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= -3.5! (180deg=-5.46!) 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= -3.73! (180deg=-5.87!) USER MOD Single : B 6 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 P DT A 1 0.791 -8.096 -5.491 1.00 0.00 P ATOM 2 OP1 DT A 1 1.588 -8.579 -6.641 1.00 0.00 O ATOM 3 OP2 DT A 1 -0.432 -8.839 -5.114 1.00 0.00 O ATOM 4 O5' DT A 1 1.518 -7.172 -4.374 1.00 0.00 O ATOM 5 C5' DT A 1 2.208 -7.942 -3.364 1.00 0.00 C ATOM 6 C4' DT A 1 2.847 -7.078 -2.240 1.00 0.00 C ATOM 7 O4' DT A 1 2.200 -5.796 -2.070 1.00 0.00 O ATOM 8 C3' DT A 1 2.984 -7.768 -0.858 1.00 0.00 C ATOM 9 O3' DT A 1 4.401 -7.809 -0.510 1.00 0.00 O ATOM 10 C2' DT A 1 2.152 -6.817 -0.023 1.00 0.00 C ATOM 11 C1' DT A 1 2.184 -5.448 -0.689 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 2.433 -2.663 -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 -1.991 -0.277 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 -2.591 -4.911 -0.570 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 2.989 -8.533 -3.842 1.00 0.00 H new ATOM 0 H5'' DT A 1 1.506 -8.644 -2.914 1.00 0.00 H new ATOM 0 H4' DT A 1 3.859 -6.928 -2.616 1.00 0.00 H new ATOM 0 H3' DT A 1 2.654 -8.802 -0.758 1.00 0.00 H new ATOM 0 H2' DT A 1 1.126 -7.178 0.056 1.00 0.00 H new ATOM 0 H2'' DT A 1 2.547 -6.756 0.991 1.00 0.00 H new ATOM 0 H1' DT A 1 3.030 -4.883 -0.298 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 -2.470 -5.809 -1.177 1.00 0.00 H new ATOM 0 H72 DT A 1 -2.930 -5.190 0.428 1.00 0.00 H new ATOM 0 H73 DT A 1 -3.329 -4.256 -1.034 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 4.845 -8.234 1.004 1.00 0.00 P ATOM 34 OP1 DG A 2 6.101 -9.014 1.012 1.00 0.00 O ATOM 35 OP2 DG A 2 3.779 -8.963 1.727 1.00 0.00 O ATOM 36 O5' DG A 2 5.052 -6.710 1.573 1.00 0.00 O ATOM 37 C5' DG A 2 6.200 -5.981 1.056 1.00 0.00 C ATOM 38 C4' DG A 2 6.390 -4.555 1.615 1.00 0.00 C ATOM 39 O4' DG A 2 5.225 -3.732 1.508 1.00 0.00 O ATOM 40 C3' DG A 2 6.784 -4.642 3.085 1.00 0.00 C ATOM 41 O3' DG A 2 8.069 -4.011 3.318 1.00 0.00 O ATOM 42 C2' DG A 2 5.592 -4.087 3.825 1.00 0.00 C ATOM 43 C1' DG A 2 4.949 -3.185 2.800 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 -0.790 -1.590 3.224 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 1.623 3.443 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 6.110 -5.918 -0.028 1.00 0.00 H new ATOM 0 H5'' DG A 2 7.100 -6.558 1.268 1.00 0.00 H new ATOM 0 H4' DG A 2 7.169 -4.090 1.010 1.00 0.00 H new ATOM 0 H3' DG A 2 6.975 -5.650 3.452 1.00 0.00 H new ATOM 0 H2' DG A 2 4.915 -4.877 4.150 1.00 0.00 H new ATOM 0 H2'' DG A 2 5.891 -3.536 4.717 1.00 0.00 H new ATOM 0 H1' DG A 2 5.374 -2.190 2.932 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 1.900 3.446 1.00 0.00 H new ATOM 0 H22 DG A 2 1.872 2.332 3.509 1.00 0.00 H new ATOM 66 P DA A 3 8.637 -3.945 4.845 1.00 0.00 P ATOM 67 OP1 DA A 3 10.112 -3.843 4.873 1.00 0.00 O ATOM 68 OP2 DA A 3 8.180 -5.082 5.673 1.00 0.00 O ATOM 69 O5' DA A 3 7.919 -2.541 5.282 1.00 0.00 O ATOM 70 C5' DA A 3 8.330 -1.372 4.535 1.00 0.00 C ATOM 71 C4' DA A 3 7.775 -0.033 4.935 1.00 0.00 C ATOM 72 O4' DA A 3 6.362 0.054 4.796 1.00 0.00 O ATOM 73 C3' DA A 3 8.245 0.278 6.340 1.00 0.00 C ATOM 74 O3' DA A 3 8.828 1.608 6.387 1.00 0.00 O ATOM 75 C2' DA A 3 6.973 0.053 7.067 1.00 0.00 C ATOM 76 C1' DA A 3 5.874 0.357 6.084 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 6.615 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 8.071 -1.539 3.489 1.00 0.00 H new ATOM 0 H5'' DA A 3 9.417 -1.310 4.589 1.00 0.00 H new ATOM 0 H4' DA A 3 8.156 0.724 4.250 1.00 0.00 H new ATOM 0 H3' DA A 3 9.056 -0.312 6.768 1.00 0.00 H new ATOM 0 H2' DA A 3 6.904 -0.975 7.424 1.00 0.00 H new ATOM 0 H2'' DA A 3 6.904 0.700 7.942 1.00 0.00 H new ATOM 0 H1' DA A 3 5.615 1.411 6.185 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 6.710 1.00 0.00 H new ATOM 0 H62 DA A 3 0.617 -2.794 6.523 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 9.414 2.160 7.801 1.00 0.00 P ATOM 99 OP1 DT A 4 10.515 3.127 7.595 1.00 0.00 O ATOM 100 OP2 DT A 4 9.844 1.069 8.704 1.00 0.00 O ATOM 101 O5' DT A 4 8.050 2.886 8.325 1.00 0.00 O ATOM 102 C5' DT A 4 7.582 4.028 7.561 1.00 0.00 C ATOM 103 C4' DT A 4 6.267 4.598 8.096 1.00 0.00 C ATOM 104 O4' DT A 4 5.225 3.608 8.030 1.00 0.00 O ATOM 105 C3' DT A 4 6.355 5.221 9.489 1.00 0.00 C ATOM 106 O3' DT A 4 5.865 6.591 9.439 1.00 0.00 O ATOM 107 C2' DT A 4 5.480 4.261 10.230 1.00 0.00 C ATOM 108 C1' DT A 4 4.505 3.693 9.250 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 9.912 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 9.869 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 5.412 -1.000 9.660 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 7.449 3.733 6.520 1.00 0.00 H new ATOM 0 H5'' DT A 4 8.344 4.807 7.577 1.00 0.00 H new ATOM 0 H4' DT A 4 6.021 5.431 7.438 1.00 0.00 H new ATOM 0 H3' DT A 4 7.340 5.330 9.942 1.00 0.00 H new ATOM 0 H2' DT A 4 6.077 3.468 10.681 1.00 0.00 H new ATOM 0 H2'' DT A 4 4.957 4.767 11.042 1.00 0.00 H new ATOM 0 H1' DT A 4 3.619 4.314 9.120 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 5.070 -1.834 10.273 1.00 0.00 H new ATOM 0 H72 DT A 4 5.570 -1.342 8.637 1.00 0.00 H new ATOM 0 H73 DT A 4 6.348 -0.614 10.062 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 6.071 7.525 10.754 1.00 0.00 P ATOM 131 OP1 DC A 5 6.211 8.956 10.404 1.00 0.00 O ATOM 132 OP2 DC A 5 7.201 7.086 11.602 1.00 0.00 O ATOM 133 O5' DC A 5 4.630 7.183 11.424 1.00 0.00 O ATOM 134 C5' DC A 5 3.459 7.827 10.856 1.00 0.00 C ATOM 135 C4' DC A 5 2.227 7.569 11.753 1.00 0.00 C ATOM 136 O4' DC A 5 1.773 6.201 11.674 1.00 0.00 O ATOM 137 C3' DC A 5 2.454 8.004 13.206 1.00 0.00 C ATOM 138 O3' DC A 5 1.397 8.903 13.662 1.00 0.00 O ATOM 139 C2' DC A 5 2.416 6.643 13.846 1.00 0.00 C ATOM 140 C1' DC A 5 1.523 5.732 12.997 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 3.604 13.312 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 3.275 7.445 9.852 1.00 0.00 H new ATOM 0 H5'' DC A 5 3.633 8.899 10.762 1.00 0.00 H new ATOM 0 H4' DC A 5 1.429 8.198 11.358 1.00 0.00 H new ATOM 0 H3' DC A 5 3.355 8.580 13.417 1.00 0.00 H new ATOM 0 H2' DC A 5 3.422 6.229 13.916 1.00 0.00 H new ATOM 0 H2'' DC A 5 2.029 6.713 14.862 1.00 0.00 H new ATOM 0 H1' DC A 5 0.489 5.798 13.335 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 1.382 9.378 15.232 1.00 0.00 P ATOM 161 OP1 DA A 6 0.951 10.785 15.380 1.00 0.00 O ATOM 162 OP2 DA A 6 2.675 9.162 15.916 1.00 0.00 O ATOM 163 O5' DA A 6 0.233 8.333 15.765 1.00 0.00 O ATOM 164 C5' DA A 6 -1.080 8.502 15.179 1.00 0.00 C ATOM 165 C4' DA A 6 -2.228 7.711 15.845 1.00 0.00 C ATOM 166 O4' DA A 6 -2.185 6.321 15.485 1.00 0.00 O ATOM 167 C3' DA A 6 -2.345 7.838 17.364 1.00 0.00 C ATOM 168 O3' DA A 6 -3.667 8.170 17.808 1.00 0.00 O ATOM 169 C2' DA A 6 -1.942 6.462 17.837 1.00 0.00 C ATOM 170 C1' DA A 6 -2.145 5.502 16.658 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 1.657 0.830 16.737 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 -1.027 8.212 14.130 1.00 0.00 H new ATOM 0 H5'' DA A 6 -1.333 9.562 15.205 1.00 0.00 H new ATOM 0 H4' DA A 6 -3.122 8.189 15.445 1.00 0.00 H new ATOM 0 H3' DA A 6 -1.731 8.648 17.757 1.00 0.00 H new ATOM 0 H2' DA A 6 -0.902 6.456 18.164 1.00 0.00 H new ATOM 0 H2'' DA A 6 -2.546 6.156 18.691 1.00 0.00 H new ATOM 0 HO3' DA A 6 -3.677 8.235 18.786 1.00 0.00 H new ATOM 0 H1' DA A 6 -3.054 4.931 16.846 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 1.791 -0.177 16.833 1.00 0.00 H new ATOM 0 H62 DA A 6 2.464 1.444 16.631 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 -0.926 -7.009 22.806 1.00 0.00 P ATOM 194 OP1 DT B 1 0.304 -7.755 22.458 1.00 0.00 O ATOM 195 OP2 DT B 1 -1.203 -6.669 24.219 1.00 0.00 O ATOM 196 O5' DT B 1 -1.853 -6.388 21.631 1.00 0.00 O ATOM 197 C5' DT B 1 -2.351 -7.368 20.689 1.00 0.00 C ATOM 198 C4' DT B 1 -2.971 -6.716 19.420 1.00 0.00 C ATOM 199 O4' DT B 1 -2.279 -5.504 19.068 1.00 0.00 O ATOM 200 C3' DT B 1 -3.110 -7.598 18.148 1.00 0.00 C ATOM 201 O3' DT B 1 -4.531 -7.637 17.804 1.00 0.00 O ATOM 202 C2' DT B 1 -2.234 -6.822 17.184 1.00 0.00 C ATOM 203 C1' DT B 1 -2.215 -5.379 17.657 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 17.119 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 2.574 -4.921 17.562 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 -3.102 -7.988 21.178 1.00 0.00 H new ATOM 0 H5'' DT B 1 -1.536 -8.029 20.393 1.00 0.00 H new ATOM 0 H4' DT B 1 -3.996 -6.528 19.741 1.00 0.00 H new ATOM 0 H3' DT B 1 -2.808 -8.644 18.200 1.00 0.00 H new ATOM 0 H2' DT B 1 -1.225 -7.234 17.164 1.00 0.00 H new ATOM 0 H2'' DT B 1 -2.626 -6.889 16.169 1.00 0.00 H new ATOM 0 H1' DT B 1 -3.029 -4.871 17.139 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 2.402 -5.823 18.149 1.00 0.00 H new ATOM 0 H72 DT B 1 2.985 -5.194 16.590 1.00 0.00 H new ATOM 0 H73 DT B 1 3.279 -4.276 18.086 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 -5.014 -8.154 16.332 1.00 0.00 P ATOM 226 OP1 DG B 2 -6.313 -8.858 16.397 1.00 0.00 O ATOM 227 OP2 DG B 2 -3.999 -9.006 15.672 1.00 0.00 O ATOM 228 O5' DG B 2 -5.140 -6.673 15.629 1.00 0.00 O ATOM 229 C5' DG B 2 -6.273 -5.861 16.048 1.00 0.00 C ATOM 230 C4' DG B 2 -6.392 -4.460 15.406 1.00 0.00 C ATOM 231 O4' DG B 2 -5.191 -3.685 15.459 1.00 0.00 O ATOM 232 C3' DG B 2 -6.802 -4.595 13.942 1.00 0.00 C ATOM 233 O3' DG B 2 -8.084 -3.957 13.705 1.00 0.00 O ATOM 234 C2' DG B 2 -5.618 -4.080 13.158 1.00 0.00 C ATOM 235 C1' DG B 2 -4.943 -3.167 14.147 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 13.675 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 13.460 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 -6.223 -5.737 17.130 1.00 0.00 H new ATOM 0 H5'' DG B 2 -7.187 -6.414 15.832 1.00 0.00 H new ATOM 0 H4' DG B 2 -7.144 -3.934 15.994 1.00 0.00 H new ATOM 0 H3' DG B 2 -7.001 -5.616 13.617 1.00 0.00 H new ATOM 0 H2' DG B 2 -4.961 -4.889 12.838 1.00 0.00 H new ATOM 0 H2'' DG B 2 -5.928 -3.547 12.259 1.00 0.00 H new ATOM 0 H1' DG B 2 -5.362 -2.170 14.012 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 13.457 1.00 0.00 H new ATOM 0 H22 DG B 2 -1.872 2.332 13.397 1.00 0.00 H new ATOM 258 P DA B 3 -8.671 -3.920 12.184 1.00 0.00 P ATOM 259 OP1 DA B 3 -10.145 -3.800 12.174 1.00 0.00 O ATOM 260 OP2 DA B 3 -8.242 -5.086 11.382 1.00 0.00 O ATOM 261 O5' DA B 3 -7.942 -2.538 11.696 1.00 0.00 O ATOM 262 C5' DA B 3 -8.337 -1.339 12.403 1.00 0.00 C ATOM 263 C4' DA B 3 -7.788 -0.019 11.935 1.00 0.00 C ATOM 264 O4' DA B 3 -6.375 0.070 12.082 1.00 0.00 O ATOM 265 C3' DA B 3 -8.253 0.230 10.515 1.00 0.00 C ATOM 266 O3' DA B 3 -8.879 1.537 10.399 1.00 0.00 O ATOM 267 C2' DA B 3 -6.967 0.016 9.810 1.00 0.00 C ATOM 268 C1' DA B 3 -5.880 0.355 10.795 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 10.283 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 -8.057 -1.463 13.449 1.00 0.00 H new ATOM 0 H5'' DA B 3 -9.425 -1.277 12.369 1.00 0.00 H new ATOM 0 H4' DA B 3 -8.179 0.774 12.573 1.00 0.00 H new ATOM 0 H3' DA B 3 -9.045 -0.398 10.108 1.00 0.00 H new ATOM 0 H2' DA B 3 -6.877 -1.016 9.472 1.00 0.00 H new ATOM 0 H2'' DA B 3 -6.900 0.648 8.925 1.00 0.00 H new ATOM 0 H1' DA B 3 -5.631 1.410 10.679 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 10.188 1.00 0.00 H new ATOM 0 H62 DA B 3 -0.617 -2.794 10.373 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 -9.411 2.024 8.938 1.00 0.00 P ATOM 291 OP1 DT B 4 -10.560 2.948 9.056 1.00 0.00 O ATOM 292 OP2 DT B 4 -9.745 0.892 8.047 1.00 0.00 O ATOM 293 O5' DT B 4 -8.052 2.795 8.461 1.00 0.00 O ATOM 294 C5' DT B 4 -7.649 3.960 9.227 1.00 0.00 C ATOM 295 C4' DT B 4 -6.340 4.572 8.724 1.00 0.00 C ATOM 296 O4' DT B 4 -5.269 3.615 8.831 1.00 0.00 O ATOM 297 C3' DT B 4 -6.413 5.177 7.324 1.00 0.00 C ATOM 298 O3' DT B 4 -5.968 6.563 7.360 1.00 0.00 O ATOM 299 C2' DT B 4 -5.490 4.235 6.617 1.00 0.00 C ATOM 300 C1' DT B 4 -4.526 3.694 7.624 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 -1.784 3.140 6.989 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 7.032 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 -5.403 -1.008 7.238 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 -7.536 3.680 10.274 1.00 0.00 H new ATOM 0 H5'' DT B 4 -8.438 4.711 9.181 1.00 0.00 H new ATOM 0 H4' DT B 4 -6.137 5.421 9.377 1.00 0.00 H new ATOM 0 H3' DT B 4 -7.392 5.252 6.851 1.00 0.00 H new ATOM 0 H2' DT B 4 -6.053 3.425 6.154 1.00 0.00 H new ATOM 0 H2'' DT B 4 -4.958 4.750 5.818 1.00 0.00 H new ATOM 0 H1' DT B 4 -3.651 4.328 7.764 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 -5.054 -1.839 6.624 1.00 0.00 H new ATOM 0 H72 DT B 4 -5.559 -1.353 8.260 1.00 0.00 H new ATOM 0 H73 DT B 4 -6.342 -0.629 6.835 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 -6.158 7.461 6.017 1.00 0.00 P ATOM 323 OP1 DC B 5 -6.349 8.894 6.328 1.00 0.00 O ATOM 324 OP2 DC B 5 -7.247 6.970 5.144 1.00 0.00 O ATOM 325 O5' DC B 5 -4.687 7.148 5.396 1.00 0.00 O ATOM 326 C5' DC B 5 -3.547 7.816 6.000 1.00 0.00 C ATOM 327 C4' DC B 5 -2.277 7.562 5.156 1.00 0.00 C ATOM 328 O4' DC B 5 -1.824 6.193 5.245 1.00 0.00 O ATOM 329 C3' DC B 5 -2.446 8.005 3.699 1.00 0.00 C ATOM 330 O3' DC B 5 -1.365 8.896 3.283 1.00 0.00 O ATOM 331 C2' DC B 5 -2.389 6.646 3.056 1.00 0.00 C ATOM 332 C1' DC B 5 -1.525 5.730 3.928 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 3.604 3.590 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 -2.802 0.290 3.617 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 -3.397 7.451 7.016 1.00 0.00 H new ATOM 0 H5'' DC B 5 -3.738 8.887 6.071 1.00 0.00 H new ATOM 0 H4' DC B 5 -1.496 8.186 5.590 1.00 0.00 H new ATOM 0 H3' DC B 5 -3.335 8.588 3.460 1.00 0.00 H new ATOM 0 H2' DC B 5 -3.393 6.234 2.953 1.00 0.00 H new ATOM 0 H2'' DC B 5 -1.970 6.719 2.053 1.00 0.00 H new ATOM 0 H1' DC B 5 -0.478 5.795 3.632 1.00 0.00 H new ATOM 0 H41 DC B 5 -3.783 0.020 3.694 1.00 0.00 H new ATOM 0 H42 DC B 5 -2.086 -0.423 3.480 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 -1.315 9.403 1.724 1.00 0.00 P ATOM 353 OP1 DA B 6 -0.852 10.804 1.615 1.00 0.00 O ATOM 354 OP2 DA B 6 -2.601 9.231 1.016 1.00 0.00 O ATOM 355 O5' DA B 6 -0.180 8.347 1.182 1.00 0.00 O ATOM 356 C5' DA B 6 1.129 8.478 1.785 1.00 0.00 C ATOM 357 C4' DA B 6 2.269 7.686 1.108 1.00 0.00 C ATOM 358 O4' DA B 6 2.204 6.292 1.445 1.00 0.00 O ATOM 359 C3' DA B 6 2.390 7.836 -0.408 1.00 0.00 C ATOM 360 O3' DA B 6 3.716 8.159 -0.845 1.00 0.00 O ATOM 361 C2' DA B 6 1.969 6.474 -0.905 1.00 0.00 C ATOM 362 C1' DA B 6 2.155 5.494 0.259 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 0.162 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 1.061 8.161 2.826 1.00 0.00 H new ATOM 0 H5'' DA B 6 1.400 9.534 1.791 1.00 0.00 H new ATOM 0 H4' DA B 6 3.169 8.146 1.516 1.00 0.00 H new ATOM 0 H3' DA B 6 1.787 8.660 -0.789 1.00 0.00 H new ATOM 0 H2' DA B 6 0.930 6.488 -1.235 1.00 0.00 H new ATOM 0 H2'' DA B 6 2.571 6.173 -1.762 1.00 0.00 H new ATOM 0 HO3' DA B 6 3.728 8.240 -1.822 1.00 0.00 H new ATOM 0 H1' DA B 6 3.057 4.915 0.062 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 0.066 1.00 0.00 H new ATOM 0 H62 DA B 6 -2.465 1.444 0.267 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