USER MOD reduce.3.24.130724 H: found=0, std=0, add=278, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 280 hydrogens (75 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 NoAdj-H: A 31 DAGHN41 : A 31 DAG N4 : A 32 DSR O1 :(H bumps) USER MOD NoAdj-H: A 36 MTC H12 : A 36 MTC C1 : A 31 DAG O1 :(H bumps) USER MOD Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= -0.543 (180deg=-0.543) USER MOD Single : A 7 DT C7 :methyl 150:sc= -0.631 (180deg=-0.631) USER MOD Single : A 9 DG O3' : rot 180:sc= 0 USER MOD Single : A 15 DC O5' : rot -28:sc= 0.00119 USER MOD Single : A 22 DT C7 :methyl 150:sc= -0.0453 (180deg=-0.0453) USER MOD Single : A 23 DG O3' : rot 180:sc= 0 USER MOD Single : A 31 DAG O3 : rot -106:sc= 0.72 USER MOD Single : A 32 DSR O3 : rot 126:sc= 1.07 USER MOD Single : A 34 MRP O2 : rot 58:sc= 0.161 USER MOD Single : A 34 MRP O4 : rot 180:sc= 0 USER MOD Single : A 36 MTC C16 :methyl 175:sc= -0.513 (180deg=-0.68) USER MOD Single : A 36 MTC O8 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 4.418 -12.435 -12.156 1.00 0.00 O ATOM 2 C5' DC A 1 3.889 -11.493 -11.209 1.00 0.00 C ATOM 3 C4' DC A 1 4.377 -10.042 -11.463 1.00 0.00 C ATOM 4 O4' DC A 1 3.503 -9.347 -12.406 1.00 0.00 O ATOM 5 C3' DC A 1 4.330 -9.161 -10.201 1.00 0.00 C ATOM 6 O3' DC A 1 5.555 -9.080 -9.433 1.00 0.00 O ATOM 7 C2' DC A 1 4.010 -7.771 -10.739 1.00 0.00 C ATOM 8 C1' DC A 1 3.626 -7.939 -12.199 1.00 0.00 C ATOM 9 N1 DC A 1 2.320 -7.279 -12.523 1.00 0.00 N ATOM 10 C2 DC A 1 2.319 -5.994 -13.160 1.00 0.00 C ATOM 11 O2 DC A 1 3.309 -5.523 -13.745 1.00 0.00 O ATOM 12 N3 DC A 1 1.210 -5.205 -13.072 1.00 0.00 N ATOM 13 C4 DC A 1 0.130 -5.618 -12.394 1.00 0.00 C ATOM 14 N4 DC A 1 -0.902 -4.779 -12.260 1.00 0.00 N ATOM 15 C5 DC A 1 0.091 -6.909 -11.773 1.00 0.00 C ATOM 16 C6 DC A 1 1.183 -7.671 -11.840 1.00 0.00 C ATOM 0 H5' DC A 1 4.177 -11.797 -10.203 1.00 0.00 H new ATOM 0 H5'' DC A 1 2.800 -11.517 -11.250 1.00 0.00 H new ATOM 0 H4' DC A 1 5.397 -10.164 -11.829 1.00 0.00 H new ATOM 0 H3' DC A 1 3.608 -9.589 -9.506 1.00 0.00 H new ATOM 0 H2' DC A 1 3.195 -7.317 -10.175 1.00 0.00 H new ATOM 0 H2'' DC A 1 4.872 -7.111 -10.640 1.00 0.00 H new ATOM 0 HO5' DC A 1 4.080 -13.331 -11.949 1.00 0.00 H new ATOM 0 H1' DC A 1 4.377 -7.476 -12.839 1.00 0.00 H new ATOM 0 H41 DC A 1 -1.734 -5.072 -11.748 1.00 0.00 H new ATOM 0 H42 DC A 1 -0.857 -3.846 -12.670 1.00 0.00 H new ATOM 0 H5 DC A 1 -0.797 -7.255 -11.265 1.00 0.00 H new ATOM 0 H6 DC A 1 1.180 -8.630 -11.343 1.00 0.00 H new ATOM 29 P DA A 2 7.068 -9.570 -9.532 1.00 0.00 P ATOM 30 OP1 DA A 2 7.080 -10.960 -10.038 1.00 0.00 O ATOM 31 OP2 DA A 2 7.672 -9.383 -8.190 1.00 0.00 O ATOM 32 O5' DA A 2 7.716 -8.624 -10.661 1.00 0.00 O ATOM 33 C5' DA A 2 8.299 -7.346 -11.079 1.00 0.00 C ATOM 34 C4' DA A 2 8.277 -6.106 -10.135 1.00 0.00 C ATOM 35 O4' DA A 2 6.930 -5.518 -10.125 1.00 0.00 O ATOM 36 C3' DA A 2 8.646 -6.354 -8.658 1.00 0.00 C ATOM 37 O3' DA A 2 9.700 -5.475 -8.201 1.00 0.00 O ATOM 38 C2' DA A 2 7.342 -6.036 -7.925 1.00 0.00 C ATOM 39 C1' DA A 2 6.671 -5.007 -8.830 1.00 0.00 C ATOM 40 N9 DA A 2 5.196 -4.883 -8.675 1.00 0.00 N ATOM 41 C8 DA A 2 4.303 -5.836 -8.246 1.00 0.00 C ATOM 42 N7 DA A 2 3.037 -5.505 -8.375 1.00 0.00 N ATOM 43 C5 DA A 2 3.100 -4.218 -8.902 1.00 0.00 C ATOM 44 C6 DA A 2 2.079 -3.316 -9.265 1.00 0.00 C ATOM 45 N6 DA A 2 0.803 -3.703 -9.232 1.00 0.00 N ATOM 46 N1 DA A 2 2.439 -2.076 -9.684 1.00 0.00 N ATOM 47 C2 DA A 2 3.741 -1.786 -9.780 1.00 0.00 C ATOM 48 N3 DA A 2 4.795 -2.584 -9.562 1.00 0.00 N ATOM 49 C4 DA A 2 4.398 -3.798 -9.093 1.00 0.00 C ATOM 0 H5' DA A 2 7.798 -7.053 -12.002 1.00 0.00 H new ATOM 0 H5'' DA A 2 9.342 -7.538 -11.330 1.00 0.00 H new ATOM 0 H4' DA A 2 9.048 -5.459 -10.552 1.00 0.00 H new ATOM 0 H3' DA A 2 9.022 -7.363 -8.490 1.00 0.00 H new ATOM 0 H2' DA A 2 6.724 -6.925 -7.800 1.00 0.00 H new ATOM 0 H2'' DA A 2 7.528 -5.635 -6.929 1.00 0.00 H new ATOM 0 H1' DA A 2 7.056 -4.013 -8.603 1.00 0.00 H new ATOM 0 H8 DA A 2 4.617 -6.784 -7.835 1.00 0.00 H new ATOM 0 H61 DA A 2 0.065 -3.050 -9.495 1.00 0.00 H new ATOM 0 H62 DA A 2 0.565 -4.652 -8.944 1.00 0.00 H new ATOM 0 H2 DA A 2 3.974 -0.773 -10.072 1.00 0.00 H new ATOM 61 P DC A 3 10.440 -5.181 -6.812 1.00 0.00 P ATOM 62 OP1 DC A 3 11.895 -5.354 -7.016 1.00 0.00 O ATOM 63 OP2 DC A 3 9.851 -6.010 -5.731 1.00 0.00 O ATOM 64 O5' DC A 3 10.115 -3.628 -6.549 1.00 0.00 O ATOM 65 C5' DC A 3 10.405 -2.506 -7.456 1.00 0.00 C ATOM 66 C4' DC A 3 9.361 -1.357 -7.474 1.00 0.00 C ATOM 67 O4' DC A 3 8.006 -1.897 -7.583 1.00 0.00 O ATOM 68 C3' DC A 3 9.375 -0.458 -6.228 1.00 0.00 C ATOM 69 O3' DC A 3 9.981 0.853 -6.482 1.00 0.00 O ATOM 70 C2' DC A 3 7.893 -0.393 -5.772 1.00 0.00 C ATOM 71 C1' DC A 3 7.082 -1.065 -6.890 1.00 0.00 C ATOM 72 N1 DC A 3 5.955 -1.924 -6.388 1.00 0.00 N ATOM 73 C2 DC A 3 4.600 -1.465 -6.504 1.00 0.00 C ATOM 74 O2 DC A 3 4.304 -0.321 -6.874 1.00 0.00 O ATOM 75 N3 DC A 3 3.583 -2.305 -6.144 1.00 0.00 N ATOM 76 C4 DC A 3 3.842 -3.522 -5.657 1.00 0.00 C ATOM 77 N4 DC A 3 2.824 -4.352 -5.411 1.00 0.00 N ATOM 78 C5 DC A 3 5.183 -3.964 -5.434 1.00 0.00 C ATOM 79 C6 DC A 3 6.183 -3.165 -5.826 1.00 0.00 C ATOM 0 H5' DC A 3 10.501 -2.899 -8.468 1.00 0.00 H new ATOM 0 H5'' DC A 3 11.373 -2.086 -7.184 1.00 0.00 H new ATOM 0 H4' DC A 3 9.643 -0.753 -8.336 1.00 0.00 H new ATOM 0 H3' DC A 3 10.007 -0.860 -5.436 1.00 0.00 H new ATOM 0 H2' DC A 3 7.753 -0.910 -4.822 1.00 0.00 H new ATOM 0 H2'' DC A 3 7.574 0.639 -5.624 1.00 0.00 H new ATOM 0 H1' DC A 3 6.623 -0.293 -7.508 1.00 0.00 H new ATOM 0 H41 DC A 3 3.005 -5.284 -5.039 1.00 0.00 H new ATOM 0 H42 DC A 3 1.866 -4.053 -5.595 1.00 0.00 H new ATOM 0 H5 DC A 3 5.384 -4.915 -4.963 1.00 0.00 H new ATOM 0 H6 DC A 3 7.201 -3.502 -5.699 1.00 0.00 H new ATOM 91 P DT A 4 9.580 2.213 -7.263 1.00 0.00 P ATOM 92 OP1 DT A 4 8.841 1.937 -8.503 1.00 0.00 O ATOM 93 OP2 DT A 4 10.735 3.125 -7.447 1.00 0.00 O ATOM 94 O5' DT A 4 8.596 2.990 -6.278 1.00 0.00 O ATOM 95 C5' DT A 4 8.762 3.273 -4.861 1.00 0.00 C ATOM 96 C4' DT A 4 7.493 3.851 -4.202 1.00 0.00 C ATOM 97 O4' DT A 4 6.437 2.825 -4.250 1.00 0.00 O ATOM 98 C3' DT A 4 7.721 4.171 -2.709 1.00 0.00 C ATOM 99 O3' DT A 4 7.344 5.532 -2.371 1.00 0.00 O ATOM 100 C2' DT A 4 6.882 3.113 -1.989 1.00 0.00 C ATOM 101 C1' DT A 4 5.776 2.747 -3.000 1.00 0.00 C ATOM 102 N1 DT A 4 5.248 1.337 -2.891 1.00 0.00 N ATOM 103 C2 DT A 4 3.840 1.110 -3.001 1.00 0.00 C ATOM 104 O2 DT A 4 2.971 1.970 -3.116 1.00 0.00 O ATOM 105 N3 DT A 4 3.460 -0.222 -2.952 1.00 0.00 N ATOM 106 C4 DT A 4 4.285 -1.329 -2.822 1.00 0.00 C ATOM 107 O4 DT A 4 3.783 -2.452 -2.809 1.00 0.00 O ATOM 108 C5 DT A 4 5.706 -1.040 -2.707 1.00 0.00 C ATOM 109 C7 DT A 4 6.677 -2.174 -2.511 1.00 0.00 C ATOM 110 C6 DT A 4 6.111 0.244 -2.764 1.00 0.00 C ATOM 0 H5' DT A 4 9.583 3.978 -4.732 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.045 2.356 -4.345 1.00 0.00 H new ATOM 0 H4' DT A 4 7.225 4.762 -4.737 1.00 0.00 H new ATOM 0 H3' DT A 4 8.771 4.129 -2.419 1.00 0.00 H new ATOM 0 H2' DT A 4 7.482 2.243 -1.724 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.460 3.503 -1.063 1.00 0.00 H new ATOM 0 H1' DT A 4 4.921 3.405 -2.841 1.00 0.00 H new ATOM 0 H3 DT A 4 2.460 -0.409 -3.019 1.00 0.00 H new ATOM 0 H71 DT A 4 7.636 -1.913 -2.957 1.00 0.00 H new ATOM 0 H72 DT A 4 6.811 -2.358 -1.445 1.00 0.00 H new ATOM 0 H73 DT A 4 6.288 -3.073 -2.988 1.00 0.00 H new ATOM 0 H6 DT A 4 7.171 0.442 -2.708 1.00 0.00 H new ATOM 123 P DC A 5 7.126 6.336 -1.005 1.00 0.00 P ATOM 124 OP1 DC A 5 7.286 7.796 -1.222 1.00 0.00 O ATOM 125 OP2 DC A 5 7.976 5.735 0.060 1.00 0.00 O ATOM 126 O5' DC A 5 5.606 6.036 -0.615 1.00 0.00 O ATOM 127 C5' DC A 5 4.411 6.322 -1.401 1.00 0.00 C ATOM 128 C4' DC A 5 3.061 6.062 -0.683 1.00 0.00 C ATOM 129 O4' DC A 5 2.804 4.620 -0.707 1.00 0.00 O ATOM 130 C3' DC A 5 2.981 6.519 0.796 1.00 0.00 C ATOM 131 O3' DC A 5 1.833 7.389 1.023 1.00 0.00 O ATOM 132 C2' DC A 5 2.855 5.183 1.563 1.00 0.00 C ATOM 133 C1' DC A 5 2.299 4.166 0.532 1.00 0.00 C ATOM 134 N1 DC A 5 2.764 2.725 0.652 1.00 0.00 N ATOM 135 C2 DC A 5 1.835 1.651 0.404 1.00 0.00 C ATOM 136 O2 DC A 5 0.609 1.813 0.307 1.00 0.00 O ATOM 137 N3 DC A 5 2.294 0.359 0.312 1.00 0.00 N ATOM 138 C4 DC A 5 3.599 0.095 0.448 1.00 0.00 C ATOM 139 N4 DC A 5 4.021 -1.176 0.386 1.00 0.00 N ATOM 140 C5 DC A 5 4.554 1.132 0.670 1.00 0.00 C ATOM 141 C6 DC A 5 4.113 2.396 0.761 1.00 0.00 C ATOM 0 H5' DC A 5 4.442 5.719 -2.309 1.00 0.00 H new ATOM 0 H5'' DC A 5 4.443 7.367 -1.711 1.00 0.00 H new ATOM 0 H4' DC A 5 2.327 6.658 -1.225 1.00 0.00 H new ATOM 0 H3' DC A 5 3.840 7.110 1.114 1.00 0.00 H new ATOM 0 H2' DC A 5 3.821 4.860 1.951 1.00 0.00 H new ATOM 0 H2'' DC A 5 2.185 5.282 2.417 1.00 0.00 H new ATOM 0 H1' DC A 5 1.219 4.136 0.673 1.00 0.00 H new ATOM 0 H41 DC A 5 5.013 -1.390 0.488 1.00 0.00 H new ATOM 0 H42 DC A 5 3.350 -1.929 0.237 1.00 0.00 H new ATOM 0 H5 DC A 5 5.606 0.905 0.762 1.00 0.00 H new ATOM 0 H6 DC A 5 4.830 3.187 0.925 1.00 0.00 H new ATOM 153 P DC A 6 1.161 8.177 2.246 1.00 0.00 P ATOM 154 OP1 DC A 6 0.481 9.416 1.798 1.00 0.00 O ATOM 155 OP2 DC A 6 2.128 8.341 3.362 1.00 0.00 O ATOM 156 O5' DC A 6 0.045 7.157 2.753 1.00 0.00 O ATOM 157 C5' DC A 6 -1.049 6.596 1.970 1.00 0.00 C ATOM 158 C4' DC A 6 -1.619 5.273 2.505 1.00 0.00 C ATOM 159 O4' DC A 6 -0.599 4.230 2.522 1.00 0.00 O ATOM 160 C3' DC A 6 -2.162 5.334 3.928 1.00 0.00 C ATOM 161 O3' DC A 6 -3.604 5.347 3.913 1.00 0.00 O ATOM 162 C2' DC A 6 -1.645 4.031 4.576 1.00 0.00 C ATOM 163 C1' DC A 6 -0.997 3.230 3.445 1.00 0.00 C ATOM 164 N1 DC A 6 0.215 2.415 3.820 1.00 0.00 N ATOM 165 C2 DC A 6 0.188 0.992 3.639 1.00 0.00 C ATOM 166 O2 DC A 6 -0.866 0.345 3.544 1.00 0.00 O ATOM 167 N3 DC A 6 1.366 0.293 3.612 1.00 0.00 N ATOM 168 C4 DC A 6 2.532 0.932 3.768 1.00 0.00 C ATOM 169 N4 DC A 6 3.667 0.227 3.676 1.00 0.00 N ATOM 170 C5 DC A 6 2.589 2.340 4.016 1.00 0.00 C ATOM 171 C6 DC A 6 1.437 3.020 4.055 1.00 0.00 C ATOM 0 H5' DC A 6 -0.701 6.438 0.949 1.00 0.00 H new ATOM 0 H5'' DC A 6 -1.855 7.329 1.923 1.00 0.00 H new ATOM 0 H4' DC A 6 -2.439 5.059 1.819 1.00 0.00 H new ATOM 0 H3' DC A 6 -1.846 6.229 4.464 1.00 0.00 H new ATOM 0 H2' DC A 6 -0.924 4.246 5.365 1.00 0.00 H new ATOM 0 H2'' DC A 6 -2.461 3.471 5.033 1.00 0.00 H new ATOM 0 H1' DC A 6 -1.709 2.489 3.082 1.00 0.00 H new ATOM 0 H41 DC A 6 4.567 0.692 3.791 1.00 0.00 H new ATOM 0 H42 DC A 6 3.631 -0.775 3.491 1.00 0.00 H new ATOM 0 H5 DC A 6 3.534 2.840 4.167 1.00 0.00 H new ATOM 0 H6 DC A 6 1.462 4.077 4.277 1.00 0.00 H new ATOM 183 P DT A 7 -4.760 6.164 4.627 1.00 0.00 P ATOM 184 OP1 DT A 7 -5.518 6.872 3.559 1.00 0.00 O ATOM 185 OP2 DT A 7 -4.129 7.055 5.633 1.00 0.00 O ATOM 186 O5' DT A 7 -5.665 5.048 5.364 1.00 0.00 O ATOM 187 C5' DT A 7 -6.471 4.047 4.663 1.00 0.00 C ATOM 188 C4' DT A 7 -6.383 2.571 5.145 1.00 0.00 C ATOM 189 O4' DT A 7 -4.967 2.154 5.264 1.00 0.00 O ATOM 190 C3' DT A 7 -7.021 2.315 6.529 1.00 0.00 C ATOM 191 O3' DT A 7 -8.006 1.240 6.501 1.00 0.00 O ATOM 192 C2' DT A 7 -5.800 1.856 7.369 1.00 0.00 C ATOM 193 C1' DT A 7 -4.863 1.235 6.328 1.00 0.00 C ATOM 194 N1 DT A 7 -3.414 1.061 6.732 1.00 0.00 N ATOM 195 C2 DT A 7 -2.807 -0.231 6.606 1.00 0.00 C ATOM 196 O2 DT A 7 -3.390 -1.285 6.375 1.00 0.00 O ATOM 197 N3 DT A 7 -1.435 -0.264 6.788 1.00 0.00 N ATOM 198 C4 DT A 7 -0.613 0.808 7.091 1.00 0.00 C ATOM 199 O4 DT A 7 0.609 0.643 7.112 1.00 0.00 O ATOM 200 C5 DT A 7 -1.296 2.069 7.344 1.00 0.00 C ATOM 201 C7 DT A 7 -0.488 3.241 7.829 1.00 0.00 C ATOM 202 C6 DT A 7 -2.628 2.141 7.128 1.00 0.00 C ATOM 0 H5' DT A 7 -6.192 4.072 3.610 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.514 4.356 4.723 1.00 0.00 H new ATOM 0 H4' DT A 7 -6.932 2.005 4.393 1.00 0.00 H new ATOM 0 H3' DT A 7 -7.550 3.190 6.906 1.00 0.00 H new ATOM 0 H2' DT A 7 -5.329 2.694 7.884 1.00 0.00 H new ATOM 0 H2'' DT A 7 -6.087 1.133 8.133 1.00 0.00 H new ATOM 0 H1' DT A 7 -5.159 0.207 6.119 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.983 -1.173 6.688 1.00 0.00 H new ATOM 0 H71 DT A 7 -0.945 4.167 7.480 1.00 0.00 H new ATOM 0 H72 DT A 7 -0.461 3.238 8.919 1.00 0.00 H new ATOM 0 H73 DT A 7 0.528 3.168 7.441 1.00 0.00 H new ATOM 0 H6 DT A 7 -3.113 3.095 7.271 1.00 0.00 H new ATOM 215 P DG A 8 -9.122 0.814 7.583 1.00 0.00 P ATOM 216 OP1 DG A 8 -10.460 1.277 7.132 1.00 0.00 O ATOM 217 OP2 DG A 8 -8.730 1.319 8.917 1.00 0.00 O ATOM 218 O5' DG A 8 -9.051 -0.799 7.573 1.00 0.00 O ATOM 219 C5' DG A 8 -7.800 -1.556 7.628 1.00 0.00 C ATOM 220 C4' DG A 8 -7.784 -2.803 8.538 1.00 0.00 C ATOM 221 O4' DG A 8 -6.388 -3.248 8.630 1.00 0.00 O ATOM 222 C3' DG A 8 -8.278 -2.624 9.983 1.00 0.00 C ATOM 223 O3' DG A 8 -9.052 -3.777 10.408 1.00 0.00 O ATOM 224 C2' DG A 8 -6.992 -2.468 10.790 1.00 0.00 C ATOM 225 C1' DG A 8 -5.899 -3.178 9.967 1.00 0.00 C ATOM 226 N9 DG A 8 -4.588 -2.448 9.935 1.00 0.00 N ATOM 227 C8 DG A 8 -4.403 -1.115 9.712 1.00 0.00 C ATOM 228 N7 DG A 8 -3.151 -0.700 9.769 1.00 0.00 N ATOM 229 C5 DG A 8 -2.433 -1.863 9.989 1.00 0.00 C ATOM 230 C6 DG A 8 -1.036 -2.058 10.094 1.00 0.00 C ATOM 231 O6 DG A 8 -0.173 -1.172 10.082 1.00 0.00 O ATOM 232 N1 DG A 8 -0.700 -3.390 10.274 1.00 0.00 N ATOM 233 C2 DG A 8 -1.585 -4.427 10.366 1.00 0.00 C ATOM 234 N2 DG A 8 -0.977 -5.591 10.523 1.00 0.00 N ATOM 235 N3 DG A 8 -2.914 -4.253 10.318 1.00 0.00 N ATOM 236 C4 DG A 8 -3.288 -2.965 10.106 1.00 0.00 C ATOM 0 H5' DG A 8 -7.009 -0.883 7.959 1.00 0.00 H new ATOM 0 H5'' DG A 8 -7.548 -1.870 6.615 1.00 0.00 H new ATOM 0 H4' DG A 8 -8.480 -3.501 8.074 1.00 0.00 H new ATOM 0 H3' DG A 8 -8.944 -1.771 10.108 1.00 0.00 H new ATOM 0 H2' DG A 8 -6.749 -1.416 10.940 1.00 0.00 H new ATOM 0 H2'' DG A 8 -7.092 -2.917 11.778 1.00 0.00 H new ATOM 0 H1' DG A 8 -5.706 -4.147 10.426 1.00 0.00 H new ATOM 0 H8 DG A 8 -5.224 -0.445 9.503 1.00 0.00 H new ATOM 0 H1 DG A 8 0.292 -3.616 10.344 1.00 0.00 H new ATOM 0 H21 DG A 8 -1.526 -6.446 10.605 1.00 0.00 H new ATOM 0 H22 DG A 8 0.041 -5.633 10.562 1.00 0.00 H new ATOM 248 P DG A 9 -9.925 -4.052 11.709 1.00 0.00 P ATOM 249 OP1 DG A 9 -10.848 -5.185 11.453 1.00 0.00 O ATOM 250 OP2 DG A 9 -10.578 -2.799 12.147 1.00 0.00 O ATOM 251 O5' DG A 9 -8.854 -4.511 12.809 1.00 0.00 O ATOM 252 C5' DG A 9 -8.021 -5.705 12.747 1.00 0.00 C ATOM 253 C4' DG A 9 -6.751 -5.686 13.624 1.00 0.00 C ATOM 254 O4' DG A 9 -5.782 -4.678 13.157 1.00 0.00 O ATOM 255 C3' DG A 9 -6.982 -5.381 15.124 1.00 0.00 C ATOM 256 O3' DG A 9 -6.374 -6.373 15.962 1.00 0.00 O ATOM 257 C2' DG A 9 -6.199 -4.039 15.320 1.00 0.00 C ATOM 258 C1' DG A 9 -5.085 -4.189 14.289 1.00 0.00 C ATOM 259 N9 DG A 9 -4.324 -2.956 13.934 1.00 0.00 N ATOM 260 C8 DG A 9 -4.803 -1.705 13.668 1.00 0.00 C ATOM 261 N7 DG A 9 -3.860 -0.779 13.524 1.00 0.00 N ATOM 262 C5 DG A 9 -2.668 -1.474 13.685 1.00 0.00 C ATOM 263 C6 DG A 9 -1.318 -1.018 13.644 1.00 0.00 C ATOM 264 O6 DG A 9 -0.918 0.134 13.422 1.00 0.00 O ATOM 265 N1 DG A 9 -0.415 -2.036 13.915 1.00 0.00 N ATOM 266 C2 DG A 9 -0.726 -3.337 14.184 1.00 0.00 C ATOM 267 N2 DG A 9 0.350 -4.043 14.482 1.00 0.00 N ATOM 268 N3 DG A 9 -1.991 -3.791 14.172 1.00 0.00 N ATOM 269 C4 DG A 9 -2.920 -2.823 13.936 1.00 0.00 C ATOM 0 H5' DG A 9 -7.721 -5.862 11.711 1.00 0.00 H new ATOM 0 H5'' DG A 9 -8.627 -6.563 13.037 1.00 0.00 H new ATOM 0 H4' DG A 9 -6.381 -6.707 13.525 1.00 0.00 H new ATOM 0 H3' DG A 9 -8.041 -5.350 15.380 1.00 0.00 H new ATOM 0 H2' DG A 9 -6.823 -3.167 15.126 1.00 0.00 H new ATOM 0 H2'' DG A 9 -5.810 -3.934 16.333 1.00 0.00 H new ATOM 0 HO3' DG A 9 -6.536 -6.151 16.903 1.00 0.00 H new ATOM 0 H1' DG A 9 -4.298 -4.829 14.688 1.00 0.00 H new ATOM 0 H8 DG A 9 -5.857 -1.487 13.582 1.00 0.00 H new ATOM 0 H1 DG A 9 0.575 -1.788 13.913 1.00 0.00 H new ATOM 0 H21 DG A 9 0.264 -5.034 14.705 1.00 0.00 H new ATOM 0 H22 DG A 9 1.267 -3.597 14.489 1.00 0.00 H new ATOM 282 O5' DC A 15 7.106 -0.324 17.310 1.00 0.00 O ATOM 283 C5' DC A 15 7.690 -1.035 16.207 1.00 0.00 C ATOM 284 C4' DC A 15 7.372 -2.551 16.265 1.00 0.00 C ATOM 285 O4' DC A 15 5.917 -2.753 16.299 1.00 0.00 O ATOM 286 C3' DC A 15 7.871 -3.350 15.046 1.00 0.00 C ATOM 287 O3' DC A 15 8.525 -4.609 15.378 1.00 0.00 O ATOM 288 C2' DC A 15 6.625 -3.577 14.175 1.00 0.00 C ATOM 289 C1' DC A 15 5.411 -3.137 15.022 1.00 0.00 C ATOM 290 N1 DC A 15 4.560 -2.009 14.483 1.00 0.00 N ATOM 291 C2 DC A 15 3.169 -1.939 14.845 1.00 0.00 C ATOM 292 O2 DC A 15 2.634 -2.725 15.643 1.00 0.00 O ATOM 293 N3 DC A 15 2.366 -0.998 14.252 1.00 0.00 N ATOM 294 C4 DC A 15 2.858 -0.169 13.324 1.00 0.00 C ATOM 295 N4 DC A 15 2.013 0.666 12.706 1.00 0.00 N ATOM 296 C5 DC A 15 4.246 -0.194 12.976 1.00 0.00 C ATOM 297 C6 DC A 15 5.035 -1.087 13.565 1.00 0.00 C ATOM 0 H5' DC A 15 8.770 -0.890 16.212 1.00 0.00 H new ATOM 0 H5'' DC A 15 7.317 -0.621 15.270 1.00 0.00 H new ATOM 0 H4' DC A 15 7.884 -2.908 17.159 1.00 0.00 H new ATOM 0 H3' DC A 15 8.651 -2.789 14.531 1.00 0.00 H new ATOM 0 H2' DC A 15 6.685 -2.998 13.254 1.00 0.00 H new ATOM 0 H2'' DC A 15 6.538 -4.625 13.888 1.00 0.00 H new ATOM 0 HO5' DC A 15 6.300 -0.793 17.612 1.00 0.00 H new ATOM 0 H1' DC A 15 4.734 -3.991 15.033 1.00 0.00 H new ATOM 0 H41 DC A 15 2.360 1.309 11.994 1.00 0.00 H new ATOM 0 H42 DC A 15 1.022 0.659 12.947 1.00 0.00 H new ATOM 0 H5 DC A 15 4.644 0.499 12.249 1.00 0.00 H new ATOM 0 H6 DC A 15 6.086 -1.094 13.318 1.00 0.00 H new ATOM 310 P DC A 16 8.223 -6.024 16.091 1.00 0.00 P ATOM 311 OP1 DC A 16 7.567 -5.838 17.406 1.00 0.00 O ATOM 312 OP2 DC A 16 9.469 -6.824 16.106 1.00 0.00 O ATOM 313 O5' DC A 16 7.171 -6.765 15.123 1.00 0.00 O ATOM 314 C5' DC A 16 7.387 -7.214 13.756 1.00 0.00 C ATOM 315 C4' DC A 16 6.129 -7.717 12.998 1.00 0.00 C ATOM 316 O4' DC A 16 5.141 -6.620 12.910 1.00 0.00 O ATOM 317 C3' DC A 16 6.524 -8.026 11.527 1.00 0.00 C ATOM 318 O3' DC A 16 6.196 -9.333 10.976 1.00 0.00 O ATOM 319 C2' DC A 16 5.831 -6.941 10.725 1.00 0.00 C ATOM 320 C1' DC A 16 4.628 -6.551 11.591 1.00 0.00 C ATOM 321 N1 DC A 16 4.094 -5.168 11.331 1.00 0.00 N ATOM 322 C2 DC A 16 2.682 -4.956 11.121 1.00 0.00 C ATOM 323 O2 DC A 16 1.834 -5.864 11.181 1.00 0.00 O ATOM 324 N3 DC A 16 2.241 -3.697 10.807 1.00 0.00 N ATOM 325 C4 DC A 16 3.112 -2.696 10.640 1.00 0.00 C ATOM 326 N4 DC A 16 2.640 -1.503 10.278 1.00 0.00 N ATOM 327 C5 DC A 16 4.514 -2.874 10.843 1.00 0.00 C ATOM 328 C6 DC A 16 4.950 -4.087 11.178 1.00 0.00 C ATOM 0 H5' DC A 16 8.123 -8.017 13.771 1.00 0.00 H new ATOM 0 H5'' DC A 16 7.824 -6.392 13.189 1.00 0.00 H new ATOM 0 H4' DC A 16 5.731 -8.588 13.518 1.00 0.00 H new ATOM 0 H3' DC A 16 7.613 -8.045 11.481 1.00 0.00 H new ATOM 0 H2' DC A 16 6.490 -6.090 10.551 1.00 0.00 H new ATOM 0 H2'' DC A 16 5.517 -7.306 9.747 1.00 0.00 H new ATOM 0 H1' DC A 16 3.783 -7.208 11.385 1.00 0.00 H new ATOM 0 H41 DC A 16 3.280 -0.721 10.143 1.00 0.00 H new ATOM 0 H42 DC A 16 1.638 -1.373 10.136 1.00 0.00 H new ATOM 0 H5 DC A 16 5.201 -2.049 10.728 1.00 0.00 H new ATOM 0 H6 DC A 16 6.008 -4.234 11.336 1.00 0.00 H new ATOM 340 P DA A 17 5.363 -10.692 11.134 1.00 0.00 P ATOM 341 OP1 DA A 17 4.570 -10.715 12.384 1.00 0.00 O ATOM 342 OP2 DA A 17 6.313 -11.808 10.940 1.00 0.00 O ATOM 343 O5' DA A 17 4.370 -10.658 9.869 1.00 0.00 O ATOM 344 C5' DA A 17 3.352 -9.643 9.647 1.00 0.00 C ATOM 345 C4' DA A 17 2.447 -9.837 8.407 1.00 0.00 C ATOM 346 O4' DA A 17 1.584 -8.652 8.438 1.00 0.00 O ATOM 347 C3' DA A 17 3.202 -9.809 7.053 1.00 0.00 C ATOM 348 O3' DA A 17 2.986 -10.939 6.160 1.00 0.00 O ATOM 349 C2' DA A 17 2.667 -8.572 6.328 1.00 0.00 C ATOM 350 C1' DA A 17 1.606 -7.916 7.229 1.00 0.00 C ATOM 351 N9 DA A 17 1.866 -6.473 7.522 1.00 0.00 N ATOM 352 C8 DA A 17 3.081 -5.896 7.746 1.00 0.00 C ATOM 353 N7 DA A 17 3.112 -4.586 7.683 1.00 0.00 N ATOM 354 C5 DA A 17 1.796 -4.265 7.377 1.00 0.00 C ATOM 355 C6 DA A 17 1.178 -3.015 7.131 1.00 0.00 C ATOM 356 N6 DA A 17 1.878 -1.873 7.127 1.00 0.00 N ATOM 357 N1 DA A 17 -0.142 -3.005 6.853 1.00 0.00 N ATOM 358 C2 DA A 17 -0.793 -4.177 6.785 1.00 0.00 C ATOM 359 N3 DA A 17 -0.326 -5.403 7.011 1.00 0.00 N ATOM 360 C4 DA A 17 0.997 -5.384 7.293 1.00 0.00 C ATOM 0 H5' DA A 17 3.847 -8.676 9.561 1.00 0.00 H new ATOM 0 H5'' DA A 17 2.716 -9.598 10.531 1.00 0.00 H new ATOM 0 H4' DA A 17 1.954 -10.808 8.459 1.00 0.00 H new ATOM 0 H3' DA A 17 4.267 -9.825 7.284 1.00 0.00 H new ATOM 0 H2' DA A 17 3.476 -7.872 6.120 1.00 0.00 H new ATOM 0 H2'' DA A 17 2.232 -8.851 5.368 1.00 0.00 H new ATOM 0 H1' DA A 17 0.650 -7.937 6.705 1.00 0.00 H new ATOM 0 H8 DA A 17 3.963 -6.481 7.962 1.00 0.00 H new ATOM 0 H61 DA A 17 1.407 -0.987 6.947 1.00 0.00 H new ATOM 0 H62 DA A 17 2.882 -1.890 7.304 1.00 0.00 H new ATOM 0 H2 DA A 17 -1.836 -4.117 6.510 1.00 0.00 H new ATOM 372 P DG A 18 1.969 -12.110 5.766 1.00 0.00 P ATOM 373 OP1 DG A 18 1.423 -12.751 6.982 1.00 0.00 O ATOM 374 OP2 DG A 18 2.702 -13.026 4.866 1.00 0.00 O ATOM 375 O5' DG A 18 0.785 -11.437 4.904 1.00 0.00 O ATOM 376 C5' DG A 18 -0.431 -10.725 5.295 1.00 0.00 C ATOM 377 C4' DG A 18 -0.875 -9.561 4.366 1.00 0.00 C ATOM 378 O4' DG A 18 -0.020 -8.399 4.564 1.00 0.00 O ATOM 379 C3' DG A 18 -0.854 -9.813 2.834 1.00 0.00 C ATOM 380 O3' DG A 18 -2.121 -9.507 2.194 1.00 0.00 O ATOM 381 C2' DG A 18 0.190 -8.799 2.335 1.00 0.00 C ATOM 382 C1' DG A 18 0.037 -7.678 3.361 1.00 0.00 C ATOM 383 N9 DG A 18 1.142 -6.686 3.440 1.00 0.00 N ATOM 384 C8 DG A 18 2.488 -6.888 3.408 1.00 0.00 C ATOM 385 N7 DG A 18 3.218 -5.770 3.415 1.00 0.00 N ATOM 386 C5 DG A 18 2.258 -4.756 3.476 1.00 0.00 C ATOM 387 C6 DG A 18 2.394 -3.338 3.519 1.00 0.00 C ATOM 388 O6 DG A 18 3.449 -2.696 3.476 1.00 0.00 O ATOM 389 N1 DG A 18 1.166 -2.688 3.606 1.00 0.00 N ATOM 390 C2 DG A 18 -0.054 -3.304 3.620 1.00 0.00 C ATOM 391 N2 DG A 18 -1.080 -2.478 3.680 1.00 0.00 N ATOM 392 N3 DG A 18 -0.187 -4.615 3.554 1.00 0.00 N ATOM 393 C4 DG A 18 0.977 -5.298 3.498 1.00 0.00 C ATOM 0 H5' DG A 18 -0.286 -10.326 6.299 1.00 0.00 H new ATOM 0 H5'' DG A 18 -1.246 -11.446 5.354 1.00 0.00 H new ATOM 0 H4' DG A 18 -1.915 -9.428 4.663 1.00 0.00 H new ATOM 0 H3' DG A 18 -0.644 -10.859 2.610 1.00 0.00 H new ATOM 0 H2' DG A 18 1.197 -9.216 2.329 1.00 0.00 H new ATOM 0 H2'' DG A 18 -0.020 -8.459 1.321 1.00 0.00 H new ATOM 0 H1' DG A 18 -0.822 -7.057 3.106 1.00 0.00 H new ATOM 0 H8 DG A 18 2.930 -7.873 3.379 1.00 0.00 H new ATOM 0 H1 DG A 18 1.178 -1.670 3.664 1.00 0.00 H new ATOM 0 H21 DG A 18 -2.031 -2.846 3.695 1.00 0.00 H new ATOM 0 H22 DG A 18 -0.923 -1.471 3.712 1.00 0.00 H new ATOM 405 P DG A 19 -3.510 -10.279 2.214 1.00 0.00 P ATOM 406 OP1 DG A 19 -3.623 -11.112 3.434 1.00 0.00 O ATOM 407 OP2 DG A 19 -3.622 -11.024 0.944 1.00 0.00 O ATOM 408 O5' DG A 19 -4.619 -9.123 2.253 1.00 0.00 O ATOM 409 C5' DG A 19 -4.716 -7.863 2.980 1.00 0.00 C ATOM 410 C4' DG A 19 -5.054 -6.610 2.112 1.00 0.00 C ATOM 411 O4' DG A 19 -3.865 -5.745 2.059 1.00 0.00 O ATOM 412 C3' DG A 19 -5.493 -6.838 0.639 1.00 0.00 C ATOM 413 O3' DG A 19 -6.757 -6.166 0.355 1.00 0.00 O ATOM 414 C2' DG A 19 -4.301 -6.274 -0.162 1.00 0.00 C ATOM 415 C1' DG A 19 -3.685 -5.220 0.755 1.00 0.00 C ATOM 416 N9 DG A 19 -2.220 -5.004 0.579 1.00 0.00 N ATOM 417 C8 DG A 19 -1.266 -5.969 0.541 1.00 0.00 C ATOM 418 N7 DG A 19 -0.035 -5.533 0.280 1.00 0.00 N ATOM 419 C5 DG A 19 -0.177 -4.148 0.280 1.00 0.00 C ATOM 420 C6 DG A 19 0.801 -3.120 0.181 1.00 0.00 C ATOM 421 O6 DG A 19 2.017 -3.270 0.039 1.00 0.00 O ATOM 422 N1 DG A 19 0.254 -1.850 0.300 1.00 0.00 N ATOM 423 C2 DG A 19 -1.070 -1.571 0.451 1.00 0.00 C ATOM 424 N2 DG A 19 -1.312 -0.276 0.493 1.00 0.00 N ATOM 425 N3 DG A 19 -2.002 -2.523 0.532 1.00 0.00 N ATOM 426 C4 DG A 19 -1.515 -3.788 0.456 1.00 0.00 C ATOM 0 H5' DG A 19 -3.770 -7.685 3.491 1.00 0.00 H new ATOM 0 H5'' DG A 19 -5.480 -7.966 3.751 1.00 0.00 H new ATOM 0 H4' DG A 19 -5.924 -6.186 2.614 1.00 0.00 H new ATOM 0 H3' DG A 19 -5.695 -7.879 0.388 1.00 0.00 H new ATOM 0 H2' DG A 19 -3.582 -7.056 -0.406 1.00 0.00 H new ATOM 0 H2'' DG A 19 -4.629 -5.836 -1.105 1.00 0.00 H new ATOM 0 H1' DG A 19 -4.158 -4.261 0.544 1.00 0.00 H new ATOM 0 H8 DG A 19 -1.489 -7.012 0.710 1.00 0.00 H new ATOM 0 H1 DG A 19 0.898 -1.059 0.272 1.00 0.00 H new ATOM 0 H21 DG A 19 -2.268 0.061 0.604 1.00 0.00 H new ATOM 0 H22 DG A 19 -0.543 0.389 0.415 1.00 0.00 H new ATOM 438 P DA A 20 -7.515 -5.384 -0.818 1.00 0.00 P ATOM 439 OP1 DA A 20 -8.928 -5.182 -0.417 1.00 0.00 O ATOM 440 OP2 DA A 20 -7.313 -6.091 -2.109 1.00 0.00 O ATOM 441 O5' DA A 20 -6.743 -3.995 -0.841 1.00 0.00 O ATOM 442 C5' DA A 20 -6.984 -2.750 -0.118 1.00 0.00 C ATOM 443 C4' DA A 20 -6.491 -1.500 -0.857 1.00 0.00 C ATOM 444 O4' DA A 20 -5.028 -1.502 -0.929 1.00 0.00 O ATOM 445 C3' DA A 20 -7.015 -1.417 -2.300 1.00 0.00 C ATOM 446 O3' DA A 20 -7.647 -0.147 -2.593 1.00 0.00 O ATOM 447 C2' DA A 20 -5.754 -1.654 -3.128 1.00 0.00 C ATOM 448 C1' DA A 20 -4.616 -1.169 -2.238 1.00 0.00 C ATOM 449 N9 DA A 20 -3.335 -1.879 -2.473 1.00 0.00 N ATOM 450 C8 DA A 20 -3.144 -3.231 -2.502 1.00 0.00 C ATOM 451 N7 DA A 20 -1.912 -3.618 -2.763 1.00 0.00 N ATOM 452 C5 DA A 20 -1.227 -2.408 -2.846 1.00 0.00 C ATOM 453 C6 DA A 20 0.146 -2.126 -3.025 1.00 0.00 C ATOM 454 N6 DA A 20 1.060 -3.091 -3.187 1.00 0.00 N ATOM 455 N1 DA A 20 0.533 -0.833 -3.017 1.00 0.00 N ATOM 456 C2 DA A 20 -0.382 0.126 -2.859 1.00 0.00 C ATOM 457 N3 DA A 20 -1.693 -0.018 -2.661 1.00 0.00 N ATOM 458 C4 DA A 20 -2.060 -1.326 -2.668 1.00 0.00 C ATOM 0 H5' DA A 20 -6.493 -2.804 0.853 1.00 0.00 H new ATOM 0 H5'' DA A 20 -8.053 -2.651 0.071 1.00 0.00 H new ATOM 0 H4' DA A 20 -6.867 -0.648 -0.291 1.00 0.00 H new ATOM 0 H3' DA A 20 -7.804 -2.139 -2.510 1.00 0.00 H new ATOM 0 H2' DA A 20 -5.638 -2.708 -3.382 1.00 0.00 H new ATOM 0 H2'' DA A 20 -5.786 -1.102 -4.067 1.00 0.00 H new ATOM 0 H1' DA A 20 -4.437 -0.111 -2.427 1.00 0.00 H new ATOM 0 H8 DA A 20 -3.945 -3.933 -2.324 1.00 0.00 H new ATOM 0 H61 DA A 20 2.042 -2.847 -3.314 1.00 0.00 H new ATOM 0 H62 DA A 20 0.774 -4.070 -3.184 1.00 0.00 H new ATOM 0 H2 DA A 20 -0.016 1.142 -2.896 1.00 0.00 H new ATOM 470 P DG A 21 -8.300 0.443 -3.929 1.00 0.00 P ATOM 471 OP1 DG A 21 -9.659 0.950 -3.643 1.00 0.00 O ATOM 472 OP2 DG A 21 -8.244 -0.565 -5.015 1.00 0.00 O ATOM 473 O5' DG A 21 -7.349 1.665 -4.343 1.00 0.00 O ATOM 474 C5' DG A 21 -6.387 2.493 -3.619 1.00 0.00 C ATOM 475 C4' DG A 21 -5.086 2.818 -4.409 1.00 0.00 C ATOM 476 O4' DG A 21 -4.219 1.635 -4.460 1.00 0.00 O ATOM 477 C3' DG A 21 -5.294 3.198 -5.895 1.00 0.00 C ATOM 478 O3' DG A 21 -4.648 4.451 -6.221 1.00 0.00 O ATOM 479 C2' DG A 21 -4.559 2.077 -6.658 1.00 0.00 C ATOM 480 C1' DG A 21 -3.474 1.699 -5.669 1.00 0.00 C ATOM 481 N9 DG A 21 -2.823 0.386 -5.905 1.00 0.00 N ATOM 482 C8 DG A 21 -3.425 -0.818 -5.876 1.00 0.00 C ATOM 483 N7 DG A 21 -2.609 -1.861 -5.968 1.00 0.00 N ATOM 484 C5 DG A 21 -1.354 -1.278 -6.101 1.00 0.00 C ATOM 485 C6 DG A 21 -0.069 -1.870 -6.244 1.00 0.00 C ATOM 486 O6 DG A 21 0.193 -3.076 -6.179 1.00 0.00 O ATOM 487 N1 DG A 21 0.933 -0.920 -6.397 1.00 0.00 N ATOM 488 C2 DG A 21 0.756 0.435 -6.360 1.00 0.00 C ATOM 489 N2 DG A 21 1.880 1.110 -6.511 1.00 0.00 N ATOM 490 N3 DG A 21 -0.441 0.996 -6.192 1.00 0.00 N ATOM 491 C4 DG A 21 -1.457 0.113 -6.074 1.00 0.00 C ATOM 0 H5' DG A 21 -6.117 1.986 -2.693 1.00 0.00 H new ATOM 0 H5'' DG A 21 -6.871 3.429 -3.341 1.00 0.00 H new ATOM 0 H4' DG A 21 -4.667 3.668 -3.871 1.00 0.00 H new ATOM 0 H3' DG A 21 -6.352 3.304 -6.135 1.00 0.00 H new ATOM 0 H2' DG A 21 -5.216 1.238 -6.887 1.00 0.00 H new ATOM 0 H2'' DG A 21 -4.147 2.427 -7.605 1.00 0.00 H new ATOM 0 H1' DG A 21 -2.644 2.404 -5.710 1.00 0.00 H new ATOM 0 H8 DG A 21 -4.496 -0.927 -5.784 1.00 0.00 H new ATOM 0 H1 DG A 21 1.881 -1.263 -6.550 1.00 0.00 H new ATOM 0 H21 DG A 21 1.868 2.130 -6.500 1.00 0.00 H new ATOM 0 H22 DG A 21 2.761 0.612 -6.639 1.00 0.00 H new ATOM 503 P DT A 22 -5.145 5.636 -7.148 1.00 0.00 P ATOM 504 OP1 DT A 22 -5.669 6.675 -6.234 1.00 0.00 O ATOM 505 OP2 DT A 22 -6.125 5.115 -8.138 1.00 0.00 O ATOM 506 O5' DT A 22 -3.774 6.154 -7.830 1.00 0.00 O ATOM 507 C5' DT A 22 -3.298 5.982 -9.194 1.00 0.00 C ATOM 508 C4' DT A 22 -1.785 5.606 -9.414 1.00 0.00 C ATOM 509 O4' DT A 22 -1.539 4.230 -8.980 1.00 0.00 O ATOM 510 C3' DT A 22 -1.557 5.573 -10.958 1.00 0.00 C ATOM 511 O3' DT A 22 -0.427 6.399 -11.335 1.00 0.00 O ATOM 512 C2' DT A 22 -1.364 4.067 -11.250 1.00 0.00 C ATOM 513 C1' DT A 22 -0.743 3.581 -9.962 1.00 0.00 C ATOM 514 N1 DT A 22 -0.833 2.106 -9.738 1.00 0.00 N ATOM 515 C2 DT A 22 0.352 1.303 -9.733 1.00 0.00 C ATOM 516 O2 DT A 22 1.508 1.723 -9.783 1.00 0.00 O ATOM 517 N3 DT A 22 0.128 -0.067 -9.694 1.00 0.00 N ATOM 518 C4 DT A 22 -1.116 -0.684 -9.702 1.00 0.00 C ATOM 519 O4 DT A 22 -1.190 -1.882 -9.948 1.00 0.00 O ATOM 520 C5 DT A 22 -2.266 0.178 -9.516 1.00 0.00 C ATOM 521 C7 DT A 22 -3.616 -0.452 -9.332 1.00 0.00 C ATOM 522 C6 DT A 22 -2.078 1.506 -9.596 1.00 0.00 C ATOM 0 H5' DT A 22 -3.492 6.909 -9.733 1.00 0.00 H new ATOM 0 H5'' DT A 22 -3.905 5.207 -9.663 1.00 0.00 H new ATOM 0 H4' DT A 22 -1.153 6.311 -8.874 1.00 0.00 H new ATOM 0 H3' DT A 22 -2.378 5.988 -11.543 1.00 0.00 H new ATOM 0 H2' DT A 22 -2.309 3.567 -11.463 1.00 0.00 H new ATOM 0 H2'' DT A 22 -0.713 3.897 -12.108 1.00 0.00 H new ATOM 0 H1' DT A 22 0.325 3.797 -9.950 1.00 0.00 H new ATOM 0 H3 DT A 22 0.948 -0.672 -9.656 1.00 0.00 H new ATOM 0 H71 DT A 22 -4.236 0.192 -8.709 1.00 0.00 H new ATOM 0 H72 DT A 22 -4.092 -0.584 -10.304 1.00 0.00 H new ATOM 0 H73 DT A 22 -3.502 -1.423 -8.850 1.00 0.00 H new ATOM 0 H6 DT A 22 -2.947 2.145 -9.547 1.00 0.00 H new ATOM 535 P DG A 23 0.478 6.571 -12.633 1.00 0.00 P ATOM 536 OP1 DG A 23 1.153 7.887 -12.591 1.00 0.00 O ATOM 537 OP2 DG A 23 -0.350 6.333 -13.837 1.00 0.00 O ATOM 538 O5' DG A 23 1.550 5.387 -12.489 1.00 0.00 O ATOM 539 C5' DG A 23 2.579 5.236 -11.464 1.00 0.00 C ATOM 540 C4' DG A 23 3.909 4.608 -11.942 1.00 0.00 C ATOM 541 O4' DG A 23 3.887 3.149 -11.815 1.00 0.00 O ATOM 542 C3' DG A 23 4.323 4.889 -13.382 1.00 0.00 C ATOM 543 O3' DG A 23 5.742 5.018 -13.516 1.00 0.00 O ATOM 544 C2' DG A 23 3.838 3.649 -14.131 1.00 0.00 C ATOM 545 C1' DG A 23 3.928 2.519 -13.097 1.00 0.00 C ATOM 546 N9 DG A 23 2.771 1.586 -13.140 1.00 0.00 N ATOM 547 C8 DG A 23 1.462 1.939 -13.022 1.00 0.00 C ATOM 548 N7 DG A 23 0.614 0.916 -13.003 1.00 0.00 N ATOM 549 C5 DG A 23 1.440 -0.198 -13.060 1.00 0.00 C ATOM 550 C6 DG A 23 1.112 -1.575 -13.020 1.00 0.00 C ATOM 551 O6 DG A 23 -0.023 -2.052 -12.945 1.00 0.00 O ATOM 552 N1 DG A 23 2.235 -2.384 -13.092 1.00 0.00 N ATOM 553 C2 DG A 23 3.526 -1.950 -13.212 1.00 0.00 C ATOM 554 N2 DG A 23 4.400 -2.942 -13.267 1.00 0.00 N ATOM 555 N3 DG A 23 3.847 -0.651 -13.273 1.00 0.00 N ATOM 556 C4 DG A 23 2.778 0.180 -13.171 1.00 0.00 C ATOM 0 H5' DG A 23 2.177 4.622 -10.658 1.00 0.00 H new ATOM 0 H5'' DG A 23 2.792 6.218 -11.041 1.00 0.00 H new ATOM 0 H4' DG A 23 4.631 5.093 -11.285 1.00 0.00 H new ATOM 0 H3' DG A 23 3.907 5.825 -13.755 1.00 0.00 H new ATOM 0 H2' DG A 23 2.818 3.777 -14.492 1.00 0.00 H new ATOM 0 H2'' DG A 23 4.461 3.442 -15.001 1.00 0.00 H new ATOM 0 HO3' DG A 23 5.967 5.196 -14.453 1.00 0.00 H new ATOM 0 H1' DG A 23 4.832 1.945 -13.300 1.00 0.00 H new ATOM 0 H8 DG A 23 1.139 2.967 -12.950 1.00 0.00 H new ATOM 0 H1 DG A 23 2.085 -3.392 -13.052 1.00 0.00 H new ATOM 0 H21 DG A 23 5.396 -2.740 -13.357 1.00 0.00 H new ATOM 0 H22 DG A 23 4.078 -3.909 -13.220 1.00 0.00 H new TER 569 DG A 23 HETATM 570 C1 DAG A 31 2.303 8.534 -3.592 1.00 0.00 C HETATM 571 C2 DAG A 31 1.822 9.521 -2.519 1.00 0.00 C HETATM 572 C3 DAG A 31 0.550 8.980 -1.818 1.00 0.00 C HETATM 573 C4 DAG A 31 -0.500 8.457 -2.822 1.00 0.00 C HETATM 574 C5 DAG A 31 0.156 7.539 -3.872 1.00 0.00 C HETATM 575 C6 DAG A 31 -0.789 7.139 -5.005 1.00 0.00 C HETATM 576 O1 DAG A 31 3.385 9.047 -4.354 1.00 0.00 O HETATM 577 O2 DAG A 31 2.857 9.668 -1.555 1.00 0.00 O HETATM 578 O3 DAG A 31 -0.028 10.017 -1.005 1.00 0.00 O HETATM 579 N4 DAG A 31 -1.617 7.809 -2.107 1.00 0.00 N HETATM 580 O5 DAG A 31 1.222 8.252 -4.460 1.00 0.00 O HETATM 0 HN42 DAG A 31 -2.395 7.410 -2.632 1.00 0.00 H new HETATM 0 HO3 DAG A 31 0.152 9.830 -0.060 1.00 0.00 H new HETATM 0 H63 DAG A 31 -1.645 6.605 -4.593 1.00 0.00 H new HETATM 0 H62 DAG A 31 -1.135 8.033 -5.523 1.00 0.00 H new HETATM 0 H61 DAG A 31 -0.262 6.493 -5.708 1.00 0.00 H new HETATM 0 H5 DAG A 31 0.468 6.631 -3.356 1.00 0.00 H new HETATM 0 H4 DAG A 31 -0.922 9.299 -3.371 1.00 0.00 H new HETATM 0 H3 DAG A 31 0.851 8.136 -1.197 1.00 0.00 H new HETATM 0 H2 DAG A 31 1.585 10.478 -2.984 1.00 0.00 H new HETATM 0 H1 DAG A 31 2.655 7.634 -3.087 1.00 0.00 H new HETATM 591 C1 DSR A 32 -2.007 5.446 -1.522 1.00 0.00 C HETATM 592 C2 DSR A 32 -1.227 4.191 -1.099 1.00 0.00 C HETATM 593 C3 DSR A 32 -2.145 2.978 -1.158 1.00 0.00 C HETATM 594 C4 DSR A 32 -3.423 3.210 -0.331 1.00 0.00 C HETATM 595 C5 DSR A 32 -4.076 4.546 -0.741 1.00 0.00 C HETATM 596 C6 DSR A 32 -5.218 4.948 0.188 1.00 0.00 C HETATM 597 O1 DSR A 32 -1.198 6.594 -1.340 1.00 0.00 O HETATM 598 O3 DSR A 32 -2.425 2.826 -2.536 1.00 0.00 O HETATM 599 O5 DSR A 32 -3.108 5.575 -0.641 1.00 0.00 O HETATM 600 S4 DSR A 32 -4.551 1.759 -0.261 1.00 0.00 S HETATM 0 HO3 DSR A 32 -2.209 1.912 -2.815 1.00 0.00 H new HETATM 0 H63 DSR A 32 -5.990 4.178 0.170 1.00 0.00 H new HETATM 0 H62 DSR A 32 -4.839 5.058 1.204 1.00 0.00 H new HETATM 0 H61 DSR A 32 -5.642 5.895 -0.146 1.00 0.00 H new HETATM 0 H5 DSR A 32 -4.460 4.413 -1.753 1.00 0.00 H new HETATM 0 H4 DSR A 32 -3.140 3.311 0.717 1.00 0.00 H new HETATM 0 H3 DSR A 32 -1.692 2.082 -0.733 1.00 0.00 H new HETATM 0 H22 DSR A 32 -0.370 4.044 -1.756 1.00 0.00 H new HETATM 0 H21 DSR A 32 -0.836 4.316 -0.089 1.00 0.00 H new HETATM 0 H1 DSR A 32 -2.313 5.359 -2.565 1.00 0.00 H new HETATM 611 C1 HIB A 33 -6.149 -1.241 3.404 1.00 0.00 C HETATM 612 C2 HIB A 33 -7.623 -1.180 3.334 1.00 0.00 C HETATM 613 C3 HIB A 33 -8.225 -0.165 2.663 1.00 0.00 C HETATM 614 C4 HIB A 33 -7.389 0.885 2.001 1.00 0.00 C HETATM 615 C5 HIB A 33 -6.037 0.830 2.065 1.00 0.00 C HETATM 616 C6 HIB A 33 -5.390 -0.290 2.803 1.00 0.00 C HETATM 617 C7 HIB A 33 -5.177 1.882 1.405 1.00 0.00 C HETATM 618 C8 HIB A 33 -3.879 -0.297 2.843 1.00 0.00 C HETATM 619 C9 HIB A 33 -10.231 0.089 3.871 1.00 0.00 C HETATM 620 CX HIB A 33 -8.906 1.601 0.347 1.00 0.00 C HETATM 621 O3 HIB A 33 -9.592 -0.085 2.610 1.00 0.00 O HETATM 622 O4 HIB A 33 -7.923 1.924 1.316 1.00 0.00 O HETATM 623 O7 HIB A 33 -4.894 2.841 2.108 1.00 0.00 O HETATM 624 I1 HIB A 33 -5.289 -2.836 4.457 1.00 0.00 I HETATM 0 HX3 HIB A 33 -8.473 0.939 -0.403 1.00 0.00 H new HETATM 0 HX2 HIB A 33 -9.744 1.101 0.832 1.00 0.00 H new HETATM 0 HX1 HIB A 33 -9.257 2.514 -0.133 1.00 0.00 H new HETATM 0 H93 HIB A 33 -9.991 -0.754 4.520 1.00 0.00 H new HETATM 0 H92 HIB A 33 -9.881 1.013 4.332 1.00 0.00 H new HETATM 0 H91 HIB A 33 -11.310 0.141 3.728 1.00 0.00 H new HETATM 0 H83 HIB A 33 -3.542 -0.244 3.878 1.00 0.00 H new HETATM 0 H82 HIB A 33 -3.507 -1.215 2.387 1.00 0.00 H new HETATM 0 H81 HIB A 33 -3.496 0.563 2.293 1.00 0.00 H new HETATM 634 C1 MRP A 34 -9.076 -3.141 3.250 1.00 0.00 C HETATM 635 C2 MRP A 34 -8.385 -4.527 3.443 1.00 0.00 C HETATM 636 C3 MRP A 34 -8.391 -4.841 4.958 1.00 0.00 C HETATM 637 C4 MRP A 34 -9.868 -4.922 5.433 1.00 0.00 C HETATM 638 C5 MRP A 34 -10.526 -3.529 5.157 1.00 0.00 C HETATM 639 C6 MRP A 34 -12.030 -3.469 5.461 1.00 0.00 C HETATM 640 C7 MRP A 34 -6.648 -5.886 6.288 1.00 0.00 C HETATM 641 O1 MRP A 34 -8.319 -2.183 3.974 1.00 0.00 O HETATM 642 O2 MRP A 34 -8.911 -5.650 2.708 1.00 0.00 O HETATM 643 O3 MRP A 34 -7.609 -6.003 5.246 1.00 0.00 O HETATM 644 O4 MRP A 34 -9.956 -5.338 6.806 1.00 0.00 O HETATM 645 O5 MRP A 34 -10.394 -3.182 3.785 1.00 0.00 O HETATM 0 HO4 MRP A 34 -10.897 -5.378 7.076 1.00 0.00 H new HETATM 0 HO2 MRP A 34 -8.879 -5.456 1.748 1.00 0.00 H new HETATM 0 H73 MRP A 34 -5.932 -5.104 6.036 1.00 0.00 H new HETATM 0 H72 MRP A 34 -7.152 -5.631 7.220 1.00 0.00 H new HETATM 0 H71 MRP A 34 -6.123 -6.834 6.407 1.00 0.00 H new HETATM 0 H63 MRP A 34 -12.555 -4.197 4.843 1.00 0.00 H new HETATM 0 H62 MRP A 34 -12.198 -3.698 6.513 1.00 0.00 H new HETATM 0 H61 MRP A 34 -12.406 -2.469 5.242 1.00 0.00 H new HETATM 0 H5 MRP A 34 -10.000 -2.845 5.823 1.00 0.00 H new HETATM 0 H4 MRP A 34 -10.416 -5.685 4.880 1.00 0.00 H new HETATM 0 H3 MRP A 34 -7.910 -4.045 5.526 1.00 0.00 H new HETATM 0 H2 MRP A 34 -7.388 -4.412 3.018 1.00 0.00 H new HETATM 0 H1 MRP A 34 -9.128 -2.887 2.191 1.00 0.00 H new HETATM 659 C1 EMP A 35 3.068 10.974 -1.084 1.00 0.00 C HETATM 660 C2 EMP A 35 3.831 10.830 0.240 1.00 0.00 C HETATM 661 C3 EMP A 35 5.241 10.258 -0.027 1.00 0.00 C HETATM 662 C4 EMP A 35 6.000 11.056 -1.112 1.00 0.00 C HETATM 663 C5 EMP A 35 5.114 11.103 -2.370 1.00 0.00 C HETATM 664 C6 EMP A 35 8.205 10.920 -2.436 1.00 0.00 C HETATM 665 C7 EMP A 35 7.995 10.034 -3.673 1.00 0.00 C HETATM 666 C8 EMP A 35 5.845 9.098 1.981 1.00 0.00 C HETATM 667 O3 EMP A 35 5.993 10.254 1.169 1.00 0.00 O HETATM 668 N4 EMP A 35 7.377 10.529 -1.277 1.00 0.00 N HETATM 669 O5 EMP A 35 3.864 11.679 -2.018 1.00 0.00 O HETATM 0 HN4 EMP A 35 7.757 9.888 -0.581 1.00 0.00 H new HETATM 0 H83 EMP A 35 4.801 8.991 2.275 1.00 0.00 H new HETATM 0 H82 EMP A 35 6.156 8.217 1.420 1.00 0.00 H new HETATM 0 H81 EMP A 35 6.464 9.198 2.872 1.00 0.00 H new HETATM 0 H73 EMP A 35 8.247 9.002 -3.428 1.00 0.00 H new HETATM 0 H72 EMP A 35 6.953 10.088 -3.987 1.00 0.00 H new HETATM 0 H71 EMP A 35 8.636 10.382 -4.483 1.00 0.00 H new HETATM 0 H62 EMP A 35 9.256 10.884 -2.149 1.00 0.00 H new HETATM 0 H61 EMP A 35 7.981 11.954 -2.699 1.00 0.00 H new HETATM 0 H52 EMP A 35 5.596 11.691 -3.151 1.00 0.00 H new HETATM 0 H51 EMP A 35 4.970 10.099 -2.770 1.00 0.00 H new HETATM 0 H4 EMP A 35 6.171 12.095 -0.832 1.00 0.00 H new HETATM 0 H3 EMP A 35 5.114 9.239 -0.393 1.00 0.00 H new HETATM 0 H22 EMP A 35 3.909 11.799 0.732 1.00 0.00 H new HETATM 0 H21 EMP A 35 3.284 10.173 0.916 1.00 0.00 H new HETATM 687 C1 MTC A 36 4.400 8.194 -4.885 1.00 0.00 C HETATM 688 C2 MTC A 36 3.936 6.794 -4.897 1.00 0.00 C HETATM 689 C3 MTC A 36 3.322 5.815 -5.179 1.00 0.00 C HETATM 690 C4 MTC A 36 2.465 4.822 -5.756 1.00 0.00 C HETATM 691 C5 MTC A 36 1.962 4.955 -7.010 1.00 0.00 C HETATM 692 C6 MTC A 36 2.312 6.063 -7.871 1.00 0.00 C HETATM 693 C7 MTC A 36 2.842 7.005 -8.385 1.00 0.00 C HETATM 694 C8 MTC A 36 3.598 8.240 -8.674 1.00 0.00 C HETATM 695 C9 MTC A 36 4.941 7.953 -9.335 1.00 0.00 C HETATM 696 C10 MTC A 36 6.028 7.492 -8.374 1.00 0.00 C HETATM 697 C11 MTC A 36 5.885 7.742 -6.885 1.00 0.00 C HETATM 698 C12 MTC A 36 4.732 8.281 -6.389 1.00 0.00 C HETATM 699 C13 MTC A 36 3.736 8.922 -7.315 1.00 0.00 C HETATM 700 C14 MTC A 36 2.923 10.143 -7.044 1.00 0.00 C HETATM 701 C15 MTC A 36 3.198 11.106 -5.931 1.00 0.00 C HETATM 702 C16 MTC A 36 6.441 11.852 -6.926 1.00 0.00 C HETATM 703 C17 MTC A 36 8.241 7.063 -5.976 1.00 0.00 C HETATM 704 C18 MTC A 36 10.187 6.606 -4.668 1.00 0.00 C HETATM 705 O8 MTC A 36 2.781 8.929 -9.588 1.00 0.00 O HETATM 706 O10 MTC A 36 7.036 7.018 -8.838 1.00 0.00 O HETATM 707 O71 MTC A 36 8.829 6.738 -6.961 1.00 0.00 O HETATM 708 O72 MTC A 36 8.818 7.035 -4.802 1.00 0.00 O HETATM 709 N11 MTC A 36 6.988 7.497 -5.889 1.00 0.00 N HETATM 710 S1 MTC A 36 3.539 12.717 -6.711 1.00 0.00 S HETATM 711 S2 MTC A 36 4.592 13.743 -5.313 1.00 0.00 S HETATM 712 S3 MTC A 36 6.494 13.059 -5.557 1.00 0.00 S HETATM 0 H183 MTC A 36 10.284 5.581 -5.027 1.00 0.00 H new HETATM 0 H182 MTC A 36 10.832 7.259 -5.256 1.00 0.00 H new HETATM 0 H181 MTC A 36 10.482 6.653 -3.620 1.00 0.00 H new HETATM 0 H163 MTC A 36 7.453 11.520 -7.157 1.00 0.00 H new HETATM 0 H162 MTC A 36 5.836 10.994 -6.632 1.00 0.00 H new HETATM 0 H161 MTC A 36 6.002 12.320 -7.807 1.00 0.00 H new HETATM 0 H152 MTC A 36 2.344 11.174 -5.258 1.00 0.00 H new HETATM 0 H151 MTC A 36 4.049 10.776 -5.334 1.00 0.00 H new HETATM 0 H11A MTC A 36 5.265 8.357 -4.242 1.00 0.00 H new HETATM 0 HO8 MTC A 36 3.210 9.774 -9.837 1.00 0.00 H new HETATM 0 H92 MTC A 36 4.800 7.189 -10.099 1.00 0.00 H new HETATM 0 H91 MTC A 36 5.282 8.854 -9.845 1.00 0.00 H new HETATM 0 H5 MTC A 36 1.269 4.200 -7.381 1.00 0.00 H new HETATM 0 H4 MTC A 36 2.210 3.937 -5.173 1.00 0.00 H new HETATM 0 H14 MTC A 36 2.075 10.347 -7.698 1.00 0.00 H new HETATM 0 H11 MTC A 36 6.711 7.713 -4.932 1.00 0.00 H new