USER MOD reduce.3.24.130724 H: found=0, std=0, add=138, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 136 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 4 DT C7 :methyl -30:sc= -3.55! (180deg=-5.97!) USER MOD Single : A 6 DA O3' : rot 180:sc= 0 USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 4 DT C7 :methyl -30:sc= -3.61! (180deg=-5.51!) USER MOD Single : B 6 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 P DT A 1 1.202 -7.338 -5.894 1.00 0.00 P ATOM 2 OP1 DT A 1 2.036 -7.686 -7.065 1.00 0.00 O ATOM 3 OP2 DT A 1 -0.085 -8.043 -5.699 1.00 0.00 O ATOM 4 O5' DT A 1 1.899 -6.614 -4.623 1.00 0.00 O ATOM 5 C5' DT A 1 2.421 -7.539 -3.641 1.00 0.00 C ATOM 6 C4' DT A 1 2.998 -6.829 -2.384 1.00 0.00 C ATOM 7 O4' DT A 1 2.307 -5.594 -2.106 1.00 0.00 O ATOM 8 C3' DT A 1 3.084 -7.663 -1.077 1.00 0.00 C ATOM 9 O3' DT A 1 4.492 -7.722 -0.687 1.00 0.00 O ATOM 10 C2' DT A 1 2.195 -6.829 -0.174 1.00 0.00 C ATOM 11 C1' DT A 1 2.212 -5.404 -0.703 1.00 0.00 C ATOM 12 N1 DT A 1 1.073 -4.504 -0.420 1.00 0.00 N ATOM 13 C2 DT A 1 1.320 -3.155 -0.270 1.00 0.00 C ATOM 14 O2 DT A 1 2.432 -2.659 -0.217 1.00 0.00 O ATOM 15 N3 DT A 1 0.197 -2.352 -0.230 1.00 0.00 N ATOM 16 C4 DT A 1 -1.112 -2.765 -0.320 1.00 0.00 C ATOM 17 O4 DT A 1 -2.051 -1.990 -0.281 1.00 0.00 O ATOM 18 C5 DT A 1 -1.273 -4.191 -0.470 1.00 0.00 C ATOM 19 C7 DT A 1 -2.570 -4.906 -0.738 1.00 0.00 C ATOM 20 C6 DT A 1 -0.201 -5.006 -0.520 1.00 0.00 C ATOM 0 H5' DT A 1 3.202 -8.145 -4.100 1.00 0.00 H new ATOM 0 H5'' DT A 1 1.628 -8.221 -3.334 1.00 0.00 H new ATOM 0 H4' DT A 1 4.032 -6.650 -2.678 1.00 0.00 H new ATOM 0 H3' DT A 1 2.764 -8.705 -1.097 1.00 0.00 H new ATOM 0 H2' DT A 1 1.179 -7.223 -0.167 1.00 0.00 H new ATOM 0 H2'' DT A 1 2.556 -6.860 0.854 1.00 0.00 H new ATOM 0 H1' DT A 1 3.021 -4.880 -0.194 1.00 0.00 H new ATOM 0 H3 DT A 1 0.354 -1.350 -0.123 1.00 0.00 H new ATOM 0 H71 DT A 1 -2.374 -5.814 -1.308 1.00 0.00 H new ATOM 0 H72 DT A 1 -3.044 -5.167 0.208 1.00 0.00 H new ATOM 0 H73 DT A 1 -3.233 -4.255 -1.308 1.00 0.00 H new ATOM 0 H6 DT A 1 -0.346 -6.069 -0.640 1.00 0.00 H new ATOM 33 P DG A 2 4.911 -8.206 0.816 1.00 0.00 P ATOM 34 OP1 DG A 2 6.179 -8.966 0.815 1.00 0.00 O ATOM 35 OP2 DG A 2 3.843 -8.987 1.480 1.00 0.00 O ATOM 36 O5' DG A 2 5.081 -6.705 1.461 1.00 0.00 O ATOM 37 C5' DG A 2 6.252 -5.954 1.033 1.00 0.00 C ATOM 38 C4' DG A 2 6.413 -4.541 1.637 1.00 0.00 C ATOM 39 O4' DG A 2 5.244 -3.724 1.522 1.00 0.00 O ATOM 40 C3' DG A 2 6.774 -4.657 3.114 1.00 0.00 C ATOM 41 O3' DG A 2 8.061 -4.047 3.389 1.00 0.00 O ATOM 42 C2' DG A 2 5.573 -4.101 3.840 1.00 0.00 C ATOM 43 C1' DG A 2 4.951 -3.186 2.815 1.00 0.00 C ATOM 44 N9 DG A 2 3.515 -3.013 2.960 1.00 0.00 N ATOM 45 C8 DG A 2 2.611 -4.051 2.880 1.00 0.00 C ATOM 46 N7 DG A 2 1.360 -3.677 2.960 1.00 0.00 N ATOM 47 C5 DG A 2 1.431 -2.289 3.100 1.00 0.00 C ATOM 48 C6 DG A 2 0.400 -1.331 3.230 1.00 0.00 C ATOM 49 O6 DG A 2 -0.791 -1.590 3.225 1.00 0.00 O ATOM 50 N1 DG A 2 0.919 -0.030 3.350 1.00 0.00 N ATOM 51 C2 DG A 2 2.262 0.290 3.350 1.00 0.00 C ATOM 52 N2 DG A 2 2.602 1.624 3.437 1.00 0.00 N ATOM 53 N3 DG A 2 3.232 -0.611 3.220 1.00 0.00 N ATOM 54 C4 DG A 2 2.751 -1.876 3.100 1.00 0.00 C ATOM 0 H5' DG A 2 6.222 -5.861 -0.053 1.00 0.00 H new ATOM 0 H5'' DG A 2 7.141 -6.535 1.279 1.00 0.00 H new ATOM 0 H4' DG A 2 7.203 -4.057 1.063 1.00 0.00 H new ATOM 0 H3' DG A 2 6.945 -5.675 3.465 1.00 0.00 H new ATOM 0 H2' DG A 2 4.886 -4.890 4.147 1.00 0.00 H new ATOM 0 H2'' DG A 2 5.861 -3.561 4.742 1.00 0.00 H new ATOM 0 H1' DG A 2 5.377 -2.193 2.958 1.00 0.00 H new ATOM 0 H8 DG A 2 2.909 -5.082 2.762 1.00 0.00 H new ATOM 0 H1 DG A 2 0.252 0.736 3.444 1.00 0.00 H new ATOM 0 H21 DG A 2 3.584 1.901 3.440 1.00 0.00 H new ATOM 0 H22 DG A 2 1.872 2.333 3.498 1.00 0.00 H new ATOM 66 P DA A 3 8.583 -3.994 4.933 1.00 0.00 P ATOM 67 OP1 DA A 3 10.059 -3.927 5.007 1.00 0.00 O ATOM 68 OP2 DA A 3 8.076 -5.122 5.745 1.00 0.00 O ATOM 69 O5' DA A 3 7.885 -2.575 5.351 1.00 0.00 O ATOM 70 C5' DA A 3 8.344 -1.412 4.624 1.00 0.00 C ATOM 71 C4' DA A 3 7.819 -0.060 5.026 1.00 0.00 C ATOM 72 O4' DA A 3 6.411 0.063 4.846 1.00 0.00 O ATOM 73 C3' DA A 3 8.258 0.223 6.447 1.00 0.00 C ATOM 74 O3' DA A 3 8.875 1.536 6.547 1.00 0.00 O ATOM 75 C2' DA A 3 6.960 0.018 7.128 1.00 0.00 C ATOM 76 C1' DA A 3 5.888 0.351 6.124 1.00 0.00 C ATOM 77 N9 DA A 3 4.615 -0.371 6.340 1.00 0.00 N ATOM 78 C8 DA A 3 4.518 -1.734 6.260 1.00 0.00 C ATOM 79 N7 DA A 3 3.297 -2.174 6.330 1.00 0.00 N ATOM 80 C5 DA A 3 2.540 -1.026 6.480 1.00 0.00 C ATOM 81 C6 DA A 3 1.152 -0.813 6.610 1.00 0.00 C ATOM 82 N6 DA A 3 0.279 -1.836 6.616 1.00 0.00 N ATOM 83 N1 DA A 3 0.730 0.455 6.730 1.00 0.00 N ATOM 84 C2 DA A 3 1.628 1.435 6.720 1.00 0.00 C ATOM 85 N3 DA A 3 2.937 1.369 6.600 1.00 0.00 N ATOM 86 C4 DA A 3 3.329 0.088 6.480 1.00 0.00 C ATOM 0 H5' DA A 3 8.102 -1.562 3.572 1.00 0.00 H new ATOM 0 H5'' DA A 3 9.431 -1.381 4.700 1.00 0.00 H new ATOM 0 H4' DA A 3 8.242 0.697 4.366 1.00 0.00 H new ATOM 0 H3' DA A 3 9.047 -0.390 6.882 1.00 0.00 H new ATOM 0 H2' DA A 3 6.862 -1.012 7.472 1.00 0.00 H new ATOM 0 H2'' DA A 3 6.879 0.657 8.007 1.00 0.00 H new ATOM 0 H1' DA A 3 5.632 1.405 6.232 1.00 0.00 H new ATOM 0 H8 DA A 3 5.375 -2.382 6.149 1.00 0.00 H new ATOM 0 H61 DA A 3 -0.720 -1.653 6.712 1.00 0.00 H new ATOM 0 H62 DA A 3 0.616 -2.794 6.525 1.00 0.00 H new ATOM 0 H2 DA A 3 1.224 2.431 6.826 1.00 0.00 H new ATOM 98 P DT A 4 9.411 2.039 8.001 1.00 0.00 P ATOM 99 OP1 DT A 4 10.557 2.966 7.873 1.00 0.00 O ATOM 100 OP2 DT A 4 9.752 0.917 8.903 1.00 0.00 O ATOM 101 O5' DT A 4 8.053 2.809 8.474 1.00 0.00 O ATOM 102 C5' DT A 4 7.654 3.976 7.708 1.00 0.00 C ATOM 103 C4' DT A 4 6.352 4.592 8.225 1.00 0.00 C ATOM 104 O4' DT A 4 5.280 3.640 8.098 1.00 0.00 O ATOM 105 C3' DT A 4 6.438 5.173 9.638 1.00 0.00 C ATOM 106 O3' DT A 4 6.216 6.618 9.598 1.00 0.00 O ATOM 107 C2' DT A 4 5.475 4.242 10.316 1.00 0.00 C ATOM 108 C1' DT A 4 4.521 3.706 9.295 1.00 0.00 C ATOM 109 N1 DT A 4 3.952 2.412 9.720 1.00 0.00 N ATOM 110 C2 DT A 4 2.593 2.230 9.870 1.00 0.00 C ATOM 111 O2 DT A 4 1.783 3.138 9.910 1.00 0.00 O ATOM 112 N3 DT A 4 2.176 0.914 9.910 1.00 0.00 N ATOM 113 C4 DT A 4 2.973 -0.203 9.820 1.00 0.00 C ATOM 114 O4 DT A 4 2.525 -1.334 9.867 1.00 0.00 O ATOM 115 C5 DT A 4 4.379 0.084 9.670 1.00 0.00 C ATOM 116 C7 DT A 4 5.402 -1.008 9.696 1.00 0.00 C ATOM 117 C6 DT A 4 4.823 1.356 9.620 1.00 0.00 C ATOM 0 H5' DT A 4 7.531 3.696 6.662 1.00 0.00 H new ATOM 0 H5'' DT A 4 8.447 4.722 7.747 1.00 0.00 H new ATOM 0 H4' DT A 4 6.147 5.458 7.596 1.00 0.00 H new ATOM 0 H3' DT A 4 7.378 5.186 10.190 1.00 0.00 H new ATOM 0 H2' DT A 4 6.014 3.424 10.794 1.00 0.00 H new ATOM 0 H2'' DT A 4 4.931 4.768 11.101 1.00 0.00 H new ATOM 0 H1' DT A 4 3.643 4.336 9.154 1.00 0.00 H new ATOM 0 H3 DT A 4 1.174 0.754 10.017 1.00 0.00 H new ATOM 0 H71 DT A 4 5.049 -1.822 10.329 1.00 0.00 H new ATOM 0 H72 DT A 4 5.564 -1.379 8.684 1.00 0.00 H new ATOM 0 H73 DT A 4 6.339 -0.619 10.094 1.00 0.00 H new ATOM 0 H6 DT A 4 5.879 1.547 9.500 1.00 0.00 H new ATOM 130 P DC A 5 5.319 7.401 10.712 1.00 0.00 P ATOM 131 OP1 DC A 5 5.555 8.861 10.675 1.00 0.00 O ATOM 132 OP2 DC A 5 5.494 6.874 12.084 1.00 0.00 O ATOM 133 O5' DC A 5 3.904 6.972 10.029 1.00 0.00 O ATOM 134 C5' DC A 5 2.744 7.816 10.246 1.00 0.00 C ATOM 135 C4' DC A 5 1.844 7.474 11.457 1.00 0.00 C ATOM 136 O4' DC A 5 1.543 6.068 11.541 1.00 0.00 O ATOM 137 C3' DC A 5 2.288 8.029 12.821 1.00 0.00 C ATOM 138 O3' DC A 5 1.302 8.996 13.315 1.00 0.00 O ATOM 139 C2' DC A 5 2.363 6.742 13.608 1.00 0.00 C ATOM 140 C1' DC A 5 1.466 5.708 12.918 1.00 0.00 C ATOM 141 N1 DC A 5 1.779 4.275 13.100 1.00 0.00 N ATOM 142 C2 DC A 5 0.788 3.308 13.250 1.00 0.00 C ATOM 143 O2 DC A 5 -0.400 3.598 13.306 1.00 0.00 O ATOM 144 N3 DC A 5 1.152 2.002 13.300 1.00 0.00 N ATOM 145 C4 DC A 5 2.438 1.644 13.200 1.00 0.00 C ATOM 146 N4 DC A 5 2.802 0.290 13.282 1.00 0.00 N ATOM 147 C5 DC A 5 3.474 2.618 13.050 1.00 0.00 C ATOM 148 C6 DC A 5 3.086 3.921 13.000 1.00 0.00 C ATOM 0 H5' DC A 5 2.129 7.784 9.347 1.00 0.00 H new ATOM 0 H5'' DC A 5 3.089 8.844 10.360 1.00 0.00 H new ATOM 0 H4' DC A 5 0.928 8.020 11.232 1.00 0.00 H new ATOM 0 H3' DC A 5 3.219 8.595 12.851 1.00 0.00 H new ATOM 0 H2' DC A 5 3.391 6.383 13.654 1.00 0.00 H new ATOM 0 H2'' DC A 5 2.036 6.904 14.635 1.00 0.00 H new ATOM 0 H1' DC A 5 0.477 5.757 13.374 1.00 0.00 H new ATOM 0 H41 DC A 5 3.783 0.020 13.205 1.00 0.00 H new ATOM 0 H42 DC A 5 2.086 -0.423 13.418 1.00 0.00 H new ATOM 0 H5 DC A 5 4.513 2.333 12.980 1.00 0.00 H new ATOM 0 H6 DC A 5 3.834 4.691 12.878 1.00 0.00 H new ATOM 160 P DA A 6 1.288 9.470 14.889 1.00 0.00 P ATOM 161 OP1 DA A 6 0.786 10.853 15.038 1.00 0.00 O ATOM 162 OP2 DA A 6 2.604 9.332 15.548 1.00 0.00 O ATOM 163 O5' DA A 6 0.202 8.376 15.466 1.00 0.00 O ATOM 164 C5' DA A 6 -1.128 8.458 14.899 1.00 0.00 C ATOM 165 C4' DA A 6 -2.244 7.667 15.618 1.00 0.00 C ATOM 166 O4' DA A 6 -2.163 6.256 15.348 1.00 0.00 O ATOM 167 C3' DA A 6 -2.366 7.886 17.124 1.00 0.00 C ATOM 168 O3' DA A 6 -3.690 8.240 17.544 1.00 0.00 O ATOM 169 C2' DA A 6 -1.956 6.545 17.686 1.00 0.00 C ATOM 170 C1' DA A 6 -2.148 5.510 16.571 1.00 0.00 C ATOM 171 N9 DA A 6 -1.073 4.504 16.480 1.00 0.00 N ATOM 172 C8 DA A 6 0.253 4.833 16.400 1.00 0.00 C ATOM 173 N7 DA A 6 1.049 3.808 16.470 1.00 0.00 N ATOM 174 C5 DA A 6 0.191 2.733 16.620 1.00 0.00 C ATOM 175 C6 DA A 6 0.417 1.347 16.750 1.00 0.00 C ATOM 176 N6 DA A 6 1.658 0.831 16.738 1.00 0.00 N ATOM 177 N1 DA A 6 -0.658 0.554 16.870 1.00 0.00 N ATOM 178 C2 DA A 6 -1.868 1.105 16.860 1.00 0.00 C ATOM 179 N3 DA A 6 -2.210 2.370 16.740 1.00 0.00 N ATOM 180 C4 DA A 6 -1.112 3.139 16.620 1.00 0.00 C ATOM 0 H5' DA A 6 -1.079 8.113 13.866 1.00 0.00 H new ATOM 0 H5'' DA A 6 -1.421 9.508 14.870 1.00 0.00 H new ATOM 0 H4' DA A 6 -3.151 8.089 15.185 1.00 0.00 H new ATOM 0 H3' DA A 6 -1.756 8.722 17.467 1.00 0.00 H new ATOM 0 H2' DA A 6 -0.917 6.567 18.016 1.00 0.00 H new ATOM 0 H2'' DA A 6 -2.562 6.291 18.556 1.00 0.00 H new ATOM 0 HO3' DA A 6 -3.703 8.365 18.516 1.00 0.00 H new ATOM 0 H1' DA A 6 -3.062 4.953 16.775 1.00 0.00 H new ATOM 0 H8 DA A 6 0.605 5.848 16.289 1.00 0.00 H new ATOM 0 H61 DA A 6 1.793 -0.175 16.834 1.00 0.00 H new ATOM 0 H62 DA A 6 2.465 1.446 16.633 1.00 0.00 H new ATOM 0 H2 DA A 6 -2.690 0.413 16.966 1.00 0.00 H new TER 192 DA A 6 ATOM 193 P DT B 1 -1.041 -6.016 22.469 1.00 0.00 P ATOM 194 OP1 DT B 1 0.186 -5.503 21.819 1.00 0.00 O ATOM 195 OP2 DT B 1 -0.905 -6.954 23.605 1.00 0.00 O ATOM 196 O5' DT B 1 -2.440 -5.976 21.654 1.00 0.00 O ATOM 197 C5' DT B 1 -2.643 -7.077 20.732 1.00 0.00 C ATOM 198 C4' DT B 1 -3.161 -6.586 19.352 1.00 0.00 C ATOM 199 O4' DT B 1 -2.451 -5.395 18.976 1.00 0.00 O ATOM 200 C3' DT B 1 -3.152 -7.578 18.154 1.00 0.00 C ATOM 201 O3' DT B 1 -4.544 -7.739 17.734 1.00 0.00 O ATOM 202 C2' DT B 1 -2.218 -6.849 17.200 1.00 0.00 C ATOM 203 C1' DT B 1 -2.237 -5.377 17.579 1.00 0.00 C ATOM 204 N1 DT B 1 -1.073 -4.504 17.320 1.00 0.00 N ATOM 205 C2 DT B 1 -1.320 -3.155 17.170 1.00 0.00 C ATOM 206 O2 DT B 1 -2.431 -2.656 17.113 1.00 0.00 O ATOM 207 N3 DT B 1 -0.197 -2.352 17.130 1.00 0.00 N ATOM 208 C4 DT B 1 1.112 -2.765 17.220 1.00 0.00 C ATOM 209 O4 DT B 1 2.050 -1.990 17.176 1.00 0.00 O ATOM 210 C5 DT B 1 1.273 -4.191 17.370 1.00 0.00 C ATOM 211 C7 DT B 1 2.570 -4.908 17.630 1.00 0.00 C ATOM 212 C6 DT B 1 0.201 -5.006 17.420 1.00 0.00 C ATOM 0 H5' DT B 1 -3.357 -7.781 21.159 1.00 0.00 H new ATOM 0 H5'' DT B 1 -1.705 -7.616 20.597 1.00 0.00 H new ATOM 0 H4' DT B 1 -4.224 -6.427 19.535 1.00 0.00 H new ATOM 0 H3' DT B 1 -2.803 -8.600 18.300 1.00 0.00 H new ATOM 0 H2' DT B 1 -1.207 -7.250 17.271 1.00 0.00 H new ATOM 0 H2'' DT B 1 -2.542 -6.984 16.168 1.00 0.00 H new ATOM 0 H1' DT B 1 -2.986 -4.926 16.928 1.00 0.00 H new ATOM 0 H3 DT B 1 -0.354 -1.350 17.023 1.00 0.00 H new ATOM 0 H71 DT B 1 2.376 -5.815 18.202 1.00 0.00 H new ATOM 0 H72 DT B 1 3.037 -5.170 16.681 1.00 0.00 H new ATOM 0 H73 DT B 1 3.238 -4.258 18.196 1.00 0.00 H new ATOM 0 H6 DT B 1 0.346 -6.069 17.540 1.00 0.00 H new ATOM 225 P DG B 2 -4.929 -8.194 16.214 1.00 0.00 P ATOM 226 OP1 DG B 2 -6.211 -8.932 16.173 1.00 0.00 O ATOM 227 OP2 DG B 2 -3.860 -8.992 15.572 1.00 0.00 O ATOM 228 O5' DG B 2 -5.060 -6.685 15.576 1.00 0.00 O ATOM 229 C5' DG B 2 -6.214 -5.908 16.010 1.00 0.00 C ATOM 230 C4' DG B 2 -6.368 -4.498 15.396 1.00 0.00 C ATOM 231 O4' DG B 2 -5.184 -3.699 15.456 1.00 0.00 O ATOM 232 C3' DG B 2 -6.789 -4.613 13.934 1.00 0.00 C ATOM 233 O3' DG B 2 -8.070 -3.965 13.714 1.00 0.00 O ATOM 234 C2' DG B 2 -5.609 -4.087 13.153 1.00 0.00 C ATOM 235 C1' DG B 2 -4.941 -3.174 14.148 1.00 0.00 C ATOM 236 N9 DG B 2 -3.515 -3.013 13.940 1.00 0.00 N ATOM 237 C8 DG B 2 -2.611 -4.051 14.020 1.00 0.00 C ATOM 238 N7 DG B 2 -1.360 -3.677 13.940 1.00 0.00 N ATOM 239 C5 DG B 2 -1.431 -2.289 13.800 1.00 0.00 C ATOM 240 C6 DG B 2 -0.400 -1.331 13.670 1.00 0.00 C ATOM 241 O6 DG B 2 0.790 -1.590 13.674 1.00 0.00 O ATOM 242 N1 DG B 2 -0.919 -0.030 13.550 1.00 0.00 N ATOM 243 C2 DG B 2 -2.262 0.290 13.550 1.00 0.00 C ATOM 244 N2 DG B 2 -2.602 1.623 13.459 1.00 0.00 N ATOM 245 N3 DG B 2 -3.232 -0.611 13.680 1.00 0.00 N ATOM 246 C4 DG B 2 -2.751 -1.876 13.800 1.00 0.00 C ATOM 0 H5' DG B 2 -6.167 -5.804 17.094 1.00 0.00 H new ATOM 0 H5'' DG B 2 -7.114 -6.479 15.783 1.00 0.00 H new ATOM 0 H4' DG B 2 -7.126 -3.999 16.000 1.00 0.00 H new ATOM 0 H3' DG B 2 -6.994 -5.629 13.596 1.00 0.00 H new ATOM 0 H2' DG B 2 -4.946 -4.889 12.830 1.00 0.00 H new ATOM 0 H2'' DG B 2 -5.922 -3.551 12.257 1.00 0.00 H new ATOM 0 H1' DG B 2 -5.368 -2.179 14.020 1.00 0.00 H new ATOM 0 H8 DG B 2 -2.909 -5.082 14.138 1.00 0.00 H new ATOM 0 H1 DG B 2 -0.252 0.736 13.456 1.00 0.00 H new ATOM 0 H21 DG B 2 -3.584 1.900 13.456 1.00 0.00 H new ATOM 0 H22 DG B 2 -1.872 2.332 13.395 1.00 0.00 H new ATOM 258 P DA B 3 -8.671 -3.914 12.199 1.00 0.00 P ATOM 259 OP1 DA B 3 -10.144 -3.787 12.204 1.00 0.00 O ATOM 260 OP2 DA B 3 -8.256 -5.077 11.384 1.00 0.00 O ATOM 261 O5' DA B 3 -7.940 -2.532 11.712 1.00 0.00 O ATOM 262 C5' DA B 3 -8.325 -1.337 12.431 1.00 0.00 C ATOM 263 C4' DA B 3 -7.763 -0.015 11.986 1.00 0.00 C ATOM 264 O4' DA B 3 -6.348 0.059 12.113 1.00 0.00 O ATOM 265 C3' DA B 3 -8.242 0.270 10.578 1.00 0.00 C ATOM 266 O3' DA B 3 -8.835 1.596 10.509 1.00 0.00 O ATOM 267 C2' DA B 3 -6.974 0.042 9.846 1.00 0.00 C ATOM 268 C1' DA B 3 -5.871 0.358 10.821 1.00 0.00 C ATOM 269 N9 DA B 3 -4.615 -0.371 10.560 1.00 0.00 N ATOM 270 C8 DA B 3 -4.518 -1.734 10.640 1.00 0.00 C ATOM 271 N7 DA B 3 -3.297 -2.174 10.570 1.00 0.00 N ATOM 272 C5 DA B 3 -2.540 -1.026 10.420 1.00 0.00 C ATOM 273 C6 DA B 3 -1.152 -0.813 10.290 1.00 0.00 C ATOM 274 N6 DA B 3 -0.280 -1.836 10.284 1.00 0.00 N ATOM 275 N1 DA B 3 -0.730 0.455 10.170 1.00 0.00 N ATOM 276 C2 DA B 3 -1.628 1.435 10.180 1.00 0.00 C ATOM 277 N3 DA B 3 -2.937 1.369 10.300 1.00 0.00 N ATOM 278 C4 DA B 3 -3.329 0.088 10.420 1.00 0.00 C ATOM 0 H5' DA B 3 -8.051 -1.478 13.477 1.00 0.00 H new ATOM 0 H5'' DA B 3 -9.412 -1.264 12.393 1.00 0.00 H new ATOM 0 H4' DA B 3 -8.135 0.765 12.651 1.00 0.00 H new ATOM 0 H3' DA B 3 -9.051 -0.333 10.167 1.00 0.00 H new ATOM 0 H2' DA B 3 -6.904 -0.989 9.498 1.00 0.00 H new ATOM 0 H2'' DA B 3 -6.911 0.681 8.965 1.00 0.00 H new ATOM 0 H1' DA B 3 -5.618 1.413 10.715 1.00 0.00 H new ATOM 0 H8 DA B 3 -5.375 -2.382 10.751 1.00 0.00 H new ATOM 0 H61 DA B 3 0.719 -1.654 10.189 1.00 0.00 H new ATOM 0 H62 DA B 3 -0.617 -2.794 10.375 1.00 0.00 H new ATOM 0 H2 DA B 3 -1.224 2.431 10.074 1.00 0.00 H new ATOM 290 P DT B 4 -9.398 2.136 9.080 1.00 0.00 P ATOM 291 OP1 DT B 4 -10.510 3.096 9.260 1.00 0.00 O ATOM 292 OP2 DT B 4 -9.804 1.037 8.177 1.00 0.00 O ATOM 293 O5' DT B 4 -8.031 2.871 8.573 1.00 0.00 O ATOM 294 C5' DT B 4 -7.577 4.017 9.339 1.00 0.00 C ATOM 295 C4' DT B 4 -6.258 4.593 8.819 1.00 0.00 C ATOM 296 O4' DT B 4 -5.217 3.602 8.881 1.00 0.00 O ATOM 297 C3' DT B 4 -6.334 5.234 7.434 1.00 0.00 C ATOM 298 O3' DT B 4 -5.810 6.592 7.504 1.00 0.00 O ATOM 299 C2' DT B 4 -5.475 4.266 6.684 1.00 0.00 C ATOM 300 C1' DT B 4 -4.501 3.691 7.660 1.00 0.00 C ATOM 301 N1 DT B 4 -3.952 2.412 7.180 1.00 0.00 N ATOM 302 C2 DT B 4 -2.593 2.230 7.030 1.00 0.00 C ATOM 303 O2 DT B 4 -1.782 3.138 6.988 1.00 0.00 O ATOM 304 N3 DT B 4 -2.176 0.914 6.990 1.00 0.00 N ATOM 305 C4 DT B 4 -2.973 -0.203 7.080 1.00 0.00 C ATOM 306 O4 DT B 4 -2.526 -1.334 7.031 1.00 0.00 O ATOM 307 C5 DT B 4 -4.379 0.084 7.230 1.00 0.00 C ATOM 308 C7 DT B 4 -5.410 -1.002 7.256 1.00 0.00 C ATOM 309 C6 DT B 4 -4.823 1.356 7.280 1.00 0.00 C ATOM 0 H5' DT B 4 -7.455 3.726 10.382 1.00 0.00 H new ATOM 0 H5'' DT B 4 -8.342 4.793 9.312 1.00 0.00 H new ATOM 0 H4' DT B 4 -6.018 5.419 9.489 1.00 0.00 H new ATOM 0 H3' DT B 4 -7.316 5.369 6.981 1.00 0.00 H new ATOM 0 H2' DT B 4 -6.082 3.479 6.237 1.00 0.00 H new ATOM 0 H2'' DT B 4 -4.953 4.767 5.869 1.00 0.00 H new ATOM 0 H1' DT B 4 -3.614 4.310 7.794 1.00 0.00 H new ATOM 0 H3 DT B 4 -1.174 0.754 6.883 1.00 0.00 H new ATOM 0 H71 DT B 4 -5.068 -1.843 6.653 1.00 0.00 H new ATOM 0 H72 DT B 4 -5.565 -1.332 8.283 1.00 0.00 H new ATOM 0 H73 DT B 4 -6.348 -0.623 6.851 1.00 0.00 H new ATOM 0 H6 DT B 4 -5.879 1.547 7.400 1.00 0.00 H new ATOM 322 P DC B 5 -6.002 7.556 6.210 1.00 0.00 P ATOM 323 OP1 DC B 5 -6.112 8.982 6.589 1.00 0.00 O ATOM 324 OP2 DC B 5 -7.142 7.156 5.356 1.00 0.00 O ATOM 325 O5' DC B 5 -4.568 7.198 5.530 1.00 0.00 O ATOM 326 C5' DC B 5 -3.385 7.825 6.092 1.00 0.00 C ATOM 327 C4' DC B 5 -2.166 7.561 5.180 1.00 0.00 C ATOM 328 O4' DC B 5 -1.732 6.186 5.241 1.00 0.00 O ATOM 329 C3' DC B 5 -2.402 8.012 3.734 1.00 0.00 C ATOM 330 O3' DC B 5 -1.332 8.894 3.273 1.00 0.00 O ATOM 331 C2' DC B 5 -2.397 6.657 3.080 1.00 0.00 C ATOM 332 C1' DC B 5 -1.507 5.728 3.911 1.00 0.00 C ATOM 333 N1 DC B 5 -1.779 4.275 3.800 1.00 0.00 N ATOM 334 C2 DC B 5 -0.788 3.308 3.650 1.00 0.00 C ATOM 335 O2 DC B 5 0.398 3.603 3.588 1.00 0.00 O ATOM 336 N3 DC B 5 -1.152 2.002 3.600 1.00 0.00 N ATOM 337 C4 DC B 5 -2.438 1.644 3.700 1.00 0.00 C ATOM 338 N4 DC B 5 -2.801 0.289 3.633 1.00 0.00 N ATOM 339 C5 DC B 5 -3.474 2.618 3.850 1.00 0.00 C ATOM 340 C6 DC B 5 -3.086 3.921 3.900 1.00 0.00 C ATOM 0 H5' DC B 5 -3.195 7.432 7.091 1.00 0.00 H new ATOM 0 H5'' DC B 5 -3.546 8.898 6.197 1.00 0.00 H new ATOM 0 H4' DC B 5 -1.356 8.176 5.572 1.00 0.00 H new ATOM 0 H3' DC B 5 -3.295 8.606 3.540 1.00 0.00 H new ATOM 0 H2' DC B 5 -3.410 6.260 3.021 1.00 0.00 H new ATOM 0 H2'' DC B 5 -2.023 6.729 2.059 1.00 0.00 H new ATOM 0 H1' DC B 5 -0.477 5.786 3.558 1.00 0.00 H new ATOM 0 H41 DC B 5 -3.782 0.019 3.710 1.00 0.00 H new ATOM 0 H42 DC B 5 -2.084 -0.425 3.508 1.00 0.00 H new ATOM 0 H5 DC B 5 -4.513 2.333 3.920 1.00 0.00 H new ATOM 0 H6 DC B 5 -3.834 4.691 4.022 1.00 0.00 H new ATOM 352 P DA B 6 -1.327 9.388 1.709 1.00 0.00 P ATOM 353 OP1 DA B 6 -0.878 10.791 1.575 1.00 0.00 O ATOM 354 OP2 DA B 6 -2.630 9.199 1.036 1.00 0.00 O ATOM 355 O5' DA B 6 -0.198 8.335 1.151 1.00 0.00 O ATOM 356 C5' DA B 6 1.127 8.488 1.714 1.00 0.00 C ATOM 357 C4' DA B 6 2.259 7.704 1.013 1.00 0.00 C ATOM 358 O4' DA B 6 2.224 6.315 1.376 1.00 0.00 O ATOM 359 C3' DA B 6 2.335 7.830 -0.508 1.00 0.00 C ATOM 360 O3' DA B 6 3.645 8.157 -0.990 1.00 0.00 O ATOM 361 C2' DA B 6 1.916 6.455 -0.970 1.00 0.00 C ATOM 362 C1' DA B 6 2.143 5.497 0.206 1.00 0.00 C ATOM 363 N9 DA B 6 1.073 4.504 0.420 1.00 0.00 N ATOM 364 C8 DA B 6 -0.253 4.833 0.500 1.00 0.00 C ATOM 365 N7 DA B 6 -1.049 3.808 0.430 1.00 0.00 N ATOM 366 C5 DA B 6 -0.191 2.733 0.280 1.00 0.00 C ATOM 367 C6 DA B 6 -0.417 1.347 0.150 1.00 0.00 C ATOM 368 N6 DA B 6 -1.658 0.831 0.163 1.00 0.00 N ATOM 369 N1 DA B 6 0.658 0.554 0.030 1.00 0.00 N ATOM 370 C2 DA B 6 1.868 1.105 0.040 1.00 0.00 C ATOM 371 N3 DA B 6 2.210 2.370 0.160 1.00 0.00 N ATOM 372 C4 DA B 6 1.112 3.139 0.280 1.00 0.00 C ATOM 0 H5' DA B 6 1.093 8.180 2.759 1.00 0.00 H new ATOM 0 H5'' DA B 6 1.385 9.547 1.702 1.00 0.00 H new ATOM 0 H4' DA B 6 3.164 8.187 1.383 1.00 0.00 H new ATOM 0 H3' DA B 6 1.712 8.642 -0.883 1.00 0.00 H new ATOM 0 H2' DA B 6 0.869 6.453 -1.273 1.00 0.00 H new ATOM 0 H2'' DA B 6 2.499 6.146 -1.837 1.00 0.00 H new ATOM 0 HO3' DA B 6 3.627 8.221 -1.968 1.00 0.00 H new ATOM 0 H1' DA B 6 3.042 4.920 -0.010 1.00 0.00 H new ATOM 0 H8 DA B 6 -0.605 5.848 0.611 1.00 0.00 H new ATOM 0 H61 DA B 6 -1.793 -0.175 0.067 1.00 0.00 H new ATOM 0 H62 DA B 6 -2.465 1.446 0.269 1.00 0.00 H new ATOM 0 H2 DA B 6 2.690 0.413 -0.066 1.00 0.00 H new TER 384 DA B 6