A A 16 -0.532 0.871 3.197 1.00 0.16 C ATOM 415 N3 A A 16 0.097 -0.074 3.878 1.00 0.15 N ATOM 416 C4 A A 16 -0.617 -0.436 4.972 1.00 0.17 C ATOM 0 H5' A A 16 1.165 -6.516 6.845 1.00 0.18 H new ATOM 0 H5'' A A 16 0.246 -5.247 7.630 1.00 0.18 H new ATOM 0 H4' A A 16 1.855 -5.134 5.102 1.00 0.19 H new ATOM 0 H3' A A 16 2.761 -4.445 7.638 1.00 0.18 H new ATOM 0 H2' A A 16 1.052 -2.695 8.077 1.00 0.21 H new ATOM 0 HO2' A A 16 3.474 -1.721 7.262 1.00 0.25 H new ATOM 0 H1' A A 16 1.642 -1.644 5.325 1.00 0.20 H new ATOM 0 H8 A A 16 -1.402 -2.009 7.685 1.00 0.23 H new ATOM 0 H61 A A 16 -3.985 2.390 4.249 1.00 0.24 H new ATOM 0 H62 A A 16 -4.108 1.363 5.681 1.00 0.24 H new ATOM 0 H2 A A 16 -0.027 1.209 2.304 1.00 0.16 H new ATOM 428 P A A 17 5.019 -4.245 6.263 1.00 0.20 P ATOM 429 OP1 A A 17 4.955 -5.283 7.320 1.00 0.26 O ATOM 430 OP2 A A 17 5.947 -3.109 6.471 1.00 0.30 O ATOM 431 O5' A A 17 5.370 -4.927 4.873 1.00 0.22 O ATOM 432 C5' A A 17 4.572 -5.968 4.314 1.00 0.23 C ATOM 433 C4' A A 17 5.275 -6.671 3.139 1.00 0.21 C ATOM 434 O4' A A 17 4.422 -7.754 2.660 1.00 0.24 O ATOM 435 C3' A A 17 5.481 -5.822 1.878 1.00 0.18 C ATOM 436 O3' A A 17 6.627 -4.963 1.980 1.00 0.20 O ATOM 437 C2' A A 17 5.608 -6.887 0.775 1.00 0.19 C ATOM 438 O2' A A 17 6.958 -7.314 0.585 1.00 0.27 O ATOM 439 C1' A A 17 4.720 -8.049 1.287 1.00 0.18 C ATOM 440 N9 A A 17 3.446 -8.305 0.534 1.00 0.16 N ATOM 441 C8 A A 17 2.140 -8.202 0.958 1.00 0.16 C ATOM 442 N7 A A 17 1.250 -8.516 0.054 1.00 0.17 N ATOM 443 C5 A A 17 1.982 -8.861 -1.048 1.00 0.16 C ATOM 444 C6 A A 17 1.556 -9.286 -2.322 1.00 0.17 C ATOM 445 N6 A A 17 0.236 -9.409 -2.618 1.00 0.20 N ATOM 446 N1 A A 17 2.550 -9.555 -3.221 1.00 0.20 N ATOM 447 C2 A A 17 3.823 -9.410 -2.866 1.00 0.21 C ATOM 448 N3 A A 17 4.331 -9.026 -1.694 1.00 0.20 N ATOM 449 C4 A A 17 3.340 -8.752 -0.804 1.00 0.16 C ATOM 0 H5' A A 17 3.624 -5.553 3.972 1.00 0.23 H new ATOM 0 H5'' A A 17 4.339 -6.700 5.087 1.00 0.23 H new ATOM 0 H4' A A 17 6.242 -6.957 3.552 1.00 0.21 H new ATOM 0 H3' A A 17 4.670 -5.119 1.687 1.00 0.18 H new ATOM 0 H2' A A 17 5.300 -6.507 -0.199 1.00 0.19 H new ATOM 0 HO2' A A 17 7.569 -6.616 0.901 1.00 0.27 H new ATOM 0 H1' A A 17 5.286 -8.969 1.141 1.00 0.18 H new ATOM 0 H8 A A 17 1.873 -7.887 1.956 1.00 0.16 H new ATOM 0 H61 A A 17 -0.052 -9.718 -3.546 1.00 0.20 H new ATOM 0 H62 A A 17 -0.467 -9.192 -1.912 1.00 0.20 H new ATOM 0 H2 A A 17 4.548 -9.635 -3.635 1.00 0.21 H new ATOM 461 P G A 18 6.651 -3.454 1.495 1.00 0.19 P ATOM 462 OP1 G A 18 7.762 -2.748 2.173 1.00 0.27 O ATOM 463 OP2 G A 18 5.314 -2.855 1.701 1.00 0.21 O ATOM 464 O5' G A 18 6.983 -3.586 -0.057 1.00 0.26 O ATOM 465 C5' G A 18 6.194 -3.041 -1.117 1.00 0.25 C ATOM 466 C4' G A 18 6.326 -3.893 -2.403 1.00 0.21 C ATOM 467 O4' G A 18 5.860 -5.257 -2.131 1.00 0.22 O ATOM 468 C3' G A 18 5.468 -3.424 -3.602 1.00 0.20 C ATOM 469 O3' G A 18 6.159 -2.536 -4.491 1.00 0.21 O ATOM 470 C2' G A 18 5.073 -4.739 -4.299 1.00 0.20 C ATOM 471 O2' G A 18 6.085 -5.233 -5.181 1.00 0.24 O ATOM 472 C1' G A 18 4.883 -5.670 -3.087 1.00 0.19 C ATOM 473 N9 G A 18 3.511 -5.641 -2.473 1.00 0.16 N ATOM 474 C8 G A 18 3.128 -5.276 -1.213 1.00 0.17 C ATOM 475 N7 G A 18 1.846 -5.371 -0.977 1.00 0.17 N ATOM 476 C5 G A 18 1.316 -5.832 -2.147 1.00 0.15 C ATOM 477 C6 G A 18 -0.023 -6.118 -2.441 1.00 0.17 C ATOM 478 O6 G A 18 -0.968 -5.979 -1.654 1.00 0.20 O ATOM 479 N1 G A 18 -0.169 -6.573 -3.773 1.00 0.18 N ATOM 480 C2 G A 18 0.870 -6.736 -4.698 1.00 0.19 C ATOM 481 N2 G A 18 0.437 -7.190 -5.889 1.00 0.25 N ATOM 482 N3 G A 18 2.151 -6.454 -4.381 1.00 0.18 N ATOM 483 C4 G A 18 2.313 -6.014 -3.109 1.00 0.15 C ATOM 0 H5' G A 18 6.510 -2.018 -1.321 1.00 0.25 H new ATOM 0 H5'' G A 18 5.149 -2.997 -0.811 1.00 0.25 H new ATOM 0 H4' G A 18 7.380 -3.809 -2.668 1.00 0.21 H new ATOM 0 H3' G A 18 4.612 -2.834 -3.275 1.00 0.20 H new ATOM 0 H2' G A 18 4.201 -4.640 -4.945 1.00 0.20 H new ATOM 0 HO2' G A 18 6.602 -4.481 -5.540 1.00 0.24 H new ATOM 0 H1' G A 18 5.002 -6.702 -3.416 1.00 0.19 H new ATOM 0 H8 G A 18 3.832 -4.935 -0.468 1.00 0.17 H new ATOM 0 H1 G A 18 -1.112 -6.802 -4.086 1.00 0.18 H new ATOM 0 H21 G A 18 1.101 -7.349 -6.646 1.00 0.25 H new ATOM 0 H22 G A 18 -0.556 -7.375 -6.034 1.00 0.25 H new ATOM 495 P U A 19 5.462 -1.252 -5.131 1.00 0.18 P ATOM 496 OP1 U A 19 6.474 -0.499 -5.908 1.00 0.24 O ATOM 497 OP2 U A 19 4.749 -0.502 -4.072 1.00 0.23 O ATOM 498 O5' U A 19 4.361 -1.830 -6.104 1.00 0.21 O ATOM 499 C5' U A 19 4.580 -2.443 -7.368 1.00 0.22 C ATOM 500 C4' U A 19 3.264 -3.015 -7.967 1.00 0.19 C ATOM 501 O4' U A 19 2.619 -3.914 -6.998 1.00 0.19 O ATOM 502 C3' U A 19 2.204 -1.954 -8.320 1.00 0.19 C ATOM 503 O3' U A 19 2.344 -1.480 -9.670 1.00 0.25 O ATOM 504 C2' U A 19 0.862 -2.645 -8.015 1.00 0.25 C ATOM 505 O2' U A 19 0.207 -3.221 -9.145 1.00 0.40 O ATOM 506 C1' U A 19 1.195 -3.735 -6.980 1.00 0.19 C ATOM 507 N1 U A 19 0.683 -3.428 -5.591 1.00 0.18 N ATOM 508 C2 U A 19 -0.652 -3.841 -5.259 1.00 0.17 C ATOM 509 O2 U A 19 -1.413 -4.450 -6.018 1.00 0.20 O ATOM 510 N3 U A 19 -1.061 -3.500 -3.952 1.00 0.16 N ATOM 511 C4 U A 19 -0.300 -2.819 -2.981 1.00 0.18 C ATOM 512 O4 U A 19 -0.767 -2.581 -1.869 1.00 0.21 O ATOM 513 C5 U A 19 1.027 -2.436 -3.404 1.00 0.19 C ATOM 514 C6 U A 19 1.447 -2.740 -4.645 1.00 0.19 C ATOM 0 H5' U A 19 5.310 -3.245 -7.261 1.00 0.22 H new ATOM 0 H5'' U A 19 5.006 -1.714 -8.057 1.00 0.22 H new ATOM 0 H4' U A 19 3.579 -3.515 -8.883 1.00 0.19 H new ATOM 0 H3' U A 19 2.302 -1.037 -7.739 1.00 0.19 H new ATOM 0 H2' U A 19 0.153 -1.898 -7.657 1.00 0.25 H new ATOM 0 HO2' U A 19 0.048 -2.528 -9.819 1.00 0.40 H new ATOM 0 H1' U A 19 0.682 -4.657 -7.254 1.00 0.19 H new ATOM 0 H3 U A 19 -2.005 -3.775 -3.682 1.00 0.16 H new ATOM 0 H5 U A 19 1.680 -1.907 -2.726 1.00 0.19 H new ATOM 0 H6 U A 19 2.442 -2.431 -4.929 1.00 0.19 H new ATOM 525 P U A 20 1.689 -0.131 -10.211 1.00 0.29 P ATOM 526 OP1 U A 20 2.253 0.158 -11.546 1.00 0.44 O ATOM 527 OP2 U A 20 1.810 0.925 -9.175 1.00 0.37 O ATOM 528 O5' U A 20 0.164 -0.558 -10.399 1.00 0.22 O ATOM 529 C5' U A 20 -0.882 0.406 -10.281 1.00 0.24 C ATOM 530 C4' U A 20 -2.285 -0.202 -10.545 1.00 0.19 C ATOM 531 O4' U A 20 -2.524 -1.403 -9.724 1.00 0.18 O ATOM 532 C3' U A 20 -3.423 0.758 -10.158 1.00 0.19 C ATOM 533 O3' U A 20 -3.782 1.635 -11.236 1.00 0.23 O ATOM 534 C2' U A 20 -4.553 -0.170 -9.694 1.00 0.21 C ATOM 535 O2' U A 20 -5.305 -0.716 -10.780 1.00 0.26 O ATOM 536 C1' U A 20 -3.739 -1.268 -8.963 1.00 0.20 C ATOM 537 N1 U A 20 -3.432 -1.033 -7.494 1.00 0.17 N ATOM 538 C2 U A 20 -4.514 -1.117 -6.553 1.00 0.18 C ATOM 539 O2 U A 20 -5.695 -1.350 -6.829 1.00 0.23 O ATOM 540 N3 U A 20 -4.134 -0.904 -5.216 1.00 0.16 N ATOM 541 C4 U A 20 -2.839 -0.634 -4.729 1.00 0.17 C ATOM 542 O4 U A 20 -2.635 -0.472 -3.528 1.00 0.18 O ATOM 543 C5 U A 20 -1.814 -0.568 -5.737 1.00 0.21 C ATOM 544 C6 U A 20 -2.135 -0.761 -7.029 1.00 0.19 C ATOM 0 H5' U A 20 -0.704 1.219 -10.985 1.00 0.24 H new ATOM 0 H5'' U A 20 -0.860 0.840 -9.281 1.00 0.24 H new ATOM 0 H4' U A 20 -2.287 -0.422 -11.613 1.00 0.19 H new ATOM 0 H3' U A 20 -3.144 1.455 -9.368 1.00 0.19 H new ATOM 0 H2' U A 20 -5.309 0.329 -9.087 1.00 0.21 H new ATOM 0 HO2' U A 20 -5.178 -0.161 -11.578 1.00 0.26 H new ATOM 0 H1' U A 20 -4.350 -2.170 -8.924 1.00 0.20 H new ATOM 0 H3 U A 20 -4.879 -0.950 -4.521 1.00 0.16 H new ATOM 0 H5 U A 20 -0.791 -0.364 -5.457 1.00 0.21 H new ATOM 0 H6 U A 20 -1.341 -0.703 -7.759 1.00 0.19 H new ATOM 555 P U A 21 -4.174 3.159 -10.992 1.00 0.28 P ATOM 556 OP1 U A 21 -3.855 3.925 -12.213 1.00 0.40 O ATOM 557 OP2 U A 21 -3.577 3.639 -9.718 1.00 0.34 O ATOM 558 O5' U A 21 -5.757 3.064 -10.850 1.00 0.30 O ATOM 559 C5' U A 21 -6.493 4.088 -10.176 1.00 0.30 C ATOM 560 C4' U A 21 -7.831 3.567 -9.584 1.00 0.23 C ATOM 561 O4' U A 21 -7.656 2.254 -8.931 1.00 0.20 O ATOM 562 C3' U A 21 -8.379 4.478 -8.462 1.00 0.21 C ATOM 563 O3' U A 21 -9.098 5.633 -8.896 1.00 0.28 O ATOM 564 C2' U A 21 -9.026 3.505 -7.450 1.00 0.20 C ATOM 565 O2' U A 21 -10.336 3.050 -7.798 1.00 0.27 O ATOM 566 C1' U A 21 -8.029 2.319 -7.544 1.00 0.18 C ATOM 567 N1 U A 21 -6.801 2.361 -6.646 1.00 0.17 N ATOM 568 C2 U A 21 -6.998 2.265 -5.229 1.00 0.17 C ATOM 569 O2 U A 21 -8.093 2.157 -4.670 1.00 0.22 O ATOM 570 N3 U A 21 -5.807 2.294 -4.473 1.00 0.18 N ATOM 571 C4 U A 21 -4.491 2.416 -4.961 1.00 0.20 C ATOM 572 O4 U A 21 -3.530 2.441 -4.193 1.00 0.23 O ATOM 573 C5 U A 21 -4.386 2.505 -6.396 1.00 0.20 C ATOM 574 C6 U A 21 -5.497 2.475 -7.151 1.00 0.19 C ATOM 0 H5' U A 21 -6.700 4.901 -10.872 1.00 0.30 H new ATOM 0 H5'' U A 21 -5.882 4.503 -9.374 1.00 0.30 H new ATOM 0 H4' U A 21 -8.509 3.528 -10.437 1.00 0.23 H new ATOM 0 H3' U A 21 -7.600 5.041 -7.947 1.00 0.21 H new ATOM 0 H2' U A 21 -9.173 3.966 -6.473 1.00 0.20 H new ATOM 0 HO2' U A 21 -10.666 2.441 -7.105 1.00 0.27 H new ATOM 0 H1' U A 21 -8.535 1.429 -7.169 1.00 0.18 H new ATOM 0 H3 U A 21 -5.910 2.218 -3.461 1.00 0.18 H new ATOM 0 H5 U A 21 -3.416 2.596 -6.863 1.00 0.20 H new ATOM 0 H6 U A 21 -5.378 2.543 -8.222 1.00 0.19 H new ATOM 585 P A A 22 -10.576 5.840 -9.417 1.00 0.27 P ATOM 586 OP1 A A 22 -11.012 4.595 -10.090 1.00 0.34 O ATOM 587 OP2 A A 22 -10.649 7.094 -10.199 1.00 0.37 O ATOM 588 O5' A A 22 -11.422 5.977 -8.087 1.00 0.22 O ATOM 589 C5' A A 22 -11.303 7.077 -7.195 1.00 0.22 C ATOM 590 C4' A A 22 -11.915 6.717 -5.826 1.00 0.18 C ATOM 591 O4' A A 22 -11.195 5.585 -5.222 1.00 0.22 O ATOM 592 C3' A A 22 -11.804 7.850 -4.793 1.00 0.21 C ATOM 593 O3' A A 22 -12.903 8.769 -4.893 1.00 0.30 O ATOM 594 C2' A A 22 -11.719 7.096 -3.456 1.00 0.21 C ATOM 595 O2' A A 22 -12.997 6.734 -2.930 1.00 0.29 O ATOM 596 C1' A A 22 -10.921 5.837 -3.842 1.00 0.19 C ATOM 597 N9 A A 22 -9.443 5.910 -3.643 1.00 0.19 N ATOM 598 C8 A A 22 -8.438 6.036 -4.570 1.00 0.20 C ATOM 599 N7 A A 22 -7.227 6.065 -4.066 1.00 0.22 N ATOM 600 C5 A A 22 -7.432 5.959 -2.708 1.00 0.22 C ATOM 601 C6 A A 22 -6.508 5.936 -1.643 1.00 0.27 C ATOM 602 N6 A A 22 -5.163 6.023 -1.869 1.00 0.30 N ATOM 603 N1 A A 22 -7.058 5.810 -0.402 1.00 0.28 N ATOM 604 C2 A A 22 -8.381 5.720 -0.247 1.00 0.26 C ATOM 605 N3 A A 22 -9.328 5.728 -1.172 1.00 0.23 N ATOM 606 C4 A A 22 -8.783 5.857 -2.408 1.00 0.21 C ATOM 0 H5' A A 22 -11.809 7.949 -7.610 1.00 0.22 H new ATOM 0 H5'' A A 22 -10.253 7.345 -7.074 1.00 0.22 H new ATOM 0 H4' A A 22 -12.961 6.497 -6.039 1.00 0.18 H new ATOM 0 H3' A A 22 -10.940 8.499 -4.935 1.00 0.21 H new ATOM 0 H2' A A 22 -11.268 7.702 -2.670 1.00 0.21 H new ATOM 0 HO2' A A 22 -13.682 7.333 -3.294 1.00 0.29 H new ATOM 0 H1' A A 22 -11.244 5.041 -3.171 1.00 0.19 H new ATOM 0 H8 A A 22 -8.629 6.106 -5.631 1.00 0.20 H new ATOM 0 H61 A A 22 -4.512 6.004 -1.084 1.00 0.30 H new ATOM 0 H62 A A 22 -4.810 6.106 -2.822 1.00 0.30 H new ATOM 0 H2 A A 22 -8.726 5.628 0.772 1.00 0.26 H new ATOM 618 P G A 23 -12.848 10.234 -4.275 1.00 0.34 P ATOM 619 OP1 G A 23 -14.027 10.988 -4.754 1.00 0.47 O ATOM 620 OP2 G A 23 -11.510 10.826 -4.527 1.00 0.36 O ATOM 621 O5' G A 23 -13.043 9.909 -2.728 1.00 0.33 O ATOM 622 C5' G A 23 -12.503 10.769 -1.730 1.00 0.34 C ATOM 623 C4' G A 23 -12.575 10.128 -0.326 1.00 0.27 C ATOM 624 O4' G A 23 -11.793 8.882 -0.268 1.00 0.20 O ATOM 625 C3' G A 23 -11.967 11.039 0.752 1.00 0.29 C ATOM 626 O3' G A 23 -12.970 11.893 1.323 1.00 0.45 O ATOM 627 C2' G A 23 -11.318 10.069 1.750 1.00 0.21 C ATOM 628 O2' G A 23 -12.236 9.620 2.747 1.00 0.28 O ATOM 629 C1' G A 23 -10.877 8.897 0.839 1.00 0.19 C ATOM 630 N9 G A 23 -9.476 8.938 0.309 1.00 0.19 N ATOM 631 C8 G A 23 -9.047 9.030 -0.988 1.00 0.20 C ATOM 632 N7 G A 23 -7.745 9.022 -1.134 1.00 0.21 N ATOM 633 C5 G A 23 -7.256 8.912 0.143 1.00 0.20 C ATOM 634 C6 G A 23 -5.920 8.853 0.572 1.00 0.22 C ATOM 635 O6 G A 23 -4.925 8.895 -0.159 1.00 0.25 O ATOM 636 N1 G A 23 -5.830 8.736 1.979 1.00 0.21 N ATOM 637 C2 G A 23 -6.904 8.680 2.871 1.00 0.21 C ATOM 638 N2 G A 23 -6.526 8.574 4.167 1.00 0.23 N ATOM 639 N3 G A 23 -8.177 8.732 2.424 1.00 0.20 N ATOM 640 C4 G A 23 -8.296 8.849 1.072 1.00 0.18 C ATOM 0 H5' G A 23 -13.049 11.713 -1.728 1.00 0.34 H new ATOM 0 H5'' G A 23 -11.466 11.001 -1.972 1.00 0.34 H new ATOM 0 H4' G A 23 -13.635 9.952 -0.143 1.00 0.27 H new ATOM 0 H3' G A 23 -11.223 11.737 0.368 1.00 0.29 H new ATOM 0 H2' G A 23 -10.504 10.527 2.312 1.00 0.21 H new ATOM 0 HO2' G A 23 -12.940 10.291 2.870 1.00 0.28 H new ATOM 0 H1' G A 23 -10.892 8.001 1.459 1.00 0.19 H new ATOM 0 H8 G A 23 -9.727 9.103 -1.824 1.00 0.20 H new ATOM 0 H1 G A 23 -4.893 8.688 2.380 1.00 0.21 H new ATOM 0 H21 G A 23 -7.232 8.526 4.902 1.00 0.23 H new ATOM 0 H22 G A 23 -5.535 8.543 4.408 1.00 0.23 H new ATOM 652 P U A 24 -12.722 13.419 1.677 1.00 0.64 P ATOM 653 OP1 U A 24 -14.034 14.066 1.905 1.00 0.93 O ATOM 654 OP2 U A 24 -11.837 14.026 0.650 1.00 0.86 O ATOM 655 O5' U A 24 -11.975 13.282 3.073 1.00 0.42 O ATOM 656 C5' U A 24 -10.928 14.166 3.472 1.00 0.44 C ATOM 657 C4' U A 24 -9.967 13.474 4.463 1.00 0.31 C ATOM 658 O4' U A 24 -9.340 12.307 3.835 1.00 0.31 O ATOM 659 C3' U A 24 -8.790 14.356 4.893 1.00 0.41 C ATOM 660 O3' U A 24 -9.143 15.199 6.003 1.00 0.54 O ATOM 661 C2' U A 24 -7.681 13.338 5.205 1.00 0.37 C ATOM 662 O2' U A 24 -7.764 12.838 6.542 1.00 0.45 O ATOM 663 C1' U A 24 -7.951 12.206 4.173 1.00 0.27 C ATOM 664 N1 U A 24 -7.084 12.176 2.919 1.00 0.20 N ATOM 665 C2 U A 24 -5.662 11.997 3.077 1.00 0.17 C ATOM 666 O2 U A 24 -5.072 11.880 4.155 1.00 0.24 O ATOM 667 N3 U A 24 -4.938 11.955 1.868 1.00 0.19 N ATOM 668 C4 U A 24 -5.457 12.063 0.561 1.00 0.23 C ATOM 669 O4 U A 24 -4.706 12.017 -0.416 1.00 0.30 O ATOM 670 C5 U A 24 -6.892 12.233 0.491 1.00 0.25 C ATOM 671 C6 U A 24 -7.623 12.276 1.623 1.00 0.23 C ATOM 0 H5' U A 24 -11.355 15.056 3.935 1.00 0.44 H new ATOM 0 H5'' U A 24 -10.374 14.498 2.594 1.00 0.44 H new ATOM 0 H4' U A 24 -10.591 13.226 5.322 1.00 0.31 H new ATOM 0 H3' U A 24 -8.470 15.069 4.133 1.00 0.41 H new ATOM 0 H2' U A 24 -6.684 13.773 5.133 1.00 0.37 H new ATOM 0 HO2' U A 24 -8.333 13.429 7.078 1.00 0.45 H new ATOM 0 H1' U A 24 -7.677 11.265 4.650 1.00 0.27 H new ATOM 0 H3 U A 24 -3.928 11.833 1.947 1.00 0.19 H new ATOM 0 H5 U A 24 -7.378 12.326 -0.469 1.00 0.25 H new ATOM 0 H6 U A 24 -8.692 12.395 1.529 1.00 0.23 H new ATOM 682 P C A 25 -8.589 16.677 6.190 1.00 0.58 P ATOM 683 OP1 C A 25 -9.379 17.342 7.251 1.00 0.75 O ATOM 684 OP2 C A 25 -8.532 17.343 4.864 1.00 0.62 O ATOM 685 O5' C A 25 -7.122 16.391 6.743 1.00 0.49 O ATOM 686 C5' C A 25 -5.993 17.174 6.355 1.00 0.47 C ATOM 687 C4' C A 25 -4.663 16.393 6.501 1.00 0.36 C ATOM 688 O4' C A 25 -4.614 15.271 5.562 1.00 0.31 O ATOM 689 C3' C A 25 -3.427 17.222 6.132 1.00 0.35 C ATOM 690 O3' C A 25 -2.975 18.027 7.224 1.00 0.49 O ATOM 691 C2' C A 25 -2.395 16.167 5.714 1.00 0.35 C ATOM 692 O2' C A 25 -1.663 15.641 6.823 1.00 0.50 O ATOM 693 C1' C A 25 -3.275 15.061 5.070 1.00 0.30 C ATOM 694 N1 C A 25 -3.248 14.985 3.553 1.00 0.27 N ATOM 695 C2 C A 25 -2.005 14.634 2.895 1.00 0.27 C ATOM 696 O2 C A 25 -0.952 14.411 3.522 1.00 0.31 O ATOM 697 N3 C A 25 -1.992 14.556 1.521 1.00 0.28 N ATOM 698 C4 C A 25 -3.097 14.789 0.784 1.00 0.30 C ATOM 699 N4 C A 25 -3.060 14.714 -0.570 1.00 0.35 N ATOM 700 C5 C A 25 -4.339 15.135 1.420 1.00 0.32 C ATOM 701 C6 C A 25 -4.374 15.218 2.758 1.00 0.30 C ATOM 0 H5' C A 25 -5.952 18.076 6.965 1.00 0.47 H new ATOM 0 H5'' C A 25 -6.113 17.494 5.320 1.00 0.47 H new ATOM 0 H4' C A 25 -4.643 16.094 7.549 1.00 0.36 H new ATOM 0 H3' C A 25 -3.625 17.943 5.339 1.00 0.35 H new ATOM 0 H2' C A 25 -1.634 16.578 5.051 1.00 0.35 H new ATOM 0 HO2' C A 25 -1.788 16.222 7.602 1.00 0.50 H new ATOM 0 H1' C A 25 -2.863 14.095 5.360 1.00 0.30 H new ATOM 0 H41 C A 25 -3.904 14.893 -1.114 1.00 0.35 H new ATOM 0 H42 C A 25 -2.188 14.479 -1.044 1.00 0.35 H new ATOM 0 H5 C A 25 -5.225 15.324 0.833 1.00 0.32 H new ATOM 0 H6 C A 25 -5.306 15.474 3.239 1.00 0.30 H new ATOM 713 P C A 26 -3.113 19.604 7.306 1.00 0.59 P ATOM 714 OP1 C A 26 -3.557 19.958 8.671 1.00 0.82 O ATOM 715 OP2 C A 26 -3.931 20.108 6.177 1.00 0.67 O ATOM 716 O5' C A 26 -1.633 20.112 7.082 1.00 0.61 O ATOM 717 C5' C A 26 -0.556 19.859 7.983 1.00 0.69 C ATOM 718 C4' C A 26 0.785 19.644 7.240 1.00 0.61 C ATOM 719 O4' C A 26 0.715 18.457 6.385 1.00 0.56 O ATOM 720 C3' C A 26 1.179 20.775 6.288 1.00 0.56 C ATOM 721 O3' C A 26 1.840 21.850 6.961 1.00 0.61 O ATOM 722 C2' C A 26 2.040 20.095 5.222 1.00 0.53 C ATOM 723 O2' C A 26 3.419 20.023 5.591 1.00 0.61 O ATOM 724 C1' C A 26 1.418 18.674 5.148 1.00 0.49 C ATOM 725 N1 C A 26 0.477 18.435 3.987 1.00 0.40 N ATOM 726 C2 C A 26 0.929 17.641 2.871 1.00 0.36 C ATOM 727 O2 C A 26 2.071 17.145 2.820 1.00 0.45 O ATOM 728 N3 C A 26 0.058 17.432 1.826 1.00 0.34 N ATOM 729 C4 C A 26 -1.188 17.953 1.821 1.00 0.33 C ATOM 730 N4 C A 26 -2.026 17.745 0.776 1.00 0.35 N ATOM 731 C5 C A 26 -1.648 18.748 2.923 1.00 0.41 C ATOM 732 C6 C A 26 -0.813 18.961 3.949 1.00 0.44 C ATOM 0 H5' C A 26 -0.784 18.977 8.582 1.00 0.69 H new ATOM 0 H5'' C A 26 -0.457 20.696 8.674 1.00 0.69 H new ATOM 0 H4' C A 26 1.514 19.569 8.047 1.00 0.61 H new ATOM 0 H3' C A 26 0.313 21.263 5.841 1.00 0.56 H new ATOM 0 H2' C A 26 2.039 20.638 4.277 1.00 0.53 H new ATOM 0 HO2' C A 26 3.614 20.710 6.262 1.00 0.61 H new ATOM 0 HO3' C A 26 2.074 22.547 6.313 1.00 0.61 H new ATOM 0 H1' C A 26 2.238 17.974 4.986 1.00 0.49 H new ATOM 0 H41 C A 26 -2.964 18.145 0.787 1.00 0.35 H new ATOM 0 H42 C A 26 -1.718 17.188 -0.021 1.00 0.35 H new ATOM 0 H5 C A 26 -2.644 19.165 2.926 1.00 0.41 H new ATOM 0 H6 C A 26 -1.153 19.563 4.778 1.00 0.44 H new TER 745 C A 26 HETATM 746 C4 BDR A 29 2.423 -1.870 1.043 1.00 0.17 C HETATM 747 O BDR A 29 1.213 -1.761 0.299 1.00 0.19 O HETATM 748 C1 BDR A 29 1.101 -0.425 -0.192 1.00 0.19 C HETATM 749 C2 BDR A 29 2.397 0.286 0.215 1.00 0.23 C HETATM 750 O2 BDR A 29 3.417 0.049 -0.761 1.00 0.30 O HETATM 751 C3 BDR A 29 2.668 -0.446 1.516 1.00 0.19 C HETATM 752 O3 BDR A 29 4.007 -0.388 2.013 1.00 0.21 O HETATM 753 C5 BDR A 29 2.277 -2.898 2.164 1.00 0.21 C HETATM 754 O5 BDR A 29 2.091 -4.230 1.681 1.00 0.26 O HETATM 0 HO2 BDR A 29 4.261 -0.157 -0.308 1.00 0.30 H new HETATM 0 H52 BDR A 29 3.165 -2.867 2.795 1.00 0.21 H new HETATM 0 H51 BDR A 29 1.430 -2.624 2.792 1.00 0.21 H new HETATM 0 H5 BDR A 29 2.353 -4.276 0.738 1.00 0.26 H new HETATM 0 H4 BDR A 29 3.276 -2.240 0.474 1.00 0.17 H new HETATM 0 H3 BDR A 29 2.074 -0.035 2.332 1.00 0.19 H new HETATM 0 H2 BDR A 29 2.352 1.372 0.303 1.00 0.23 H new HETATM 763 C5 IDG A 30 3.623 1.725 4.951 1.00 0.21 C HETATM 764 O5 IDG A 30 3.399 0.639 4.031 1.00 0.19 O HETATM 765 C1 IDG A 30 4.286 0.640 2.920 1.00 0.20 C HETATM 766 C2 IDG A 30 5.740 0.515 3.395 1.00 0.24 C HETATM 767 N2 IDG A 30 5.991 -0.855 3.915 1.00 0.28 N HETATM 768 C3 IDG A 30 6.066 1.586 4.441 1.00 0.26 C HETATM 769 O3 IDG A 30 6.121 2.862 3.817 1.00 0.27 O HETATM 770 C4 IDG A 30 5.018 1.605 5.558 1.00 0.24 C HETATM 771 O4 IDG A 30 5.107 0.420 6.339 1.00 0.28 O HETATM 772 C6 IDG A 30 2.514 1.697 5.988 1.00 0.25 C HETATM 773 N6 IDG A 30 1.225 2.164 5.431 1.00 0.29 N HETATM 0 HN62 IDG A 30 0.395 2.195 6.023 1.00 0.29 H new HETATM 0 HN61 IDG A 30 1.167 2.455 4.455 1.00 0.29 H new HETATM 0 HN22 IDG A 30 6.914 -1.104 4.272 1.00 0.28 H new HETATM 0 HN21 IDG A 30 5.241 -1.546 3.915 1.00 0.28 H new HETATM 0 HO4 IDG A 30 6.005 0.349 6.724 1.00 0.28 H new HETATM 0 HO3 IDG A 30 5.740 3.536 4.418 1.00 0.27 H new HETATM 0 H62 IDG A 30 2.399 0.682 6.369 1.00 0.25 H new HETATM 0 H61 IDG A 30 2.792 2.325 6.834 1.00 0.25 H new HETATM 0 H5 IDG A 30 3.591 2.692 4.449 1.00 0.21 H new HETATM 0 H4 IDG A 30 5.205 2.463 6.204 1.00 0.24 H new HETATM 0 H3 IDG A 30 7.033 1.348 4.883 1.00 0.26 H new HETATM 0 H2 IDG A 30 6.404 0.680 2.547 1.00 0.24 H new HETATM 789 C5 BDG A 27 -3.661 -2.693 2.947 1.00 0.20 C HETATM 790 O5 BDG A 27 -2.454 -1.904 2.929 1.00 0.17 O HETATM 791 C1 BDG A 27 -1.605 -2.145 1.810 1.00 0.14 C HETATM 792 C2 BDG A 27 -1.205 -3.617 1.745 1.00 0.15 C HETATM 793 N2 BDG A 27 -0.401 -3.877 0.527 1.00 0.16 N HETATM 794 C3 BDG A 27 -2.447 -4.498 1.727 1.00 0.18 C HETATM 795 O3 BDG A 27 -2.062 -5.864 1.745 1.00 0.21 O HETATM 796 C4 BDG A 27 -3.316 -4.181 2.942 1.00 0.22 C HETATM 797 O4 BDG A 27 -4.511 -4.950 2.896 1.00 0.29 O HETATM 798 C6 BDG A 27 -4.452 -2.283 4.177 1.00 0.25 C HETATM 799 N6 BDG A 27 -5.036 -0.931 4.022 1.00 0.29 N HETATM 0 HN62 BDG A 27 -5.594 -0.527 4.774 1.00 0.29 H new HETATM 0 HN61 BDG A 27 -4.880 -0.403 3.163 1.00 0.29 H new HETATM 0 HN22 BDG A 27 -0.054 -4.817 0.336 1.00 0.16 H new HETATM 0 HN21 BDG A 27 -0.194 -3.116 -0.120 1.00 0.16 H new HETATM 0 HO4 BDG A 27 -4.286 -5.904 2.891 1.00 0.29 H new HETATM 0 HO3 BDG A 27 -2.174 -6.224 2.650 1.00 0.21 H new HETATM 0 H62 BDG A 27 -5.248 -3.006 4.356 1.00 0.25 H new HETATM 0 H61 BDG A 27 -3.802 -2.301 5.052 1.00 0.25 H new HETATM 0 H5 BDG A 27 -4.267 -2.517 2.058 1.00 0.20 H new HETATM 0 H4 BDG A 27 -2.768 -4.430 3.851 1.00 0.22 H new HETATM 0 H3 BDG A 27 -3.019 -4.303 0.820 1.00 0.18 H new HETATM 0 H2 BDG A 27 -0.608 -3.851 2.627 1.00 0.15 H new HETATM 815 C1 NEB A 28 -2.783 1.981 -1.314 1.00 0.22 C HETATM 816 N1 NEB A 28 -3.009 3.432 -1.506 1.00 0.27 N HETATM 817 C2 NEB A 28 -3.942 1.372 -0.533 1.00 0.22 C HETATM 818 C3 NEB A 28 -3.722 -0.120 -0.326 1.00 0.18 C HETATM 819 N3 NEB A 28 -4.859 -0.639 0.421 1.00 0.20 N HETATM 820 C4 NEB A 28 -2.419 -0.350 0.436 1.00 0.16 C HETATM 821 O4 NEB A 28 -2.204 -1.765 0.603 1.00 0.15 O HETATM 822 C5 NEB A 28 -1.231 0.261 -0.320 1.00 0.17 C HETATM 823 O5 NEB A 28 -0.037 0.119 0.473 1.00 0.17 O HETATM 824 C6 NEB A 28 -1.452 1.745 -0.602 1.00 0.22 C HETATM 825 O6 NEB A 28 -0.390 2.238 -1.408 1.00 0.27 O HETATM 0 HO6 NEB A 28 0.464 2.088 -0.951 1.00 0.27 H new HETATM 0 H6 NEB A 28 -1.475 2.274 0.351 1.00 0.22 H new HETATM 0 H5 NEB A 28 -1.132 -0.265 -1.270 1.00 0.17 H new HETATM 0 H4 NEB A 28 -2.497 0.132 1.410 1.00 0.16 H new HETATM 0 H32 NEB A 28 -4.901 -1.629 0.663 1.00 0.20 H new HETATM 0 H31 NEB A 28 -5.613 -0.013 0.702 1.00 0.20 H new HETATM 0 H3 NEB A 28 -3.643 -0.637 -1.283 1.00 0.18 H new HETATM 0 H22 NEB A 28 -4.038 1.869 0.433 1.00 0.22 H new HETATM 0 H21 NEB A 28 -4.876 1.536 -1.070 1.00 0.22 H new HETATM 0 H13 NEB A 28 -2.174 3.856 -1.909 1.00 0.27 H new HETATM 0 H12 NEB A 28 -3.799 3.573 -2.135 1.00 0.27 H new HETATM 0 H11 NEB A 28 -3.210 3.867 -0.606 1.00 0.27 H new HETATM 0 H1 NEB A 28 -2.735 1.493 -2.287 1.00 0.22 H new