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= -3.37! (180deg=-5.19!) 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= -3.39! (180deg=-5.71!) USER MOD Single : B 6 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 P DT A 1 0.645 -7.470 -5.735 1.00 0.00 P ATOM 2 OP1 DT A 1 -0.699 -7.963 -5.359 1.00 0.00 O ATOM 3 OP2 DT A 1 1.341 -8.104 -6.877 1.00 0.00 O ATOM 4 O5' DT A 1 1.525 -6.678 -4.628 1.00 0.00 O ATOM 5 C5' DT A 1 2.208 -7.553 -3.701 1.00 0.00 C ATOM 6 C4' DT A 1 2.883 -6.796 -2.522 1.00 0.00 C ATOM 7 O4' DT A 1 2.196 -5.570 -2.199 1.00 0.00 O ATOM 8 C3' DT A 1 3.113 -7.599 -1.213 1.00 0.00 C ATOM 9 O3' DT A 1 4.546 -7.557 -0.919 1.00 0.00 O ATOM 10 C2' DT A 1 2.259 -6.795 -0.256 1.00 0.00 C ATOM 11 C1' DT A 1 2.206 -5.377 -0.792 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 2.431 -2.656 -0.221 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 -2.050 -1.991 -0.279 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 -2.575 -4.936 -0.585 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 2.966 -8.121 -4.240 1.00 0.00 H new ATOM 0 H5'' DT A 1 1.495 -8.273 -3.300 1.00 0.00 H new ATOM 0 H4' DT A 1 3.876 -6.596 -2.924 1.00 0.00 H new ATOM 0 H3' DT A 1 2.851 -8.657 -1.203 1.00 0.00 H new ATOM 0 H2' DT A 1 1.257 -7.218 -0.185 1.00 0.00 H new ATOM 0 H2'' DT A 1 2.684 -6.812 0.748 1.00 0.00 H new ATOM 0 H1' DT A 1 3.043 -4.833 -0.355 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 -2.429 -5.832 -1.188 1.00 0.00 H new ATOM 0 H72 DT A 1 -2.921 -5.220 0.409 1.00 0.00 H new ATOM 0 H73 DT A 1 -3.320 -4.296 -1.059 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 5.098 -8.104 0.517 1.00 0.00 P ATOM 34 OP1 DG A 2 6.412 -8.771 0.380 1.00 0.00 O ATOM 35 OP2 DG A 2 4.132 -9.001 1.190 1.00 0.00 O ATOM 36 O5' DG A 2 5.213 -6.644 1.260 1.00 0.00 O ATOM 37 C5' DG A 2 6.336 -5.808 0.864 1.00 0.00 C ATOM 38 C4' DG A 2 6.439 -4.427 1.548 1.00 0.00 C ATOM 39 O4' DG A 2 5.231 -3.662 1.474 1.00 0.00 O ATOM 40 C3' DG A 2 6.799 -4.607 3.021 1.00 0.00 C ATOM 41 O3' DG A 2 8.096 -4.030 3.324 1.00 0.00 O ATOM 42 C2' DG A 2 5.603 -4.084 3.780 1.00 0.00 C ATOM 43 C1' DG A 2 4.947 -3.162 2.783 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 3.434 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 6.283 -5.652 -0.214 1.00 0.00 H new ATOM 0 H5'' DG A 2 7.257 -6.357 1.062 1.00 0.00 H new ATOM 0 H4' DG A 2 7.212 -3.879 1.009 1.00 0.00 H new ATOM 0 H3' DG A 2 6.960 -5.641 3.325 1.00 0.00 H new ATOM 0 H2' DG A 2 4.935 -4.889 4.086 1.00 0.00 H new ATOM 0 H2'' DG A 2 5.899 -3.555 4.686 1.00 0.00 H new ATOM 0 H1' DG A 2 5.358 -2.164 2.937 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 3.437 1.00 0.00 H new ATOM 0 H22 DG A 2 1.872 2.334 3.493 1.00 0.00 H new ATOM 66 P DA A 3 8.588 -3.972 4.881 1.00 0.00 P ATOM 67 OP1 DA A 3 10.062 -3.903 4.982 1.00 0.00 O ATOM 68 OP2 DA A 3 8.067 -5.101 5.683 1.00 0.00 O ATOM 69 O5' DA A 3 7.882 -2.553 5.292 1.00 0.00 O ATOM 70 C5' DA A 3 8.314 -1.397 4.539 1.00 0.00 C ATOM 71 C4' DA A 3 7.757 -0.045 4.899 1.00 0.00 C ATOM 72 O4' DA A 3 6.343 0.042 4.770 1.00 0.00 O ATOM 73 C3' DA A 3 8.231 0.312 6.291 1.00 0.00 C ATOM 74 O3' DA A 3 8.766 1.665 6.292 1.00 0.00 O ATOM 75 C2' DA A 3 6.974 0.071 7.037 1.00 0.00 C ATOM 76 C1' DA A 3 5.866 0.357 6.061 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 0.280 -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 8.081 -1.581 3.490 1.00 0.00 H new ATOM 0 H5'' DA A 3 9.399 -1.338 4.619 1.00 0.00 H new ATOM 0 H4' DA A 3 8.134 0.684 4.182 1.00 0.00 H new ATOM 0 H3' DA A 3 9.062 -0.244 6.726 1.00 0.00 H new ATOM 0 H2' DA A 3 6.923 -0.956 7.399 1.00 0.00 H new ATOM 0 H2'' DA A 3 6.905 0.720 7.910 1.00 0.00 H new ATOM 0 H1' DA A 3 5.604 1.411 6.150 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 -0.719 -1.654 6.711 1.00 0.00 H new ATOM 0 H62 DA A 3 0.617 -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 9.375 2.274 7.672 1.00 0.00 P ATOM 99 OP1 DT A 4 10.433 3.274 7.405 1.00 0.00 O ATOM 100 OP2 DT A 4 9.872 1.224 8.587 1.00 0.00 O ATOM 101 O5' DT A 4 8.002 2.966 8.222 1.00 0.00 O ATOM 102 C5' DT A 4 7.492 4.098 7.469 1.00 0.00 C ATOM 103 C4' DT A 4 6.182 4.643 8.038 1.00 0.00 C ATOM 104 O4' DT A 4 5.161 3.630 8.002 1.00 0.00 O ATOM 105 C3' DT A 4 6.289 5.273 9.427 1.00 0.00 C ATOM 106 O3' DT A 4 5.731 6.619 9.390 1.00 0.00 O ATOM 107 C2' DT A 4 5.475 4.281 10.196 1.00 0.00 C ATOM 108 C1' DT A 4 4.481 3.701 9.244 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 1.781 3.137 9.914 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 2.526 -1.334 9.868 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 5.417 -0.996 9.645 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 7.337 3.799 6.432 1.00 0.00 H new ATOM 0 H5'' DT A 4 8.239 4.892 7.463 1.00 0.00 H new ATOM 0 H4' DT A 4 5.905 5.471 7.385 1.00 0.00 H new ATOM 0 H3' DT A 4 7.284 5.424 9.846 1.00 0.00 H new ATOM 0 H2' DT A 4 6.111 3.500 10.613 1.00 0.00 H new ATOM 0 H2'' DT A 4 4.971 4.762 11.034 1.00 0.00 H new ATOM 0 H1' DT A 4 3.585 4.314 9.147 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 5.080 -1.838 10.249 1.00 0.00 H new ATOM 0 H72 DT A 4 5.574 -1.326 8.618 1.00 0.00 H new ATOM 0 H73 DT A 4 6.353 -0.611 10.049 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 5.976 7.586 10.674 1.00 0.00 P ATOM 131 OP1 DC A 5 6.071 9.011 10.287 1.00 0.00 O ATOM 132 OP2 DC A 5 7.150 7.189 11.482 1.00 0.00 O ATOM 133 O5' DC A 5 4.571 7.229 11.413 1.00 0.00 O ATOM 134 C5' DC A 5 3.375 7.885 10.915 1.00 0.00 C ATOM 135 C4' DC A 5 2.182 7.610 11.857 1.00 0.00 C ATOM 136 O4' DC A 5 1.722 6.247 11.745 1.00 0.00 O ATOM 137 C3' DC A 5 2.467 7.994 13.315 1.00 0.00 C ATOM 138 O3' DC A 5 1.434 8.879 13.850 1.00 0.00 O ATOM 139 C2' DC A 5 2.443 6.612 13.910 1.00 0.00 C ATOM 140 C1' DC A 5 1.519 5.734 13.058 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 -0.398 3.605 13.316 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 2.801 0.289 13.275 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 3.146 7.526 9.912 1.00 0.00 H new ATOM 0 H5'' DC A 5 3.546 8.959 10.838 1.00 0.00 H new ATOM 0 H4' DC A 5 1.374 8.262 11.525 1.00 0.00 H new ATOM 0 H3' DC A 5 3.379 8.560 13.505 1.00 0.00 H new ATOM 0 H2' DC A 5 3.449 6.192 13.934 1.00 0.00 H new ATOM 0 H2'' DC A 5 2.088 6.649 14.940 1.00 0.00 H new ATOM 0 H1' DC A 5 0.497 5.791 13.433 1.00 0.00 H new ATOM 0 H41 DC A 5 3.782 0.019 13.199 1.00 0.00 H new ATOM 0 H42 DC A 5 2.084 -0.425 13.406 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 1.492 9.300 15.435 1.00 0.00 P ATOM 161 OP1 DA A 6 1.134 10.720 15.644 1.00 0.00 O ATOM 162 OP2 DA A 6 2.793 8.999 16.070 1.00 0.00 O ATOM 163 O5' DA A 6 0.311 8.292 15.970 1.00 0.00 O ATOM 164 C5' DA A 6 -1.014 8.551 15.446 1.00 0.00 C ATOM 165 C4' DA A 6 -2.174 7.760 16.093 1.00 0.00 C ATOM 166 O4' DA A 6 -2.185 6.397 15.642 1.00 0.00 O ATOM 167 C3' DA A 6 -2.260 7.789 17.619 1.00 0.00 C ATOM 168 O3' DA A 6 -3.567 8.112 18.111 1.00 0.00 O ATOM 169 C2' DA A 6 -1.880 6.375 17.992 1.00 0.00 C ATOM 170 C1' DA A 6 -2.127 5.501 16.755 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 16.736 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 -1.007 8.336 14.378 1.00 0.00 H new ATOM 0 H5'' DA A 6 -1.223 9.615 15.555 1.00 0.00 H new ATOM 0 H4' DA A 6 -3.058 8.299 15.751 1.00 0.00 H new ATOM 0 H3' DA A 6 -1.622 8.560 18.050 1.00 0.00 H new ATOM 0 H2' DA A 6 -0.835 6.325 18.297 1.00 0.00 H new ATOM 0 H2'' DA A 6 -2.475 6.026 18.836 1.00 0.00 H new ATOM 0 HO3' DA A 6 -3.557 8.113 19.091 1.00 0.00 H new ATOM 0 H1' DA A 6 -3.040 4.931 16.928 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 16.832 1.00 0.00 H new ATOM 0 H62 DA A 6 2.465 1.446 16.629 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 0.986 -8.233 20.429 1.00 0.00 P ATOM 194 OP1 DT B 1 2.220 -8.553 19.680 1.00 0.00 O ATOM 195 OP2 DT B 1 0.926 -8.489 21.885 1.00 0.00 O ATOM 196 O5' DT B 1 -0.162 -7.334 19.722 1.00 0.00 O ATOM 197 C5' DT B 1 -1.513 -7.765 19.996 1.00 0.00 C ATOM 198 C4' DT B 1 -2.593 -7.065 19.133 1.00 0.00 C ATOM 199 O4' DT B 1 -2.284 -5.680 18.954 1.00 0.00 O ATOM 200 C3' DT B 1 -2.892 -7.758 17.796 1.00 0.00 C ATOM 201 O3' DT B 1 -4.325 -7.695 17.511 1.00 0.00 O ATOM 202 C2' DT B 1 -2.082 -6.839 16.934 1.00 0.00 C ATOM 203 C1' DT B 1 -2.180 -5.449 17.563 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 -2.434 -2.665 17.115 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 17.180 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 2.562 -4.906 17.673 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 -1.733 -7.585 21.048 1.00 0.00 H new ATOM 0 H5'' DT B 1 -1.578 -8.841 19.836 1.00 0.00 H new ATOM 0 H4' DT B 1 -3.520 -7.149 19.700 1.00 0.00 H new ATOM 0 H3' DT B 1 -2.658 -8.818 17.700 1.00 0.00 H new ATOM 0 H2' DT B 1 -1.044 -7.169 16.884 1.00 0.00 H new ATOM 0 H2'' DT B 1 -2.463 -6.830 15.913 1.00 0.00 H new ATOM 0 H1' DT B 1 -3.030 -4.953 17.095 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 2.350 -5.816 18.234 1.00 0.00 H new ATOM 0 H72 DT B 1 3.063 -5.163 16.740 1.00 0.00 H new ATOM 0 H73 DT B 1 3.208 -4.257 18.265 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 -4.859 -8.226 16.060 1.00 0.00 P ATOM 226 OP1 DG B 2 -6.130 -8.974 16.181 1.00 0.00 O ATOM 227 OP2 DG B 2 -3.851 -9.038 15.342 1.00 0.00 O ATOM 228 O5' DG B 2 -5.062 -6.745 15.381 1.00 0.00 O ATOM 229 C5' DG B 2 -6.238 -6.005 15.811 1.00 0.00 C ATOM 230 C4' DG B 2 -6.408 -4.586 15.223 1.00 0.00 C ATOM 231 O4' DG B 2 -5.249 -3.756 15.355 1.00 0.00 O ATOM 232 C3' DG B 2 -6.760 -4.686 13.742 1.00 0.00 C ATOM 233 O3' DG B 2 -8.050 -4.082 13.465 1.00 0.00 O ATOM 234 C2' DG B 2 -5.559 -4.111 13.033 1.00 0.00 C ATOM 235 C1' DG B 2 -4.952 -3.198 14.071 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 0.791 -1.589 13.675 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 13.461 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 -6.213 -5.924 16.898 1.00 0.00 H new ATOM 0 H5'' DG B 2 -7.122 -6.589 15.555 1.00 0.00 H new ATOM 0 H4' DG B 2 -7.206 -4.118 15.800 1.00 0.00 H new ATOM 0 H3' DG B 2 -6.922 -5.700 13.378 1.00 0.00 H new ATOM 0 H2' DG B 2 -4.862 -4.890 12.725 1.00 0.00 H new ATOM 0 H2'' DG B 2 -5.845 -3.565 12.134 1.00 0.00 H new ATOM 0 H1' DG B 2 -5.384 -2.207 13.934 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 13.458 1.00 0.00 H new ATOM 0 H22 DG B 2 -1.872 2.332 13.398 1.00 0.00 H new ATOM 258 P DA B 3 -8.559 -4.012 11.917 1.00 0.00 P ATOM 259 OP1 DA B 3 -10.035 -3.954 11.832 1.00 0.00 O ATOM 260 OP2 DA B 3 -8.037 -5.124 11.094 1.00 0.00 O ATOM 261 O5' DA B 3 -7.868 -2.582 11.524 1.00 0.00 O ATOM 262 C5' DA B 3 -8.335 -1.433 12.269 1.00 0.00 C ATOM 263 C4' DA B 3 -7.806 -0.072 11.904 1.00 0.00 C ATOM 264 O4' DA B 3 -6.396 0.047 12.076 1.00 0.00 O ATOM 265 C3' DA B 3 -8.251 0.251 10.494 1.00 0.00 C ATOM 266 O3' DA B 3 -8.837 1.580 10.438 1.00 0.00 O ATOM 267 C2' DA B 3 -6.963 0.037 9.795 1.00 0.00 C ATOM 268 C1' DA B 3 -5.883 0.350 10.796 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 -0.279 -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 -8.106 -1.606 13.321 1.00 0.00 H new ATOM 0 H5'' DA B 3 -9.421 -1.400 12.180 1.00 0.00 H new ATOM 0 H4' DA B 3 -8.222 0.663 12.592 1.00 0.00 H new ATOM 0 H3' DA B 3 -9.054 -0.337 10.049 1.00 0.00 H new ATOM 0 H2' DA B 3 -6.879 -0.990 9.440 1.00 0.00 H new ATOM 0 H2'' DA B 3 -6.883 0.683 8.921 1.00 0.00 H new ATOM 0 H1' DA B 3 -5.625 1.405 10.701 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 0.720 -1.653 10.188 1.00 0.00 H new ATOM 0 H62 DA B 3 -0.616 -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 -9.388 2.134 9.009 1.00 0.00 P ATOM 291 OP1 DT B 4 -10.504 3.089 9.188 1.00 0.00 O ATOM 292 OP2 DT B 4 -9.779 1.045 8.088 1.00 0.00 O ATOM 293 O5' DT B 4 -8.018 2.879 8.527 1.00 0.00 O ATOM 294 C5' DT B 4 -7.578 4.018 9.312 1.00 0.00 C ATOM 295 C4' DT B 4 -6.255 4.600 8.811 1.00 0.00 C ATOM 296 O4' DT B 4 -5.215 3.607 8.878 1.00 0.00 O ATOM 297 C3' DT B 4 -6.320 5.249 7.430 1.00 0.00 C ATOM 298 O3' DT B 4 -5.780 6.600 7.513 1.00 0.00 O ATOM 299 C2' DT B 4 -5.468 4.275 6.680 1.00 0.00 C ATOM 300 C1' DT B 4 -4.498 3.693 7.657 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 -2.525 -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 -5.408 -1.003 7.213 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 -7.467 3.716 10.353 1.00 0.00 H new ATOM 0 H5'' DT B 4 -8.345 4.792 9.285 1.00 0.00 H new ATOM 0 H4' DT B 4 -6.019 5.422 9.487 1.00 0.00 H new ATOM 0 H3' DT B 4 -7.298 5.397 6.972 1.00 0.00 H new ATOM 0 H2' DT B 4 -6.081 3.492 6.233 1.00 0.00 H new ATOM 0 H2'' DT B 4 -4.942 4.772 5.865 1.00 0.00 H new ATOM 0 H1' DT B 4 -3.608 4.308 7.790 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 -5.061 -1.823 6.585 1.00 0.00 H new ATOM 0 H72 DT B 4 -5.570 -1.367 8.228 1.00 0.00 H new ATOM 0 H73 DT B 4 -6.344 -0.612 6.814 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 -5.964 7.578 6.228 1.00 0.00 P ATOM 323 OP1 DC B 5 -6.059 9.002 6.621 1.00 0.00 O ATOM 324 OP2 DC B 5 -7.108 7.199 5.371 1.00 0.00 O ATOM 325 O5' DC B 5 -4.535 7.211 5.546 1.00 0.00 O ATOM 326 C5' DC B 5 -3.347 7.828 6.108 1.00 0.00 C ATOM 327 C4' DC B 5 -2.134 7.560 5.189 1.00 0.00 C ATOM 328 O4' DC B 5 -1.710 6.182 5.244 1.00 0.00 O ATOM 329 C3' DC B 5 -2.377 8.016 3.745 1.00 0.00 C ATOM 330 O3' DC B 5 -1.304 8.893 3.280 1.00 0.00 O ATOM 331 C2' DC B 5 -2.386 6.664 3.087 1.00 0.00 C ATOM 332 C1' DC B 5 -1.499 5.726 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 3.589 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 3.627 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 -3.155 7.429 7.104 1.00 0.00 H new ATOM 0 H5'' DC B 5 -3.501 8.901 6.219 1.00 0.00 H new ATOM 0 H4' DC B 5 -1.317 8.169 5.577 1.00 0.00 H new ATOM 0 H3' DC B 5 -3.268 8.616 3.558 1.00 0.00 H new ATOM 0 H2' DC B 5 -3.403 6.275 3.032 1.00 0.00 H new ATOM 0 H2'' DC B 5 -2.016 6.736 2.064 1.00 0.00 H new ATOM 0 H1' DC B 5 -0.472 5.778 3.549 1.00 0.00 H new ATOM 0 H41 DC B 5 -3.782 0.019 3.704 1.00 0.00 H new ATOM 0 H42 DC B 5 -2.084 -0.425 3.497 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 -1.306 9.394 1.719 1.00 0.00 P ATOM 353 OP1 DA B 6 -0.853 10.796 1.588 1.00 0.00 O ATOM 354 OP2 DA B 6 -2.614 9.213 1.053 1.00 0.00 O ATOM 355 O5' DA B 6 -0.185 8.339 1.149 1.00 0.00 O ATOM 356 C5' DA B 6 1.144 8.486 1.704 1.00 0.00 C ATOM 357 C4' DA B 6 2.270 7.702 0.994 1.00 0.00 C ATOM 358 O4' DA B 6 2.238 6.315 1.360 1.00 0.00 O ATOM 359 C3' DA B 6 2.333 7.826 -0.528 1.00 0.00 C ATOM 360 O3' DA B 6 3.638 8.150 -1.022 1.00 0.00 O ATOM 361 C2' DA B 6 1.908 6.451 -0.984 1.00 0.00 C ATOM 362 C1' DA B 6 2.143 5.495 0.193 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 0.830 0.164 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 1.116 8.175 2.748 1.00 0.00 H new ATOM 0 H5'' DA B 6 1.404 9.544 1.694 1.00 0.00 H new ATOM 0 H4' DA B 6 3.178 8.186 1.354 1.00 0.00 H new ATOM 0 H3' DA B 6 1.708 8.639 -0.898 1.00 0.00 H new ATOM 0 H2' DA B 6 0.858 6.450 -1.278 1.00 0.00 H new ATOM 0 H2'' DA B 6 2.484 6.139 -1.855 1.00 0.00 H new ATOM 0 HO3' DA B 6 3.611 8.213 -2.000 1.00 0.00 H new ATOM 0 H1' DA B 6 3.039 4.915 -0.031 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 -1.792 -0.177 0.068 1.00 0.00 H new ATOM 0 H62 DA B 6 -2.465 1.444 0.271 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