USER MOD reduce.3.24.130724 H: found=0, std=0, add=137, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 137 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 Set 1.1: A 5 DT C7 :methyl -30:sc= -4.94! (180deg=-11.7!) USER MOD Set 1.2: A 6 DT C7 :methyl -30:sc= -0.0768 (180deg=-0.336) USER MOD Single : A 1 G O2' : rot 180:sc= -1.6 USER MOD Single : A 1 G O5' : rot 180:sc= -0.0284 USER MOD Single : A 2 G O2' : rot -2:sc= -1.39! USER MOD Single : A 3 A O2' : rot -97:sc= 0.866 USER MOD Single : A 4 C O2' : rot -8:sc= 0.207 USER MOD Single : A 10 DT C7 :methyl -30:sc= -0.238 (180deg=-1.66!) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 8.544 4.285 6.179 1.00 0.00 O ATOM 2 C5' G A 1 9.606 3.462 6.694 1.00 0.00 C ATOM 3 C4' G A 1 9.112 2.372 7.636 1.00 0.00 C ATOM 4 O4' G A 1 8.444 2.929 8.790 1.00 0.00 O ATOM 5 C3' G A 1 8.106 1.467 6.956 1.00 0.00 C ATOM 6 O3' G A 1 8.748 0.344 6.326 1.00 0.00 O ATOM 7 C2' G A 1 7.182 1.031 8.056 1.00 0.00 C ATOM 8 O2' G A 1 7.525 -0.271 8.554 1.00 0.00 O ATOM 9 C1' G A 1 7.318 2.082 9.138 1.00 0.00 C ATOM 10 N9 G A 1 6.070 2.847 9.240 1.00 0.00 N ATOM 11 C8 G A 1 5.810 4.130 8.913 1.00 0.00 C ATOM 12 N7 G A 1 4.604 4.559 9.088 1.00 0.00 N ATOM 13 C5 G A 1 3.969 3.417 9.597 1.00 0.00 C ATOM 14 C6 G A 1 2.621 3.214 9.998 1.00 0.00 C ATOM 15 O6 G A 1 1.690 4.015 9.996 1.00 0.00 O ATOM 16 N1 G A 1 2.414 1.919 10.442 1.00 0.00 N ATOM 17 C2 G A 1 3.371 0.937 10.500 1.00 0.00 C ATOM 18 N2 G A 1 2.978 -0.244 10.950 1.00 0.00 N ATOM 19 N3 G A 1 4.634 1.113 10.131 1.00 0.00 N ATOM 20 C4 G A 1 4.867 2.368 9.691 1.00 0.00 C ATOM 0 H5' G A 1 10.323 4.092 7.221 1.00 0.00 H new ATOM 0 H5'' G A 1 10.137 3.001 5.861 1.00 0.00 H new ATOM 0 H4' G A 1 10.000 1.815 7.934 1.00 0.00 H new ATOM 0 H3' G A 1 7.572 1.977 6.154 1.00 0.00 H new ATOM 0 H2' G A 1 6.156 0.947 7.699 1.00 0.00 H new ATOM 0 HO2' G A 1 6.903 -0.522 9.269 1.00 0.00 H new ATOM 0 HO5' G A 1 8.918 4.967 5.583 1.00 0.00 H new ATOM 0 H1' G A 1 7.499 1.629 10.113 1.00 0.00 H new ATOM 0 H8 G A 1 6.582 4.775 8.519 1.00 0.00 H new ATOM 0 H1 G A 1 1.473 1.675 10.751 1.00 0.00 H new ATOM 0 H21 G A 1 3.645 -1.013 11.016 1.00 0.00 H new ATOM 0 H22 G A 1 2.008 -0.385 11.231 1.00 0.00 H new ATOM 33 P G A 2 7.898 -0.685 5.417 1.00 0.00 P ATOM 34 OP1 G A 2 8.846 -1.483 4.609 1.00 0.00 O ATOM 35 OP2 G A 2 6.808 0.064 4.752 1.00 0.00 O ATOM 36 O5' G A 2 7.234 -1.654 6.533 1.00 0.00 O ATOM 37 C5' G A 2 7.931 -2.828 7.009 1.00 0.00 C ATOM 38 C4' G A 2 6.997 -3.857 7.630 1.00 0.00 C ATOM 39 O4' G A 2 6.334 -3.336 8.811 1.00 0.00 O ATOM 40 C3' G A 2 5.898 -4.236 6.661 1.00 0.00 C ATOM 41 O3' G A 2 6.267 -5.327 5.812 1.00 0.00 O ATOM 42 C2' G A 2 4.753 -4.582 7.552 1.00 0.00 C ATOM 43 O2' G A 2 4.845 -5.943 7.993 1.00 0.00 O ATOM 44 C1' G A 2 4.910 -3.625 8.710 1.00 0.00 C ATOM 45 N9 G A 2 4.187 -2.382 8.420 1.00 0.00 N ATOM 46 C8 G A 2 4.683 -1.236 7.924 1.00 0.00 C ATOM 47 N7 G A 2 3.870 -0.267 7.711 1.00 0.00 N ATOM 48 C5 G A 2 2.657 -0.825 8.114 1.00 0.00 C ATOM 49 C6 G A 2 1.363 -0.259 8.124 1.00 0.00 C ATOM 50 O6 G A 2 1.024 0.867 7.781 1.00 0.00 O ATOM 51 N1 G A 2 0.423 -1.153 8.599 1.00 0.00 N ATOM 52 C2 G A 2 0.683 -2.435 9.017 1.00 0.00 C ATOM 53 N2 G A 2 -0.362 -3.138 9.429 1.00 0.00 N ATOM 54 N3 G A 2 1.899 -2.985 9.017 1.00 0.00 N ATOM 55 C4 G A 2 2.839 -2.129 8.553 1.00 0.00 C ATOM 0 H5' G A 2 8.676 -2.529 7.746 1.00 0.00 H new ATOM 0 H5'' G A 2 8.469 -3.287 6.180 1.00 0.00 H new ATOM 0 H4' G A 2 7.619 -4.714 7.886 1.00 0.00 H new ATOM 0 H3' G A 2 5.664 -3.431 5.964 1.00 0.00 H new ATOM 0 H2' G A 2 3.785 -4.495 7.059 1.00 0.00 H new ATOM 0 HO2' G A 2 5.625 -6.369 7.580 1.00 0.00 H new ATOM 0 H1' G A 2 4.517 -4.050 9.633 1.00 0.00 H new ATOM 0 H8 G A 2 5.737 -1.134 7.711 1.00 0.00 H new ATOM 0 H1 G A 2 -0.545 -0.834 8.643 1.00 0.00 H new ATOM 0 H21 G A 2 -0.236 -4.097 9.752 1.00 0.00 H new ATOM 0 H22 G A 2 -1.292 -2.720 9.423 1.00 0.00 H new ATOM 67 P A A 3 5.698 -5.384 4.305 1.00 0.00 P ATOM 68 OP1 A A 3 6.177 -6.635 3.673 1.00 0.00 O ATOM 69 OP2 A A 3 5.964 -4.079 3.657 1.00 0.00 O ATOM 70 O5' A A 3 4.109 -5.513 4.545 1.00 0.00 O ATOM 71 C5' A A 3 3.583 -6.624 5.279 1.00 0.00 C ATOM 72 C4' A A 3 2.155 -6.377 5.756 1.00 0.00 C ATOM 73 O4' A A 3 2.051 -5.218 6.613 1.00 0.00 O ATOM 74 C3' A A 3 1.226 -6.122 4.599 1.00 0.00 C ATOM 75 O3' A A 3 0.767 -7.352 4.022 1.00 0.00 O ATOM 76 C2' A A 3 0.114 -5.323 5.228 1.00 0.00 C ATOM 77 O2' A A 3 -0.888 -6.186 5.782 1.00 0.00 O ATOM 78 C1' A A 3 0.803 -4.531 6.315 1.00 0.00 C ATOM 79 N9 A A 3 1.052 -3.149 5.860 1.00 0.00 N ATOM 80 C8 A A 3 2.216 -2.545 5.523 1.00 0.00 C ATOM 81 N7 A A 3 2.167 -1.305 5.179 1.00 0.00 N ATOM 82 C5 A A 3 0.800 -1.035 5.292 1.00 0.00 C ATOM 83 C6 A A 3 0.042 0.117 5.072 1.00 0.00 C ATOM 84 N6 A A 3 0.576 1.274 4.689 1.00 0.00 N ATOM 85 N1 A A 3 -1.284 0.036 5.275 1.00 0.00 N ATOM 86 C2 A A 3 -1.837 -1.114 5.674 1.00 0.00 C ATOM 87 N3 A A 3 -1.212 -2.263 5.916 1.00 0.00 N ATOM 88 C4 A A 3 0.114 -2.153 5.704 1.00 0.00 C ATOM 0 H5' A A 3 4.222 -6.824 6.139 1.00 0.00 H new ATOM 0 H5'' A A 3 3.605 -7.515 4.651 1.00 0.00 H new ATOM 0 H4' A A 3 1.879 -7.280 6.301 1.00 0.00 H new ATOM 0 H3' A A 3 1.694 -5.595 3.768 1.00 0.00 H new ATOM 0 H2' A A 3 -0.403 -4.688 4.509 1.00 0.00 H new ATOM 0 HO2' A A 3 -1.624 -6.285 5.143 1.00 0.00 H new ATOM 0 H1' A A 3 0.183 -4.466 7.209 1.00 0.00 H new ATOM 0 H8 A A 3 3.152 -3.084 5.542 1.00 0.00 H new ATOM 0 H61 A A 3 -0.021 2.087 4.541 1.00 0.00 H new ATOM 0 H62 A A 3 1.583 1.347 4.543 1.00 0.00 H new ATOM 0 H2 A A 3 -2.908 -1.110 5.815 1.00 0.00 H new ATOM 100 P C A 4 0.979 -7.661 2.451 1.00 0.00 P ATOM 101 OP1 C A 4 1.287 -9.098 2.293 1.00 0.00 O ATOM 102 OP2 C A 4 1.896 -6.641 1.888 1.00 0.00 O ATOM 103 O5' C A 4 -0.491 -7.392 1.861 1.00 0.00 O ATOM 104 C5' C A 4 -1.632 -8.041 2.438 1.00 0.00 C ATOM 105 C4' C A 4 -2.794 -7.071 2.614 1.00 0.00 C ATOM 106 O4' C A 4 -2.437 -5.964 3.472 1.00 0.00 O ATOM 107 C3' C A 4 -3.192 -6.473 1.289 1.00 0.00 C ATOM 108 O3' C A 4 -4.181 -7.257 0.619 1.00 0.00 O ATOM 109 C2' C A 4 -3.700 -5.111 1.634 1.00 0.00 C ATOM 110 O2' C A 4 -5.113 -5.133 1.865 1.00 0.00 O ATOM 111 C1' C A 4 -2.951 -4.733 2.893 1.00 0.00 C ATOM 112 N1 C A 4 -1.857 -3.788 2.571 1.00 0.00 N ATOM 113 C2 C A 4 -2.172 -2.442 2.504 1.00 0.00 C ATOM 114 O2 C A 4 -3.323 -2.069 2.686 1.00 0.00 O ATOM 115 N3 C A 4 -1.181 -1.556 2.222 1.00 0.00 N ATOM 116 C4 C A 4 0.070 -1.971 2.013 1.00 0.00 C ATOM 117 N4 C A 4 1.012 -1.073 1.746 1.00 0.00 N ATOM 118 C5 C A 4 0.404 -3.360 2.076 1.00 0.00 C ATOM 119 C6 C A 4 -0.588 -4.229 2.356 1.00 0.00 C ATOM 0 H5' C A 4 -1.361 -8.465 3.405 1.00 0.00 H new ATOM 0 H5'' C A 4 -1.941 -8.870 1.801 1.00 0.00 H new ATOM 0 H4' C A 4 -3.609 -7.646 3.053 1.00 0.00 H new ATOM 0 H3' C A 4 -2.356 -6.436 0.591 1.00 0.00 H new ATOM 0 H2' C A 4 -3.540 -4.395 0.828 1.00 0.00 H new ATOM 0 HO2' C A 4 -5.471 -6.012 1.622 1.00 0.00 H new ATOM 0 H1' C A 4 -3.605 -4.231 3.606 1.00 0.00 H new ATOM 0 H41 C A 4 1.973 -1.375 1.584 1.00 0.00 H new ATOM 0 H42 C A 4 0.774 -0.082 1.703 1.00 0.00 H new ATOM 0 H5 C A 4 1.415 -3.701 1.905 1.00 0.00 H new ATOM 0 H6 C A 4 -0.373 -5.286 2.410 1.00 0.00 H new ATOM 131 P DT A 5 -4.209 -7.285 -0.989 1.00 0.00 P ATOM 132 OP1 DT A 5 -5.255 -8.240 -1.419 1.00 0.00 O ATOM 133 OP2 DT A 5 -2.820 -7.441 -1.477 1.00 0.00 O ATOM 134 O5' DT A 5 -4.700 -5.796 -1.346 1.00 0.00 O ATOM 135 C5' DT A 5 -6.086 -5.450 -1.263 1.00 0.00 C ATOM 136 C4' DT A 5 -6.312 -3.972 -1.552 1.00 0.00 C ATOM 137 O4' DT A 5 -5.625 -3.129 -0.588 1.00 0.00 O ATOM 138 C3' DT A 5 -5.781 -3.595 -2.921 1.00 0.00 C ATOM 139 O3' DT A 5 -6.782 -3.706 -3.944 1.00 0.00 O ATOM 140 C2' DT A 5 -5.334 -2.193 -2.741 1.00 0.00 C ATOM 141 C1' DT A 5 -4.963 -2.045 -1.295 1.00 0.00 C ATOM 142 N1 DT A 5 -3.500 -2.116 -1.144 1.00 0.00 N ATOM 143 C2 DT A 5 -2.807 -0.930 -1.001 1.00 0.00 C ATOM 144 O2 DT A 5 -3.371 0.157 -0.969 1.00 0.00 O ATOM 145 N3 DT A 5 -1.439 -1.038 -0.890 1.00 0.00 N ATOM 146 C4 DT A 5 -0.712 -2.208 -0.905 1.00 0.00 C ATOM 147 O4 DT A 5 0.510 -2.184 -0.803 1.00 0.00 O ATOM 148 C5 DT A 5 -1.519 -3.400 -1.054 1.00 0.00 C ATOM 149 C7 DT A 5 -0.845 -4.771 -1.051 1.00 0.00 C ATOM 150 C6 DT A 5 -2.861 -3.316 -1.169 1.00 0.00 C ATOM 0 H5' DT A 5 -6.462 -5.689 -0.268 1.00 0.00 H new ATOM 0 H5'' DT A 5 -6.655 -6.051 -1.972 1.00 0.00 H new ATOM 0 H4' DT A 5 -7.389 -3.815 -1.497 1.00 0.00 H new ATOM 0 H3' DT A 5 -4.983 -4.258 -3.255 1.00 0.00 H new ATOM 0 H2' DT A 5 -4.482 -1.972 -3.384 1.00 0.00 H new ATOM 0 H2'' DT A 5 -6.127 -1.496 -3.011 1.00 0.00 H new ATOM 0 H1' DT A 5 -5.277 -1.083 -0.891 1.00 0.00 H new ATOM 0 H3 DT A 5 -0.914 -0.170 -0.787 1.00 0.00 H new ATOM 0 H71 DT A 5 0.164 -4.681 -1.454 1.00 0.00 H new ATOM 0 H72 DT A 5 -0.796 -5.150 -0.030 1.00 0.00 H new ATOM 0 H73 DT A 5 -1.422 -5.461 -1.667 1.00 0.00 H new ATOM 0 H6 DT A 5 -3.440 -4.221 -1.283 1.00 0.00 H new ATOM 163 P DT A 6 -6.398 -4.280 -5.408 1.00 0.00 P ATOM 164 OP1 DT A 6 -7.640 -4.384 -6.206 1.00 0.00 O ATOM 165 OP2 DT A 6 -5.538 -5.474 -5.224 1.00 0.00 O ATOM 166 O5' DT A 6 -5.488 -3.097 -6.039 1.00 0.00 O ATOM 167 C5' DT A 6 -5.964 -1.739 -6.068 1.00 0.00 C ATOM 168 C4' DT A 6 -4.843 -0.723 -5.795 1.00 0.00 C ATOM 169 O4' DT A 6 -3.947 -1.203 -4.753 1.00 0.00 O ATOM 170 C3' DT A 6 -3.995 -0.458 -7.037 1.00 0.00 C ATOM 171 O3' DT A 6 -3.905 0.962 -7.269 1.00 0.00 O ATOM 172 C2' DT A 6 -2.655 -1.046 -6.715 1.00 0.00 C ATOM 173 C1' DT A 6 -2.583 -1.126 -5.218 1.00 0.00 C ATOM 174 N1 DT A 6 -1.804 -2.305 -4.791 1.00 0.00 N ATOM 175 C2 DT A 6 -0.517 -2.093 -4.327 1.00 0.00 C ATOM 176 O2 DT A 6 -0.022 -0.975 -4.248 1.00 0.00 O ATOM 177 N3 DT A 6 0.186 -3.213 -3.956 1.00 0.00 N ATOM 178 C4 DT A 6 -0.270 -4.512 -4.002 1.00 0.00 C ATOM 179 O4 DT A 6 0.456 -5.436 -3.649 1.00 0.00 O ATOM 180 C5 DT A 6 -1.625 -4.646 -4.496 1.00 0.00 C ATOM 181 C7 DT A 6 -2.262 -6.033 -4.591 1.00 0.00 C ATOM 182 C6 DT A 6 -2.336 -3.563 -4.868 1.00 0.00 C ATOM 0 H5' DT A 6 -6.752 -1.616 -5.325 1.00 0.00 H new ATOM 0 H5'' DT A 6 -6.409 -1.533 -7.041 1.00 0.00 H new ATOM 0 H4' DT A 6 -5.340 0.196 -5.485 1.00 0.00 H new ATOM 0 H3' DT A 6 -4.414 -0.896 -7.943 1.00 0.00 H new ATOM 0 H2' DT A 6 -2.545 -2.033 -7.164 1.00 0.00 H new ATOM 0 H2'' DT A 6 -1.852 -0.425 -7.111 1.00 0.00 H new ATOM 0 H1' DT A 6 -2.077 -0.257 -4.798 1.00 0.00 H new ATOM 0 H3 DT A 6 1.136 -3.069 -3.614 1.00 0.00 H new ATOM 0 H71 DT A 6 -1.487 -6.777 -4.775 1.00 0.00 H new ATOM 0 H72 DT A 6 -2.773 -6.264 -3.656 1.00 0.00 H new ATOM 0 H73 DT A 6 -2.981 -6.048 -5.410 1.00 0.00 H new ATOM 0 H6 DT A 6 -3.344 -3.691 -5.234 1.00 0.00 H new ATOM 195 P DC A 7 -2.975 1.591 -8.433 1.00 0.00 P ATOM 196 OP1 DC A 7 -3.687 2.755 -9.007 1.00 0.00 O ATOM 197 OP2 DC A 7 -2.516 0.497 -9.320 1.00 0.00 O ATOM 198 O5' DC A 7 -1.702 2.139 -7.608 1.00 0.00 O ATOM 199 C5' DC A 7 -1.835 3.264 -6.723 1.00 0.00 C ATOM 200 C4' DC A 7 -0.507 3.640 -6.067 1.00 0.00 C ATOM 201 O4' DC A 7 0.063 2.514 -5.350 1.00 0.00 O ATOM 202 C3' DC A 7 0.520 4.089 -7.105 1.00 0.00 C ATOM 203 O3' DC A 7 1.082 5.362 -6.754 1.00 0.00 O ATOM 204 C2' DC A 7 1.570 3.034 -7.086 1.00 0.00 C ATOM 205 C1' DC A 7 1.434 2.341 -5.760 1.00 0.00 C ATOM 206 N1 DC A 7 1.778 0.910 -5.852 1.00 0.00 N ATOM 207 C2 DC A 7 2.751 0.424 -4.987 1.00 0.00 C ATOM 208 O2 DC A 7 3.309 1.180 -4.190 1.00 0.00 O ATOM 209 N3 DC A 7 3.068 -0.895 -5.055 1.00 0.00 N ATOM 210 C4 DC A 7 2.461 -1.701 -5.930 1.00 0.00 C ATOM 211 N4 DC A 7 2.797 -2.984 -5.963 1.00 0.00 N ATOM 212 C5 DC A 7 1.461 -1.207 -6.822 1.00 0.00 C ATOM 213 C6 DC A 7 1.152 0.098 -6.750 1.00 0.00 C ATOM 0 H5' DC A 7 -2.568 3.032 -5.950 1.00 0.00 H new ATOM 0 H5'' DC A 7 -2.219 4.119 -7.280 1.00 0.00 H new ATOM 0 H4' DC A 7 -0.727 4.456 -5.378 1.00 0.00 H new ATOM 0 H3' DC A 7 0.073 4.211 -8.092 1.00 0.00 H new ATOM 0 H2' DC A 7 1.434 2.332 -7.909 1.00 0.00 H new ATOM 0 H2'' DC A 7 2.563 3.469 -7.199 1.00 0.00 H new ATOM 0 H1' DC A 7 2.124 2.769 -5.033 1.00 0.00 H new ATOM 0 H41 DC A 7 2.343 -3.613 -6.625 1.00 0.00 H new ATOM 0 H42 DC A 7 3.509 -3.341 -5.326 1.00 0.00 H new ATOM 0 H5 DC A 7 0.971 -1.860 -7.529 1.00 0.00 H new ATOM 0 H6 DC A 7 0.401 0.508 -7.409 1.00 0.00 H new ATOM 225 P DG A 8 0.535 6.725 -7.418 1.00 0.00 P ATOM 226 OP1 DG A 8 0.232 6.459 -8.844 1.00 0.00 O ATOM 227 OP2 DG A 8 1.470 7.816 -7.060 1.00 0.00 O ATOM 228 O5' DG A 8 -0.859 6.975 -6.644 1.00 0.00 O ATOM 229 C5' DG A 8 -0.891 7.579 -5.331 1.00 0.00 C ATOM 230 C4' DG A 8 -2.175 7.263 -4.576 1.00 0.00 C ATOM 231 O4' DG A 8 -2.363 5.828 -4.442 1.00 0.00 O ATOM 232 C3' DG A 8 -2.151 7.857 -3.166 1.00 0.00 C ATOM 233 O3' DG A 8 -3.327 8.659 -2.933 1.00 0.00 O ATOM 234 C2' DG A 8 -2.122 6.669 -2.257 1.00 0.00 C ATOM 235 C1' DG A 8 -2.657 5.520 -3.065 1.00 0.00 C ATOM 236 N9 DG A 8 -2.056 4.235 -2.654 1.00 0.00 N ATOM 237 C8 DG A 8 -2.658 3.133 -2.151 1.00 0.00 C ATOM 238 N7 DG A 8 -1.915 2.127 -1.855 1.00 0.00 N ATOM 239 C5 DG A 8 -0.647 2.593 -2.198 1.00 0.00 C ATOM 240 C6 DG A 8 0.613 1.946 -2.109 1.00 0.00 C ATOM 241 O6 DG A 8 0.865 0.819 -1.690 1.00 0.00 O ATOM 242 N1 DG A 8 1.634 2.763 -2.561 1.00 0.00 N ATOM 243 C2 DG A 8 1.472 4.046 -3.036 1.00 0.00 C ATOM 244 N2 DG A 8 2.573 4.670 -3.426 1.00 0.00 N ATOM 245 N3 DG A 8 0.298 4.668 -3.124 1.00 0.00 N ATOM 246 C4 DG A 8 -0.720 3.889 -2.691 1.00 0.00 C ATOM 0 H5' DG A 8 -0.787 8.660 -5.429 1.00 0.00 H new ATOM 0 H5'' DG A 8 -0.037 7.228 -4.752 1.00 0.00 H new ATOM 0 H4' DG A 8 -2.989 7.700 -5.154 1.00 0.00 H new ATOM 0 H3' DG A 8 -1.297 8.516 -3.006 1.00 0.00 H new ATOM 0 H2' DG A 8 -1.108 6.466 -1.912 1.00 0.00 H new ATOM 0 H2'' DG A 8 -2.732 6.841 -1.370 1.00 0.00 H new ATOM 0 H1' DG A 8 -3.729 5.400 -2.910 1.00 0.00 H new ATOM 0 H8 DG A 8 -3.727 3.100 -2.003 1.00 0.00 H new ATOM 0 H1 DG A 8 2.581 2.386 -2.541 1.00 0.00 H new ATOM 0 H21 DG A 8 2.519 5.622 -3.787 1.00 0.00 H new ATOM 0 H22 DG A 8 3.475 4.198 -3.365 1.00 0.00 H new ATOM 258 P DG A 9 -3.540 9.464 -1.546 1.00 0.00 P ATOM 259 OP1 DG A 9 -4.403 10.635 -1.821 1.00 0.00 O ATOM 260 OP2 DG A 9 -2.216 9.659 -0.911 1.00 0.00 O ATOM 261 O5' DG A 9 -4.376 8.418 -0.637 1.00 0.00 O ATOM 262 C5' DG A 9 -5.785 8.186 -0.865 1.00 0.00 C ATOM 263 C4' DG A 9 -6.310 6.948 -0.144 1.00 0.00 C ATOM 264 O4' DG A 9 -5.512 5.784 -0.455 1.00 0.00 O ATOM 265 C3' DG A 9 -6.288 7.121 1.370 1.00 0.00 C ATOM 266 O3' DG A 9 -7.616 7.346 1.877 1.00 0.00 O ATOM 267 C2' DG A 9 -5.731 5.833 1.896 1.00 0.00 C ATOM 268 C1' DG A 9 -5.406 4.961 0.722 1.00 0.00 C ATOM 269 N9 DG A 9 -4.059 4.390 0.859 1.00 0.00 N ATOM 270 C8 DG A 9 -2.854 4.971 0.685 1.00 0.00 C ATOM 271 N7 DG A 9 -1.805 4.232 0.830 1.00 0.00 N ATOM 272 C5 DG A 9 -2.378 2.993 1.148 1.00 0.00 C ATOM 273 C6 DG A 9 -1.767 1.740 1.432 1.00 0.00 C ATOM 274 O6 DG A 9 -0.572 1.451 1.446 1.00 0.00 O ATOM 275 N1 DG A 9 -2.715 0.768 1.702 1.00 0.00 N ATOM 276 C2 DG A 9 -4.079 0.964 1.702 1.00 0.00 C ATOM 277 N2 DG A 9 -4.828 -0.082 1.994 1.00 0.00 N ATOM 278 N3 DG A 9 -4.658 2.124 1.436 1.00 0.00 N ATOM 279 C4 DG A 9 -3.760 3.091 1.169 1.00 0.00 C ATOM 0 H5' DG A 9 -5.961 8.078 -1.935 1.00 0.00 H new ATOM 0 H5'' DG A 9 -6.349 9.058 -0.535 1.00 0.00 H new ATOM 0 H4' DG A 9 -7.335 6.814 -0.488 1.00 0.00 H new ATOM 0 H3' DG A 9 -5.692 7.981 1.676 1.00 0.00 H new ATOM 0 H2' DG A 9 -4.838 6.019 2.493 1.00 0.00 H new ATOM 0 H2'' DG A 9 -6.454 5.342 2.548 1.00 0.00 H new ATOM 0 H1' DG A 9 -6.095 4.119 0.656 1.00 0.00 H new ATOM 0 H8 DG A 9 -2.770 6.018 0.433 1.00 0.00 H new ATOM 0 H1 DG A 9 -2.376 -0.169 1.919 1.00 0.00 H new ATOM 0 H21 DG A 9 -5.844 0.006 2.009 1.00 0.00 H new ATOM 0 H22 DG A 9 -4.391 -0.979 2.205 1.00 0.00 H new ATOM 291 P DT A 10 -7.901 7.475 3.465 1.00 0.00 P ATOM 292 OP1 DT A 10 -9.322 7.845 3.648 1.00 0.00 O ATOM 293 OP2 DT A 10 -6.841 8.319 4.062 1.00 0.00 O ATOM 294 O5' DT A 10 -7.700 5.961 4.003 1.00 0.00 O ATOM 295 C5' DT A 10 -8.729 4.966 3.841 1.00 0.00 C ATOM 296 C4' DT A 10 -8.356 3.646 4.527 1.00 0.00 C ATOM 297 O4' DT A 10 -7.114 3.128 4.009 1.00 0.00 O ATOM 298 C3' DT A 10 -8.194 3.820 6.026 1.00 0.00 C ATOM 299 O3' DT A 10 -9.317 3.262 6.734 1.00 0.00 O ATOM 300 C2' DT A 10 -6.944 3.085 6.363 1.00 0.00 C ATOM 301 C1' DT A 10 -6.363 2.545 5.085 1.00 0.00 C ATOM 302 N1 DT A 10 -4.932 2.876 4.971 1.00 0.00 N ATOM 303 C2 DT A 10 -4.023 1.840 5.068 1.00 0.00 C ATOM 304 O2 DT A 10 -4.361 0.677 5.278 1.00 0.00 O ATOM 305 N3 DT A 10 -2.704 2.185 4.929 1.00 0.00 N ATOM 306 C4 DT A 10 -2.204 3.447 4.707 1.00 0.00 C ATOM 307 O4 DT A 10 -0.993 3.624 4.601 1.00 0.00 O ATOM 308 C5 DT A 10 -3.218 4.475 4.622 1.00 0.00 C ATOM 309 C7 DT A 10 -2.802 5.928 4.376 1.00 0.00 C ATOM 310 C6 DT A 10 -4.526 4.164 4.756 1.00 0.00 C ATOM 0 H5' DT A 10 -8.899 4.789 2.779 1.00 0.00 H new ATOM 0 H5'' DT A 10 -9.665 5.340 4.256 1.00 0.00 H new ATOM 0 H4' DT A 10 -9.172 2.953 4.323 1.00 0.00 H new ATOM 0 H3' DT A 10 -8.144 4.871 6.311 1.00 0.00 H new ATOM 0 H2' DT A 10 -6.233 3.749 6.854 1.00 0.00 H new ATOM 0 H2'' DT A 10 -7.155 2.273 7.059 1.00 0.00 H new ATOM 0 H1' DT A 10 -6.431 1.457 5.060 1.00 0.00 H new ATOM 0 H3 DT A 10 -2.023 1.428 4.997 1.00 0.00 H new ATOM 0 H71 DT A 10 -1.814 6.101 4.803 1.00 0.00 H new ATOM 0 H72 DT A 10 -2.772 6.121 3.304 1.00 0.00 H new ATOM 0 H73 DT A 10 -3.523 6.597 4.846 1.00 0.00 H new ATOM 0 H6 DT A 10 -5.266 4.948 4.692 1.00 0.00 H new ATOM 323 P DC A 11 -9.337 3.179 8.351 1.00 0.00 P ATOM 324 OP1 DC A 11 -10.650 2.638 8.767 1.00 0.00 O ATOM 325 OP2 DC A 11 -8.874 4.479 8.887 1.00 0.00 O ATOM 326 O5' DC A 11 -8.197 2.069 8.680 1.00 0.00 O ATOM 327 C5' DC A 11 -8.523 0.670 8.778 1.00 0.00 C ATOM 328 C4' DC A 11 -7.344 -0.173 9.291 1.00 0.00 C ATOM 329 O4' DC A 11 -6.213 -0.130 8.389 1.00 0.00 O ATOM 330 C3' DC A 11 -6.843 0.318 10.636 1.00 0.00 C ATOM 331 O3' DC A 11 -7.417 -0.421 11.726 1.00 0.00 O ATOM 332 C2' DC A 11 -5.359 0.105 10.581 1.00 0.00 C ATOM 333 C1' DC A 11 -5.007 -0.282 9.171 1.00 0.00 C ATOM 334 N1 DC A 11 -3.912 0.569 8.672 1.00 0.00 N ATOM 335 C2 DC A 11 -2.638 0.020 8.615 1.00 0.00 C ATOM 336 O2 DC A 11 -2.438 -1.144 8.964 1.00 0.00 O ATOM 337 N3 DC A 11 -1.621 0.802 8.176 1.00 0.00 N ATOM 338 C4 DC A 11 -1.837 2.066 7.807 1.00 0.00 C ATOM 339 N4 DC A 11 -0.814 2.799 7.383 1.00 0.00 N ATOM 340 C5 DC A 11 -3.146 2.637 7.863 1.00 0.00 C ATOM 341 C6 DC A 11 -4.147 1.853 8.301 1.00 0.00 C ATOM 0 H5' DC A 11 -8.830 0.302 7.799 1.00 0.00 H new ATOM 0 H5'' DC A 11 -9.374 0.544 9.447 1.00 0.00 H new ATOM 0 H4' DC A 11 -7.732 -1.188 9.370 1.00 0.00 H new ATOM 0 H3' DC A 11 -7.118 1.358 10.811 1.00 0.00 H new ATOM 0 H2' DC A 11 -4.831 1.013 10.872 1.00 0.00 H new ATOM 0 H2'' DC A 11 -5.058 -0.676 11.279 1.00 0.00 H new ATOM 0 H1' DC A 11 -4.651 -1.310 9.108 1.00 0.00 H new ATOM 0 H41 DC A 11 -0.964 3.767 7.098 1.00 0.00 H new ATOM 0 H42 DC A 11 0.121 2.394 7.343 1.00 0.00 H new ATOM 0 H5 DC A 11 -3.325 3.660 7.565 1.00 0.00 H new ATOM 0 H6 DC A 11 -5.150 2.250 8.358 1.00 0.00 H new ATOM 353 P DC A 12 -6.971 -0.110 13.251 1.00 0.00 P ATOM 354 OP1 DC A 12 -7.877 -0.850 14.156 1.00 0.00 O ATOM 355 OP2 DC A 12 -6.817 1.355 13.401 1.00 0.00 O ATOM 356 O5' DC A 12 -5.504 -0.779 13.347 1.00 0.00 O ATOM 357 C5' DC A 12 -5.347 -2.202 13.471 1.00 0.00 C ATOM 358 C4' DC A 12 -3.873 -2.609 13.448 1.00 0.00 C ATOM 359 O4' DC A 12 -3.199 -2.096 12.274 1.00 0.00 O ATOM 360 C3' DC A 12 -3.135 -2.066 14.656 1.00 0.00 C ATOM 361 O3' DC A 12 -3.088 -3.025 15.721 1.00 0.00 O ATOM 362 C2' DC A 12 -1.768 -1.748 14.150 1.00 0.00 C ATOM 363 C1' DC A 12 -1.866 -1.662 12.642 1.00 0.00 C ATOM 364 N1 DC A 12 -1.609 -0.280 12.182 1.00 0.00 N ATOM 365 C2 DC A 12 -0.357 0.007 11.651 1.00 0.00 C ATOM 366 O2 DC A 12 0.499 -0.870 11.561 1.00 0.00 O ATOM 367 N3 DC A 12 -0.107 1.278 11.244 1.00 0.00 N ATOM 368 C4 DC A 12 -1.035 2.231 11.353 1.00 0.00 C ATOM 369 N4 DC A 12 -0.748 3.464 10.948 1.00 0.00 N ATOM 370 C5 DC A 12 -2.322 1.947 11.898 1.00 0.00 C ATOM 371 C6 DC A 12 -2.568 0.683 12.296 1.00 0.00 C ATOM 0 H5' DC A 12 -5.875 -2.699 12.658 1.00 0.00 H new ATOM 0 H5'' DC A 12 -5.804 -2.540 14.401 1.00 0.00 H new ATOM 0 H4' DC A 12 -3.860 -3.699 13.447 1.00 0.00 H new ATOM 0 H3' DC A 12 -3.631 -1.192 15.078 1.00 0.00 H new ATOM 0 H2' DC A 12 -1.411 -0.807 14.568 1.00 0.00 H new ATOM 0 H2'' DC A 12 -1.057 -2.519 14.447 1.00 0.00 H new ATOM 0 HO3' DC A 12 -2.604 -2.644 16.483 1.00 0.00 H new ATOM 0 H1' DC A 12 -1.118 -2.297 12.168 1.00 0.00 H new ATOM 0 H41 DC A 12 -1.448 4.202 11.025 1.00 0.00 H new ATOM 0 H42 DC A 12 0.172 3.672 10.560 1.00 0.00 H new ATOM 0 H5 DC A 12 -3.073 2.718 11.989 1.00 0.00 H new ATOM 0 H6 DC A 12 -3.533 0.430 12.709 1.00 0.00 H new TER 384 DC A 12