USER MOD reduce.3.24.130724 H: found=0, std=0, add=266, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 266 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 DG O5' : rot 180:sc= -0.103 USER MOD Single : A 24 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 8.557 2.715 6.031 1.00 0.00 O ATOM 2 C5' DG A 1 9.381 1.826 5.272 1.00 0.00 C ATOM 3 C4' DG A 1 9.318 2.141 3.778 1.00 0.00 C ATOM 4 O4' DG A 1 8.124 1.554 3.177 1.00 0.00 O ATOM 5 C3' DG A 1 9.269 3.649 3.534 1.00 0.00 C ATOM 6 O3' DG A 1 10.312 4.000 2.622 1.00 0.00 O ATOM 7 C2' DG A 1 7.927 3.918 2.940 1.00 0.00 C ATOM 8 C1' DG A 1 7.456 2.591 2.414 1.00 0.00 C ATOM 9 N9 DG A 1 5.995 2.482 2.519 1.00 0.00 N ATOM 10 C8 DG A 1 5.189 2.752 3.566 1.00 0.00 C ATOM 11 N7 DG A 1 3.917 2.591 3.403 1.00 0.00 N ATOM 12 C5 DG A 1 3.857 2.159 2.073 1.00 0.00 C ATOM 13 C6 DG A 1 2.733 1.809 1.277 1.00 0.00 C ATOM 14 O6 DG A 1 1.545 1.809 1.593 1.00 0.00 O ATOM 15 N1 DG A 1 3.116 1.433 -0.005 1.00 0.00 N ATOM 16 C2 DG A 1 4.414 1.393 -0.469 1.00 0.00 C ATOM 17 N2 DG A 1 4.577 1.008 -1.734 1.00 0.00 N ATOM 18 N3 DG A 1 5.476 1.718 0.273 1.00 0.00 N ATOM 19 C4 DG A 1 5.129 2.090 1.526 1.00 0.00 C ATOM 0 H5' DG A 1 9.061 0.798 5.442 1.00 0.00 H new ATOM 0 H5'' DG A 1 10.412 1.900 5.617 1.00 0.00 H new ATOM 0 H4' DG A 1 10.217 1.720 3.326 1.00 0.00 H new ATOM 0 H3' DG A 1 9.412 4.231 4.444 1.00 0.00 H new ATOM 0 H2' DG A 1 7.238 4.313 3.687 1.00 0.00 H new ATOM 0 H2'' DG A 1 7.991 4.658 2.142 1.00 0.00 H new ATOM 0 HO5' DG A 1 8.618 2.486 6.982 1.00 0.00 H new ATOM 0 H1' DG A 1 7.702 2.487 1.357 1.00 0.00 H new ATOM 0 H8 DG A 1 5.593 3.091 4.509 1.00 0.00 H new ATOM 0 H1 DG A 1 2.377 1.165 -0.655 1.00 0.00 H new ATOM 0 H21 DG A 1 5.513 0.958 -2.135 1.00 0.00 H new ATOM 0 H22 DG A 1 3.765 0.763 -2.301 1.00 0.00 H new ATOM 32 P DG A 2 10.722 5.536 2.384 1.00 0.00 P ATOM 33 OP1 DG A 2 12.177 5.673 2.610 1.00 0.00 O ATOM 34 OP2 DG A 2 9.772 6.393 3.129 1.00 0.00 O ATOM 35 O5' DG A 2 10.432 5.710 0.808 1.00 0.00 O ATOM 36 C5' DG A 2 10.614 4.599 -0.078 1.00 0.00 C ATOM 37 C4' DG A 2 9.841 4.775 -1.385 1.00 0.00 C ATOM 38 O4' DG A 2 8.438 4.429 -1.207 1.00 0.00 O ATOM 39 C3' DG A 2 9.910 6.218 -1.883 1.00 0.00 C ATOM 40 O3' DG A 2 10.523 6.221 -3.177 1.00 0.00 O ATOM 41 C2' DG A 2 8.494 6.697 -1.957 1.00 0.00 C ATOM 42 C1' DG A 2 7.643 5.458 -1.844 1.00 0.00 C ATOM 43 N9 DG A 2 6.416 5.731 -1.081 1.00 0.00 N ATOM 44 C8 DG A 2 6.267 6.112 0.208 1.00 0.00 C ATOM 45 N7 DG A 2 5.064 6.291 0.644 1.00 0.00 N ATOM 46 C5 DG A 2 4.303 5.993 -0.493 1.00 0.00 C ATOM 47 C6 DG A 2 2.893 6.001 -0.677 1.00 0.00 C ATOM 48 O6 DG A 2 2.019 6.277 0.141 1.00 0.00 O ATOM 49 N1 DG A 2 2.546 5.639 -1.975 1.00 0.00 N ATOM 50 C2 DG A 2 3.440 5.310 -2.973 1.00 0.00 C ATOM 51 N2 DG A 2 2.912 4.991 -4.154 1.00 0.00 N ATOM 52 N3 DG A 2 4.765 5.300 -2.808 1.00 0.00 N ATOM 53 C4 DG A 2 5.127 5.650 -1.553 1.00 0.00 C ATOM 0 H5' DG A 2 10.287 3.684 0.416 1.00 0.00 H new ATOM 0 H5'' DG A 2 11.675 4.481 -0.298 1.00 0.00 H new ATOM 0 H4' DG A 2 10.304 4.112 -2.116 1.00 0.00 H new ATOM 0 H3' DG A 2 10.496 6.865 -1.230 1.00 0.00 H new ATOM 0 H2' DG A 2 8.275 7.399 -1.152 1.00 0.00 H new ATOM 0 H2'' DG A 2 8.305 7.219 -2.895 1.00 0.00 H new ATOM 0 H1' DG A 2 7.330 5.125 -2.834 1.00 0.00 H new ATOM 0 H8 DG A 2 7.123 6.261 0.850 1.00 0.00 H new ATOM 0 H1 DG A 2 1.553 5.615 -2.207 1.00 0.00 H new ATOM 0 H21 DG A 2 3.520 4.738 -4.933 1.00 0.00 H new ATOM 0 H22 DG A 2 1.900 5.000 -4.279 1.00 0.00 H new ATOM 65 P DA A 3 11.052 7.585 -3.846 1.00 0.00 P ATOM 66 OP1 DA A 3 12.526 7.620 -3.729 1.00 0.00 O ATOM 67 OP2 DA A 3 10.241 8.705 -3.321 1.00 0.00 O ATOM 68 O5' DA A 3 10.673 7.371 -5.400 1.00 0.00 O ATOM 69 C5' DA A 3 9.433 6.755 -5.774 1.00 0.00 C ATOM 70 C4' DA A 3 9.655 5.461 -6.554 1.00 0.00 C ATOM 71 O4' DA A 3 10.168 4.414 -5.680 1.00 0.00 O ATOM 72 C3' DA A 3 8.352 4.958 -7.163 1.00 0.00 C ATOM 73 O3' DA A 3 8.271 5.358 -8.533 1.00 0.00 O ATOM 74 C2' DA A 3 8.405 3.474 -7.030 1.00 0.00 C ATOM 75 C1' DA A 3 9.409 3.196 -5.925 1.00 0.00 C ATOM 76 N9 DA A 3 8.730 2.762 -4.684 1.00 0.00 N ATOM 77 C8 DA A 3 7.455 2.972 -4.269 1.00 0.00 C ATOM 78 N7 DA A 3 7.119 2.510 -3.113 1.00 0.00 N ATOM 79 C5 DA A 3 8.310 1.916 -2.689 1.00 0.00 C ATOM 80 C6 DA A 3 8.661 1.230 -1.523 1.00 0.00 C ATOM 81 N6 DA A 3 7.811 1.020 -0.519 1.00 0.00 N ATOM 82 N1 DA A 3 9.922 0.773 -1.429 1.00 0.00 N ATOM 83 C2 DA A 3 10.790 0.978 -2.422 1.00 0.00 C ATOM 84 N3 DA A 3 10.565 1.616 -3.568 1.00 0.00 N ATOM 85 C4 DA A 3 9.296 2.063 -3.639 1.00 0.00 C ATOM 0 H5' DA A 3 8.851 7.449 -6.380 1.00 0.00 H new ATOM 0 H5'' DA A 3 8.847 6.544 -4.879 1.00 0.00 H new ATOM 0 H4' DA A 3 10.374 5.684 -7.342 1.00 0.00 H new ATOM 0 H3' DA A 3 7.471 5.365 -6.667 1.00 0.00 H new ATOM 0 H2' DA A 3 7.425 3.068 -6.780 1.00 0.00 H new ATOM 0 H2'' DA A 3 8.714 3.008 -7.966 1.00 0.00 H new ATOM 0 H1' DA A 3 10.074 2.390 -6.235 1.00 0.00 H new ATOM 0 H8 DA A 3 6.747 3.507 -4.885 1.00 0.00 H new ATOM 0 H61 DA A 3 8.118 0.513 0.311 1.00 0.00 H new ATOM 0 H62 DA A 3 6.854 1.366 -0.580 1.00 0.00 H new ATOM 0 H2 DA A 3 11.785 0.582 -2.280 1.00 0.00 H new ATOM 97 P DG A 4 6.846 5.416 -9.282 1.00 0.00 P ATOM 98 OP1 DG A 4 7.079 5.254 -10.734 1.00 0.00 O ATOM 99 OP2 DG A 4 6.108 6.597 -8.780 1.00 0.00 O ATOM 100 O5' DG A 4 6.104 4.091 -8.740 1.00 0.00 O ATOM 101 C5' DG A 4 5.552 3.136 -9.654 1.00 0.00 C ATOM 102 C4' DG A 4 4.035 3.026 -9.513 1.00 0.00 C ATOM 103 O4' DG A 4 3.678 2.173 -8.390 1.00 0.00 O ATOM 104 C3' DG A 4 3.396 4.394 -9.279 1.00 0.00 C ATOM 105 O3' DG A 4 2.589 4.740 -10.407 1.00 0.00 O ATOM 106 C2' DG A 4 2.564 4.258 -8.043 1.00 0.00 C ATOM 107 C1' DG A 4 2.551 2.785 -7.719 1.00 0.00 C ATOM 108 N9 DG A 4 2.624 2.569 -6.262 1.00 0.00 N ATOM 109 C8 DG A 4 3.711 2.410 -5.467 1.00 0.00 C ATOM 110 N7 DG A 4 3.509 2.234 -4.204 1.00 0.00 N ATOM 111 C5 DG A 4 2.114 2.279 -4.130 1.00 0.00 C ATOM 112 C6 DG A 4 1.258 2.148 -3.004 1.00 0.00 C ATOM 113 O6 DG A 4 1.567 1.966 -1.829 1.00 0.00 O ATOM 114 N1 DG A 4 -0.077 2.254 -3.363 1.00 0.00 N ATOM 115 C2 DG A 4 -0.544 2.460 -4.645 1.00 0.00 C ATOM 116 N2 DG A 4 -1.866 2.542 -4.784 1.00 0.00 N ATOM 117 N3 DG A 4 0.254 2.584 -5.713 1.00 0.00 N ATOM 118 C4 DG A 4 1.563 2.484 -5.387 1.00 0.00 C ATOM 0 H5' DG A 4 6.005 2.160 -9.478 1.00 0.00 H new ATOM 0 H5'' DG A 4 5.802 3.424 -10.675 1.00 0.00 H new ATOM 0 H4' DG A 4 3.666 2.599 -10.446 1.00 0.00 H new ATOM 0 H3' DG A 4 4.139 5.182 -9.156 1.00 0.00 H new ATOM 0 H2' DG A 4 2.987 4.836 -7.221 1.00 0.00 H new ATOM 0 H2'' DG A 4 1.553 4.631 -8.208 1.00 0.00 H new ATOM 0 H1' DG A 4 1.621 2.332 -8.063 1.00 0.00 H new ATOM 0 H8 DG A 4 4.710 2.430 -5.876 1.00 0.00 H new ATOM 0 H1 DG A 4 -0.770 2.173 -2.619 1.00 0.00 H new ATOM 0 H21 DG A 4 -2.273 2.694 -5.707 1.00 0.00 H new ATOM 0 H22 DG A 4 -2.471 2.453 -3.968 1.00 0.00 H new ATOM 130 P DG A 5 2.062 6.249 -10.600 1.00 0.00 P ATOM 131 OP1 DG A 5 2.041 6.551 -12.049 1.00 0.00 O ATOM 132 OP2 DG A 5 2.811 7.124 -9.672 1.00 0.00 O ATOM 133 O5' DG A 5 0.541 6.149 -10.082 1.00 0.00 O ATOM 134 C5' DG A 5 -0.260 5.011 -10.414 1.00 0.00 C ATOM 135 C4' DG A 5 -1.558 4.973 -9.607 1.00 0.00 C ATOM 136 O4' DG A 5 -1.330 4.439 -8.274 1.00 0.00 O ATOM 137 C3' DG A 5 -2.158 6.369 -9.454 1.00 0.00 C ATOM 138 O3' DG A 5 -3.411 6.408 -10.145 1.00 0.00 O ATOM 139 C2' DG A 5 -2.343 6.585 -7.988 1.00 0.00 C ATOM 140 C1' DG A 5 -2.091 5.248 -7.345 1.00 0.00 C ATOM 141 N9 DG A 5 -1.362 5.423 -6.090 1.00 0.00 N ATOM 142 C8 DG A 5 -0.070 5.752 -5.893 1.00 0.00 C ATOM 143 N7 DG A 5 0.343 5.852 -4.671 1.00 0.00 N ATOM 144 C5 DG A 5 -0.826 5.554 -3.955 1.00 0.00 C ATOM 145 C6 DG A 5 -1.052 5.494 -2.552 1.00 0.00 C ATOM 146 O6 DG A 5 -0.250 5.692 -1.642 1.00 0.00 O ATOM 147 N1 DG A 5 -2.371 5.160 -2.262 1.00 0.00 N ATOM 148 C2 DG A 5 -3.354 4.916 -3.199 1.00 0.00 C ATOM 149 N2 DG A 5 -4.565 4.626 -2.724 1.00 0.00 N ATOM 150 N3 DG A 5 -3.149 4.969 -4.517 1.00 0.00 N ATOM 151 C4 DG A 5 -1.872 5.291 -4.823 1.00 0.00 C ATOM 0 H5' DG A 5 0.309 4.100 -10.229 1.00 0.00 H new ATOM 0 H5'' DG A 5 -0.495 5.030 -11.478 1.00 0.00 H new ATOM 0 H4' DG A 5 -2.246 4.331 -10.156 1.00 0.00 H new ATOM 0 H3' DG A 5 -1.521 7.148 -9.873 1.00 0.00 H new ATOM 0 H2' DG A 5 -1.649 7.337 -7.612 1.00 0.00 H new ATOM 0 H2'' DG A 5 -3.349 6.942 -7.769 1.00 0.00 H new ATOM 0 H1' DG A 5 -3.034 4.753 -7.113 1.00 0.00 H new ATOM 0 H8 DG A 5 0.596 5.926 -6.725 1.00 0.00 H new ATOM 0 H1 DG A 5 -2.632 5.090 -1.278 1.00 0.00 H new ATOM 0 H21 DG A 5 -5.333 4.436 -3.368 1.00 0.00 H new ATOM 0 H22 DG A 5 -4.724 4.594 -1.717 1.00 0.00 H new ATOM 163 P DA A 6 -4.153 7.800 -10.453 1.00 0.00 P ATOM 164 OP1 DA A 6 -3.888 8.168 -11.862 1.00 0.00 O ATOM 165 OP2 DA A 6 -3.825 8.752 -9.367 1.00 0.00 O ATOM 166 O5' DA A 6 -5.710 7.396 -10.319 1.00 0.00 O ATOM 167 C5' DA A 6 -6.250 6.954 -9.066 1.00 0.00 C ATOM 168 C4' DA A 6 -7.064 5.668 -9.219 1.00 0.00 C ATOM 169 O4' DA A 6 -6.244 4.593 -9.765 1.00 0.00 O ATOM 170 C3' DA A 6 -7.604 5.194 -7.878 1.00 0.00 C ATOM 171 O3' DA A 6 -8.950 5.638 -7.704 1.00 0.00 O ATOM 172 C2' DA A 6 -7.526 3.704 -7.929 1.00 0.00 C ATOM 173 C1' DA A 6 -6.487 3.387 -8.989 1.00 0.00 C ATOM 174 N9 DA A 6 -5.223 2.908 -8.379 1.00 0.00 N ATOM 175 C8 DA A 6 -4.789 2.977 -7.093 1.00 0.00 C ATOM 176 N7 DA A 6 -3.626 2.488 -6.829 1.00 0.00 N ATOM 177 C5 DA A 6 -3.217 2.033 -8.083 1.00 0.00 C ATOM 178 C6 DA A 6 -2.053 1.397 -8.525 1.00 0.00 C ATOM 179 N6 DA A 6 -1.037 1.095 -7.719 1.00 0.00 N ATOM 180 N1 DA A 6 -1.975 1.086 -9.830 1.00 0.00 N ATOM 181 C2 DA A 6 -2.981 1.381 -10.656 1.00 0.00 C ATOM 182 N3 DA A 6 -4.127 1.981 -10.346 1.00 0.00 N ATOM 183 C4 DA A 6 -4.183 2.283 -9.033 1.00 0.00 C ATOM 0 H5' DA A 6 -6.882 7.737 -8.647 1.00 0.00 H new ATOM 0 H5'' DA A 6 -5.438 6.788 -8.359 1.00 0.00 H new ATOM 0 H4' DA A 6 -7.887 5.900 -9.895 1.00 0.00 H new ATOM 0 H3' DA A 6 -7.037 5.592 -7.037 1.00 0.00 H new ATOM 0 H2' DA A 6 -7.237 3.293 -6.962 1.00 0.00 H new ATOM 0 H2'' DA A 6 -8.492 3.269 -8.185 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.860 2.590 -9.632 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.396 3.425 -6.321 1.00 0.00 H new ATOM 0 H61 DA A 6 -0.210 0.630 -8.093 1.00 0.00 H new ATOM 0 H62 DA A 6 -1.086 1.328 -6.727 1.00 0.00 H new ATOM 0 H2 DA A 6 -2.850 1.102 -11.691 1.00 0.00 H new ATOM 195 P DG A 7 -9.629 5.582 -6.245 1.00 0.00 P ATOM 196 OP1 DG A 7 -11.058 5.234 -6.412 1.00 0.00 O ATOM 197 OP2 DG A 7 -9.250 6.811 -5.511 1.00 0.00 O ATOM 198 O5' DG A 7 -8.881 4.330 -5.556 1.00 0.00 O ATOM 199 C5' DG A 7 -9.601 3.127 -5.262 1.00 0.00 C ATOM 200 C4' DG A 7 -9.369 2.658 -3.825 1.00 0.00 C ATOM 201 O4' DG A 7 -8.128 1.911 -3.703 1.00 0.00 O ATOM 202 C3' DG A 7 -9.299 3.839 -2.856 1.00 0.00 C ATOM 203 O3' DG A 7 -10.460 3.828 -2.019 1.00 0.00 O ATOM 204 C2' DG A 7 -8.049 3.629 -2.049 1.00 0.00 C ATOM 205 C1' DG A 7 -7.555 2.250 -2.420 1.00 0.00 C ATOM 206 N9 DG A 7 -6.082 2.200 -2.460 1.00 0.00 N ATOM 207 C8 DG A 7 -5.247 2.054 -3.519 1.00 0.00 C ATOM 208 N7 DG A 7 -3.979 2.004 -3.279 1.00 0.00 N ATOM 209 C5 DG A 7 -3.946 2.134 -1.887 1.00 0.00 C ATOM 210 C6 DG A 7 -2.837 2.155 -0.999 1.00 0.00 C ATOM 211 O6 DG A 7 -1.642 2.060 -1.270 1.00 0.00 O ATOM 212 N1 DG A 7 -3.244 2.305 0.322 1.00 0.00 N ATOM 213 C2 DG A 7 -4.552 2.421 0.741 1.00 0.00 C ATOM 214 N2 DG A 7 -4.738 2.569 2.052 1.00 0.00 N ATOM 215 N3 DG A 7 -5.602 2.401 -0.086 1.00 0.00 N ATOM 216 C4 DG A 7 -5.231 2.256 -1.379 1.00 0.00 C ATOM 0 H5' DG A 7 -9.294 2.342 -5.954 1.00 0.00 H new ATOM 0 H5'' DG A 7 -10.666 3.294 -5.422 1.00 0.00 H new ATOM 0 H4' DG A 7 -10.215 2.019 -3.574 1.00 0.00 H new ATOM 0 H3' DG A 7 -9.273 4.801 -3.367 1.00 0.00 H new ATOM 0 H2' DG A 7 -7.302 4.388 -2.279 1.00 0.00 H new ATOM 0 H2'' DG A 7 -8.255 3.698 -0.981 1.00 0.00 H new ATOM 0 H1' DG A 7 -7.865 1.525 -1.667 1.00 0.00 H new ATOM 0 H8 DG A 7 -5.629 1.982 -4.527 1.00 0.00 H new ATOM 0 H1 DG A 7 -2.517 2.331 1.037 1.00 0.00 H new ATOM 0 H21 DG A 7 -5.683 2.660 2.426 1.00 0.00 H new ATOM 0 H22 DG A 7 -3.936 2.591 2.682 1.00 0.00 H new ATOM 228 P DG A 8 -10.926 5.162 -1.250 1.00 0.00 P ATOM 229 OP1 DG A 8 -12.317 4.963 -0.782 1.00 0.00 O ATOM 230 OP2 DG A 8 -10.594 6.327 -2.100 1.00 0.00 O ATOM 231 O5' DG A 8 -9.960 5.186 0.039 1.00 0.00 O ATOM 232 C5' DG A 8 -10.285 4.428 1.208 1.00 0.00 C ATOM 233 C4' DG A 8 -9.564 4.969 2.441 1.00 0.00 C ATOM 234 O4' DG A 8 -8.188 4.494 2.489 1.00 0.00 O ATOM 235 C3' DG A 8 -9.537 6.497 2.421 1.00 0.00 C ATOM 236 O3' DG A 8 -10.108 6.988 3.637 1.00 0.00 O ATOM 237 C2' DG A 8 -8.092 6.871 2.338 1.00 0.00 C ATOM 238 C1' DG A 8 -7.339 5.633 2.750 1.00 0.00 C ATOM 239 N9 DG A 8 -6.070 5.528 2.026 1.00 0.00 N ATOM 240 C8 DG A 8 -5.825 5.664 0.708 1.00 0.00 C ATOM 241 N7 DG A 8 -4.603 5.532 0.309 1.00 0.00 N ATOM 242 C5 DG A 8 -3.938 5.277 1.517 1.00 0.00 C ATOM 243 C6 DG A 8 -2.560 5.041 1.773 1.00 0.00 C ATOM 244 O6 DG A 8 -1.630 5.006 0.970 1.00 0.00 O ATOM 245 N1 DG A 8 -2.323 4.831 3.129 1.00 0.00 N ATOM 246 C2 DG A 8 -3.285 4.847 4.115 1.00 0.00 C ATOM 247 N2 DG A 8 -2.859 4.629 5.359 1.00 0.00 N ATOM 248 N3 DG A 8 -4.581 5.068 3.882 1.00 0.00 N ATOM 249 C4 DG A 8 -4.836 5.274 2.571 1.00 0.00 C ATOM 0 H5' DG A 8 -10.012 3.384 1.054 1.00 0.00 H new ATOM 0 H5'' DG A 8 -11.362 4.455 1.373 1.00 0.00 H new ATOM 0 H4' DG A 8 -10.109 4.614 3.316 1.00 0.00 H new ATOM 0 H3' DG A 8 -10.103 6.916 1.589 1.00 0.00 H new ATOM 0 H2' DG A 8 -7.822 7.178 1.328 1.00 0.00 H new ATOM 0 H2'' DG A 8 -7.864 7.708 2.997 1.00 0.00 H new ATOM 0 H1' DG A 8 -7.092 5.676 3.811 1.00 0.00 H new ATOM 0 H8 DG A 8 -6.621 5.876 0.010 1.00 0.00 H new ATOM 0 H1 DG A 8 -1.361 4.651 3.415 1.00 0.00 H new ATOM 0 H21 DG A 8 -3.523 4.628 6.133 1.00 0.00 H new ATOM 0 H22 DG A 8 -1.869 4.463 5.537 1.00 0.00 H new ATOM 261 P DA A 9 -11.689 6.900 3.907 1.00 0.00 P ATOM 262 OP1 DA A 9 -12.300 6.075 2.839 1.00 0.00 O ATOM 263 OP2 DA A 9 -12.195 8.266 4.168 1.00 0.00 O ATOM 264 O5' DA A 9 -11.740 6.067 5.285 1.00 0.00 O ATOM 265 C5' DA A 9 -10.529 5.790 6.002 1.00 0.00 C ATOM 266 C4' DA A 9 -10.556 4.403 6.646 1.00 0.00 C ATOM 267 O4' DA A 9 -10.967 3.390 5.687 1.00 0.00 O ATOM 268 C3' DA A 9 -9.181 4.003 7.168 1.00 0.00 C ATOM 269 O3' DA A 9 -9.074 4.308 8.560 1.00 0.00 O ATOM 270 C2' DA A 9 -9.077 2.538 6.918 1.00 0.00 C ATOM 271 C1' DA A 9 -10.091 2.238 5.833 1.00 0.00 C ATOM 272 N9 DA A 9 -9.409 1.942 4.560 1.00 0.00 N ATOM 273 C8 DA A 9 -8.219 2.392 4.094 1.00 0.00 C ATOM 274 N7 DA A 9 -7.838 1.984 2.933 1.00 0.00 N ATOM 275 C5 DA A 9 -8.901 1.155 2.564 1.00 0.00 C ATOM 276 C6 DA A 9 -9.150 0.387 1.425 1.00 0.00 C ATOM 277 N6 DA A 9 -8.308 0.325 0.394 1.00 0.00 N ATOM 278 N1 DA A 9 -10.297 -0.312 1.386 1.00 0.00 N ATOM 279 C2 DA A 9 -11.153 -0.261 2.409 1.00 0.00 C ATOM 280 N3 DA A 9 -11.019 0.433 3.536 1.00 0.00 N ATOM 281 C4 DA A 9 -9.862 1.124 3.549 1.00 0.00 C ATOM 0 H5' DA A 9 -10.382 6.546 6.773 1.00 0.00 H new ATOM 0 H5'' DA A 9 -9.680 5.859 5.322 1.00 0.00 H new ATOM 0 H4' DA A 9 -11.267 4.461 7.470 1.00 0.00 H new ATOM 0 H3' DA A 9 -8.374 4.544 6.674 1.00 0.00 H new ATOM 0 H2' DA A 9 -8.071 2.265 6.601 1.00 0.00 H new ATOM 0 H2'' DA A 9 -9.291 1.970 7.823 1.00 0.00 H new ATOM 0 H1' DA A 9 -10.679 1.362 6.108 1.00 0.00 H new ATOM 0 H8 DA A 9 -7.611 3.069 4.676 1.00 0.00 H new ATOM 0 H61 DA A 9 -8.535 -0.251 -0.416 1.00 0.00 H new ATOM 0 H62 DA A 9 -7.436 0.854 0.415 1.00 0.00 H new ATOM 0 H2 DA A 9 -12.054 -0.848 2.311 1.00 0.00 H new ATOM 293 P DG A 10 -7.623 4.456 9.243 1.00 0.00 P ATOM 294 OP1 DG A 10 -7.748 4.104 10.675 1.00 0.00 O ATOM 295 OP2 DG A 10 -7.059 5.768 8.853 1.00 0.00 O ATOM 296 O5' DG A 10 -6.766 3.300 8.512 1.00 0.00 O ATOM 297 C5' DG A 10 -6.484 2.069 9.187 1.00 0.00 C ATOM 298 C4' DG A 10 -4.984 1.777 9.241 1.00 0.00 C ATOM 299 O4' DG A 10 -4.514 1.179 8.003 1.00 0.00 O ATOM 300 C3' DG A 10 -4.171 3.050 9.478 1.00 0.00 C ATOM 301 O3' DG A 10 -3.646 3.024 10.805 1.00 0.00 O ATOM 302 C2' DG A 10 -3.074 3.031 8.453 1.00 0.00 C ATOM 303 C1' DG A 10 -3.183 1.692 7.758 1.00 0.00 C ATOM 304 N9 DG A 10 -2.939 1.830 6.311 1.00 0.00 N ATOM 305 C8 DG A 10 -3.825 2.022 5.303 1.00 0.00 C ATOM 306 N7 DG A 10 -3.358 2.106 4.103 1.00 0.00 N ATOM 307 C5 DG A 10 -1.985 1.953 4.319 1.00 0.00 C ATOM 308 C6 DG A 10 -0.914 1.952 3.388 1.00 0.00 C ATOM 309 O6 DG A 10 -0.965 2.087 2.167 1.00 0.00 O ATOM 310 N1 DG A 10 0.308 1.769 4.019 1.00 0.00 N ATOM 311 C2 DG A 10 0.486 1.606 5.377 1.00 0.00 C ATOM 312 N2 DG A 10 1.742 1.445 5.791 1.00 0.00 N ATOM 313 N3 DG A 10 -0.517 1.606 6.262 1.00 0.00 N ATOM 314 C4 DG A 10 -1.720 1.784 5.670 1.00 0.00 C ATOM 0 H5' DG A 10 -6.995 1.251 8.678 1.00 0.00 H new ATOM 0 H5'' DG A 10 -6.882 2.112 10.201 1.00 0.00 H new ATOM 0 H4' DG A 10 -4.842 1.084 10.070 1.00 0.00 H new ATOM 0 H3' DG A 10 -4.767 3.958 9.381 1.00 0.00 H new ATOM 0 H2' DG A 10 -3.188 3.850 7.743 1.00 0.00 H new ATOM 0 H2'' DG A 10 -2.098 3.149 8.923 1.00 0.00 H new ATOM 0 H1' DG A 10 -2.432 1.004 8.147 1.00 0.00 H new ATOM 0 H8 DG A 10 -4.884 2.102 5.497 1.00 0.00 H new ATOM 0 H1 DG A 10 1.142 1.754 3.431 1.00 0.00 H new ATOM 0 H21 DG A 10 1.940 1.320 6.784 1.00 0.00 H new ATOM 0 H22 DG A 10 2.506 1.447 5.115 1.00 0.00 H new ATOM 326 P DG A 11 -3.079 4.365 11.481 1.00 0.00 P ATOM 327 OP1 DG A 11 -4.060 4.831 12.486 1.00 0.00 O ATOM 328 OP2 DG A 11 -2.635 5.278 10.403 1.00 0.00 O ATOM 329 O5' DG A 11 -1.779 3.828 12.256 1.00 0.00 O ATOM 330 C5' DG A 11 -1.045 2.701 11.762 1.00 0.00 C ATOM 331 C4' DG A 11 0.300 3.118 11.204 1.00 0.00 C ATOM 332 O4' DG A 11 0.236 3.323 9.772 1.00 0.00 O ATOM 333 C3' DG A 11 0.764 4.409 11.848 1.00 0.00 C ATOM 334 O3' DG A 11 1.910 4.132 12.660 1.00 0.00 O ATOM 335 C2' DG A 11 1.091 5.312 10.706 1.00 0.00 C ATOM 336 C1' DG A 11 1.107 4.426 9.491 1.00 0.00 C ATOM 337 N9 DG A 11 0.667 5.163 8.304 1.00 0.00 N ATOM 338 C8 DG A 11 -0.510 5.773 8.083 1.00 0.00 C ATOM 339 N7 DG A 11 -0.676 6.371 6.950 1.00 0.00 N ATOM 340 C5 DG A 11 0.554 6.135 6.324 1.00 0.00 C ATOM 341 C6 DG A 11 1.020 6.533 5.042 1.00 0.00 C ATOM 342 O6 DG A 11 0.428 7.187 4.185 1.00 0.00 O ATOM 343 N1 DG A 11 2.316 6.086 4.808 1.00 0.00 N ATOM 344 C2 DG A 11 3.074 5.349 5.695 1.00 0.00 C ATOM 345 N2 DG A 11 4.300 5.019 5.290 1.00 0.00 N ATOM 346 N3 DG A 11 2.643 4.970 6.902 1.00 0.00 N ATOM 347 C4 DG A 11 1.384 5.393 7.152 1.00 0.00 C ATOM 0 H5' DG A 11 -1.623 2.200 10.985 1.00 0.00 H new ATOM 0 H5'' DG A 11 -0.899 1.979 12.566 1.00 0.00 H new ATOM 0 H4' DG A 11 1.002 2.313 11.423 1.00 0.00 H new ATOM 0 H3' DG A 11 0.019 4.868 12.498 1.00 0.00 H new ATOM 0 H2' DG A 11 0.349 6.104 10.606 1.00 0.00 H new ATOM 0 H2'' DG A 11 2.056 5.797 10.852 1.00 0.00 H new ATOM 0 H1' DG A 11 2.116 4.072 9.278 1.00 0.00 H new ATOM 0 H8 DG A 11 -1.292 5.764 8.828 1.00 0.00 H new ATOM 0 H1 DG A 11 2.739 6.321 3.910 1.00 0.00 H new ATOM 0 H21 DG A 11 4.909 4.475 5.900 1.00 0.00 H new ATOM 0 H22 DG A 11 4.629 5.311 4.370 1.00 0.00 H new ATOM 359 P DA A 12 1.745 3.376 14.077 1.00 0.00 P ATOM 360 OP1 DA A 12 1.232 4.352 15.064 1.00 0.00 O ATOM 361 OP2 DA A 12 2.998 2.638 14.355 1.00 0.00 O ATOM 362 O5' DA A 12 0.579 2.296 13.783 1.00 0.00 O ATOM 363 C5' DA A 12 0.785 0.898 14.039 1.00 0.00 C ATOM 364 C4' DA A 12 0.796 0.091 12.736 1.00 0.00 C ATOM 365 O4' DA A 12 1.279 0.950 11.680 1.00 0.00 O ATOM 366 C3' DA A 12 1.737 -1.106 12.836 1.00 0.00 C ATOM 367 O3' DA A 12 1.122 -2.224 12.183 1.00 0.00 O ATOM 368 C2' DA A 12 2.966 -0.685 12.102 1.00 0.00 C ATOM 369 C1' DA A 12 2.494 0.387 11.145 1.00 0.00 C ATOM 370 N9 DA A 12 3.484 1.456 11.033 1.00 0.00 N ATOM 371 C8 DA A 12 4.195 2.049 12.005 1.00 0.00 C ATOM 372 N7 DA A 12 4.979 3.019 11.670 1.00 0.00 N ATOM 373 C5 DA A 12 4.755 3.087 10.291 1.00 0.00 C ATOM 374 C6 DA A 12 5.263 3.912 9.283 1.00 0.00 C ATOM 375 N6 DA A 12 6.155 4.875 9.509 1.00 0.00 N ATOM 376 N1 DA A 12 4.815 3.703 8.033 1.00 0.00 N ATOM 377 C2 DA A 12 3.922 2.740 7.790 1.00 0.00 C ATOM 378 N3 DA A 12 3.383 1.905 8.662 1.00 0.00 N ATOM 379 C4 DA A 12 3.843 2.133 9.901 1.00 0.00 C ATOM 0 H5' DA A 12 -0.003 0.526 14.694 1.00 0.00 H new ATOM 0 H5'' DA A 12 1.729 0.757 14.565 1.00 0.00 H new ATOM 0 H4' DA A 12 -0.214 -0.269 12.539 1.00 0.00 H new ATOM 0 H3' DA A 12 1.962 -1.396 13.862 1.00 0.00 H new ATOM 0 H2' DA A 12 3.723 -0.300 12.785 1.00 0.00 H new ATOM 0 H2'' DA A 12 3.415 -1.523 11.568 1.00 0.00 H new ATOM 0 H1' DA A 12 2.338 -0.052 10.160 1.00 0.00 H new ATOM 0 H8 DA A 12 4.114 1.726 13.032 1.00 0.00 H new ATOM 0 H61 DA A 12 6.493 5.449 8.736 1.00 0.00 H new ATOM 0 H62 DA A 12 6.500 5.039 10.455 1.00 0.00 H new ATOM 0 H2 DA A 12 3.604 2.631 6.764 1.00 0.00 H new ATOM 391 P DG A 13 -0.116 -3.001 12.855 1.00 0.00 P ATOM 392 OP1 DG A 13 -0.243 -2.544 14.257 1.00 0.00 O ATOM 393 OP2 DG A 13 0.027 -4.444 12.560 1.00 0.00 O ATOM 394 O5' DG A 13 -1.381 -2.439 12.024 1.00 0.00 O ATOM 395 C5' DG A 13 -1.263 -2.090 10.637 1.00 0.00 C ATOM 396 C4' DG A 13 -2.634 -1.983 9.964 1.00 0.00 C ATOM 397 O4' DG A 13 -2.563 -1.100 8.813 1.00 0.00 O ATOM 398 C3' DG A 13 -3.141 -3.343 9.491 1.00 0.00 C ATOM 399 O3' DG A 13 -4.446 -3.566 10.032 1.00 0.00 O ATOM 400 C2' DG A 13 -3.180 -3.285 8.003 1.00 0.00 C ATOM 401 C1' DG A 13 -2.930 -1.848 7.626 1.00 0.00 C ATOM 402 N9 DG A 13 -1.876 -1.747 6.601 1.00 0.00 N ATOM 403 C8 DG A 13 -0.546 -2.000 6.694 1.00 0.00 C ATOM 404 N7 DG A 13 0.173 -1.819 5.638 1.00 0.00 N ATOM 405 C5 DG A 13 -0.784 -1.391 4.712 1.00 0.00 C ATOM 406 C6 DG A 13 -0.631 -1.026 3.349 1.00 0.00 C ATOM 407 O6 DG A 13 0.396 -1.007 2.676 1.00 0.00 O ATOM 408 N1 DG A 13 -1.843 -0.656 2.781 1.00 0.00 N ATOM 409 C2 DG A 13 -3.057 -0.639 3.438 1.00 0.00 C ATOM 410 N2 DG A 13 -4.111 -0.256 2.718 1.00 0.00 N ATOM 411 N3 DG A 13 -3.210 -0.983 4.720 1.00 0.00 N ATOM 412 C4 DG A 13 -2.041 -1.345 5.295 1.00 0.00 C ATOM 0 H5' DG A 13 -0.662 -2.840 10.122 1.00 0.00 H new ATOM 0 H5'' DG A 13 -0.736 -1.140 10.544 1.00 0.00 H new ATOM 0 H4' DG A 13 -3.323 -1.586 10.710 1.00 0.00 H new ATOM 0 H3' DG A 13 -2.500 -4.161 9.819 1.00 0.00 H new ATOM 0 H2' DG A 13 -2.422 -3.938 7.569 1.00 0.00 H new ATOM 0 H2'' DG A 13 -4.145 -3.623 7.626 1.00 0.00 H new ATOM 0 H1' DG A 13 -3.842 -1.428 7.202 1.00 0.00 H new ATOM 0 H8 DG A 13 -0.105 -2.341 7.619 1.00 0.00 H new ATOM 0 H1 DG A 13 -1.836 -0.374 1.801 1.00 0.00 H new ATOM 0 H21 DG A 13 -5.036 -0.222 3.146 1.00 0.00 H new ATOM 0 H22 DG A 13 -3.993 0.004 1.739 1.00 0.00 H new ATOM 424 P DG A 14 -5.102 -5.034 10.005 1.00 0.00 P ATOM 425 OP1 DG A 14 -6.165 -5.087 11.034 1.00 0.00 O ATOM 426 OP2 DG A 14 -4.010 -6.031 10.019 1.00 0.00 O ATOM 427 O5' DG A 14 -5.802 -5.072 8.555 1.00 0.00 O ATOM 428 C5' DG A 14 -6.791 -4.101 8.197 1.00 0.00 C ATOM 429 C4' DG A 14 -7.304 -4.327 6.777 1.00 0.00 C ATOM 430 O4' DG A 14 -6.366 -3.786 5.796 1.00 0.00 O ATOM 431 C3' DG A 14 -7.466 -5.819 6.492 1.00 0.00 C ATOM 432 O3' DG A 14 -8.766 -6.040 5.936 1.00 0.00 O ATOM 433 C2' DG A 14 -6.395 -6.149 5.504 1.00 0.00 C ATOM 434 C1' DG A 14 -6.066 -4.839 4.845 1.00 0.00 C ATOM 435 N9 DG A 14 -4.658 -4.808 4.432 1.00 0.00 N ATOM 436 C8 DG A 14 -3.548 -4.996 5.172 1.00 0.00 C ATOM 437 N7 DG A 14 -2.407 -4.934 4.569 1.00 0.00 N ATOM 438 C5 DG A 14 -2.799 -4.672 3.250 1.00 0.00 C ATOM 439 C6 DG A 14 -2.011 -4.492 2.079 1.00 0.00 C ATOM 440 O6 DG A 14 -0.788 -4.526 1.972 1.00 0.00 O ATOM 441 N1 DG A 14 -2.804 -4.254 0.962 1.00 0.00 N ATOM 442 C2 DG A 14 -4.183 -4.194 0.964 1.00 0.00 C ATOM 443 N2 DG A 14 -4.767 -3.968 -0.212 1.00 0.00 N ATOM 444 N3 DG A 14 -4.930 -4.361 2.060 1.00 0.00 N ATOM 445 C4 DG A 14 -4.180 -4.595 3.161 1.00 0.00 C ATOM 0 H5' DG A 14 -6.367 -3.100 8.277 1.00 0.00 H new ATOM 0 H5'' DG A 14 -7.624 -4.151 8.899 1.00 0.00 H new ATOM 0 H4' DG A 14 -8.266 -3.821 6.697 1.00 0.00 H new ATOM 0 H3' DG A 14 -7.378 -6.440 7.383 1.00 0.00 H new ATOM 0 H2' DG A 14 -5.521 -6.575 5.996 1.00 0.00 H new ATOM 0 H2'' DG A 14 -6.741 -6.883 4.776 1.00 0.00 H new ATOM 0 H1' DG A 14 -6.659 -4.701 3.941 1.00 0.00 H new ATOM 0 H8 DG A 14 -3.610 -5.192 6.232 1.00 0.00 H new ATOM 0 H1 DG A 14 -2.329 -4.113 0.070 1.00 0.00 H new ATOM 0 H21 DG A 14 -5.784 -3.913 -0.274 1.00 0.00 H new ATOM 0 H22 DG A 14 -4.197 -3.850 -1.050 1.00 0.00 H new ATOM 457 P DA A 15 -9.383 -7.520 5.832 1.00 0.00 P ATOM 458 OP1 DA A 15 -10.385 -7.682 6.910 1.00 0.00 O ATOM 459 OP2 DA A 15 -8.266 -8.483 5.711 1.00 0.00 O ATOM 460 O5' DA A 15 -10.162 -7.469 4.421 1.00 0.00 O ATOM 461 C5' DA A 15 -9.672 -6.660 3.343 1.00 0.00 C ATOM 462 C4' DA A 15 -10.584 -5.462 3.077 1.00 0.00 C ATOM 463 O4' DA A 15 -10.428 -4.449 4.111 1.00 0.00 O ATOM 464 C3' DA A 15 -10.257 -4.808 1.741 1.00 0.00 C ATOM 465 O3' DA A 15 -11.158 -5.286 0.738 1.00 0.00 O ATOM 466 C2' DA A 15 -10.422 -3.340 1.970 1.00 0.00 C ATOM 467 C1' DA A 15 -10.320 -3.147 3.471 1.00 0.00 C ATOM 468 N9 DA A 15 -9.043 -2.498 3.845 1.00 0.00 N ATOM 469 C8 DA A 15 -7.831 -2.534 3.234 1.00 0.00 C ATOM 470 N7 DA A 15 -6.862 -1.886 3.788 1.00 0.00 N ATOM 471 C5 DA A 15 -7.492 -1.346 4.913 1.00 0.00 C ATOM 472 C6 DA A 15 -7.033 -0.536 5.957 1.00 0.00 C ATOM 473 N6 DA A 15 -5.775 -0.107 6.047 1.00 0.00 N ATOM 474 N1 DA A 15 -7.920 -0.187 6.906 1.00 0.00 N ATOM 475 C2 DA A 15 -9.183 -0.607 6.836 1.00 0.00 C ATOM 476 N3 DA A 15 -9.724 -1.376 5.894 1.00 0.00 N ATOM 477 C4 DA A 15 -8.817 -1.713 4.955 1.00 0.00 C ATOM 0 H5' DA A 15 -9.593 -7.265 2.440 1.00 0.00 H new ATOM 0 H5'' DA A 15 -8.668 -6.308 3.579 1.00 0.00 H new ATOM 0 H4' DA A 15 -11.606 -5.842 3.069 1.00 0.00 H new ATOM 0 H3' DA A 15 -9.250 -5.038 1.394 1.00 0.00 H new ATOM 0 H2' DA A 15 -9.651 -2.773 1.449 1.00 0.00 H new ATOM 0 H2'' DA A 15 -11.384 -2.990 1.594 1.00 0.00 H new ATOM 0 H1' DA A 15 -11.127 -2.494 3.803 1.00 0.00 H new ATOM 0 H8 DA A 15 -7.683 -3.085 2.317 1.00 0.00 H new ATOM 0 H61 DA A 15 -5.492 0.482 6.830 1.00 0.00 H new ATOM 0 H62 DA A 15 -5.095 -0.368 5.333 1.00 0.00 H new ATOM 0 H2 DA A 15 -9.840 -0.288 7.632 1.00 0.00 H new ATOM 489 P DG A 16 -10.825 -5.062 -0.820 1.00 0.00 P ATOM 490 OP1 DG A 16 -12.095 -4.792 -1.532 1.00 0.00 O ATOM 491 OP2 DG A 16 -9.947 -6.165 -1.270 1.00 0.00 O ATOM 492 O5' DG A 16 -9.959 -3.703 -0.801 1.00 0.00 O ATOM 493 C5' DG A 16 -10.508 -2.481 -1.305 1.00 0.00 C ATOM 494 C4' DG A 16 -9.575 -1.819 -2.316 1.00 0.00 C ATOM 495 O4' DG A 16 -8.532 -1.070 -1.636 1.00 0.00 O ATOM 496 C3' DG A 16 -8.903 -2.856 -3.220 1.00 0.00 C ATOM 497 O3' DG A 16 -9.339 -2.658 -4.569 1.00 0.00 O ATOM 498 C2' DG A 16 -7.429 -2.618 -3.086 1.00 0.00 C ATOM 499 C1' DG A 16 -7.292 -1.314 -2.334 1.00 0.00 C ATOM 500 N9 DG A 16 -6.159 -1.365 -1.396 1.00 0.00 N ATOM 501 C8 DG A 16 -6.147 -1.580 -0.058 1.00 0.00 C ATOM 502 N7 DG A 16 -5.003 -1.565 0.540 1.00 0.00 N ATOM 503 C5 DG A 16 -4.131 -1.308 -0.523 1.00 0.00 C ATOM 504 C6 DG A 16 -2.718 -1.171 -0.529 1.00 0.00 C ATOM 505 O6 DG A 16 -1.940 -1.252 0.417 1.00 0.00 O ATOM 506 N1 DG A 16 -2.237 -0.917 -1.805 1.00 0.00 N ATOM 507 C2 DG A 16 -3.011 -0.809 -2.942 1.00 0.00 C ATOM 508 N2 DG A 16 -2.358 -0.568 -4.079 1.00 0.00 N ATOM 509 N3 DG A 16 -4.340 -0.938 -2.946 1.00 0.00 N ATOM 510 C4 DG A 16 -4.833 -1.185 -1.712 1.00 0.00 C ATOM 0 H5' DG A 16 -10.693 -1.796 -0.477 1.00 0.00 H new ATOM 0 H5'' DG A 16 -11.471 -2.681 -1.775 1.00 0.00 H new ATOM 0 H4' DG A 16 -10.187 -1.151 -2.922 1.00 0.00 H new ATOM 0 H3' DG A 16 -9.155 -3.880 -2.944 1.00 0.00 H new ATOM 0 H2' DG A 16 -6.948 -3.434 -2.546 1.00 0.00 H new ATOM 0 H2'' DG A 16 -6.952 -2.558 -4.064 1.00 0.00 H new ATOM 0 H1' DG A 16 -7.091 -0.500 -3.031 1.00 0.00 H new ATOM 0 H8 DG A 16 -7.062 -1.757 0.488 1.00 0.00 H new ATOM 0 H1 DG A 16 -1.229 -0.801 -1.911 1.00 0.00 H new ATOM 0 H21 DG A 16 -2.874 -0.477 -4.954 1.00 0.00 H new ATOM 0 H22 DG A 16 -1.342 -0.474 -4.074 1.00 0.00 H new ATOM 522 P DG A 17 -9.337 -3.879 -5.620 1.00 0.00 P ATOM 523 OP1 DG A 17 -10.186 -3.498 -6.771 1.00 0.00 O ATOM 524 OP2 DG A 17 -9.619 -5.129 -4.878 1.00 0.00 O ATOM 525 O5' DG A 17 -7.805 -3.920 -6.114 1.00 0.00 O ATOM 526 C5' DG A 17 -7.472 -3.631 -7.476 1.00 0.00 C ATOM 527 C4' DG A 17 -6.101 -4.195 -7.848 1.00 0.00 C ATOM 528 O4' DG A 17 -5.077 -3.688 -6.947 1.00 0.00 O ATOM 529 C3' DG A 17 -6.095 -5.720 -7.765 1.00 0.00 C ATOM 530 O3' DG A 17 -5.604 -6.251 -8.998 1.00 0.00 O ATOM 531 C2' DG A 17 -5.150 -6.049 -6.660 1.00 0.00 C ATOM 532 C1' DG A 17 -4.304 -4.816 -6.489 1.00 0.00 C ATOM 533 N9 DG A 17 -3.882 -4.650 -5.095 1.00 0.00 N ATOM 534 C8 DG A 17 -4.599 -4.755 -3.957 1.00 0.00 C ATOM 535 N7 DG A 17 -3.977 -4.570 -2.839 1.00 0.00 N ATOM 536 C5 DG A 17 -2.673 -4.309 -3.282 1.00 0.00 C ATOM 537 C6 DG A 17 -1.493 -4.023 -2.542 1.00 0.00 C ATOM 538 O6 DG A 17 -1.358 -3.938 -1.323 1.00 0.00 O ATOM 539 N1 DG A 17 -0.400 -3.827 -3.383 1.00 0.00 N ATOM 540 C2 DG A 17 -0.435 -3.896 -4.761 1.00 0.00 C ATOM 541 N2 DG A 17 0.716 -3.683 -5.395 1.00 0.00 N ATOM 542 N3 DG A 17 -1.539 -4.163 -5.459 1.00 0.00 N ATOM 543 C4 DG A 17 -2.613 -4.358 -4.664 1.00 0.00 C ATOM 0 H5' DG A 17 -7.478 -2.552 -7.632 1.00 0.00 H new ATOM 0 H5'' DG A 17 -8.231 -4.052 -8.135 1.00 0.00 H new ATOM 0 H4' DG A 17 -5.890 -3.882 -8.870 1.00 0.00 H new ATOM 0 H3' DG A 17 -7.087 -6.134 -7.586 1.00 0.00 H new ATOM 0 H2' DG A 17 -5.685 -6.290 -5.742 1.00 0.00 H new ATOM 0 H2'' DG A 17 -4.538 -6.916 -6.909 1.00 0.00 H new ATOM 0 H1' DG A 17 -3.389 -4.902 -7.076 1.00 0.00 H new ATOM 0 H8 DG A 17 -5.654 -4.985 -3.979 1.00 0.00 H new ATOM 0 H1 DG A 17 0.497 -3.616 -2.946 1.00 0.00 H new ATOM 0 H21 DG A 17 0.752 -3.721 -6.414 1.00 0.00 H new ATOM 0 H22 DG A 17 1.562 -3.482 -4.862 1.00 0.00 H new ATOM 555 P DA A 18 -6.487 -6.215 -10.339 1.00 0.00 P ATOM 556 OP1 DA A 18 -7.574 -5.227 -10.156 1.00 0.00 O ATOM 557 OP2 DA A 18 -6.809 -7.607 -10.724 1.00 0.00 O ATOM 558 O5' DA A 18 -5.437 -5.623 -11.411 1.00 0.00 O ATOM 559 C5' DA A 18 -4.081 -5.347 -11.027 1.00 0.00 C ATOM 560 C4' DA A 18 -3.623 -3.976 -11.524 1.00 0.00 C ATOM 561 O4' DA A 18 -4.526 -2.933 -11.060 1.00 0.00 O ATOM 562 C3' DA A 18 -2.226 -3.630 -11.023 1.00 0.00 C ATOM 563 O3' DA A 18 -1.255 -3.939 -12.025 1.00 0.00 O ATOM 564 C2' DA A 18 -2.263 -2.165 -10.739 1.00 0.00 C ATOM 565 C1' DA A 18 -3.730 -1.828 -10.552 1.00 0.00 C ATOM 566 N9 DA A 18 -4.047 -1.585 -9.129 1.00 0.00 N ATOM 567 C8 DA A 18 -3.355 -1.915 -8.010 1.00 0.00 C ATOM 568 N7 DA A 18 -3.865 -1.581 -6.873 1.00 0.00 N ATOM 569 C5 DA A 18 -5.049 -0.953 -7.270 1.00 0.00 C ATOM 570 C6 DA A 18 -6.088 -0.353 -6.554 1.00 0.00 C ATOM 571 N6 DA A 18 -6.109 -0.284 -5.224 1.00 0.00 N ATOM 572 N1 DA A 18 -7.107 0.169 -7.260 1.00 0.00 N ATOM 573 C2 DA A 18 -7.105 0.106 -8.592 1.00 0.00 C ATOM 574 N3 DA A 18 -6.175 -0.435 -9.370 1.00 0.00 N ATOM 575 C4 DA A 18 -5.166 -0.951 -8.640 1.00 0.00 C ATOM 0 H5' DA A 18 -3.424 -6.118 -11.429 1.00 0.00 H new ATOM 0 H5'' DA A 18 -3.994 -5.389 -9.941 1.00 0.00 H new ATOM 0 H4' DA A 18 -3.619 -4.028 -12.613 1.00 0.00 H new ATOM 0 H3' DA A 18 -1.949 -4.199 -10.135 1.00 0.00 H new ATOM 0 H2' DA A 18 -1.687 -1.923 -9.845 1.00 0.00 H new ATOM 0 H2'' DA A 18 -1.830 -1.594 -11.561 1.00 0.00 H new ATOM 0 H1' DA A 18 -3.959 -0.914 -11.100 1.00 0.00 H new ATOM 0 H8 DA A 18 -2.412 -2.438 -8.069 1.00 0.00 H new ATOM 0 H61 DA A 18 -6.892 0.165 -4.749 1.00 0.00 H new ATOM 0 H62 DA A 18 -5.342 -0.680 -4.681 1.00 0.00 H new ATOM 0 H2 DA A 18 -7.955 0.544 -9.094 1.00 0.00 H new ATOM 587 P DG A 19 0.308 -4.003 -11.639 1.00 0.00 P ATOM 588 OP1 DG A 19 1.098 -3.735 -12.862 1.00 0.00 O ATOM 589 OP2 DG A 19 0.543 -5.241 -10.865 1.00 0.00 O ATOM 590 O5' DG A 19 0.478 -2.744 -10.642 1.00 0.00 O ATOM 591 C5' DG A 19 1.294 -1.626 -11.012 1.00 0.00 C ATOM 592 C4' DG A 19 2.454 -1.422 -10.040 1.00 0.00 C ATOM 593 O4' DG A 19 2.020 -0.685 -8.863 1.00 0.00 O ATOM 594 C3' DG A 19 3.039 -2.755 -9.573 1.00 0.00 C ATOM 595 O3' DG A 19 4.401 -2.843 -9.999 1.00 0.00 O ATOM 596 C2' DG A 19 2.950 -2.742 -8.077 1.00 0.00 C ATOM 597 C1' DG A 19 2.618 -1.318 -7.709 1.00 0.00 C ATOM 598 N9 DG A 19 1.725 -1.258 -6.543 1.00 0.00 N ATOM 599 C8 DG A 19 0.373 -1.178 -6.478 1.00 0.00 C ATOM 600 N7 DG A 19 -0.163 -1.097 -5.303 1.00 0.00 N ATOM 601 C5 DG A 19 0.966 -1.128 -4.473 1.00 0.00 C ATOM 602 C6 DG A 19 1.062 -1.074 -3.057 1.00 0.00 C ATOM 603 O6 DG A 19 0.154 -0.985 -2.235 1.00 0.00 O ATOM 604 N1 DG A 19 2.382 -1.134 -2.629 1.00 0.00 N ATOM 605 C2 DG A 19 3.480 -1.235 -3.458 1.00 0.00 C ATOM 606 N2 DG A 19 4.670 -1.285 -2.861 1.00 0.00 N ATOM 607 N3 DG A 19 3.400 -1.285 -4.789 1.00 0.00 N ATOM 608 C4 DG A 19 2.122 -1.228 -5.228 1.00 0.00 C ATOM 0 H5' DG A 19 0.682 -0.724 -11.042 1.00 0.00 H new ATOM 0 H5'' DG A 19 1.686 -1.779 -12.018 1.00 0.00 H new ATOM 0 H4' DG A 19 3.216 -0.859 -10.579 1.00 0.00 H new ATOM 0 H3' DG A 19 2.505 -3.611 -9.986 1.00 0.00 H new ATOM 0 H2' DG A 19 2.181 -3.429 -7.723 1.00 0.00 H new ATOM 0 H2'' DG A 19 3.891 -3.056 -7.625 1.00 0.00 H new ATOM 0 H1' DG A 19 3.528 -0.789 -7.426 1.00 0.00 H new ATOM 0 H8 DG A 19 -0.233 -1.182 -7.372 1.00 0.00 H new ATOM 0 H1 DG A 19 2.553 -1.101 -1.624 1.00 0.00 H new ATOM 0 H21 DG A 19 5.519 -1.360 -3.421 1.00 0.00 H new ATOM 0 H22 DG A 19 4.732 -1.248 -1.844 1.00 0.00 H new ATOM 620 P DG A 20 5.188 -4.245 -9.939 1.00 0.00 P ATOM 621 OP1 DG A 20 6.357 -4.160 -10.844 1.00 0.00 O ATOM 622 OP2 DG A 20 4.204 -5.338 -10.103 1.00 0.00 O ATOM 623 O5' DG A 20 5.725 -4.272 -8.419 1.00 0.00 O ATOM 624 C5' DG A 20 6.886 -3.523 -8.043 1.00 0.00 C ATOM 625 C4' DG A 20 7.468 -4.020 -6.719 1.00 0.00 C ATOM 626 O4' DG A 20 6.722 -3.475 -5.587 1.00 0.00 O ATOM 627 C3' DG A 20 7.397 -5.544 -6.639 1.00 0.00 C ATOM 628 O3' DG A 20 8.666 -6.051 -6.216 1.00 0.00 O ATOM 629 C2' DG A 20 6.354 -5.823 -5.607 1.00 0.00 C ATOM 630 C1' DG A 20 6.326 -4.587 -4.750 1.00 0.00 C ATOM 631 N9 DG A 20 4.993 -4.385 -4.171 1.00 0.00 N ATOM 632 C8 DG A 20 3.795 -4.349 -4.784 1.00 0.00 C ATOM 633 N7 DG A 20 2.747 -4.192 -4.045 1.00 0.00 N ATOM 634 C5 DG A 20 3.311 -4.113 -2.767 1.00 0.00 C ATOM 635 C6 DG A 20 2.686 -3.941 -1.502 1.00 0.00 C ATOM 636 O6 DG A 20 1.490 -3.820 -1.253 1.00 0.00 O ATOM 637 N1 DG A 20 3.619 -3.917 -0.472 1.00 0.00 N ATOM 638 C2 DG A 20 4.985 -4.042 -0.633 1.00 0.00 C ATOM 639 N2 DG A 20 5.717 -3.992 0.479 1.00 0.00 N ATOM 640 N3 DG A 20 5.579 -4.203 -1.820 1.00 0.00 N ATOM 641 C4 DG A 20 4.690 -4.230 -2.838 1.00 0.00 C ATOM 0 H5' DG A 20 6.627 -2.468 -7.955 1.00 0.00 H new ATOM 0 H5'' DG A 20 7.640 -3.602 -8.826 1.00 0.00 H new ATOM 0 H4' DG A 20 8.505 -3.689 -6.676 1.00 0.00 H new ATOM 0 H3' DG A 20 7.156 -6.011 -7.594 1.00 0.00 H new ATOM 0 H2' DG A 20 5.383 -6.009 -6.066 1.00 0.00 H new ATOM 0 H2'' DG A 20 6.604 -6.707 -5.020 1.00 0.00 H new ATOM 0 H1' DG A 20 7.013 -4.681 -3.909 1.00 0.00 H new ATOM 0 H8 DG A 20 3.713 -4.448 -5.856 1.00 0.00 H new ATOM 0 H1 DG A 20 3.267 -3.798 0.478 1.00 0.00 H new ATOM 0 H21 DG A 20 6.732 -4.078 0.426 1.00 0.00 H new ATOM 0 H22 DG A 20 5.262 -3.867 1.384 1.00 0.00 H new ATOM 653 P DA A 21 9.930 -6.066 -7.210 1.00 0.00 P ATOM 654 OP1 DA A 21 9.694 -5.070 -8.280 1.00 0.00 O ATOM 655 OP2 DA A 21 10.228 -7.473 -7.561 1.00 0.00 O ATOM 656 O5' DA A 21 11.112 -5.519 -6.261 1.00 0.00 O ATOM 657 C5' DA A 21 10.892 -5.344 -4.855 1.00 0.00 C ATOM 658 C4' DA A 21 11.472 -4.020 -4.353 1.00 0.00 C ATOM 659 O4' DA A 21 11.077 -2.921 -5.221 1.00 0.00 O ATOM 660 C3' DA A 21 10.989 -3.694 -2.947 1.00 0.00 C ATOM 661 O3' DA A 21 11.972 -4.106 -1.993 1.00 0.00 O ATOM 662 C2' DA A 21 10.800 -2.213 -2.933 1.00 0.00 C ATOM 663 C1' DA A 21 10.661 -1.806 -4.389 1.00 0.00 C ATOM 664 N9 DA A 21 9.270 -1.427 -4.714 1.00 0.00 N ATOM 665 C8 DA A 21 8.112 -1.713 -4.067 1.00 0.00 C ATOM 666 N7 DA A 21 7.017 -1.256 -4.573 1.00 0.00 N ATOM 667 C5 DA A 21 7.490 -0.581 -5.703 1.00 0.00 C ATOM 668 C6 DA A 21 6.849 0.143 -6.712 1.00 0.00 C ATOM 669 N6 DA A 21 5.530 0.324 -6.752 1.00 0.00 N ATOM 670 N1 DA A 21 7.618 0.675 -7.676 1.00 0.00 N ATOM 671 C2 DA A 21 8.941 0.507 -7.654 1.00 0.00 C ATOM 672 N3 DA A 21 9.651 -0.158 -6.749 1.00 0.00 N ATOM 673 C4 DA A 21 8.859 -0.682 -5.794 1.00 0.00 C ATOM 0 H5' DA A 21 11.347 -6.171 -4.310 1.00 0.00 H new ATOM 0 H5'' DA A 21 9.822 -5.375 -4.647 1.00 0.00 H new ATOM 0 H4' DA A 21 12.556 -4.137 -4.352 1.00 0.00 H new ATOM 0 H3' DA A 21 10.065 -4.210 -2.686 1.00 0.00 H new ATOM 0 H2' DA A 21 9.914 -1.936 -2.362 1.00 0.00 H new ATOM 0 H2'' DA A 21 11.649 -1.714 -2.466 1.00 0.00 H new ATOM 0 H1' DA A 21 11.290 -0.935 -4.575 1.00 0.00 H new ATOM 0 H8 DA A 21 8.107 -2.302 -3.162 1.00 0.00 H new ATOM 0 H61 DA A 21 5.112 0.861 -7.511 1.00 0.00 H new ATOM 0 H62 DA A 21 4.938 -0.075 -6.023 1.00 0.00 H new ATOM 0 H2 DA A 21 9.496 0.962 -8.461 1.00 0.00 H new ATOM 685 P DG A 22 11.545 -4.434 -0.476 1.00 0.00 P ATOM 686 OP1 DG A 22 12.753 -4.348 0.374 1.00 0.00 O ATOM 687 OP2 DG A 22 10.731 -5.670 -0.482 1.00 0.00 O ATOM 688 O5' DG A 22 10.580 -3.197 -0.108 1.00 0.00 O ATOM 689 C5' DG A 22 11.104 -2.032 0.536 1.00 0.00 C ATOM 690 C4' DG A 22 10.257 -1.625 1.742 1.00 0.00 C ATOM 691 O4' DG A 22 9.081 -0.877 1.324 1.00 0.00 O ATOM 692 C3' DG A 22 9.782 -2.850 2.523 1.00 0.00 C ATOM 693 O3' DG A 22 10.407 -2.859 3.812 1.00 0.00 O ATOM 694 C2' DG A 22 8.294 -2.708 2.643 1.00 0.00 C ATOM 695 C1' DG A 22 7.971 -1.320 2.139 1.00 0.00 C ATOM 696 N9 DG A 22 6.718 -1.321 1.362 1.00 0.00 N ATOM 697 C8 DG A 22 6.534 -1.352 0.020 1.00 0.00 C ATOM 698 N7 DG A 22 5.321 -1.330 -0.419 1.00 0.00 N ATOM 699 C5 DG A 22 4.589 -1.277 0.770 1.00 0.00 C ATOM 700 C6 DG A 22 3.183 -1.230 0.970 1.00 0.00 C ATOM 701 O6 DG A 22 2.292 -1.227 0.124 1.00 0.00 O ATOM 702 N1 DG A 22 2.861 -1.185 2.321 1.00 0.00 N ATOM 703 C2 DG A 22 3.774 -1.185 3.356 1.00 0.00 C ATOM 704 N2 DG A 22 3.265 -1.141 4.588 1.00 0.00 N ATOM 705 N3 DG A 22 5.099 -1.227 3.177 1.00 0.00 N ATOM 706 C4 DG A 22 5.437 -1.272 1.868 1.00 0.00 C ATOM 0 H5' DG A 22 11.142 -1.208 -0.177 1.00 0.00 H new ATOM 0 H5'' DG A 22 12.128 -2.223 0.858 1.00 0.00 H new ATOM 0 H4' DG A 22 10.890 -1.004 2.376 1.00 0.00 H new ATOM 0 H3' DG A 22 10.040 -3.787 2.029 1.00 0.00 H new ATOM 0 H2' DG A 22 7.780 -3.467 2.054 1.00 0.00 H new ATOM 0 H2'' DG A 22 7.971 -2.834 3.676 1.00 0.00 H new ATOM 0 H1' DG A 22 7.826 -0.640 2.979 1.00 0.00 H new ATOM 0 H8 DG A 22 7.373 -1.394 -0.658 1.00 0.00 H new ATOM 0 H1 DG A 22 1.872 -1.149 2.567 1.00 0.00 H new ATOM 0 H21 DG A 22 3.886 -1.138 5.397 1.00 0.00 H new ATOM 0 H22 DG A 22 2.254 -1.110 4.721 1.00 0.00 H new ATOM 718 P DG A 23 11.389 -4.061 4.242 1.00 0.00 P ATOM 719 OP1 DG A 23 12.470 -3.498 5.080 1.00 0.00 O ATOM 720 OP2 DG A 23 11.723 -4.841 3.030 1.00 0.00 O ATOM 721 O5' DG A 23 10.444 -4.967 5.180 1.00 0.00 O ATOM 722 C5' DG A 23 9.545 -4.358 6.111 1.00 0.00 C ATOM 723 C4' DG A 23 8.443 -5.324 6.556 1.00 0.00 C ATOM 724 O4' DG A 23 7.128 -4.754 6.295 1.00 0.00 O ATOM 725 C3' DG A 23 8.536 -6.658 5.812 1.00 0.00 C ATOM 726 O3' DG A 23 8.813 -7.702 6.750 1.00 0.00 O ATOM 727 C2' DG A 23 7.203 -6.857 5.157 1.00 0.00 C ATOM 728 C1' DG A 23 6.293 -5.798 5.744 1.00 0.00 C ATOM 729 N9 DG A 23 5.367 -5.253 4.729 1.00 0.00 N ATOM 730 C8 DG A 23 5.573 -4.994 3.415 1.00 0.00 C ATOM 731 N7 DG A 23 4.587 -4.507 2.738 1.00 0.00 N ATOM 732 C5 DG A 23 3.586 -4.426 3.711 1.00 0.00 C ATOM 733 C6 DG A 23 2.247 -3.966 3.603 1.00 0.00 C ATOM 734 O6 DG A 23 1.668 -3.531 2.609 1.00 0.00 O ATOM 735 N1 DG A 23 1.579 -4.051 4.818 1.00 0.00 N ATOM 736 C2 DG A 23 2.126 -4.519 5.995 1.00 0.00 C ATOM 737 N2 DG A 23 1.323 -4.524 7.058 1.00 0.00 N ATOM 738 N3 DG A 23 3.386 -4.954 6.106 1.00 0.00 N ATOM 739 C4 DG A 23 4.058 -4.881 4.934 1.00 0.00 C ATOM 0 H5' DG A 23 9.093 -3.477 5.656 1.00 0.00 H new ATOM 0 H5'' DG A 23 10.102 -4.016 6.983 1.00 0.00 H new ATOM 0 H4' DG A 23 8.580 -5.492 7.624 1.00 0.00 H new ATOM 0 H3' DG A 23 9.334 -6.668 5.069 1.00 0.00 H new ATOM 0 H2' DG A 23 7.279 -6.751 4.075 1.00 0.00 H new ATOM 0 H2'' DG A 23 6.816 -7.857 5.353 1.00 0.00 H new ATOM 0 H1' DG A 23 5.672 -6.239 6.524 1.00 0.00 H new ATOM 0 H8 DG A 23 6.528 -5.188 2.950 1.00 0.00 H new ATOM 0 H1 DG A 23 0.607 -3.743 4.842 1.00 0.00 H new ATOM 0 H21 DG A 23 1.669 -4.859 7.957 1.00 0.00 H new ATOM 0 H22 DG A 23 0.362 -4.193 6.973 1.00 0.00 H new ATOM 751 P DA A 24 9.341 -9.136 6.244 1.00 0.00 P ATOM 752 OP1 DA A 24 10.548 -9.488 7.022 1.00 0.00 O ATOM 753 OP2 DA A 24 9.397 -9.113 4.765 1.00 0.00 O ATOM 754 O5' DA A 24 8.149 -10.126 6.687 1.00 0.00 O ATOM 755 C5' DA A 24 7.103 -9.671 7.552 1.00 0.00 C ATOM 756 C4' DA A 24 5.732 -10.137 7.067 1.00 0.00 C ATOM 757 O4' DA A 24 5.142 -9.147 6.186 1.00 0.00 O ATOM 758 C3' DA A 24 5.839 -11.448 6.299 1.00 0.00 C ATOM 759 O3' DA A 24 5.323 -12.536 7.073 1.00 0.00 O ATOM 760 C2' DA A 24 5.034 -11.251 5.051 1.00 0.00 C ATOM 761 C1' DA A 24 4.453 -9.853 5.132 1.00 0.00 C ATOM 762 N9 DA A 24 4.614 -9.147 3.852 1.00 0.00 N ATOM 763 C8 DA A 24 5.678 -9.124 3.024 1.00 0.00 C ATOM 764 N7 DA A 24 5.586 -8.415 1.949 1.00 0.00 N ATOM 765 C5 DA A 24 4.292 -7.893 2.070 1.00 0.00 C ATOM 766 C6 DA A 24 3.534 -7.042 1.261 1.00 0.00 C ATOM 767 N6 DA A 24 3.983 -6.535 0.112 1.00 0.00 N ATOM 768 N1 DA A 24 2.294 -6.730 1.681 1.00 0.00 N ATOM 769 C2 DA A 24 1.825 -7.227 2.828 1.00 0.00 C ATOM 770 N3 DA A 24 2.456 -8.040 3.669 1.00 0.00 N ATOM 771 C4 DA A 24 3.694 -8.337 3.228 1.00 0.00 C ATOM 0 H5' DA A 24 7.121 -8.582 7.604 1.00 0.00 H new ATOM 0 H5'' DA A 24 7.278 -10.042 8.562 1.00 0.00 H new ATOM 0 H4' DA A 24 5.108 -10.278 7.950 1.00 0.00 H new ATOM 0 H3' DA A 24 6.876 -11.697 6.072 1.00 0.00 H new ATOM 0 H2' DA A 24 5.659 -11.361 4.165 1.00 0.00 H new ATOM 0 H2'' DA A 24 4.242 -11.997 4.978 1.00 0.00 H new ATOM 0 HO3' DA A 24 5.400 -13.368 6.560 1.00 0.00 H new ATOM 0 H1' DA A 24 3.385 -9.905 5.345 1.00 0.00 H new ATOM 0 H8 DA A 24 6.576 -9.679 3.252 1.00 0.00 H new ATOM 0 H61 DA A 24 3.388 -5.918 -0.440 1.00 0.00 H new ATOM 0 H62 DA A 24 4.922 -6.764 -0.214 1.00 0.00 H new ATOM 0 H2 DA A 24 0.822 -6.936 3.103 1.00 0.00 H new TER 784 DA A 24