USER MOD reduce.3.24.130724 H: found=0, std=0, add=276, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 276 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 DA O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl -30:sc= -1.82! (180deg=-2.64!) USER MOD Single : A 7 DT C7 :methyl 150:sc= -0.198 (180deg=-0.198) USER MOD Single : A 8 DT C7 :methyl -30:sc= -0.566 (180deg=-3.39!) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 1 DA O5' : rot 180:sc= 0 USER MOD Single : B 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 6 DT C7 :methyl -30:sc= -1.78! (180deg=-2.7!) USER MOD Single : B 7 DT C7 :methyl 150:sc= -0.203 (180deg=-0.203) USER MOD Single : B 8 DT C7 :methyl -30:sc= -0.574 (180deg=-3.38!) USER MOD Single : B 12 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 13.479 8.590 0.931 1.00 0.00 O ATOM 2 C5' DA A 1 12.655 9.414 0.101 1.00 0.00 C ATOM 3 C4' DA A 1 11.704 10.286 0.939 1.00 0.00 C ATOM 4 O4' DA A 1 10.874 11.120 0.092 1.00 0.00 O ATOM 5 C3' DA A 1 10.778 9.436 1.809 1.00 0.00 C ATOM 6 O3' DA A 1 10.875 9.856 3.181 1.00 0.00 O ATOM 7 C2' DA A 1 9.386 9.662 1.266 1.00 0.00 C ATOM 8 C1' DA A 1 9.473 10.867 0.354 1.00 0.00 C ATOM 9 N9 DA A 1 8.733 10.632 -0.895 1.00 0.00 N ATOM 10 C8 DA A 1 7.499 11.046 -1.210 1.00 0.00 C ATOM 11 N7 DA A 1 7.031 10.727 -2.372 1.00 0.00 N ATOM 12 C5 DA A 1 8.097 9.999 -2.911 1.00 0.00 C ATOM 13 C6 DA A 1 8.281 9.354 -4.141 1.00 0.00 C ATOM 14 N6 DA A 1 7.347 9.323 -5.096 1.00 0.00 N ATOM 15 N1 DA A 1 9.457 8.734 -4.342 1.00 0.00 N ATOM 16 C2 DA A 1 10.396 8.744 -3.391 1.00 0.00 C ATOM 17 N3 DA A 1 10.326 9.319 -2.194 1.00 0.00 N ATOM 18 C4 DA A 1 9.142 9.935 -2.015 1.00 0.00 C ATOM 0 H5' DA A 1 12.074 8.786 -0.575 1.00 0.00 H new ATOM 0 H5'' DA A 1 13.284 10.052 -0.519 1.00 0.00 H new ATOM 0 H4' DA A 1 12.338 10.906 1.573 1.00 0.00 H new ATOM 0 H3' DA A 1 11.041 8.379 1.782 1.00 0.00 H new ATOM 0 H2' DA A 1 9.035 8.786 0.720 1.00 0.00 H new ATOM 0 H2'' DA A 1 8.677 9.838 2.075 1.00 0.00 H new ATOM 0 HO5' DA A 1 14.070 8.047 0.369 1.00 0.00 H new ATOM 0 H1' DA A 1 9.020 11.736 0.830 1.00 0.00 H new ATOM 0 H8 DA A 1 6.913 11.628 -0.515 1.00 0.00 H new ATOM 0 H61 DA A 1 7.532 8.839 -5.975 1.00 0.00 H new ATOM 0 H62 DA A 1 6.449 9.783 -4.946 1.00 0.00 H new ATOM 0 H2 DA A 1 11.316 8.227 -3.621 1.00 0.00 H new ATOM 31 P DA A 2 10.064 9.104 4.357 1.00 0.00 P ATOM 32 OP1 DA A 2 10.433 9.732 5.646 1.00 0.00 O ATOM 33 OP2 DA A 2 10.228 7.643 4.174 1.00 0.00 O ATOM 34 O5' DA A 2 8.535 9.484 4.027 1.00 0.00 O ATOM 35 C5' DA A 2 8.002 10.762 4.390 1.00 0.00 C ATOM 36 C4' DA A 2 6.559 10.919 3.919 1.00 0.00 C ATOM 37 O4' DA A 2 6.477 10.916 2.482 1.00 0.00 O ATOM 38 C3' DA A 2 5.663 9.782 4.422 1.00 0.00 C ATOM 39 O3' DA A 2 4.858 10.195 5.531 1.00 0.00 O ATOM 40 C2' DA A 2 4.805 9.402 3.242 1.00 0.00 C ATOM 41 C1' DA A 2 5.237 10.297 2.093 1.00 0.00 C ATOM 42 N9 DA A 2 5.382 9.529 0.847 1.00 0.00 N ATOM 43 C8 DA A 2 6.044 8.371 0.605 1.00 0.00 C ATOM 44 N7 DA A 2 5.981 7.892 -0.588 1.00 0.00 N ATOM 45 C5 DA A 2 5.184 8.839 -1.230 1.00 0.00 C ATOM 46 C6 DA A 2 4.718 8.944 -2.538 1.00 0.00 C ATOM 47 N6 DA A 2 5.032 8.064 -3.484 1.00 0.00 N ATOM 48 N1 DA A 2 3.950 10.007 -2.841 1.00 0.00 N ATOM 49 C2 DA A 2 3.662 10.917 -1.906 1.00 0.00 C ATOM 50 N3 DA A 2 4.052 10.912 -0.637 1.00 0.00 N ATOM 51 C4 DA A 2 4.816 9.837 -0.364 1.00 0.00 C ATOM 0 H5' DA A 2 8.616 11.551 3.955 1.00 0.00 H new ATOM 0 H5'' DA A 2 8.048 10.883 5.472 1.00 0.00 H new ATOM 0 H4' DA A 2 6.217 11.871 4.325 1.00 0.00 H new ATOM 0 H3' DA A 2 6.254 8.941 4.785 1.00 0.00 H new ATOM 0 H2' DA A 2 4.939 8.351 2.987 1.00 0.00 H new ATOM 0 H2'' DA A 2 3.748 9.543 3.468 1.00 0.00 H new ATOM 0 H1' DA A 2 4.483 11.058 1.893 1.00 0.00 H new ATOM 0 H8 DA A 2 6.602 7.870 1.382 1.00 0.00 H new ATOM 0 H61 DA A 2 4.668 8.180 -4.430 1.00 0.00 H new ATOM 0 H62 DA A 2 5.637 7.273 -3.264 1.00 0.00 H new ATOM 0 H2 DA A 2 3.045 11.747 -2.216 1.00 0.00 H new ATOM 63 P DG A 3 4.490 9.157 6.712 1.00 0.00 P ATOM 64 OP1 DG A 3 5.003 9.714 7.982 1.00 0.00 O ATOM 65 OP2 DG A 3 4.886 7.789 6.291 1.00 0.00 O ATOM 66 O5' DG A 3 2.880 9.230 6.746 1.00 0.00 O ATOM 67 C5' DG A 3 2.155 9.352 5.524 1.00 0.00 C ATOM 68 C4' DG A 3 0.682 9.650 5.741 1.00 0.00 C ATOM 69 O4' DG A 3 -0.012 9.697 4.468 1.00 0.00 O ATOM 70 C3' DG A 3 0.043 8.568 6.589 1.00 0.00 C ATOM 71 O3' DG A 3 -0.782 9.150 7.610 1.00 0.00 O ATOM 72 C2' DG A 3 -0.770 7.756 5.614 1.00 0.00 C ATOM 73 C1' DG A 3 -1.016 8.668 4.423 1.00 0.00 C ATOM 74 N9 DG A 3 -0.963 7.913 3.162 1.00 0.00 N ATOM 75 C8 DG A 3 -1.807 7.963 2.109 1.00 0.00 C ATOM 76 N7 DG A 3 -1.615 7.126 1.146 1.00 0.00 N ATOM 77 C5 DG A 3 -0.498 6.421 1.606 1.00 0.00 C ATOM 78 C6 DG A 3 0.208 5.352 1.004 1.00 0.00 C ATOM 79 O6 DG A 3 -0.023 4.802 -0.067 1.00 0.00 O ATOM 80 N1 DG A 3 1.268 4.928 1.794 1.00 0.00 N ATOM 81 C2 DG A 3 1.613 5.472 3.020 1.00 0.00 C ATOM 82 N2 DG A 3 2.681 4.954 3.631 1.00 0.00 N ATOM 83 N3 DG A 3 0.950 6.478 3.593 1.00 0.00 N ATOM 84 C4 DG A 3 -0.089 6.902 2.838 1.00 0.00 C ATOM 0 H5' DG A 3 2.254 8.428 4.954 1.00 0.00 H new ATOM 0 H5'' DG A 3 2.597 10.146 4.922 1.00 0.00 H new ATOM 0 H4' DG A 3 0.605 10.613 6.247 1.00 0.00 H new ATOM 0 H3' DG A 3 0.776 7.954 7.113 1.00 0.00 H new ATOM 0 H2' DG A 3 -0.235 6.855 5.313 1.00 0.00 H new ATOM 0 H2'' DG A 3 -1.710 7.434 6.061 1.00 0.00 H new ATOM 0 H1' DG A 3 -2.011 9.110 4.470 1.00 0.00 H new ATOM 0 H8 DG A 3 -2.615 8.679 2.074 1.00 0.00 H new ATOM 0 H1 DG A 3 1.836 4.156 1.445 1.00 0.00 H new ATOM 0 H21 DG A 3 2.978 5.319 4.536 1.00 0.00 H new ATOM 0 H22 DG A 3 3.200 4.193 3.193 1.00 0.00 H new ATOM 96 P DG A 4 -1.883 8.272 8.394 1.00 0.00 P ATOM 97 OP1 DG A 4 -2.465 9.108 9.469 1.00 0.00 O ATOM 98 OP2 DG A 4 -1.284 6.960 8.723 1.00 0.00 O ATOM 99 O5' DG A 4 -3.004 8.049 7.258 1.00 0.00 O ATOM 100 C5' DG A 4 -3.853 9.128 6.850 1.00 0.00 C ATOM 101 C4' DG A 4 -4.809 8.706 5.743 1.00 0.00 C ATOM 102 O4' DG A 4 -4.113 8.220 4.577 1.00 0.00 O ATOM 103 C3' DG A 4 -5.703 7.582 6.212 1.00 0.00 C ATOM 104 O3' DG A 4 -6.943 8.053 6.738 1.00 0.00 O ATOM 105 C2' DG A 4 -5.923 6.734 4.986 1.00 0.00 C ATOM 106 C1' DG A 4 -4.950 7.235 3.935 1.00 0.00 C ATOM 107 N9 DG A 4 -4.172 6.098 3.421 1.00 0.00 N ATOM 108 C8 DG A 4 -3.350 5.269 4.099 1.00 0.00 C ATOM 109 N7 DG A 4 -2.853 4.266 3.468 1.00 0.00 N ATOM 110 C5 DG A 4 -3.405 4.428 2.199 1.00 0.00 C ATOM 111 C6 DG A 4 -3.243 3.632 1.044 1.00 0.00 C ATOM 112 O6 DG A 4 -2.586 2.603 0.921 1.00 0.00 O ATOM 113 N1 DG A 4 -3.966 4.131 -0.026 1.00 0.00 N ATOM 114 C2 DG A 4 -4.758 5.266 0.005 1.00 0.00 C ATOM 115 N2 DG A 4 -5.385 5.582 -1.128 1.00 0.00 N ATOM 116 N3 DG A 4 -4.918 6.027 1.093 1.00 0.00 N ATOM 117 C4 DG A 4 -4.216 5.553 2.153 1.00 0.00 C ATOM 0 H5' DG A 4 -3.241 9.961 6.504 1.00 0.00 H new ATOM 0 H5'' DG A 4 -4.424 9.486 7.707 1.00 0.00 H new ATOM 0 H4' DG A 4 -5.384 9.597 5.489 1.00 0.00 H new ATOM 0 H3' DG A 4 -5.244 7.028 7.031 1.00 0.00 H new ATOM 0 H2' DG A 4 -5.748 5.681 5.206 1.00 0.00 H new ATOM 0 H2'' DG A 4 -6.951 6.819 4.635 1.00 0.00 H new ATOM 0 H1' DG A 4 -5.456 7.690 3.083 1.00 0.00 H new ATOM 0 H8 DG A 4 -3.117 5.443 5.139 1.00 0.00 H new ATOM 0 H1 DG A 4 -3.911 3.622 -0.908 1.00 0.00 H new ATOM 0 H21 DG A 4 -5.983 6.407 -1.167 1.00 0.00 H new ATOM 0 H22 DG A 4 -5.267 4.998 -1.956 1.00 0.00 H new ATOM 129 P DT A 5 -7.972 7.001 7.393 1.00 0.00 P ATOM 130 OP1 DT A 5 -8.770 7.710 8.419 1.00 0.00 O ATOM 131 OP2 DT A 5 -7.224 5.776 7.752 1.00 0.00 O ATOM 132 O5' DT A 5 -8.929 6.651 6.153 1.00 0.00 O ATOM 133 C5' DT A 5 -9.414 7.692 5.302 1.00 0.00 C ATOM 134 C4' DT A 5 -9.823 7.154 3.941 1.00 0.00 C ATOM 135 O4' DT A 5 -8.748 6.411 3.318 1.00 0.00 O ATOM 136 C3' DT A 5 -11.022 6.228 4.067 1.00 0.00 C ATOM 137 O3' DT A 5 -12.115 6.749 3.311 1.00 0.00 O ATOM 138 C2' DT A 5 -10.556 4.898 3.510 1.00 0.00 C ATOM 139 C1' DT A 5 -9.277 5.201 2.745 1.00 0.00 C ATOM 140 N1 DT A 5 -8.315 4.087 2.858 1.00 0.00 N ATOM 141 C2 DT A 5 -7.982 3.394 1.704 1.00 0.00 C ATOM 142 O2 DT A 5 -8.493 3.642 0.602 1.00 0.00 O ATOM 143 N3 DT A 5 -7.052 2.384 1.862 1.00 0.00 N ATOM 144 C4 DT A 5 -6.438 2.012 3.046 1.00 0.00 C ATOM 145 O4 DT A 5 -5.616 1.101 3.069 1.00 0.00 O ATOM 146 C5 DT A 5 -6.852 2.787 4.190 1.00 0.00 C ATOM 147 C7 DT A 5 -6.250 2.488 5.561 1.00 0.00 C ATOM 148 C6 DT A 5 -7.757 3.774 4.067 1.00 0.00 C ATOM 0 H5' DT A 5 -8.641 8.451 5.177 1.00 0.00 H new ATOM 0 H5'' DT A 5 -10.267 8.180 5.773 1.00 0.00 H new ATOM 0 H4' DT A 5 -10.074 8.018 3.325 1.00 0.00 H new ATOM 0 H3' DT A 5 -11.369 6.127 5.095 1.00 0.00 H new ATOM 0 H2' DT A 5 -10.374 4.180 4.310 1.00 0.00 H new ATOM 0 H2'' DT A 5 -11.310 4.461 2.855 1.00 0.00 H new ATOM 0 H1' DT A 5 -9.471 5.325 1.680 1.00 0.00 H new ATOM 0 H3 DT A 5 -6.793 1.862 1.025 1.00 0.00 H new ATOM 0 H71 DT A 5 -6.223 3.402 6.154 1.00 0.00 H new ATOM 0 H72 DT A 5 -6.860 1.743 6.072 1.00 0.00 H new ATOM 0 H73 DT A 5 -5.237 2.105 5.438 1.00 0.00 H new ATOM 0 H6 DT A 5 -8.050 4.333 4.943 1.00 0.00 H new ATOM 161 P DT A 6 -13.512 5.962 3.214 1.00 0.00 P ATOM 162 OP1 DT A 6 -14.333 6.322 4.390 1.00 0.00 O ATOM 163 OP2 DT A 6 -13.237 4.539 2.909 1.00 0.00 O ATOM 164 O5' DT A 6 -14.175 6.640 1.912 1.00 0.00 O ATOM 165 C5' DT A 6 -15.209 5.978 1.177 1.00 0.00 C ATOM 166 C4' DT A 6 -14.666 5.306 -0.096 1.00 0.00 C ATOM 167 O4' DT A 6 -13.954 6.262 -0.929 1.00 0.00 O ATOM 168 C3' DT A 6 -13.699 4.168 0.238 1.00 0.00 C ATOM 169 O3' DT A 6 -14.153 2.947 -0.359 1.00 0.00 O ATOM 170 C2' DT A 6 -12.361 4.581 -0.340 1.00 0.00 C ATOM 171 C1' DT A 6 -12.649 5.743 -1.287 1.00 0.00 C ATOM 172 N1 DT A 6 -11.606 6.788 -1.174 1.00 0.00 N ATOM 173 C2 DT A 6 -10.691 6.885 -2.208 1.00 0.00 C ATOM 174 O2 DT A 6 -10.716 6.133 -3.180 1.00 0.00 O ATOM 175 N3 DT A 6 -9.736 7.875 -2.087 1.00 0.00 N ATOM 176 C4 DT A 6 -9.617 8.768 -1.039 1.00 0.00 C ATOM 177 O4 DT A 6 -8.722 9.612 -1.037 1.00 0.00 O ATOM 178 C5 DT A 6 -10.617 8.596 -0.004 1.00 0.00 C ATOM 179 C7 DT A 6 -10.627 9.541 1.194 1.00 0.00 C ATOM 180 C6 DT A 6 -11.558 7.630 -0.097 1.00 0.00 C ATOM 0 H5' DT A 6 -15.981 6.699 0.906 1.00 0.00 H new ATOM 0 H5'' DT A 6 -15.682 5.228 1.811 1.00 0.00 H new ATOM 0 H4' DT A 6 -15.531 4.911 -0.628 1.00 0.00 H new ATOM 0 H3' DT A 6 -13.630 3.995 1.312 1.00 0.00 H new ATOM 0 H2' DT A 6 -11.672 4.883 0.449 1.00 0.00 H new ATOM 0 H2'' DT A 6 -11.893 3.752 -0.871 1.00 0.00 H new ATOM 0 H1' DT A 6 -12.641 5.410 -2.325 1.00 0.00 H new ATOM 0 H3 DT A 6 -9.055 7.955 -2.842 1.00 0.00 H new ATOM 0 H71 DT A 6 -9.612 9.882 1.397 1.00 0.00 H new ATOM 0 H72 DT A 6 -11.261 10.400 0.975 1.00 0.00 H new ATOM 0 H73 DT A 6 -11.015 9.017 2.067 1.00 0.00 H new ATOM 0 H6 DT A 6 -12.285 7.521 0.694 1.00 0.00 H new ATOM 193 P DT A 7 -14.391 1.619 0.524 1.00 0.00 P ATOM 194 OP1 DT A 7 -15.740 1.090 0.215 1.00 0.00 O ATOM 195 OP2 DT A 7 -14.013 1.905 1.924 1.00 0.00 O ATOM 196 O5' DT A 7 -13.298 0.610 -0.083 1.00 0.00 O ATOM 197 C5' DT A 7 -13.018 0.584 -1.487 1.00 0.00 C ATOM 198 C4' DT A 7 -11.702 -0.147 -1.765 1.00 0.00 C ATOM 199 O4' DT A 7 -10.626 0.359 -0.927 1.00 0.00 O ATOM 200 C3' DT A 7 -11.863 -1.625 -1.458 1.00 0.00 C ATOM 201 O3' DT A 7 -11.390 -2.408 -2.550 1.00 0.00 O ATOM 202 C2' DT A 7 -11.026 -1.865 -0.223 1.00 0.00 C ATOM 203 C1' DT A 7 -10.033 -0.729 -0.180 1.00 0.00 C ATOM 204 N1 DT A 7 -9.765 -0.347 1.215 1.00 0.00 N ATOM 205 C2 DT A 7 -8.587 -0.794 1.775 1.00 0.00 C ATOM 206 O2 DT A 7 -7.772 -1.471 1.148 1.00 0.00 O ATOM 207 N3 DT A 7 -8.382 -0.462 3.095 1.00 0.00 N ATOM 208 C4 DT A 7 -9.236 0.266 3.897 1.00 0.00 C ATOM 209 O4 DT A 7 -8.942 0.498 5.069 1.00 0.00 O ATOM 210 C5 DT A 7 -10.447 0.695 3.231 1.00 0.00 C ATOM 211 C7 DT A 7 -11.489 1.495 4.012 1.00 0.00 C ATOM 212 C6 DT A 7 -10.671 0.383 1.935 1.00 0.00 C ATOM 0 H5' DT A 7 -12.961 1.603 -1.870 1.00 0.00 H new ATOM 0 H5'' DT A 7 -13.833 0.089 -2.016 1.00 0.00 H new ATOM 0 H4' DT A 7 -11.455 0.015 -2.814 1.00 0.00 H new ATOM 0 H3' DT A 7 -12.905 -1.903 -1.299 1.00 0.00 H new ATOM 0 H2' DT A 7 -11.645 -1.879 0.674 1.00 0.00 H new ATOM 0 H2'' DT A 7 -10.518 -2.828 -0.274 1.00 0.00 H new ATOM 0 H1' DT A 7 -9.075 -1.009 -0.617 1.00 0.00 H new ATOM 0 H3 DT A 7 -7.514 -0.786 3.522 1.00 0.00 H new ATOM 0 H71 DT A 7 -12.019 2.163 3.333 1.00 0.00 H new ATOM 0 H72 DT A 7 -12.200 0.811 4.476 1.00 0.00 H new ATOM 0 H73 DT A 7 -10.993 2.082 4.785 1.00 0.00 H new ATOM 0 H6 DT A 7 -11.582 0.716 1.459 1.00 0.00 H new ATOM 225 P DT A 8 -11.769 -3.963 -2.672 1.00 0.00 P ATOM 226 OP1 DT A 8 -12.891 -4.095 -3.622 1.00 0.00 O ATOM 227 OP2 DT A 8 -11.878 -4.538 -1.313 1.00 0.00 O ATOM 228 O5' DT A 8 -10.466 -4.573 -3.371 1.00 0.00 O ATOM 229 C5' DT A 8 -9.245 -4.702 -2.646 1.00 0.00 C ATOM 230 C4' DT A 8 -8.335 -5.718 -3.316 1.00 0.00 C ATOM 231 O4' DT A 8 -9.050 -6.961 -3.518 1.00 0.00 O ATOM 232 C3' DT A 8 -7.877 -5.211 -4.675 1.00 0.00 C ATOM 233 O3' DT A 8 -6.467 -5.388 -4.824 1.00 0.00 O ATOM 234 C2' DT A 8 -8.626 -6.047 -5.687 1.00 0.00 C ATOM 235 C1' DT A 8 -9.113 -7.274 -4.924 1.00 0.00 C ATOM 236 N1 DT A 8 -10.485 -7.664 -5.335 1.00 0.00 N ATOM 237 C2 DT A 8 -10.647 -8.942 -5.839 1.00 0.00 C ATOM 238 O2 DT A 8 -9.710 -9.733 -5.932 1.00 0.00 O ATOM 239 N3 DT A 8 -11.924 -9.284 -6.231 1.00 0.00 N ATOM 240 C4 DT A 8 -13.043 -8.476 -6.166 1.00 0.00 C ATOM 241 O4 DT A 8 -14.135 -8.889 -6.548 1.00 0.00 O ATOM 242 C5 DT A 8 -12.787 -7.160 -5.626 1.00 0.00 C ATOM 243 C7 DT A 8 -13.934 -6.162 -5.500 1.00 0.00 C ATOM 244 C6 DT A 8 -11.549 -6.797 -5.234 1.00 0.00 C ATOM 0 H5' DT A 8 -9.454 -5.011 -1.622 1.00 0.00 H new ATOM 0 H5'' DT A 8 -8.744 -3.736 -2.591 1.00 0.00 H new ATOM 0 H4' DT A 8 -7.471 -5.875 -2.670 1.00 0.00 H new ATOM 0 H3' DT A 8 -8.077 -4.147 -4.801 1.00 0.00 H new ATOM 0 H2' DT A 8 -9.462 -5.492 -6.112 1.00 0.00 H new ATOM 0 H2'' DT A 8 -7.979 -6.332 -6.516 1.00 0.00 H new ATOM 0 H1' DT A 8 -8.479 -8.132 -5.148 1.00 0.00 H new ATOM 0 H3 DT A 8 -12.055 -10.224 -6.605 1.00 0.00 H new ATOM 0 H71 DT A 8 -14.668 -6.351 -6.283 1.00 0.00 H new ATOM 0 H72 DT A 8 -14.407 -6.273 -4.524 1.00 0.00 H new ATOM 0 H73 DT A 8 -13.547 -5.148 -5.602 1.00 0.00 H new ATOM 0 H6 DT A 8 -11.389 -5.807 -4.833 1.00 0.00 H new ATOM 257 P DA A 9 -5.742 -5.025 -6.213 1.00 0.00 P ATOM 258 OP1 DA A 9 -6.687 -4.247 -7.045 1.00 0.00 O ATOM 259 OP2 DA A 9 -5.128 -6.258 -6.754 1.00 0.00 O ATOM 260 O5' DA A 9 -4.564 -4.039 -5.740 1.00 0.00 O ATOM 261 C5' DA A 9 -4.858 -2.796 -5.097 1.00 0.00 C ATOM 262 C4' DA A 9 -4.316 -2.756 -3.665 1.00 0.00 C ATOM 263 O4' DA A 9 -4.383 -1.415 -3.125 1.00 0.00 O ATOM 264 C3' DA A 9 -5.117 -3.672 -2.737 1.00 0.00 C ATOM 265 O3' DA A 9 -4.261 -4.616 -2.087 1.00 0.00 O ATOM 266 C2' DA A 9 -5.745 -2.763 -1.714 1.00 0.00 C ATOM 267 C1' DA A 9 -5.019 -1.440 -1.833 1.00 0.00 C ATOM 268 N9 DA A 9 -5.952 -0.328 -1.679 1.00 0.00 N ATOM 269 C8 DA A 9 -5.961 0.633 -0.741 1.00 0.00 C ATOM 270 N7 DA A 9 -6.897 1.514 -0.795 1.00 0.00 N ATOM 271 C5 DA A 9 -7.613 1.086 -1.916 1.00 0.00 C ATOM 272 C6 DA A 9 -8.752 1.579 -2.546 1.00 0.00 C ATOM 273 N6 DA A 9 -9.407 2.658 -2.103 1.00 0.00 N ATOM 274 N1 DA A 9 -9.198 0.910 -3.635 1.00 0.00 N ATOM 275 C2 DA A 9 -8.552 -0.183 -4.072 1.00 0.00 C ATOM 276 N3 DA A 9 -7.460 -0.727 -3.543 1.00 0.00 N ATOM 277 C4 DA A 9 -7.043 -0.039 -2.462 1.00 0.00 C ATOM 0 H5' DA A 9 -5.937 -2.640 -5.082 1.00 0.00 H new ATOM 0 H5'' DA A 9 -4.426 -1.977 -5.673 1.00 0.00 H new ATOM 0 H4' DA A 9 -3.281 -3.094 -3.715 1.00 0.00 H new ATOM 0 H3' DA A 9 -5.860 -4.244 -3.293 1.00 0.00 H new ATOM 0 H2' DA A 9 -6.812 -2.641 -1.902 1.00 0.00 H new ATOM 0 H2'' DA A 9 -5.643 -3.175 -0.710 1.00 0.00 H new ATOM 0 H1' DA A 9 -4.272 -1.335 -1.046 1.00 0.00 H new ATOM 0 H8 DA A 9 -5.208 0.665 0.033 1.00 0.00 H new ATOM 0 H61 DA A 9 -10.238 2.987 -2.594 1.00 0.00 H new ATOM 0 H62 DA A 9 -9.075 3.152 -1.274 1.00 0.00 H new ATOM 0 H2 DA A 9 -8.962 -0.671 -4.944 1.00 0.00 H new ATOM 289 P DA A 10 -3.934 -6.047 -2.742 1.00 0.00 P ATOM 290 OP1 DA A 10 -3.546 -5.835 -4.151 1.00 0.00 O ATOM 291 OP2 DA A 10 -5.040 -6.975 -2.411 1.00 0.00 O ATOM 292 O5' DA A 10 -2.625 -6.504 -1.919 1.00 0.00 O ATOM 293 C5' DA A 10 -1.319 -6.099 -2.346 1.00 0.00 C ATOM 294 C4' DA A 10 -0.388 -5.773 -1.141 1.00 0.00 C ATOM 295 O4' DA A 10 -0.607 -4.431 -0.635 1.00 0.00 O ATOM 296 C3' DA A 10 -0.592 -6.736 0.041 1.00 0.00 C ATOM 297 O3' DA A 10 0.617 -7.456 0.324 1.00 0.00 O ATOM 298 C2' DA A 10 -0.968 -5.852 1.217 1.00 0.00 C ATOM 299 C1' DA A 10 -0.590 -4.454 0.813 1.00 0.00 C ATOM 300 N9 DA A 10 -1.515 -3.460 1.369 1.00 0.00 N ATOM 301 C8 DA A 10 -2.215 -2.520 0.721 1.00 0.00 C ATOM 302 N7 DA A 10 -2.906 -1.686 1.429 1.00 0.00 N ATOM 303 C5 DA A 10 -2.631 -2.134 2.726 1.00 0.00 C ATOM 304 C6 DA A 10 -3.041 -1.696 3.990 1.00 0.00 C ATOM 305 N6 DA A 10 -3.851 -0.656 4.176 1.00 0.00 N ATOM 306 N1 DA A 10 -2.583 -2.369 5.058 1.00 0.00 N ATOM 307 C2 DA A 10 -1.769 -3.413 4.898 1.00 0.00 C ATOM 308 N3 DA A 10 -1.314 -3.909 3.753 1.00 0.00 N ATOM 309 C4 DA A 10 -1.787 -3.218 2.697 1.00 0.00 C ATOM 0 H5' DA A 10 -1.403 -5.222 -2.987 1.00 0.00 H new ATOM 0 H5'' DA A 10 -0.872 -6.891 -2.946 1.00 0.00 H new ATOM 0 H4' DA A 10 0.623 -5.876 -1.535 1.00 0.00 H new ATOM 0 H3' DA A 10 -1.359 -7.481 -0.173 1.00 0.00 H new ATOM 0 H2' DA A 10 -2.034 -5.922 1.434 1.00 0.00 H new ATOM 0 H2'' DA A 10 -0.438 -6.155 2.120 1.00 0.00 H new ATOM 0 H1' DA A 10 0.395 -4.193 1.201 1.00 0.00 H new ATOM 0 H8 DA A 10 -2.203 -2.460 -0.357 1.00 0.00 H new ATOM 0 H61 DA A 10 -4.118 -0.380 5.121 1.00 0.00 H new ATOM 0 H62 DA A 10 -4.205 -0.135 3.373 1.00 0.00 H new ATOM 0 H2 DA A 10 -1.444 -3.911 5.800 1.00 0.00 H new ATOM 321 P DG A 11 1.280 -8.425 -0.779 1.00 0.00 P ATOM 322 OP1 DG A 11 0.207 -9.256 -1.370 1.00 0.00 O ATOM 323 OP2 DG A 11 2.463 -9.074 -0.170 1.00 0.00 O ATOM 324 O5' DG A 11 1.786 -7.386 -1.902 1.00 0.00 O ATOM 325 C5' DG A 11 1.838 -7.785 -3.273 1.00 0.00 C ATOM 326 C4' DG A 11 2.392 -6.689 -4.180 1.00 0.00 C ATOM 327 O4' DG A 11 1.419 -5.653 -4.440 1.00 0.00 O ATOM 328 C3' DG A 11 3.616 -6.013 -3.567 1.00 0.00 C ATOM 329 O3' DG A 11 4.815 -6.453 -4.215 1.00 0.00 O ATOM 330 C2' DG A 11 3.383 -4.529 -3.751 1.00 0.00 C ATOM 331 C1' DG A 11 2.121 -4.402 -4.571 1.00 0.00 C ATOM 332 N9 DG A 11 1.306 -3.263 -4.134 1.00 0.00 N ATOM 333 C8 DG A 11 0.511 -2.483 -4.884 1.00 0.00 C ATOM 334 N7 DG A 11 -0.128 -1.532 -4.297 1.00 0.00 N ATOM 335 C5 DG A 11 0.293 -1.683 -2.974 1.00 0.00 C ATOM 336 C6 DG A 11 -0.053 -0.931 -1.826 1.00 0.00 C ATOM 337 O6 DG A 11 -0.823 0.024 -1.751 1.00 0.00 O ATOM 338 N1 DG A 11 0.594 -1.404 -0.691 1.00 0.00 N ATOM 339 C2 DG A 11 1.471 -2.475 -0.661 1.00 0.00 C ATOM 340 N2 DG A 11 2.015 -2.774 0.523 1.00 0.00 N ATOM 341 N3 DG A 11 1.801 -3.189 -1.743 1.00 0.00 N ATOM 342 C4 DG A 11 1.179 -2.743 -2.861 1.00 0.00 C ATOM 0 H5' DG A 11 0.837 -8.057 -3.607 1.00 0.00 H new ATOM 0 H5'' DG A 11 2.458 -8.677 -3.365 1.00 0.00 H new ATOM 0 H4' DG A 11 2.659 -7.192 -5.109 1.00 0.00 H new ATOM 0 H3' DG A 11 3.744 -6.262 -2.514 1.00 0.00 H new ATOM 0 H2' DG A 11 3.274 -4.029 -2.788 1.00 0.00 H new ATOM 0 H2'' DG A 11 4.227 -4.062 -4.259 1.00 0.00 H new ATOM 0 H1' DG A 11 2.354 -4.204 -5.617 1.00 0.00 H new ATOM 0 H8 DG A 11 0.411 -2.648 -5.947 1.00 0.00 H new ATOM 0 H1 DG A 11 0.408 -0.924 0.190 1.00 0.00 H new ATOM 0 H21 DG A 11 2.668 -3.554 0.602 1.00 0.00 H new ATOM 0 H22 DG A 11 1.777 -2.222 1.347 1.00 0.00 H new ATOM 354 P DG A 12 6.113 -5.509 -4.310 1.00 0.00 P ATOM 355 OP1 DG A 12 7.216 -6.304 -4.888 1.00 0.00 O ATOM 356 OP2 DG A 12 6.299 -4.827 -3.006 1.00 0.00 O ATOM 357 O5' DG A 12 5.658 -4.413 -5.399 1.00 0.00 O ATOM 358 C5' DG A 12 5.084 -4.814 -6.650 1.00 0.00 C ATOM 359 C4' DG A 12 4.700 -3.602 -7.493 1.00 0.00 C ATOM 360 O4' DG A 12 3.669 -2.835 -6.848 1.00 0.00 O ATOM 361 C3' DG A 12 5.903 -2.705 -7.696 1.00 0.00 C ATOM 362 O3' DG A 12 6.250 -2.619 -9.081 1.00 0.00 O ATOM 363 C2' DG A 12 5.509 -1.364 -7.151 1.00 0.00 C ATOM 364 C1' DG A 12 4.022 -1.444 -6.867 1.00 0.00 C ATOM 365 N9 DG A 12 3.667 -0.803 -5.584 1.00 0.00 N ATOM 366 C8 DG A 12 4.212 -0.976 -4.351 1.00 0.00 C ATOM 367 N7 DG A 12 3.675 -0.344 -3.365 1.00 0.00 N ATOM 368 C5 DG A 12 2.640 0.345 -3.997 1.00 0.00 C ATOM 369 C6 DG A 12 1.674 1.223 -3.447 1.00 0.00 C ATOM 370 O6 DG A 12 1.539 1.564 -2.275 1.00 0.00 O ATOM 371 N1 DG A 12 0.809 1.705 -4.419 1.00 0.00 N ATOM 372 C2 DG A 12 0.864 1.380 -5.764 1.00 0.00 C ATOM 373 N2 DG A 12 -0.060 1.926 -6.551 1.00 0.00 N ATOM 374 N3 DG A 12 1.774 0.554 -6.291 1.00 0.00 N ATOM 375 C4 DG A 12 2.627 0.073 -5.358 1.00 0.00 C ATOM 0 H5' DG A 12 4.202 -5.428 -6.468 1.00 0.00 H new ATOM 0 H5'' DG A 12 5.795 -5.431 -7.198 1.00 0.00 H new ATOM 0 H4' DG A 12 4.336 -3.969 -8.453 1.00 0.00 H new ATOM 0 H3' DG A 12 6.784 -3.096 -7.187 1.00 0.00 H new ATOM 0 H2' DG A 12 6.067 -1.133 -6.243 1.00 0.00 H new ATOM 0 H2'' DG A 12 5.726 -0.573 -7.869 1.00 0.00 H new ATOM 0 HO3' DG A 12 7.028 -2.033 -9.187 1.00 0.00 H new ATOM 0 H1' DG A 12 3.472 -0.907 -7.640 1.00 0.00 H new ATOM 0 H8 DG A 12 5.066 -1.621 -4.203 1.00 0.00 H new ATOM 0 H1 DG A 12 0.076 2.348 -4.120 1.00 0.00 H new ATOM 0 H21 DG A 12 -0.065 1.720 -7.550 1.00 0.00 H new ATOM 0 H22 DG A 12 -0.763 2.550 -6.155 1.00 0.00 H new TER 388 DG A 12 ATOM 389 O5' DA B 1 -13.308 -1.739 7.264 1.00 0.00 O ATOM 390 C5' DA B 1 -12.667 -2.911 6.751 1.00 0.00 C ATOM 391 C4' DA B 1 -11.482 -3.337 7.636 1.00 0.00 C ATOM 392 O4' DA B 1 -10.839 -4.527 7.114 1.00 0.00 O ATOM 393 C3' DA B 1 -10.425 -2.236 7.729 1.00 0.00 C ATOM 394 O3' DA B 1 -10.147 -1.940 9.108 1.00 0.00 O ATOM 395 C2' DA B 1 -9.202 -2.786 7.031 1.00 0.00 C ATOM 396 C1' DA B 1 -9.437 -4.271 6.862 1.00 0.00 C ATOM 397 N9 DA B 1 -9.050 -4.711 5.513 1.00 0.00 N ATOM 398 C8 DA B 1 -7.911 -5.306 5.136 1.00 0.00 C ATOM 399 N7 DA B 1 -7.771 -5.613 3.888 1.00 0.00 N ATOM 400 C5 DA B 1 -8.983 -5.164 3.354 1.00 0.00 C ATOM 401 C6 DA B 1 -9.512 -5.176 2.056 1.00 0.00 C ATOM 402 N6 DA B 1 -8.852 -5.667 1.003 1.00 0.00 N ATOM 403 N1 DA B 1 -10.739 -4.653 1.886 1.00 0.00 N ATOM 404 C2 DA B 1 -11.406 -4.145 2.926 1.00 0.00 C ATOM 405 N3 DA B 1 -11.001 -4.080 4.192 1.00 0.00 N ATOM 406 C4 DA B 1 -9.772 -4.611 4.340 1.00 0.00 C ATOM 0 H5' DA B 1 -12.316 -2.721 5.737 1.00 0.00 H new ATOM 0 H5'' DA B 1 -13.389 -3.725 6.691 1.00 0.00 H new ATOM 0 H4' DA B 1 -11.895 -3.536 8.625 1.00 0.00 H new ATOM 0 H3' DA B 1 -10.755 -1.306 7.266 1.00 0.00 H new ATOM 0 H2' DA B 1 -9.057 -2.304 6.064 1.00 0.00 H new ATOM 0 H2'' DA B 1 -8.303 -2.600 7.619 1.00 0.00 H new ATOM 0 HO5' DA B 1 -14.055 -1.492 6.680 1.00 0.00 H new ATOM 0 H1' DA B 1 -8.824 -4.834 7.566 1.00 0.00 H new ATOM 0 H8 DA B 1 -7.133 -5.523 5.853 1.00 0.00 H new ATOM 0 H61 DA B 1 -9.283 -5.652 0.079 1.00 0.00 H new ATOM 0 H62 DA B 1 -7.917 -6.057 1.124 1.00 0.00 H new ATOM 0 H2 DA B 1 -12.385 -3.741 2.715 1.00 0.00 H new ATOM 419 P DA B 2 -9.117 -0.772 9.534 1.00 0.00 P ATOM 420 OP1 DA B 2 -9.109 -0.681 11.012 1.00 0.00 O ATOM 421 OP2 DA B 2 -9.417 0.430 8.722 1.00 0.00 O ATOM 422 O5' DA B 2 -7.698 -1.363 9.054 1.00 0.00 O ATOM 423 C5' DA B 2 -7.009 -2.343 9.838 1.00 0.00 C ATOM 424 C4' DA B 2 -5.724 -2.800 9.154 1.00 0.00 C ATOM 425 O4' DA B 2 -6.004 -3.491 7.923 1.00 0.00 O ATOM 426 C3' DA B 2 -4.806 -1.622 8.808 1.00 0.00 C ATOM 427 O3' DA B 2 -3.724 -1.506 9.737 1.00 0.00 O ATOM 428 C2' DA B 2 -4.300 -1.910 7.418 1.00 0.00 C ATOM 429 C1' DA B 2 -4.946 -3.216 6.989 1.00 0.00 C ATOM 430 N9 DA B 2 -5.449 -3.130 5.609 1.00 0.00 N ATOM 431 C8 DA B 2 -6.225 -2.189 5.017 1.00 0.00 C ATOM 432 N7 DA B 2 -6.494 -2.345 3.768 1.00 0.00 N ATOM 433 C5 DA B 2 -5.824 -3.533 3.481 1.00 0.00 C ATOM 434 C6 DA B 2 -5.696 -4.282 2.314 1.00 0.00 C ATOM 435 N6 DA B 2 -6.294 -3.944 1.176 1.00 0.00 N ATOM 436 N1 DA B 2 -4.960 -5.409 2.375 1.00 0.00 N ATOM 437 C2 DA B 2 -4.388 -5.776 3.525 1.00 0.00 C ATOM 438 N3 DA B 2 -4.447 -5.139 4.689 1.00 0.00 N ATOM 439 C4 DA B 2 -5.186 -4.017 4.596 1.00 0.00 C ATOM 0 H5' DA B 2 -7.660 -3.202 10.004 1.00 0.00 H new ATOM 0 H5'' DA B 2 -6.774 -1.927 10.818 1.00 0.00 H new ATOM 0 H4' DA B 2 -5.231 -3.462 9.866 1.00 0.00 H new ATOM 0 H3' DA B 2 -5.339 -0.673 8.859 1.00 0.00 H new ATOM 0 H2' DA B 2 -4.563 -1.103 6.734 1.00 0.00 H new ATOM 0 H2'' DA B 2 -3.213 -1.993 7.410 1.00 0.00 H new ATOM 0 H1' DA B 2 -4.218 -4.027 6.996 1.00 0.00 H new ATOM 0 H8 DA B 2 -6.602 -1.342 5.571 1.00 0.00 H new ATOM 0 H61 DA B 2 -6.172 -4.522 0.345 1.00 0.00 H new ATOM 0 H62 DA B 2 -6.874 -3.106 1.134 1.00 0.00 H new ATOM 0 H2 DA B 2 -3.815 -6.691 3.506 1.00 0.00 H new ATOM 451 P DG B 3 -3.139 -0.055 10.141 1.00 0.00 P ATOM 452 OP1 DG B 3 -3.280 0.098 11.605 1.00 0.00 O ATOM 453 OP2 DG B 3 -3.717 0.967 9.231 1.00 0.00 O ATOM 454 O5' DG B 3 -1.571 -0.208 9.801 1.00 0.00 O ATOM 455 C5' DG B 3 -1.170 -0.948 8.649 1.00 0.00 C ATOM 456 C4' DG B 3 0.327 -1.201 8.604 1.00 0.00 C ATOM 457 O4' DG B 3 0.680 -1.896 7.382 1.00 0.00 O ATOM 458 C3' DG B 3 1.086 0.111 8.640 1.00 0.00 C ATOM 459 O3' DG B 3 2.177 0.036 9.570 1.00 0.00 O ATOM 460 C2' DG B 3 1.573 0.303 7.226 1.00 0.00 C ATOM 461 C1' DG B 3 1.572 -1.082 6.599 1.00 0.00 C ATOM 462 N9 DG B 3 1.155 -1.022 5.190 1.00 0.00 N ATOM 463 C8 DG B 3 1.709 -1.625 4.116 1.00 0.00 C ATOM 464 N7 DG B 3 1.226 -1.340 2.954 1.00 0.00 N ATOM 465 C5 DG B 3 0.218 -0.430 3.284 1.00 0.00 C ATOM 466 C6 DG B 3 -0.685 0.264 2.443 1.00 0.00 C ATOM 467 O6 DG B 3 -0.767 0.218 1.220 1.00 0.00 O ATOM 468 N1 DG B 3 -1.538 1.082 3.170 1.00 0.00 N ATOM 469 C2 DG B 3 -1.528 1.216 4.549 1.00 0.00 C ATOM 470 N2 DG B 3 -2.440 2.031 5.083 1.00 0.00 N ATOM 471 N3 DG B 3 -0.678 0.566 5.347 1.00 0.00 N ATOM 472 C4 DG B 3 0.163 -0.235 4.653 1.00 0.00 C ATOM 0 H5' DG B 3 -1.469 -0.406 7.752 1.00 0.00 H new ATOM 0 H5'' DG B 3 -1.696 -1.903 8.635 1.00 0.00 H new ATOM 0 H4' DG B 3 0.592 -1.807 9.470 1.00 0.00 H new ATOM 0 H3' DG B 3 0.470 0.947 8.972 1.00 0.00 H new ATOM 0 H2' DG B 3 0.921 0.982 6.676 1.00 0.00 H new ATOM 0 H2'' DG B 3 2.572 0.739 7.212 1.00 0.00 H new ATOM 0 H1' DG B 3 2.574 -1.511 6.601 1.00 0.00 H new ATOM 0 H8 DG B 3 2.527 -2.321 4.226 1.00 0.00 H new ATOM 0 H1 DG B 3 -2.225 1.627 2.649 1.00 0.00 H new ATOM 0 H21 DG B 3 -2.475 2.165 6.094 1.00 0.00 H new ATOM 0 H22 DG B 3 -3.102 2.520 4.480 1.00 0.00 H new ATOM 484 P DG B 4 3.380 1.109 9.532 1.00 0.00 P ATOM 485 OP1 DG B 4 4.267 0.854 10.691 1.00 0.00 O ATOM 486 OP2 DG B 4 2.799 2.454 9.331 1.00 0.00 O ATOM 487 O5' DG B 4 4.163 0.687 8.189 1.00 0.00 O ATOM 488 C5' DG B 4 4.951 -0.509 8.149 1.00 0.00 C ATOM 489 C4' DG B 4 5.569 -0.731 6.775 1.00 0.00 C ATOM 490 O4' DG B 4 4.573 -0.819 5.737 1.00 0.00 O ATOM 491 C3' DG B 4 6.477 0.419 6.407 1.00 0.00 C ATOM 492 O3' DG B 4 7.837 0.177 6.764 1.00 0.00 O ATOM 493 C2' DG B 4 6.326 0.560 4.914 1.00 0.00 C ATOM 494 C1' DG B 4 5.155 -0.318 4.515 1.00 0.00 C ATOM 495 N9 DG B 4 4.201 0.481 3.733 1.00 0.00 N ATOM 496 C8 DG B 4 3.523 1.586 4.113 1.00 0.00 C ATOM 497 N7 DG B 4 2.819 2.195 3.227 1.00 0.00 N ATOM 498 C5 DG B 4 3.044 1.409 2.098 1.00 0.00 C ATOM 499 C6 DG B 4 2.545 1.564 0.786 1.00 0.00 C ATOM 500 O6 DG B 4 1.813 2.449 0.355 1.00 0.00 O ATOM 501 N1 DG B 4 3.007 0.567 -0.057 1.00 0.00 N ATOM 502 C2 DG B 4 3.855 -0.463 0.314 1.00 0.00 C ATOM 503 N2 DG B 4 4.196 -1.323 -0.646 1.00 0.00 N ATOM 504 N3 DG B 4 4.332 -0.619 1.553 1.00 0.00 N ATOM 505 C4 DG B 4 3.889 0.349 2.394 1.00 0.00 C ATOM 0 H5' DG B 4 4.328 -1.364 8.410 1.00 0.00 H new ATOM 0 H5'' DG B 4 5.741 -0.450 8.898 1.00 0.00 H new ATOM 0 H4' DG B 4 6.119 -1.670 6.843 1.00 0.00 H new ATOM 0 H3' DG B 4 6.204 1.327 6.945 1.00 0.00 H new ATOM 0 H2' DG B 4 6.143 1.599 4.639 1.00 0.00 H new ATOM 0 H2'' DG B 4 7.236 0.250 4.401 1.00 0.00 H new ATOM 0 H1' DG B 4 5.459 -1.157 3.890 1.00 0.00 H new ATOM 0 H8 DG B 4 3.571 1.946 5.130 1.00 0.00 H new ATOM 0 H1 DG B 4 2.698 0.594 -1.029 1.00 0.00 H new ATOM 0 H21 DG B 4 4.818 -2.103 -0.434 1.00 0.00 H new ATOM 0 H22 DG B 4 3.835 -1.201 -1.592 1.00 0.00 H new ATOM 517 P DT B 5 8.926 1.345 6.554 1.00 0.00 P ATOM 518 OP1 DT B 5 10.001 1.163 7.556 1.00 0.00 O ATOM 519 OP2 DT B 5 8.214 2.638 6.457 1.00 0.00 O ATOM 520 O5' DT B 5 9.517 0.995 5.103 1.00 0.00 O ATOM 521 C5' DT B 5 9.839 -0.355 4.762 1.00 0.00 C ATOM 522 C4' DT B 5 9.857 -0.563 3.258 1.00 0.00 C ATOM 523 O4' DT B 5 8.615 -0.140 2.648 1.00 0.00 O ATOM 524 C3' DT B 5 10.986 0.230 2.619 1.00 0.00 C ATOM 525 O3' DT B 5 11.887 -0.659 1.958 1.00 0.00 O ATOM 526 C2' DT B 5 10.310 1.159 1.631 1.00 0.00 C ATOM 527 C1' DT B 5 8.903 0.611 1.454 1.00 0.00 C ATOM 528 N1 DT B 5 7.929 1.703 1.257 1.00 0.00 N ATOM 529 C2 DT B 5 7.272 1.779 0.037 1.00 0.00 C ATOM 530 O2 DT B 5 7.506 1.001 -0.900 1.00 0.00 O ATOM 531 N3 DT B 5 6.348 2.799 -0.079 1.00 0.00 N ATOM 532 C4 DT B 5 6.028 3.731 0.893 1.00 0.00 C ATOM 533 O4 DT B 5 5.180 4.594 0.682 1.00 0.00 O ATOM 534 C5 DT B 5 6.765 3.574 2.122 1.00 0.00 C ATOM 535 C7 DT B 5 6.509 4.532 3.284 1.00 0.00 C ATOM 536 C6 DT B 5 7.673 2.592 2.264 1.00 0.00 C ATOM 0 H5' DT B 5 9.111 -1.029 5.214 1.00 0.00 H new ATOM 0 H5'' DT B 5 10.813 -0.613 5.177 1.00 0.00 H new ATOM 0 H4' DT B 5 10.000 -1.631 3.091 1.00 0.00 H new ATOM 0 H3' DT B 5 11.572 0.788 3.349 1.00 0.00 H new ATOM 0 H2' DT B 5 10.288 2.182 2.006 1.00 0.00 H new ATOM 0 H2'' DT B 5 10.845 1.179 0.682 1.00 0.00 H new ATOM 0 H1' DT B 5 8.831 -0.020 0.568 1.00 0.00 H new ATOM 0 H3 DT B 5 5.853 2.873 -0.968 1.00 0.00 H new ATOM 0 H71 DT B 5 6.691 4.017 4.227 1.00 0.00 H new ATOM 0 H72 DT B 5 7.178 5.389 3.203 1.00 0.00 H new ATOM 0 H73 DT B 5 5.475 4.875 3.252 1.00 0.00 H new ATOM 0 H6 DT B 5 8.213 2.504 3.195 1.00 0.00 H new ATOM 549 P DT B 6 13.160 -0.108 1.149 1.00 0.00 P ATOM 550 OP1 DT B 6 14.272 0.086 2.105 1.00 0.00 O ATOM 551 OP2 DT B 6 12.725 1.009 0.280 1.00 0.00 O ATOM 552 O5' DT B 6 13.517 -1.368 0.212 1.00 0.00 O ATOM 553 C5' DT B 6 14.289 -1.208 -0.982 1.00 0.00 C ATOM 554 C4' DT B 6 13.400 -1.193 -2.239 1.00 0.00 C ATOM 555 O4' DT B 6 12.567 -2.383 -2.303 1.00 0.00 O ATOM 556 C3' DT B 6 12.476 0.026 -2.261 1.00 0.00 C ATOM 557 O3' DT B 6 12.685 0.780 -3.461 1.00 0.00 O ATOM 558 C2' DT B 6 11.066 -0.525 -2.213 1.00 0.00 C ATOM 559 C1' DT B 6 11.182 -2.015 -2.525 1.00 0.00 C ATOM 560 N1 DT B 6 10.272 -2.808 -1.669 1.00 0.00 N ATOM 561 C2 DT B 6 9.134 -3.328 -2.262 1.00 0.00 C ATOM 562 O2 DT B 6 8.865 -3.136 -3.447 1.00 0.00 O ATOM 563 N3 DT B 6 8.307 -4.074 -1.447 1.00 0.00 N ATOM 564 C4 DT B 6 8.514 -4.347 -0.108 1.00 0.00 C ATOM 565 O4 DT B 6 7.705 -5.026 0.523 1.00 0.00 O ATOM 566 C5 DT B 6 9.727 -3.766 0.430 1.00 0.00 C ATOM 567 C7 DT B 6 10.100 -4.020 1.887 1.00 0.00 C ATOM 568 C6 DT B 6 10.550 -3.026 -0.347 1.00 0.00 C ATOM 0 H5' DT B 6 15.013 -2.019 -1.058 1.00 0.00 H new ATOM 0 H5'' DT B 6 14.856 -0.279 -0.927 1.00 0.00 H new ATOM 0 H4' DT B 6 14.076 -1.158 -3.093 1.00 0.00 H new ATOM 0 H3' DT B 6 12.668 0.697 -1.424 1.00 0.00 H new ATOM 0 H2' DT B 6 10.619 -0.366 -1.232 1.00 0.00 H new ATOM 0 H2'' DT B 6 10.427 -0.023 -2.940 1.00 0.00 H new ATOM 0 H1' DT B 6 10.891 -2.220 -3.555 1.00 0.00 H new ATOM 0 H3 DT B 6 7.464 -4.460 -1.873 1.00 0.00 H new ATOM 0 H71 DT B 6 9.193 -4.156 2.476 1.00 0.00 H new ATOM 0 H72 DT B 6 10.715 -4.918 1.954 1.00 0.00 H new ATOM 0 H73 DT B 6 10.659 -3.168 2.273 1.00 0.00 H new ATOM 0 H6 DT B 6 11.444 -2.599 0.084 1.00 0.00 H new ATOM 581 P DT B 7 13.050 2.349 -3.414 1.00 0.00 P ATOM 582 OP1 DT B 7 14.240 2.576 -4.266 1.00 0.00 O ATOM 583 OP2 DT B 7 13.055 2.794 -2.004 1.00 0.00 O ATOM 584 O5' DT B 7 11.776 3.013 -4.133 1.00 0.00 O ATOM 585 C5' DT B 7 11.151 2.383 -5.256 1.00 0.00 C ATOM 586 C4' DT B 7 9.763 2.975 -5.510 1.00 0.00 C ATOM 587 O4' DT B 7 8.968 3.004 -4.292 1.00 0.00 O ATOM 588 C3' DT B 7 9.899 4.405 -6.000 1.00 0.00 C ATOM 589 O3' DT B 7 9.117 4.599 -7.175 1.00 0.00 O ATOM 590 C2' DT B 7 9.385 5.261 -4.866 1.00 0.00 C ATOM 591 C1' DT B 7 8.512 4.352 -4.036 1.00 0.00 C ATOM 592 N1 DT B 7 8.628 4.704 -2.613 1.00 0.00 N ATOM 593 C2 DT B 7 7.601 5.440 -2.059 1.00 0.00 C ATOM 594 O2 DT B 7 6.612 5.785 -2.706 1.00 0.00 O ATOM 595 N3 DT B 7 7.756 5.794 -0.738 1.00 0.00 N ATOM 596 C4 DT B 7 8.830 5.485 0.071 1.00 0.00 C ATOM 597 O4 DT B 7 8.855 5.863 1.241 1.00 0.00 O ATOM 598 C5 DT B 7 9.860 4.712 -0.588 1.00 0.00 C ATOM 599 C7 DT B 7 11.115 4.317 0.190 1.00 0.00 C ATOM 600 C6 DT B 7 9.731 4.350 -1.885 1.00 0.00 C ATOM 0 H5' DT B 7 11.067 1.311 -5.077 1.00 0.00 H new ATOM 0 H5'' DT B 7 11.773 2.510 -6.142 1.00 0.00 H new ATOM 0 H4' DT B 7 9.271 2.347 -6.253 1.00 0.00 H new ATOM 0 H3' DT B 7 10.927 4.657 -6.261 1.00 0.00 H new ATOM 0 H2' DT B 7 10.207 5.663 -4.274 1.00 0.00 H new ATOM 0 H2'' DT B 7 8.818 6.112 -5.243 1.00 0.00 H new ATOM 0 H1' DT B 7 7.458 4.450 -4.297 1.00 0.00 H new ATOM 0 H3 DT B 7 7.003 6.338 -0.316 1.00 0.00 H new ATOM 0 H71 DT B 7 11.500 3.373 -0.195 1.00 0.00 H new ATOM 0 H72 DT B 7 11.873 5.091 0.075 1.00 0.00 H new ATOM 0 H73 DT B 7 10.868 4.205 1.246 1.00 0.00 H new ATOM 0 H6 DT B 7 10.513 3.771 -2.354 1.00 0.00 H new ATOM 613 P DT B 8 9.351 5.877 -8.117 1.00 0.00 P ATOM 614 OP1 DT B 8 10.188 5.465 -9.261 1.00 0.00 O ATOM 615 OP2 DT B 8 9.760 7.025 -7.276 1.00 0.00 O ATOM 616 O5' DT B 8 7.877 6.162 -8.670 1.00 0.00 O ATOM 617 C5' DT B 8 6.872 6.702 -7.815 1.00 0.00 C ATOM 618 C4' DT B 8 5.759 7.330 -8.637 1.00 0.00 C ATOM 619 O4' DT B 8 6.317 8.275 -9.581 1.00 0.00 O ATOM 620 C3' DT B 8 5.008 6.265 -9.422 1.00 0.00 C ATOM 621 O3' DT B 8 3.597 6.441 -9.279 1.00 0.00 O ATOM 622 C2' DT B 8 5.423 6.464 -10.862 1.00 0.00 C ATOM 623 C1' DT B 8 6.005 7.871 -10.930 1.00 0.00 C ATOM 624 N1 DT B 8 7.201 7.926 -11.806 1.00 0.00 N ATOM 625 C2 DT B 8 7.147 8.794 -12.882 1.00 0.00 C ATOM 626 O2 DT B 8 6.168 9.504 -13.105 1.00 0.00 O ATOM 627 N3 DT B 8 8.261 8.823 -13.697 1.00 0.00 N ATOM 628 C4 DT B 8 9.410 8.073 -13.536 1.00 0.00 C ATOM 629 O4 DT B 8 10.342 8.181 -14.330 1.00 0.00 O ATOM 630 C5 DT B 8 9.384 7.196 -12.388 1.00 0.00 C ATOM 631 C7 DT B 8 10.589 6.308 -12.092 1.00 0.00 C ATOM 632 C6 DT B 8 8.311 7.146 -11.574 1.00 0.00 C ATOM 0 H5' DT B 8 7.311 7.450 -7.154 1.00 0.00 H new ATOM 0 H5'' DT B 8 6.464 5.915 -7.180 1.00 0.00 H new ATOM 0 H4' DT B 8 5.077 7.833 -7.952 1.00 0.00 H new ATOM 0 H3' DT B 8 5.239 5.260 -9.068 1.00 0.00 H new ATOM 0 H2' DT B 8 6.160 5.720 -11.164 1.00 0.00 H new ATOM 0 H2'' DT B 8 4.571 6.359 -11.534 1.00 0.00 H new ATOM 0 H1' DT B 8 5.281 8.556 -11.370 1.00 0.00 H new ATOM 0 H3 DT B 8 8.233 9.459 -14.494 1.00 0.00 H new ATOM 0 H71 DT B 8 11.090 6.051 -13.025 1.00 0.00 H new ATOM 0 H72 DT B 8 11.283 6.841 -11.443 1.00 0.00 H new ATOM 0 H73 DT B 8 10.256 5.396 -11.596 1.00 0.00 H new ATOM 0 H6 DT B 8 8.322 6.481 -10.723 1.00 0.00 H new ATOM 645 P DA B 9 2.572 5.505 -10.091 1.00 0.00 P ATOM 646 OP1 DA B 9 3.326 4.364 -10.656 1.00 0.00 O ATOM 647 OP2 DA B 9 1.763 6.366 -10.982 1.00 0.00 O ATOM 648 O5' DA B 9 1.617 4.946 -8.925 1.00 0.00 O ATOM 649 C5' DA B 9 2.144 4.145 -7.863 1.00 0.00 C ATOM 650 C4' DA B 9 1.983 4.832 -6.503 1.00 0.00 C ATOM 651 O4' DA B 9 2.270 3.912 -5.424 1.00 0.00 O ATOM 652 C3' DA B 9 2.930 6.026 -6.362 1.00 0.00 C ATOM 653 O3' DA B 9 2.204 7.220 -6.052 1.00 0.00 O ATOM 654 C2' DA B 9 3.852 5.679 -5.225 1.00 0.00 C ATOM 655 C1' DA B 9 3.207 4.511 -4.508 1.00 0.00 C ATOM 656 N9 DA B 9 4.220 3.550 -4.081 1.00 0.00 N ATOM 657 C8 DA B 9 4.527 3.157 -2.834 1.00 0.00 C ATOM 658 N7 DA B 9 5.474 2.298 -2.693 1.00 0.00 N ATOM 659 C5 DA B 9 5.857 2.090 -4.021 1.00 0.00 C ATOM 660 C6 DA B 9 6.831 1.283 -4.601 1.00 0.00 C ATOM 661 N6 DA B 9 7.644 0.506 -3.876 1.00 0.00 N ATOM 662 N1 DA B 9 6.945 1.318 -5.949 1.00 0.00 N ATOM 663 C2 DA B 9 6.139 2.109 -6.677 1.00 0.00 C ATOM 664 N3 DA B 9 5.182 2.909 -6.219 1.00 0.00 N ATOM 665 C4 DA B 9 5.095 2.851 -4.875 1.00 0.00 C ATOM 0 H5' DA B 9 3.200 3.945 -8.047 1.00 0.00 H new ATOM 0 H5'' DA B 9 1.635 3.181 -7.847 1.00 0.00 H new ATOM 0 H4' DA B 9 0.949 5.173 -6.447 1.00 0.00 H new ATOM 0 H3' DA B 9 3.471 6.212 -7.290 1.00 0.00 H new ATOM 0 H2' DA B 9 4.843 5.412 -5.593 1.00 0.00 H new ATOM 0 H2'' DA B 9 3.980 6.528 -4.553 1.00 0.00 H new ATOM 0 H1' DA B 9 2.690 4.845 -3.608 1.00 0.00 H new ATOM 0 H8 DA B 9 3.997 3.549 -1.979 1.00 0.00 H new ATOM 0 H61 DA B 9 8.345 -0.071 -4.340 1.00 0.00 H new ATOM 0 H62 DA B 9 7.562 0.491 -2.859 1.00 0.00 H new ATOM 0 H2 DA B 9 6.284 2.093 -7.747 1.00 0.00 H new ATOM 677 P DA B 10 1.631 8.181 -7.206 1.00 0.00 P ATOM 678 OP1 DA B 10 0.916 7.346 -8.193 1.00 0.00 O ATOM 679 OP2 DA B 10 2.722 9.079 -7.649 1.00 0.00 O ATOM 680 O5' DA B 10 0.544 9.060 -6.404 1.00 0.00 O ATOM 681 C5' DA B 10 -0.799 8.586 -6.242 1.00 0.00 C ATOM 682 C4' DA B 10 -1.374 8.938 -4.838 1.00 0.00 C ATOM 683 O4' DA B 10 -0.948 7.991 -3.825 1.00 0.00 O ATOM 684 C3' DA B 10 -0.943 10.334 -4.355 1.00 0.00 C ATOM 685 O3' DA B 10 -2.087 11.178 -4.159 1.00 0.00 O ATOM 686 C2' DA B 10 -0.227 10.099 -3.038 1.00 0.00 C ATOM 687 C1' DA B 10 -0.602 8.706 -2.613 1.00 0.00 C ATOM 688 N9 DA B 10 0.495 8.041 -1.902 1.00 0.00 N ATOM 689 C8 DA B 10 1.070 6.863 -2.172 1.00 0.00 C ATOM 690 N7 DA B 10 1.969 6.426 -1.352 1.00 0.00 N ATOM 691 C5 DA B 10 2.001 7.457 -0.405 1.00 0.00 C ATOM 692 C6 DA B 10 2.742 7.652 0.765 1.00 0.00 C ATOM 693 N6 DA B 10 3.639 6.778 1.216 1.00 0.00 N ATOM 694 N1 DA B 10 2.524 8.783 1.456 1.00 0.00 N ATOM 695 C2 DA B 10 1.630 9.673 1.026 1.00 0.00 C ATOM 696 N3 DA B 10 0.870 9.589 -0.060 1.00 0.00 N ATOM 697 C4 DA B 10 1.108 8.447 -0.737 1.00 0.00 C ATOM 0 H5' DA B 10 -0.822 7.505 -6.383 1.00 0.00 H new ATOM 0 H5'' DA B 10 -1.433 9.022 -7.014 1.00 0.00 H new ATOM 0 H4' DA B 10 -2.456 8.905 -4.965 1.00 0.00 H new ATOM 0 H3' DA B 10 -0.305 10.834 -5.083 1.00 0.00 H new ATOM 0 H2' DA B 10 0.852 10.195 -3.157 1.00 0.00 H new ATOM 0 H2'' DA B 10 -0.532 10.832 -2.291 1.00 0.00 H new ATOM 0 H1' DA B 10 -1.438 8.729 -1.914 1.00 0.00 H new ATOM 0 H8 DA B 10 0.792 6.295 -3.048 1.00 0.00 H new ATOM 0 H61 DA B 10 4.152 6.971 2.076 1.00 0.00 H new ATOM 0 H62 DA B 10 3.814 5.915 0.701 1.00 0.00 H new ATOM 0 H2 DA B 10 1.510 10.562 1.628 1.00 0.00 H new ATOM 709 P DG B 11 -3.067 11.542 -5.384 1.00 0.00 P ATOM 710 OP1 DG B 11 -2.234 11.917 -6.548 1.00 0.00 O ATOM 711 OP2 DG B 11 -4.099 12.479 -4.886 1.00 0.00 O ATOM 712 O5' DG B 11 -3.770 10.129 -5.705 1.00 0.00 O ATOM 713 C5' DG B 11 -4.190 9.824 -7.036 1.00 0.00 C ATOM 714 C4' DG B 11 -4.882 8.467 -7.135 1.00 0.00 C ATOM 715 O4' DG B 11 -3.940 7.372 -7.103 1.00 0.00 O ATOM 716 C3' DG B 11 -5.866 8.249 -5.989 1.00 0.00 C ATOM 717 O3' DG B 11 -7.215 8.402 -6.444 1.00 0.00 O ATOM 718 C2' DG B 11 -5.590 6.846 -5.491 1.00 0.00 C ATOM 719 C1' DG B 11 -4.569 6.260 -6.438 1.00 0.00 C ATOM 720 N9 DG B 11 -3.598 5.419 -5.729 1.00 0.00 N ATOM 721 C8 DG B 11 -2.968 4.325 -6.186 1.00 0.00 C ATOM 722 N7 DG B 11 -2.141 3.731 -5.397 1.00 0.00 N ATOM 723 C5 DG B 11 -2.225 4.524 -4.251 1.00 0.00 C ATOM 724 C6 DG B 11 -1.554 4.394 -3.012 1.00 0.00 C ATOM 725 O6 DG B 11 -0.729 3.543 -2.685 1.00 0.00 O ATOM 726 N1 DG B 11 -1.924 5.393 -2.121 1.00 0.00 N ATOM 727 C2 DG B 11 -2.834 6.402 -2.389 1.00 0.00 C ATOM 728 N2 DG B 11 -3.081 7.266 -1.399 1.00 0.00 N ATOM 729 N3 DG B 11 -3.471 6.531 -3.557 1.00 0.00 N ATOM 730 C4 DG B 11 -3.122 5.564 -4.441 1.00 0.00 C ATOM 0 H5' DG B 11 -3.324 9.836 -7.698 1.00 0.00 H new ATOM 0 H5'' DG B 11 -4.870 10.601 -7.386 1.00 0.00 H new ATOM 0 H4' DG B 11 -5.407 8.480 -8.090 1.00 0.00 H new ATOM 0 H3' DG B 11 -5.742 8.980 -5.190 1.00 0.00 H new ATOM 0 H2' DG B 11 -5.210 6.862 -4.469 1.00 0.00 H new ATOM 0 H2'' DG B 11 -6.502 6.249 -5.482 1.00 0.00 H new ATOM 0 H1' DG B 11 -5.043 5.601 -7.166 1.00 0.00 H new ATOM 0 H8 DG B 11 -3.149 3.954 -7.184 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.492 5.383 -1.197 1.00 0.00 H new ATOM 0 H21 DG B 11 -3.743 8.029 -1.541 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.608 7.162 -0.501 1.00 0.00 H new ATOM 742 P DG B 12 -8.431 7.614 -5.745 1.00 0.00 P ATOM 743 OP1 DG B 12 -9.693 8.106 -6.335 1.00 0.00 O ATOM 744 OP2 DG B 12 -8.239 7.654 -4.275 1.00 0.00 O ATOM 745 O5' DG B 12 -8.194 6.104 -6.251 1.00 0.00 O ATOM 746 C5' DG B 12 -7.979 5.820 -7.639 1.00 0.00 C ATOM 747 C4' DG B 12 -7.742 4.330 -7.866 1.00 0.00 C ATOM 748 O4' DG B 12 -6.533 3.898 -7.216 1.00 0.00 O ATOM 749 C3' DG B 12 -8.895 3.524 -7.305 1.00 0.00 C ATOM 750 O3' DG B 12 -9.570 2.808 -8.342 1.00 0.00 O ATOM 751 C2' DG B 12 -8.291 2.586 -6.303 1.00 0.00 C ATOM 752 C1' DG B 12 -6.788 2.694 -6.476 1.00 0.00 C ATOM 753 N9 DG B 12 -6.082 2.725 -5.178 1.00 0.00 N ATOM 754 C8 DG B 12 -6.309 3.502 -4.087 1.00 0.00 C ATOM 755 N7 DG B 12 -5.502 3.386 -3.089 1.00 0.00 N ATOM 756 C5 DG B 12 -4.617 2.412 -3.551 1.00 0.00 C ATOM 757 C6 DG B 12 -3.488 1.844 -2.911 1.00 0.00 C ATOM 758 O6 DG B 12 -3.041 2.097 -1.795 1.00 0.00 O ATOM 759 N1 DG B 12 -2.865 0.900 -3.715 1.00 0.00 N ATOM 760 C2 DG B 12 -3.277 0.544 -4.988 1.00 0.00 C ATOM 761 N2 DG B 12 -2.547 -0.371 -5.621 1.00 0.00 N ATOM 762 N3 DG B 12 -4.343 1.075 -5.599 1.00 0.00 N ATOM 763 C4 DG B 12 -4.964 1.998 -4.829 1.00 0.00 C ATOM 0 H5' DG B 12 -7.121 6.387 -8.000 1.00 0.00 H new ATOM 0 H5'' DG B 12 -8.843 6.146 -8.218 1.00 0.00 H new ATOM 0 H4' DG B 12 -7.657 4.170 -8.941 1.00 0.00 H new ATOM 0 H3' DG B 12 -9.644 4.167 -6.842 1.00 0.00 H new ATOM 0 H2' DG B 12 -8.587 2.856 -5.289 1.00 0.00 H new ATOM 0 H2'' DG B 12 -8.630 1.564 -6.472 1.00 0.00 H new ATOM 0 HO3' DG B 12 -10.310 2.293 -7.956 1.00 0.00 H new ATOM 0 H1' DG B 12 -6.415 1.818 -7.006 1.00 0.00 H new ATOM 0 H8 DG B 12 -7.138 4.194 -4.057 1.00 0.00 H new ATOM 0 H1 DG B 12 -2.040 0.432 -3.339 1.00 0.00 H new ATOM 0 H21 DG B 12 -2.807 -0.669 -6.561 1.00 0.00 H new ATOM 0 H22 DG B 12 -1.728 -0.774 -5.166 1.00 0.00 H new TER 776 DG B 12