USER MOD reduce.3.24.130724 H: found=0, std=0, add=281, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 286 hydrogens (14 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 12 DC H42 : A 12 DC N4 : B 13 DG O6 :(H bumps) USER MOD Single : A 1 DC O5' : rot 25:sc= 0.231 USER MOD Single : A 3 DT C7 :methyl 150:sc= -1.55 (180deg=-1.55) USER MOD Single : A 5 DT C7 :methyl 150:sc= -0.0308 (180deg=-0.0308) USER MOD Single : A 8 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= -0.0434 (180deg=-0.0434) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= 0 USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -12.282 -14.425 2.966 1.00 0.00 O ATOM 2 C5' DC A 1 -11.952 -14.124 4.325 1.00 0.00 C ATOM 3 C4' DC A 1 -10.457 -14.169 4.541 1.00 0.00 C ATOM 4 O4' DC A 1 -9.902 -15.245 3.762 1.00 0.00 O ATOM 5 C3' DC A 1 -9.701 -12.918 4.092 1.00 0.00 C ATOM 6 O3' DC A 1 -9.450 -12.066 5.213 1.00 0.00 O ATOM 7 C2' DC A 1 -8.389 -13.456 3.531 1.00 0.00 C ATOM 8 C1' DC A 1 -8.534 -14.974 3.540 1.00 0.00 C ATOM 9 N1 DC A 1 -8.139 -15.641 2.287 1.00 0.00 N ATOM 10 C2 DC A 1 -7.293 -16.751 2.353 1.00 0.00 C ATOM 11 O2 DC A 1 -6.893 -17.136 3.461 1.00 0.00 O ATOM 12 N3 DC A 1 -6.931 -17.376 1.210 1.00 0.00 N ATOM 13 C4 DC A 1 -7.378 -16.928 0.035 1.00 0.00 C ATOM 14 N4 DC A 1 -6.991 -17.572 -1.068 1.00 0.00 N ATOM 15 C5 DC A 1 -8.241 -15.798 -0.062 1.00 0.00 C ATOM 16 C6 DC A 1 -8.594 -15.191 1.079 1.00 0.00 C ATOM 0 H5' DC A 1 -12.441 -14.838 4.988 1.00 0.00 H new ATOM 0 H5'' DC A 1 -12.331 -13.136 4.585 1.00 0.00 H new ATOM 0 H4' DC A 1 -10.336 -14.280 5.619 1.00 0.00 H new ATOM 0 H3' DC A 1 -10.257 -12.328 3.364 1.00 0.00 H new ATOM 0 H2' DC A 1 -8.212 -13.085 2.522 1.00 0.00 H new ATOM 0 H2'' DC A 1 -7.542 -13.139 4.140 1.00 0.00 H new ATOM 0 HO5' DC A 1 -11.571 -14.971 2.570 1.00 0.00 H new ATOM 0 H1' DC A 1 -7.867 -15.361 4.310 1.00 0.00 H new ATOM 0 H41 DC A 1 -7.314 -17.256 -1.983 1.00 0.00 H new ATOM 0 H42 DC A 1 -6.372 -18.380 -0.996 1.00 0.00 H new ATOM 0 H5 DC A 1 -8.597 -15.445 -1.019 1.00 0.00 H new ATOM 0 H6 DC A 1 -9.248 -14.333 1.044 1.00 0.00 H new ATOM 29 P DC A 2 -8.967 -10.549 4.975 1.00 0.00 P ATOM 30 OP1 DC A 2 -9.736 -9.667 5.888 1.00 0.00 O ATOM 31 OP2 DC A 2 -8.991 -10.289 3.513 1.00 0.00 O ATOM 32 O5' DC A 2 -7.445 -10.554 5.445 1.00 0.00 O ATOM 33 C5' DC A 2 -7.074 -11.051 6.731 1.00 0.00 C ATOM 34 C4' DC A 2 -5.673 -11.616 6.690 1.00 0.00 C ATOM 35 O4' DC A 2 -5.657 -12.800 5.861 1.00 0.00 O ATOM 36 C3' DC A 2 -4.620 -10.697 6.080 1.00 0.00 C ATOM 37 O3' DC A 2 -4.059 -9.837 7.079 1.00 0.00 O ATOM 38 C2' DC A 2 -3.586 -11.682 5.567 1.00 0.00 C ATOM 39 C1' DC A 2 -4.430 -12.876 5.140 1.00 0.00 C ATOM 40 N1 DC A 2 -4.751 -12.909 3.703 1.00 0.00 N ATOM 41 C2 DC A 2 -4.147 -13.883 2.900 1.00 0.00 C ATOM 42 O2 DC A 2 -3.361 -14.686 3.421 1.00 0.00 O ATOM 43 N3 DC A 2 -4.436 -13.924 1.580 1.00 0.00 N ATOM 44 C4 DC A 2 -5.289 -13.041 1.057 1.00 0.00 C ATOM 45 N4 DC A 2 -5.546 -13.121 -0.249 1.00 0.00 N ATOM 46 C5 DC A 2 -5.919 -12.038 1.850 1.00 0.00 C ATOM 47 C6 DC A 2 -5.622 -12.010 3.156 1.00 0.00 C ATOM 0 H5' DC A 2 -7.776 -11.823 7.046 1.00 0.00 H new ATOM 0 H5'' DC A 2 -7.129 -10.250 7.468 1.00 0.00 H new ATOM 0 H4' DC A 2 -5.424 -11.790 7.737 1.00 0.00 H new ATOM 0 H3' DC A 2 -5.009 -10.034 5.307 1.00 0.00 H new ATOM 0 H2' DC A 2 -3.017 -11.271 4.733 1.00 0.00 H new ATOM 0 H2'' DC A 2 -2.867 -11.952 6.341 1.00 0.00 H new ATOM 0 H1' DC A 2 -3.851 -13.775 5.349 1.00 0.00 H new ATOM 0 H41 DC A 2 -6.193 -12.462 -0.683 1.00 0.00 H new ATOM 0 H42 DC A 2 -5.096 -13.841 -0.814 1.00 0.00 H new ATOM 0 H5 DC A 2 -6.608 -11.329 1.415 1.00 0.00 H new ATOM 0 H6 DC A 2 -6.079 -11.263 3.788 1.00 0.00 H new ATOM 59 P DT A 3 -3.203 -8.550 6.637 1.00 0.00 P ATOM 60 OP1 DT A 3 -3.178 -7.595 7.774 1.00 0.00 O ATOM 61 OP2 DT A 3 -3.710 -8.100 5.314 1.00 0.00 O ATOM 62 O5' DT A 3 -1.729 -9.119 6.427 1.00 0.00 O ATOM 63 C5' DT A 3 -1.111 -9.943 7.417 1.00 0.00 C ATOM 64 C4' DT A 3 0.086 -10.656 6.833 1.00 0.00 C ATOM 65 O4' DT A 3 -0.337 -11.407 5.669 1.00 0.00 O ATOM 66 C3' DT A 3 1.218 -9.740 6.362 1.00 0.00 C ATOM 67 O3' DT A 3 2.486 -10.295 6.725 1.00 0.00 O ATOM 68 C2' DT A 3 1.063 -9.715 4.853 1.00 0.00 C ATOM 69 C1' DT A 3 0.466 -11.071 4.552 1.00 0.00 C ATOM 70 N1 DT A 3 -0.390 -11.119 3.353 1.00 0.00 N ATOM 71 C2 DT A 3 -0.044 -11.965 2.326 1.00 0.00 C ATOM 72 O2 DT A 3 0.948 -12.674 2.352 1.00 0.00 O ATOM 73 N3 DT A 3 -0.904 -11.951 1.259 1.00 0.00 N ATOM 74 C4 DT A 3 -2.046 -11.193 1.122 1.00 0.00 C ATOM 75 O4 DT A 3 -2.730 -11.300 0.109 1.00 0.00 O ATOM 76 C5 DT A 3 -2.347 -10.321 2.236 1.00 0.00 C ATOM 77 C7 DT A 3 -3.562 -9.449 2.169 1.00 0.00 C ATOM 78 C6 DT A 3 -1.512 -10.325 3.286 1.00 0.00 C ATOM 0 H5' DT A 3 -1.829 -10.672 7.793 1.00 0.00 H new ATOM 0 H5'' DT A 3 -0.801 -9.333 8.266 1.00 0.00 H new ATOM 0 H4' DT A 3 0.472 -11.274 7.644 1.00 0.00 H new ATOM 0 H3' DT A 3 1.173 -8.746 6.806 1.00 0.00 H new ATOM 0 H2' DT A 3 0.410 -8.905 4.527 1.00 0.00 H new ATOM 0 H2'' DT A 3 2.020 -9.575 4.351 1.00 0.00 H new ATOM 0 H1' DT A 3 1.291 -11.758 4.361 1.00 0.00 H new ATOM 0 H3 DT A 3 -0.673 -12.569 0.481 1.00 0.00 H new ATOM 0 H71 DT A 3 -3.947 -9.284 3.175 1.00 0.00 H new ATOM 0 H72 DT A 3 -3.298 -8.491 1.720 1.00 0.00 H new ATOM 0 H73 DT A 3 -4.326 -9.936 1.563 1.00 0.00 H new ATOM 0 H6 DT A 3 -1.731 -9.674 4.119 1.00 0.00 H new ATOM 91 P DC A 4 3.572 -9.383 7.481 1.00 0.00 P ATOM 92 OP1 DC A 4 4.611 -10.296 8.022 1.00 0.00 O ATOM 93 OP2 DC A 4 2.858 -8.460 8.401 1.00 0.00 O ATOM 94 O5' DC A 4 4.226 -8.516 6.315 1.00 0.00 O ATOM 95 C5' DC A 4 5.361 -8.994 5.593 1.00 0.00 C ATOM 96 C4' DC A 4 5.466 -8.293 4.258 1.00 0.00 C ATOM 97 O4' DC A 4 4.519 -8.868 3.339 1.00 0.00 O ATOM 98 C3' DC A 4 5.131 -6.805 4.269 1.00 0.00 C ATOM 99 O3' DC A 4 6.310 -6.032 4.520 1.00 0.00 O ATOM 100 C2' DC A 4 4.610 -6.551 2.861 1.00 0.00 C ATOM 101 C1' DC A 4 4.293 -7.936 2.296 1.00 0.00 C ATOM 102 N1 DC A 4 2.908 -8.102 1.829 1.00 0.00 N ATOM 103 C2 DC A 4 2.685 -8.732 0.602 1.00 0.00 C ATOM 104 O2 DC A 4 3.658 -9.142 -0.044 1.00 0.00 O ATOM 105 N3 DC A 4 1.419 -8.878 0.153 1.00 0.00 N ATOM 106 C4 DC A 4 0.398 -8.419 0.879 1.00 0.00 C ATOM 107 N4 DC A 4 -0.832 -8.575 0.390 1.00 0.00 N ATOM 108 C5 DC A 4 0.593 -7.780 2.138 1.00 0.00 C ATOM 109 C6 DC A 4 1.854 -7.647 2.572 1.00 0.00 C ATOM 0 H5' DC A 4 5.277 -10.070 5.441 1.00 0.00 H new ATOM 0 H5'' DC A 4 6.268 -8.824 6.173 1.00 0.00 H new ATOM 0 H4' DC A 4 6.512 -8.417 3.980 1.00 0.00 H new ATOM 0 H3' DC A 4 4.414 -6.530 5.043 1.00 0.00 H new ATOM 0 H2' DC A 4 3.722 -5.920 2.878 1.00 0.00 H new ATOM 0 H2'' DC A 4 5.354 -6.038 2.252 1.00 0.00 H new ATOM 0 H1' DC A 4 4.929 -8.086 1.424 1.00 0.00 H new ATOM 0 H41 DC A 4 -1.637 -8.237 0.917 1.00 0.00 H new ATOM 0 H42 DC A 4 -0.968 -9.033 -0.511 1.00 0.00 H new ATOM 0 H5 DC A 4 -0.242 -7.417 2.719 1.00 0.00 H new ATOM 0 H6 DC A 4 2.041 -7.173 3.524 1.00 0.00 H new ATOM 121 P DT A 5 6.253 -4.428 4.407 1.00 0.00 P ATOM 122 OP1 DT A 5 7.304 -3.860 5.287 1.00 0.00 O ATOM 123 OP2 DT A 5 4.839 -4.008 4.589 1.00 0.00 O ATOM 124 O5' DT A 5 6.655 -4.131 2.894 1.00 0.00 O ATOM 125 C5' DT A 5 7.761 -4.800 2.279 1.00 0.00 C ATOM 126 C4' DT A 5 7.761 -4.546 0.790 1.00 0.00 C ATOM 127 O4' DT A 5 6.550 -5.107 0.228 1.00 0.00 O ATOM 128 C3' DT A 5 7.782 -3.069 0.390 1.00 0.00 C ATOM 129 O3' DT A 5 8.698 -2.847 -0.687 1.00 0.00 O ATOM 130 C2' DT A 5 6.361 -2.786 -0.064 1.00 0.00 C ATOM 131 C1' DT A 5 5.860 -4.136 -0.537 1.00 0.00 C ATOM 132 N1 DT A 5 4.413 -4.349 -0.343 1.00 0.00 N ATOM 133 C2 DT A 5 3.678 -4.854 -1.393 1.00 0.00 C ATOM 134 O2 DT A 5 4.164 -5.127 -2.478 1.00 0.00 O ATOM 135 N3 DT A 5 2.346 -5.026 -1.126 1.00 0.00 N ATOM 136 C4 DT A 5 1.689 -4.743 0.052 1.00 0.00 C ATOM 137 O4 DT A 5 0.488 -4.965 0.149 1.00 0.00 O ATOM 138 C5 DT A 5 2.516 -4.207 1.108 1.00 0.00 C ATOM 139 C7 DT A 5 1.875 -3.822 2.405 1.00 0.00 C ATOM 140 C6 DT A 5 3.824 -4.045 0.868 1.00 0.00 C ATOM 0 H5' DT A 5 7.701 -5.871 2.473 1.00 0.00 H new ATOM 0 H5'' DT A 5 8.696 -4.449 2.715 1.00 0.00 H new ATOM 0 H4' DT A 5 8.677 -5.002 0.415 1.00 0.00 H new ATOM 0 H3' DT A 5 8.102 -2.424 1.208 1.00 0.00 H new ATOM 0 H2' DT A 5 5.751 -2.395 0.750 1.00 0.00 H new ATOM 0 H2'' DT A 5 6.336 -2.047 -0.864 1.00 0.00 H new ATOM 0 H1' DT A 5 6.038 -4.202 -1.610 1.00 0.00 H new ATOM 0 H3 DT A 5 1.777 -5.406 -1.883 1.00 0.00 H new ATOM 0 H71 DT A 5 2.590 -3.952 3.217 1.00 0.00 H new ATOM 0 H72 DT A 5 1.562 -2.779 2.361 1.00 0.00 H new ATOM 0 H73 DT A 5 1.005 -4.454 2.583 1.00 0.00 H new ATOM 0 H6 DT A 5 4.448 -3.658 1.660 1.00 0.00 H new ATOM 153 P DG A 6 9.445 -1.427 -0.819 1.00 0.00 P ATOM 154 OP1 DG A 6 10.898 -1.639 -0.607 1.00 0.00 O ATOM 155 OP2 DG A 6 8.711 -0.457 0.035 1.00 0.00 O ATOM 156 O5' DG A 6 9.206 -1.001 -2.336 1.00 0.00 O ATOM 157 C5' DG A 6 10.226 -1.162 -3.322 1.00 0.00 C ATOM 158 C4' DG A 6 9.618 -1.159 -4.704 1.00 0.00 C ATOM 159 O4' DG A 6 8.618 -2.207 -4.780 1.00 0.00 O ATOM 160 C3' DG A 6 8.879 0.121 -5.086 1.00 0.00 C ATOM 161 O3' DG A 6 9.750 1.057 -5.731 1.00 0.00 O ATOM 162 C2' DG A 6 7.821 -0.389 -6.045 1.00 0.00 C ATOM 163 C1' DG A 6 7.438 -1.704 -5.397 1.00 0.00 C ATOM 164 N9 DG A 6 6.412 -1.554 -4.371 1.00 0.00 N ATOM 165 C8 DG A 6 6.583 -1.051 -3.107 1.00 0.00 C ATOM 166 N7 DG A 6 5.479 -0.993 -2.418 1.00 0.00 N ATOM 167 C5 DG A 6 4.520 -1.521 -3.274 1.00 0.00 C ATOM 168 C6 DG A 6 3.131 -1.729 -3.083 1.00 0.00 C ATOM 169 O6 DG A 6 2.454 -1.507 -2.076 1.00 0.00 O ATOM 170 N1 DG A 6 2.529 -2.261 -4.220 1.00 0.00 N ATOM 171 C2 DG A 6 3.186 -2.569 -5.389 1.00 0.00 C ATOM 172 N2 DG A 6 2.446 -3.079 -6.386 1.00 0.00 N ATOM 173 N3 DG A 6 4.483 -2.391 -5.573 1.00 0.00 N ATOM 174 C4 DG A 6 5.081 -1.865 -4.486 1.00 0.00 C ATOM 0 H5' DG A 6 10.761 -2.097 -3.154 1.00 0.00 H new ATOM 0 H5'' DG A 6 10.956 -0.357 -3.236 1.00 0.00 H new ATOM 0 H4' DG A 6 10.466 -1.284 -5.378 1.00 0.00 H new ATOM 0 H3' DG A 6 8.473 0.658 -4.229 1.00 0.00 H new ATOM 0 H2' DG A 6 6.974 0.293 -6.122 1.00 0.00 H new ATOM 0 H2'' DG A 6 8.212 -0.527 -7.053 1.00 0.00 H new ATOM 0 H1' DG A 6 7.031 -2.368 -6.160 1.00 0.00 H new ATOM 0 H8 DG A 6 7.540 -0.734 -2.720 1.00 0.00 H new ATOM 0 H1 DG A 6 1.525 -2.436 -4.184 1.00 0.00 H new ATOM 0 H21 DG A 6 2.885 -3.324 -7.273 1.00 0.00 H new ATOM 0 H22 DG A 6 1.444 -3.221 -6.256 1.00 0.00 H new ATOM 186 P DG A 7 9.747 2.601 -5.266 1.00 0.00 P ATOM 187 OP1 DG A 7 10.978 3.227 -5.810 1.00 0.00 O ATOM 188 OP2 DG A 7 9.484 2.652 -3.804 1.00 0.00 O ATOM 189 O5' DG A 7 8.494 3.245 -6.015 1.00 0.00 O ATOM 190 C5' DG A 7 8.007 2.690 -7.236 1.00 0.00 C ATOM 191 C4' DG A 7 6.712 3.354 -7.645 1.00 0.00 C ATOM 192 O4' DG A 7 5.620 2.626 -7.033 1.00 0.00 O ATOM 193 C3' DG A 7 6.542 4.814 -7.218 1.00 0.00 C ATOM 194 O3' DG A 7 5.875 5.553 -8.253 1.00 0.00 O ATOM 195 C2' DG A 7 5.678 4.721 -5.974 1.00 0.00 C ATOM 196 C1' DG A 7 4.825 3.500 -6.254 1.00 0.00 C ATOM 197 N9 DG A 7 4.411 2.783 -5.055 1.00 0.00 N ATOM 198 C8 DG A 7 5.225 2.203 -4.117 1.00 0.00 C ATOM 199 N7 DG A 7 4.566 1.656 -3.130 1.00 0.00 N ATOM 200 C5 DG A 7 3.233 1.888 -3.445 1.00 0.00 C ATOM 201 C6 DG A 7 2.047 1.528 -2.754 1.00 0.00 C ATOM 202 O6 DG A 7 1.933 0.933 -1.677 1.00 0.00 O ATOM 203 N1 DG A 7 0.910 1.944 -3.438 1.00 0.00 N ATOM 204 C2 DG A 7 0.914 2.629 -4.628 1.00 0.00 C ATOM 205 N2 DG A 7 -0.280 2.953 -5.131 1.00 0.00 N ATOM 206 N3 DG A 7 2.009 2.974 -5.277 1.00 0.00 N ATOM 207 C4 DG A 7 3.123 2.572 -4.635 1.00 0.00 C ATOM 0 H5' DG A 7 7.850 1.618 -7.117 1.00 0.00 H new ATOM 0 H5'' DG A 7 8.751 2.818 -8.022 1.00 0.00 H new ATOM 0 H4' DG A 7 6.722 3.341 -8.735 1.00 0.00 H new ATOM 0 H3' DG A 7 7.486 5.326 -7.034 1.00 0.00 H new ATOM 0 H2' DG A 7 6.278 4.598 -5.072 1.00 0.00 H new ATOM 0 H2'' DG A 7 5.071 5.616 -5.834 1.00 0.00 H new ATOM 0 H1' DG A 7 3.912 3.830 -6.750 1.00 0.00 H new ATOM 0 H8 DG A 7 6.303 2.199 -4.187 1.00 0.00 H new ATOM 0 H1 DG A 7 0.004 1.724 -3.024 1.00 0.00 H new ATOM 0 H21 DG A 7 -0.341 3.462 -6.013 1.00 0.00 H new ATOM 0 H22 DG A 7 -1.131 2.691 -4.633 1.00 0.00 H new ATOM 219 P DT A 8 5.404 7.070 -7.984 1.00 0.00 P ATOM 220 OP1 DT A 8 5.380 7.764 -9.296 1.00 0.00 O ATOM 221 OP2 DT A 8 6.215 7.631 -6.873 1.00 0.00 O ATOM 222 O5' DT A 8 3.899 6.927 -7.477 1.00 0.00 O ATOM 223 C5' DT A 8 2.963 6.098 -8.171 1.00 0.00 C ATOM 224 C4' DT A 8 1.551 6.587 -7.943 1.00 0.00 C ATOM 225 O4' DT A 8 1.011 5.909 -6.781 1.00 0.00 O ATOM 226 C3' DT A 8 1.407 8.087 -7.669 1.00 0.00 C ATOM 227 O3' DT A 8 0.272 8.611 -8.368 1.00 0.00 O ATOM 228 C2' DT A 8 1.195 8.162 -6.166 1.00 0.00 C ATOM 229 C1' DT A 8 0.491 6.853 -5.864 1.00 0.00 C ATOM 230 N1 DT A 8 0.720 6.334 -4.501 1.00 0.00 N ATOM 231 C2 DT A 8 -0.365 5.874 -3.786 1.00 0.00 C ATOM 232 O2 DT A 8 -1.502 5.868 -4.229 1.00 0.00 O ATOM 233 N3 DT A 8 -0.070 5.420 -2.530 1.00 0.00 N ATOM 234 C4 DT A 8 1.169 5.379 -1.927 1.00 0.00 C ATOM 235 O4 DT A 8 1.279 4.929 -0.790 1.00 0.00 O ATOM 236 C5 DT A 8 2.264 5.876 -2.729 1.00 0.00 C ATOM 237 C7 DT A 8 3.631 5.939 -2.117 1.00 0.00 C ATOM 238 C6 DT A 8 1.993 6.318 -3.969 1.00 0.00 C ATOM 0 H5' DT A 8 3.057 5.068 -7.828 1.00 0.00 H new ATOM 0 H5'' DT A 8 3.187 6.101 -9.238 1.00 0.00 H new ATOM 0 H4' DT A 8 1.026 6.376 -8.875 1.00 0.00 H new ATOM 0 H3' DT A 8 2.268 8.667 -8.000 1.00 0.00 H new ATOM 0 H2' DT A 8 2.139 8.248 -5.628 1.00 0.00 H new ATOM 0 H2'' DT A 8 0.588 9.023 -5.885 1.00 0.00 H new ATOM 0 H1' DT A 8 -0.583 7.022 -5.947 1.00 0.00 H new ATOM 0 H3 DT A 8 -0.854 5.073 -1.978 1.00 0.00 H new ATOM 0 H71 DT A 8 4.384 5.805 -2.894 1.00 0.00 H new ATOM 0 H72 DT A 8 3.771 6.908 -1.639 1.00 0.00 H new ATOM 0 H73 DT A 8 3.733 5.149 -1.373 1.00 0.00 H new ATOM 0 H6 DT A 8 2.810 6.677 -4.577 1.00 0.00 H new ATOM 251 P DC A 9 -0.072 10.181 -8.276 1.00 0.00 P ATOM 252 OP1 DC A 9 -0.672 10.578 -9.574 1.00 0.00 O ATOM 253 OP2 DC A 9 1.127 10.900 -7.772 1.00 0.00 O ATOM 254 O5' DC A 9 -1.204 10.259 -7.157 1.00 0.00 O ATOM 255 C5' DC A 9 -2.479 9.646 -7.357 1.00 0.00 C ATOM 256 C4' DC A 9 -3.272 9.648 -6.070 1.00 0.00 C ATOM 257 O4' DC A 9 -2.601 8.837 -5.088 1.00 0.00 O ATOM 258 C3' DC A 9 -3.433 11.007 -5.396 1.00 0.00 C ATOM 259 O3' DC A 9 -4.620 11.658 -5.867 1.00 0.00 O ATOM 260 C2' DC A 9 -3.564 10.656 -3.919 1.00 0.00 C ATOM 261 C1' DC A 9 -3.085 9.206 -3.809 1.00 0.00 C ATOM 262 N1 DC A 9 -2.004 8.980 -2.833 1.00 0.00 N ATOM 263 C2 DC A 9 -2.319 8.386 -1.606 1.00 0.00 C ATOM 264 O2 DC A 9 -3.497 8.079 -1.372 1.00 0.00 O ATOM 265 N3 DC A 9 -1.332 8.160 -0.707 1.00 0.00 N ATOM 266 C4 DC A 9 -0.076 8.504 -0.995 1.00 0.00 C ATOM 267 N4 DC A 9 0.862 8.260 -0.078 1.00 0.00 N ATOM 268 C5 DC A 9 0.276 9.112 -2.236 1.00 0.00 C ATOM 269 C6 DC A 9 -0.713 9.335 -3.116 1.00 0.00 C ATOM 0 H5' DC A 9 -2.347 8.623 -7.708 1.00 0.00 H new ATOM 0 H5'' DC A 9 -3.029 10.180 -8.131 1.00 0.00 H new ATOM 0 H4' DC A 9 -4.255 9.286 -6.373 1.00 0.00 H new ATOM 0 H3' DC A 9 -2.607 11.689 -5.599 1.00 0.00 H new ATOM 0 H2' DC A 9 -2.958 11.319 -3.301 1.00 0.00 H new ATOM 0 H2'' DC A 9 -4.595 10.757 -3.580 1.00 0.00 H new ATOM 0 H1' DC A 9 -3.932 8.614 -3.462 1.00 0.00 H new ATOM 0 H41 DC A 9 1.834 8.509 -0.263 1.00 0.00 H new ATOM 0 H42 DC A 9 0.608 7.824 0.808 1.00 0.00 H new ATOM 0 H5 DC A 9 1.298 9.382 -2.459 1.00 0.00 H new ATOM 0 H6 DC A 9 -0.486 9.802 -4.063 1.00 0.00 H new ATOM 281 P DT A 10 -4.727 13.264 -5.822 1.00 0.00 P ATOM 282 OP1 DT A 10 -5.705 13.668 -6.865 1.00 0.00 O ATOM 283 OP2 DT A 10 -3.355 13.832 -5.846 1.00 0.00 O ATOM 284 O5' DT A 10 -5.360 13.569 -4.391 1.00 0.00 O ATOM 285 C5' DT A 10 -6.605 14.265 -4.264 1.00 0.00 C ATOM 286 C4' DT A 10 -6.769 14.779 -2.851 1.00 0.00 C ATOM 287 O4' DT A 10 -6.300 13.767 -1.935 1.00 0.00 O ATOM 288 C3' DT A 10 -5.960 16.033 -2.529 1.00 0.00 C ATOM 289 O3' DT A 10 -6.759 17.211 -2.687 1.00 0.00 O ATOM 290 C2' DT A 10 -5.582 15.859 -1.068 1.00 0.00 C ATOM 291 C1' DT A 10 -5.712 14.369 -0.793 1.00 0.00 C ATOM 292 N1 DT A 10 -4.412 13.725 -0.553 1.00 0.00 N ATOM 293 C2 DT A 10 -4.217 13.061 0.634 1.00 0.00 C ATOM 294 O2 DT A 10 -5.076 12.964 1.492 1.00 0.00 O ATOM 295 N3 DT A 10 -2.974 12.511 0.780 1.00 0.00 N ATOM 296 C4 DT A 10 -1.935 12.542 -0.125 1.00 0.00 C ATOM 297 O4 DT A 10 -0.870 11.994 0.150 1.00 0.00 O ATOM 298 C5 DT A 10 -2.211 13.249 -1.356 1.00 0.00 C ATOM 299 C7 DT A 10 -1.159 13.288 -2.421 1.00 0.00 C ATOM 300 C6 DT A 10 -3.420 13.807 -1.506 1.00 0.00 C ATOM 0 H5' DT A 10 -7.431 13.599 -4.516 1.00 0.00 H new ATOM 0 H5'' DT A 10 -6.640 15.096 -4.968 1.00 0.00 H new ATOM 0 H4' DT A 10 -7.827 15.020 -2.754 1.00 0.00 H new ATOM 0 H3' DT A 10 -5.099 16.149 -3.187 1.00 0.00 H new ATOM 0 H2' DT A 10 -4.566 16.206 -0.881 1.00 0.00 H new ATOM 0 H2'' DT A 10 -6.241 16.437 -0.420 1.00 0.00 H new ATOM 0 H1' DT A 10 -6.317 14.241 0.104 1.00 0.00 H new ATOM 0 H3 DT A 10 -2.795 12.023 1.658 1.00 0.00 H new ATOM 0 H71 DT A 10 -1.634 13.351 -3.400 1.00 0.00 H new ATOM 0 H72 DT A 10 -0.521 14.159 -2.271 1.00 0.00 H new ATOM 0 H73 DT A 10 -0.555 12.382 -2.369 1.00 0.00 H new ATOM 0 H6 DT A 10 -3.627 14.347 -2.418 1.00 0.00 H new ATOM 313 P DC A 11 -6.163 18.645 -2.261 1.00 0.00 P ATOM 314 OP1 DC A 11 -7.121 19.680 -2.728 1.00 0.00 O ATOM 315 OP2 DC A 11 -4.745 18.708 -2.699 1.00 0.00 O ATOM 316 O5' DC A 11 -6.188 18.623 -0.665 1.00 0.00 O ATOM 317 C5' DC A 11 -7.319 19.110 0.060 1.00 0.00 C ATOM 318 C4' DC A 11 -7.134 18.893 1.545 1.00 0.00 C ATOM 319 O4' DC A 11 -6.188 17.819 1.769 1.00 0.00 O ATOM 320 C3' DC A 11 -6.587 20.096 2.316 1.00 0.00 C ATOM 321 O3' DC A 11 -7.224 20.173 3.597 1.00 0.00 O ATOM 322 C2' DC A 11 -5.106 19.790 2.453 1.00 0.00 C ATOM 323 C1' DC A 11 -5.081 18.275 2.533 1.00 0.00 C ATOM 324 N1 DC A 11 -3.876 17.637 1.980 1.00 0.00 N ATOM 325 C2 DC A 11 -3.137 16.760 2.783 1.00 0.00 C ATOM 326 O2 DC A 11 -3.484 16.585 3.961 1.00 0.00 O ATOM 327 N3 DC A 11 -2.065 16.124 2.256 1.00 0.00 N ATOM 328 C4 DC A 11 -1.721 16.338 0.985 1.00 0.00 C ATOM 329 N4 DC A 11 -0.664 15.668 0.508 1.00 0.00 N ATOM 330 C5 DC A 11 -2.446 17.246 0.148 1.00 0.00 C ATOM 331 C6 DC A 11 -3.496 17.877 0.689 1.00 0.00 C ATOM 0 H5' DC A 11 -8.221 18.600 -0.278 1.00 0.00 H new ATOM 0 H5'' DC A 11 -7.458 20.172 -0.143 1.00 0.00 H new ATOM 0 H4' DC A 11 -8.138 18.680 1.911 1.00 0.00 H new ATOM 0 H3' DC A 11 -6.764 21.052 1.824 1.00 0.00 H new ATOM 0 H2' DC A 11 -4.536 20.159 1.600 1.00 0.00 H new ATOM 0 H2'' DC A 11 -4.679 20.249 3.345 1.00 0.00 H new ATOM 0 H1' DC A 11 -5.106 18.008 3.590 1.00 0.00 H new ATOM 0 H41 DC A 11 -0.368 15.803 -0.459 1.00 0.00 H new ATOM 0 H42 DC A 11 -0.155 15.022 1.112 1.00 0.00 H new ATOM 0 H5 DC A 11 -2.157 17.415 -0.879 1.00 0.00 H new ATOM 0 H6 DC A 11 -4.052 18.588 0.095 1.00 0.00 H new ATOM 343 P DC A 12 -7.892 21.555 4.080 1.00 0.00 P ATOM 344 OP1 DC A 12 -9.360 21.457 3.884 1.00 0.00 O ATOM 345 OP2 DC A 12 -7.139 22.668 3.445 1.00 0.00 O ATOM 346 O5' DC A 12 -7.595 21.600 5.644 1.00 0.00 O ATOM 347 C5' DC A 12 -8.183 20.647 6.535 1.00 0.00 C ATOM 348 C4' DC A 12 -7.194 20.265 7.611 1.00 0.00 C ATOM 349 O4' DC A 12 -5.969 19.849 6.980 1.00 0.00 O ATOM 350 C3' DC A 12 -6.798 21.400 8.550 1.00 0.00 C ATOM 351 O3' DC A 12 -7.612 21.387 9.725 1.00 0.00 O ATOM 352 C2' DC A 12 -5.353 21.089 8.908 1.00 0.00 C ATOM 353 C1' DC A 12 -4.881 20.093 7.851 1.00 0.00 C ATOM 354 N1 DC A 12 -3.758 20.576 7.034 1.00 0.00 N ATOM 355 C2 DC A 12 -2.486 20.033 7.234 1.00 0.00 C ATOM 356 O2 DC A 12 -2.336 19.152 8.094 1.00 0.00 O ATOM 357 N3 DC A 12 -1.453 20.479 6.485 1.00 0.00 N ATOM 358 C4 DC A 12 -1.656 21.427 5.567 1.00 0.00 C ATOM 359 N4 DC A 12 -0.613 21.837 4.849 1.00 0.00 N ATOM 360 C5 DC A 12 -2.942 21.997 5.343 1.00 0.00 C ATOM 361 C6 DC A 12 -3.954 21.548 6.094 1.00 0.00 C ATOM 0 H5' DC A 12 -8.490 19.760 5.981 1.00 0.00 H new ATOM 0 H5'' DC A 12 -9.081 21.067 6.988 1.00 0.00 H new ATOM 0 H4' DC A 12 -7.692 19.492 8.196 1.00 0.00 H new ATOM 0 H3' DC A 12 -6.922 22.383 8.096 1.00 0.00 H new ATOM 0 H2' DC A 12 -4.742 21.992 8.898 1.00 0.00 H new ATOM 0 H2'' DC A 12 -5.278 20.665 9.909 1.00 0.00 H new ATOM 0 HO3' DC A 12 -7.344 22.120 10.317 1.00 0.00 H new ATOM 0 H1' DC A 12 -4.535 19.204 8.378 1.00 0.00 H new ATOM 0 H41 DC A 12 -0.735 22.560 4.140 1.00 0.00 H new ATOM 0 H5 DC A 12 -3.094 22.762 4.596 1.00 0.00 H new ATOM 0 H6 DC A 12 -4.942 21.961 5.955 1.00 0.00 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 8.036 20.492 7.374 1.00 0.00 O ATOM 376 C5' DG B 13 8.192 19.787 8.608 1.00 0.00 C ATOM 377 C4' DG B 13 7.220 18.635 8.702 1.00 0.00 C ATOM 378 O4' DG B 13 5.869 19.146 8.557 1.00 0.00 O ATOM 379 C3' DG B 13 7.376 17.565 7.619 1.00 0.00 C ATOM 380 O3' DG B 13 7.114 16.268 8.170 1.00 0.00 O ATOM 381 C2' DG B 13 6.316 17.952 6.604 1.00 0.00 C ATOM 382 C1' DG B 13 5.212 18.452 7.510 1.00 0.00 C ATOM 383 N9 DG B 13 4.268 19.369 6.878 1.00 0.00 N ATOM 384 C8 DG B 13 4.517 20.228 5.836 1.00 0.00 C ATOM 385 N7 DG B 13 3.472 20.920 5.478 1.00 0.00 N ATOM 386 C5 DG B 13 2.468 20.494 6.337 1.00 0.00 C ATOM 387 C6 DG B 13 1.112 20.891 6.429 1.00 0.00 C ATOM 388 O6 DG B 13 0.509 21.723 5.745 1.00 0.00 O ATOM 389 N1 DG B 13 0.443 20.211 7.443 1.00 0.00 N ATOM 390 C2 DG B 13 1.013 19.262 8.266 1.00 0.00 C ATOM 391 N2 DG B 13 0.222 18.697 9.197 1.00 0.00 N ATOM 392 N3 DG B 13 2.279 18.886 8.188 1.00 0.00 N ATOM 393 C4 DG B 13 2.944 19.537 7.209 1.00 0.00 C ATOM 0 H5' DG B 13 8.034 20.470 9.443 1.00 0.00 H new ATOM 0 H5'' DG B 13 9.213 19.413 8.691 1.00 0.00 H new ATOM 0 H4' DG B 13 7.426 18.173 9.668 1.00 0.00 H new ATOM 0 H3' DG B 13 8.376 17.515 7.188 1.00 0.00 H new ATOM 0 H2' DG B 13 6.666 18.723 5.917 1.00 0.00 H new ATOM 0 H2'' DG B 13 5.998 17.104 5.997 1.00 0.00 H new ATOM 0 HO5' DG B 13 8.675 21.234 7.338 1.00 0.00 H new ATOM 0 H1' DG B 13 4.618 17.596 7.829 1.00 0.00 H new ATOM 0 H8 DG B 13 5.482 20.321 5.361 1.00 0.00 H new ATOM 0 H1 DG B 13 -0.542 20.431 7.588 1.00 0.00 H new ATOM 0 H21 DG B 13 0.601 17.990 9.827 1.00 0.00 H new ATOM 0 H22 DG B 13 -0.756 18.975 9.272 1.00 0.00 H new ATOM 406 P DG B 14 7.314 14.951 7.266 1.00 0.00 P ATOM 407 OP1 DG B 14 8.486 14.223 7.814 1.00 0.00 O ATOM 408 OP2 DG B 14 7.293 15.329 5.829 1.00 0.00 O ATOM 409 O5' DG B 14 6.012 14.084 7.570 1.00 0.00 O ATOM 410 C5' DG B 14 5.451 14.045 8.885 1.00 0.00 C ATOM 411 C4' DG B 14 4.145 13.285 8.884 1.00 0.00 C ATOM 412 O4' DG B 14 3.311 13.763 7.804 1.00 0.00 O ATOM 413 C3' DG B 14 4.275 11.771 8.680 1.00 0.00 C ATOM 414 O3' DG B 14 3.766 11.083 9.827 1.00 0.00 O ATOM 415 C2' DG B 14 3.420 11.472 7.456 1.00 0.00 C ATOM 416 C1' DG B 14 2.525 12.688 7.348 1.00 0.00 C ATOM 417 N9 DG B 14 2.063 13.009 6.000 1.00 0.00 N ATOM 418 C8 DG B 14 2.667 12.679 4.812 1.00 0.00 C ATOM 419 N7 DG B 14 2.031 13.134 3.767 1.00 0.00 N ATOM 420 C5 DG B 14 0.933 13.798 4.299 1.00 0.00 C ATOM 421 C6 DG B 14 -0.125 14.488 3.653 1.00 0.00 C ATOM 422 O6 DG B 14 -0.310 14.663 2.443 1.00 0.00 O ATOM 423 N1 DG B 14 -1.030 15.008 4.571 1.00 0.00 N ATOM 424 C2 DG B 14 -0.933 14.883 5.932 1.00 0.00 C ATOM 425 N2 DG B 14 -1.895 15.484 6.645 1.00 0.00 N ATOM 426 N3 DG B 14 0.037 14.230 6.547 1.00 0.00 N ATOM 427 C4 DG B 14 0.933 13.721 5.675 1.00 0.00 C ATOM 0 H5' DG B 14 5.287 15.060 9.246 1.00 0.00 H new ATOM 0 H5'' DG B 14 6.153 13.572 9.572 1.00 0.00 H new ATOM 0 H4' DG B 14 3.725 13.458 9.875 1.00 0.00 H new ATOM 0 H3' DG B 14 5.308 11.451 8.545 1.00 0.00 H new ATOM 0 H2' DG B 14 4.030 11.341 6.562 1.00 0.00 H new ATOM 0 H2'' DG B 14 2.841 10.557 7.584 1.00 0.00 H new ATOM 0 H1' DG B 14 1.619 12.492 7.922 1.00 0.00 H new ATOM 0 H8 DG B 14 3.577 12.101 4.749 1.00 0.00 H new ATOM 0 H1 DG B 14 -1.829 15.523 4.202 1.00 0.00 H new ATOM 0 H21 DG B 14 -1.884 15.431 7.664 1.00 0.00 H new ATOM 0 H22 DG B 14 -2.639 15.995 6.169 1.00 0.00 H new ATOM 439 P DA B 15 4.060 9.514 10.016 1.00 0.00 P ATOM 440 OP1 DA B 15 4.799 9.332 11.290 1.00 0.00 O ATOM 441 OP2 DA B 15 4.643 9.000 8.750 1.00 0.00 O ATOM 442 O5' DA B 15 2.612 8.871 10.186 1.00 0.00 O ATOM 443 C5' DA B 15 1.619 9.496 11.003 1.00 0.00 C ATOM 444 C4' DA B 15 0.236 9.129 10.516 1.00 0.00 C ATOM 445 O4' DA B 15 -0.179 10.078 9.514 1.00 0.00 O ATOM 446 C3' DA B 15 0.127 7.768 9.837 1.00 0.00 C ATOM 447 O3' DA B 15 -0.185 6.758 10.804 1.00 0.00 O ATOM 448 C2' DA B 15 -1.026 7.954 8.863 1.00 0.00 C ATOM 449 C1' DA B 15 -1.101 9.463 8.628 1.00 0.00 C ATOM 450 N9 DA B 15 -0.761 9.882 7.268 1.00 0.00 N ATOM 451 C8 DA B 15 0.438 9.737 6.613 1.00 0.00 C ATOM 452 N7 DA B 15 0.437 10.223 5.396 1.00 0.00 N ATOM 453 C5 DA B 15 -0.848 10.720 5.237 1.00 0.00 C ATOM 454 C6 DA B 15 -1.487 11.365 4.164 1.00 0.00 C ATOM 455 N6 DA B 15 -0.886 11.644 3.006 1.00 0.00 N ATOM 456 N1 DA B 15 -2.779 11.726 4.326 1.00 0.00 N ATOM 457 C2 DA B 15 -3.376 11.460 5.497 1.00 0.00 C ATOM 458 N3 DA B 15 -2.879 10.867 6.579 1.00 0.00 N ATOM 459 C4 DA B 15 -1.597 10.515 6.381 1.00 0.00 C ATOM 0 H5' DA B 15 1.746 10.578 10.978 1.00 0.00 H new ATOM 0 H5'' DA B 15 1.742 9.184 12.040 1.00 0.00 H new ATOM 0 H4' DA B 15 -0.376 9.119 11.418 1.00 0.00 H new ATOM 0 H3' DA B 15 1.049 7.452 9.348 1.00 0.00 H new ATOM 0 H2' DA B 15 -0.847 7.417 7.931 1.00 0.00 H new ATOM 0 H2'' DA B 15 -1.959 7.572 9.277 1.00 0.00 H new ATOM 0 H1' DA B 15 -2.136 9.760 8.796 1.00 0.00 H new ATOM 0 H8 DA B 15 1.301 9.266 7.060 1.00 0.00 H new ATOM 0 H61 DA B 15 -1.403 12.115 2.263 1.00 0.00 H new ATOM 0 H62 DA B 15 0.091 11.387 2.863 1.00 0.00 H new ATOM 0 H2 DA B 15 -4.407 11.772 5.572 1.00 0.00 H new ATOM 471 P DG B 16 0.349 5.254 10.593 1.00 0.00 P ATOM 472 OP1 DG B 16 0.629 4.674 11.931 1.00 0.00 O ATOM 473 OP2 DG B 16 1.420 5.280 9.565 1.00 0.00 O ATOM 474 O5' DG B 16 -0.901 4.487 9.972 1.00 0.00 O ATOM 475 C5' DG B 16 -2.238 4.855 10.316 1.00 0.00 C ATOM 476 C4' DG B 16 -3.159 4.646 9.137 1.00 0.00 C ATOM 477 O4' DG B 16 -2.800 5.578 8.086 1.00 0.00 O ATOM 478 C3' DG B 16 -3.094 3.251 8.506 1.00 0.00 C ATOM 479 O3' DG B 16 -4.413 2.792 8.193 1.00 0.00 O ATOM 480 C2' DG B 16 -2.287 3.470 7.238 1.00 0.00 C ATOM 481 C1' DG B 16 -2.689 4.879 6.861 1.00 0.00 C ATOM 482 N9 DG B 16 -1.731 5.588 6.017 1.00 0.00 N ATOM 483 C8 DG B 16 -0.379 5.716 6.220 1.00 0.00 C ATOM 484 N7 DG B 16 0.220 6.401 5.284 1.00 0.00 N ATOM 485 C5 DG B 16 -0.801 6.749 4.409 1.00 0.00 C ATOM 486 C6 DG B 16 -0.763 7.493 3.200 1.00 0.00 C ATOM 487 O6 DG B 16 0.211 8.011 2.642 1.00 0.00 O ATOM 488 N1 DG B 16 -2.026 7.609 2.632 1.00 0.00 N ATOM 489 C2 DG B 16 -3.181 7.077 3.157 1.00 0.00 C ATOM 490 N2 DG B 16 -4.313 7.290 2.468 1.00 0.00 N ATOM 491 N3 DG B 16 -3.228 6.382 4.281 1.00 0.00 N ATOM 492 C4 DG B 16 -2.011 6.257 4.849 1.00 0.00 C ATOM 0 H5' DG B 16 -2.266 5.899 10.628 1.00 0.00 H new ATOM 0 H5'' DG B 16 -2.580 4.260 11.163 1.00 0.00 H new ATOM 0 H4' DG B 16 -4.164 4.790 9.535 1.00 0.00 H new ATOM 0 H3' DG B 16 -2.652 2.501 9.162 1.00 0.00 H new ATOM 0 H2' DG B 16 -1.215 3.383 7.415 1.00 0.00 H new ATOM 0 H2'' DG B 16 -2.541 2.749 6.461 1.00 0.00 H new ATOM 0 H1' DG B 16 -3.607 4.826 6.276 1.00 0.00 H new ATOM 0 H8 DG B 16 0.137 5.292 7.069 1.00 0.00 H new ATOM 0 H1 DG B 16 -2.103 8.129 1.758 1.00 0.00 H new ATOM 0 H21 DG B 16 -5.198 6.917 2.813 1.00 0.00 H new ATOM 0 H22 DG B 16 -4.288 7.824 1.600 1.00 0.00 H new ATOM 504 P DA B 17 -4.659 1.245 7.825 1.00 0.00 P ATOM 505 OP1 DA B 17 -5.425 0.626 8.936 1.00 0.00 O ATOM 506 OP2 DA B 17 -3.360 0.657 7.412 1.00 0.00 O ATOM 507 O5' DA B 17 -5.604 1.307 6.542 1.00 0.00 O ATOM 508 C5' DA B 17 -6.806 2.080 6.553 1.00 0.00 C ATOM 509 C4' DA B 17 -7.205 2.452 5.143 1.00 0.00 C ATOM 510 O4' DA B 17 -6.188 3.311 4.574 1.00 0.00 O ATOM 511 C3' DA B 17 -7.358 1.273 4.177 1.00 0.00 C ATOM 512 O3' DA B 17 -8.562 1.421 3.415 1.00 0.00 O ATOM 513 C2' DA B 17 -6.138 1.377 3.277 1.00 0.00 C ATOM 514 C1' DA B 17 -5.873 2.867 3.269 1.00 0.00 C ATOM 515 N9 DA B 17 -4.490 3.246 2.984 1.00 0.00 N ATOM 516 C8 DA B 17 -3.385 3.035 3.770 1.00 0.00 C ATOM 517 N7 DA B 17 -2.272 3.495 3.252 1.00 0.00 N ATOM 518 C5 DA B 17 -2.670 4.042 2.040 1.00 0.00 C ATOM 519 C6 DA B 17 -1.958 4.689 1.015 1.00 0.00 C ATOM 520 N6 DA B 17 -0.642 4.901 1.050 1.00 0.00 N ATOM 521 N1 DA B 17 -2.654 5.116 -0.061 1.00 0.00 N ATOM 522 C2 DA B 17 -3.976 4.902 -0.095 1.00 0.00 C ATOM 523 N3 DA B 17 -4.756 4.305 0.805 1.00 0.00 N ATOM 524 C4 DA B 17 -4.034 3.895 1.861 1.00 0.00 C ATOM 0 H5' DA B 17 -6.660 2.982 7.147 1.00 0.00 H new ATOM 0 H5'' DA B 17 -7.607 1.512 7.027 1.00 0.00 H new ATOM 0 H4' DA B 17 -8.180 2.927 5.245 1.00 0.00 H new ATOM 0 H3' DA B 17 -7.422 0.309 4.682 1.00 0.00 H new ATOM 0 H2' DA B 17 -5.292 0.815 3.672 1.00 0.00 H new ATOM 0 H2'' DA B 17 -6.336 0.993 2.276 1.00 0.00 H new ATOM 0 H1' DA B 17 -6.468 3.314 2.473 1.00 0.00 H new ATOM 0 H8 DA B 17 -3.428 2.536 4.727 1.00 0.00 H new ATOM 0 H61 DA B 17 -0.181 5.377 0.274 1.00 0.00 H new ATOM 0 H62 DA B 17 -0.096 4.587 1.852 1.00 0.00 H new ATOM 0 H2 DA B 17 -4.481 5.265 -0.978 1.00 0.00 H new ATOM 536 P DC B 18 -9.050 0.231 2.450 1.00 0.00 P ATOM 537 OP1 DC B 18 -10.504 0.409 2.204 1.00 0.00 O ATOM 538 OP2 DC B 18 -8.553 -1.048 3.016 1.00 0.00 O ATOM 539 O5' DC B 18 -8.273 0.501 1.085 1.00 0.00 O ATOM 540 C5' DC B 18 -8.505 1.691 0.329 1.00 0.00 C ATOM 541 C4' DC B 18 -7.732 1.648 -0.968 1.00 0.00 C ATOM 542 O4' DC B 18 -6.387 2.107 -0.734 1.00 0.00 O ATOM 543 C3' DC B 18 -7.568 0.262 -1.593 1.00 0.00 C ATOM 544 O3' DC B 18 -8.580 0.042 -2.585 1.00 0.00 O ATOM 545 C2' DC B 18 -6.190 0.312 -2.243 1.00 0.00 C ATOM 546 C1' DC B 18 -5.589 1.643 -1.802 1.00 0.00 C ATOM 547 N1 DC B 18 -4.195 1.557 -1.333 1.00 0.00 N ATOM 548 C2 DC B 18 -3.188 2.106 -2.127 1.00 0.00 C ATOM 549 O2 DC B 18 -3.499 2.663 -3.187 1.00 0.00 O ATOM 550 N3 DC B 18 -1.902 2.017 -1.721 1.00 0.00 N ATOM 551 C4 DC B 18 -1.606 1.412 -0.570 1.00 0.00 C ATOM 552 N4 DC B 18 -0.322 1.352 -0.212 1.00 0.00 N ATOM 553 C5 DC B 18 -2.614 0.844 0.264 1.00 0.00 C ATOM 554 C6 DC B 18 -3.885 0.940 -0.152 1.00 0.00 C ATOM 0 H5' DC B 18 -8.205 2.563 0.910 1.00 0.00 H new ATOM 0 H5'' DC B 18 -9.570 1.797 0.122 1.00 0.00 H new ATOM 0 H4' DC B 18 -8.318 2.268 -1.647 1.00 0.00 H new ATOM 0 H3' DC B 18 -7.661 -0.544 -0.865 1.00 0.00 H new ATOM 0 H2' DC B 18 -5.572 -0.526 -1.920 1.00 0.00 H new ATOM 0 H2'' DC B 18 -6.264 0.254 -3.329 1.00 0.00 H new ATOM 0 H1' DC B 18 -5.575 2.306 -2.667 1.00 0.00 H new ATOM 0 H41 DC B 18 -0.057 0.897 0.662 1.00 0.00 H new ATOM 0 H42 DC B 18 0.394 1.761 -0.812 1.00 0.00 H new ATOM 0 H5 DC B 18 -2.363 0.356 1.194 1.00 0.00 H new ATOM 0 H6 DC B 18 -4.676 0.524 0.454 1.00 0.00 H new ATOM 566 P DC B 19 -8.772 -1.424 -3.220 1.00 0.00 P ATOM 567 OP1 DC B 19 -9.850 -1.325 -4.237 1.00 0.00 O ATOM 568 OP2 DC B 19 -8.899 -2.400 -2.109 1.00 0.00 O ATOM 569 O5' DC B 19 -7.394 -1.703 -3.972 1.00 0.00 O ATOM 570 C5' DC B 19 -7.251 -1.458 -5.373 1.00 0.00 C ATOM 571 C4' DC B 19 -6.181 -2.352 -5.955 1.00 0.00 C ATOM 572 O4' DC B 19 -4.907 -1.681 -5.872 1.00 0.00 O ATOM 573 C3' DC B 19 -5.976 -3.678 -5.229 1.00 0.00 C ATOM 574 O3' DC B 19 -6.825 -4.682 -5.795 1.00 0.00 O ATOM 575 C2' DC B 19 -4.511 -3.994 -5.487 1.00 0.00 C ATOM 576 C1' DC B 19 -3.864 -2.641 -5.781 1.00 0.00 C ATOM 577 N1 DC B 19 -2.920 -2.176 -4.751 1.00 0.00 N ATOM 578 C2 DC B 19 -1.630 -1.808 -5.138 1.00 0.00 C ATOM 579 O2 DC B 19 -1.313 -1.897 -6.332 1.00 0.00 O ATOM 580 N3 DC B 19 -0.758 -1.366 -4.204 1.00 0.00 N ATOM 581 C4 DC B 19 -1.135 -1.288 -2.927 1.00 0.00 C ATOM 582 N4 DC B 19 -0.240 -0.853 -2.041 1.00 0.00 N ATOM 583 C5 DC B 19 -2.445 -1.658 -2.501 1.00 0.00 C ATOM 584 C6 DC B 19 -3.297 -2.094 -3.439 1.00 0.00 C ATOM 0 H5' DC B 19 -6.992 -0.413 -5.542 1.00 0.00 H new ATOM 0 H5'' DC B 19 -8.199 -1.638 -5.879 1.00 0.00 H new ATOM 0 H4' DC B 19 -6.523 -2.559 -6.969 1.00 0.00 H new ATOM 0 H3' DC B 19 -6.217 -3.637 -4.167 1.00 0.00 H new ATOM 0 H2' DC B 19 -4.052 -4.472 -4.622 1.00 0.00 H new ATOM 0 H2'' DC B 19 -4.396 -4.678 -6.328 1.00 0.00 H new ATOM 0 H1' DC B 19 -3.290 -2.759 -6.700 1.00 0.00 H new ATOM 0 H41 DC B 19 -0.492 -0.780 -1.055 1.00 0.00 H new ATOM 0 H42 DC B 19 0.697 -0.593 -2.348 1.00 0.00 H new ATOM 0 H5 DC B 19 -2.739 -1.590 -1.464 1.00 0.00 H new ATOM 0 H6 DC B 19 -4.297 -2.385 -3.154 1.00 0.00 H new ATOM 596 P DA B 20 -6.679 -6.213 -5.325 1.00 0.00 P ATOM 597 OP1 DA B 20 -7.958 -6.897 -5.644 1.00 0.00 O ATOM 598 OP2 DA B 20 -6.164 -6.234 -3.932 1.00 0.00 O ATOM 599 O5' DA B 20 -5.552 -6.805 -6.285 1.00 0.00 O ATOM 600 C5' DA B 20 -5.655 -6.680 -7.705 1.00 0.00 C ATOM 601 C4' DA B 20 -4.320 -6.964 -8.355 1.00 0.00 C ATOM 602 O4' DA B 20 -3.287 -6.240 -7.645 1.00 0.00 O ATOM 603 C3' DA B 20 -3.891 -8.430 -8.336 1.00 0.00 C ATOM 604 O3' DA B 20 -3.144 -8.747 -9.517 1.00 0.00 O ATOM 605 C2' DA B 20 -3.010 -8.521 -7.104 1.00 0.00 C ATOM 606 C1' DA B 20 -2.377 -7.140 -7.032 1.00 0.00 C ATOM 607 N9 DA B 20 -2.127 -6.667 -5.671 1.00 0.00 N ATOM 608 C8 DA B 20 -2.952 -6.790 -4.581 1.00 0.00 C ATOM 609 N7 DA B 20 -2.458 -6.274 -3.483 1.00 0.00 N ATOM 610 C5 DA B 20 -1.225 -5.773 -3.877 1.00 0.00 C ATOM 611 C6 DA B 20 -0.212 -5.103 -3.175 1.00 0.00 C ATOM 612 N6 DA B 20 -0.289 -4.806 -1.879 1.00 0.00 N ATOM 613 N1 DA B 20 0.896 -4.742 -3.857 1.00 0.00 N ATOM 614 C2 DA B 20 0.966 -5.033 -5.162 1.00 0.00 C ATOM 615 N3 DA B 20 0.076 -5.654 -5.936 1.00 0.00 N ATOM 616 C4 DA B 20 -1.009 -6.005 -5.223 1.00 0.00 C ATOM 0 H5' DA B 20 -5.987 -5.675 -7.965 1.00 0.00 H new ATOM 0 H5'' DA B 20 -6.406 -7.372 -8.084 1.00 0.00 H new ATOM 0 H4' DA B 20 -4.444 -6.661 -9.395 1.00 0.00 H new ATOM 0 H3' DA B 20 -4.731 -9.124 -8.311 1.00 0.00 H new ATOM 0 H2' DA B 20 -3.590 -8.746 -6.209 1.00 0.00 H new ATOM 0 H2'' DA B 20 -2.259 -9.305 -7.202 1.00 0.00 H new ATOM 0 H1' DA B 20 -1.407 -7.194 -7.526 1.00 0.00 H new ATOM 0 H8 DA B 20 -3.919 -7.268 -4.625 1.00 0.00 H new ATOM 0 H61 DA B 20 0.480 -4.317 -1.421 1.00 0.00 H new ATOM 0 H62 DA B 20 -1.117 -5.068 -1.344 1.00 0.00 H new ATOM 0 H2 DA B 20 1.873 -4.720 -5.658 1.00 0.00 H new ATOM 628 P DG B 21 -3.090 -10.266 -10.045 1.00 0.00 P ATOM 629 OP1 DG B 21 -3.256 -10.243 -11.521 1.00 0.00 O ATOM 630 OP2 DG B 21 -4.019 -11.080 -9.219 1.00 0.00 O ATOM 631 O5' DG B 21 -1.604 -10.735 -9.717 1.00 0.00 O ATOM 632 C5' DG B 21 -0.508 -10.342 -10.543 1.00 0.00 C ATOM 633 C4' DG B 21 0.779 -10.930 -10.016 1.00 0.00 C ATOM 634 O4' DG B 21 1.305 -10.063 -8.987 1.00 0.00 O ATOM 635 C3' DG B 21 0.637 -12.297 -9.355 1.00 0.00 C ATOM 636 O3' DG B 21 0.828 -13.340 -10.315 1.00 0.00 O ATOM 637 C2' DG B 21 1.754 -12.299 -8.327 1.00 0.00 C ATOM 638 C1' DG B 21 1.899 -10.830 -7.947 1.00 0.00 C ATOM 639 N9 DG B 21 1.248 -10.458 -6.694 1.00 0.00 N ATOM 640 C8 DG B 21 -0.069 -10.637 -6.349 1.00 0.00 C ATOM 641 N7 DG B 21 -0.355 -10.191 -5.156 1.00 0.00 N ATOM 642 C5 DG B 21 0.849 -9.687 -4.683 1.00 0.00 C ATOM 643 C6 DG B 21 1.166 -9.067 -3.446 1.00 0.00 C ATOM 644 O6 DG B 21 0.420 -8.833 -2.488 1.00 0.00 O ATOM 645 N1 DG B 21 2.506 -8.707 -3.384 1.00 0.00 N ATOM 646 C2 DG B 21 3.425 -8.917 -4.380 1.00 0.00 C ATOM 647 N2 DG B 21 4.667 -8.505 -4.129 1.00 0.00 N ATOM 648 N3 DG B 21 3.145 -9.490 -5.536 1.00 0.00 N ATOM 649 C4 DG B 21 1.848 -9.847 -5.620 1.00 0.00 C ATOM 0 H5' DG B 21 -0.435 -9.255 -10.570 1.00 0.00 H new ATOM 0 H5'' DG B 21 -0.677 -10.676 -11.567 1.00 0.00 H new ATOM 0 H4' DG B 21 1.419 -11.033 -10.893 1.00 0.00 H new ATOM 0 H3' DG B 21 -0.347 -12.467 -8.918 1.00 0.00 H new ATOM 0 H2' DG B 21 1.501 -12.913 -7.463 1.00 0.00 H new ATOM 0 H2'' DG B 21 2.679 -12.698 -8.742 1.00 0.00 H new ATOM 0 H1' DG B 21 2.964 -10.641 -7.811 1.00 0.00 H new ATOM 0 H8 DG B 21 -0.796 -11.101 -7.000 1.00 0.00 H new ATOM 0 H1 DG B 21 2.832 -8.251 -2.532 1.00 0.00 H new ATOM 0 H21 DG B 21 5.398 -8.632 -4.829 1.00 0.00 H new ATOM 0 H22 DG B 21 4.887 -8.063 -3.237 1.00 0.00 H new ATOM 661 P DA B 22 0.257 -14.813 -10.016 1.00 0.00 P ATOM 662 OP1 DA B 22 0.410 -15.605 -11.263 1.00 0.00 O ATOM 663 OP2 DA B 22 -1.083 -14.684 -9.390 1.00 0.00 O ATOM 664 O5' DA B 22 1.263 -15.400 -8.931 1.00 0.00 O ATOM 665 C5' DA B 22 2.660 -15.503 -9.205 1.00 0.00 C ATOM 666 C4' DA B 22 3.414 -15.865 -7.947 1.00 0.00 C ATOM 667 O4' DA B 22 3.541 -14.698 -7.103 1.00 0.00 O ATOM 668 C3' DA B 22 2.737 -16.903 -7.063 1.00 0.00 C ATOM 669 O3' DA B 22 3.063 -18.229 -7.495 1.00 0.00 O ATOM 670 C2' DA B 22 3.344 -16.608 -5.705 1.00 0.00 C ATOM 671 C1' DA B 22 3.494 -15.091 -5.732 1.00 0.00 C ATOM 672 N9 DA B 22 2.390 -14.375 -5.092 1.00 0.00 N ATOM 673 C8 DA B 22 1.095 -14.242 -5.528 1.00 0.00 C ATOM 674 N7 DA B 22 0.336 -13.538 -4.721 1.00 0.00 N ATOM 675 C5 DA B 22 1.190 -13.184 -3.686 1.00 0.00 C ATOM 676 C6 DA B 22 0.997 -12.434 -2.513 1.00 0.00 C ATOM 677 N6 DA B 22 -0.169 -11.885 -2.166 1.00 0.00 N ATOM 678 N1 DA B 22 2.058 -12.266 -1.694 1.00 0.00 N ATOM 679 C2 DA B 22 3.228 -12.821 -2.038 1.00 0.00 C ATOM 680 N3 DA B 22 3.531 -13.547 -3.109 1.00 0.00 N ATOM 681 C4 DA B 22 2.458 -13.692 -3.904 1.00 0.00 C ATOM 0 H5' DA B 22 3.031 -14.557 -9.600 1.00 0.00 H new ATOM 0 H5'' DA B 22 2.833 -16.259 -9.971 1.00 0.00 H new ATOM 0 H4' DA B 22 4.358 -16.268 -8.313 1.00 0.00 H new ATOM 0 H3' DA B 22 1.648 -16.853 -7.076 1.00 0.00 H new ATOM 0 H2' DA B 22 2.697 -16.937 -4.892 1.00 0.00 H new ATOM 0 H2'' DA B 22 4.303 -17.108 -5.572 1.00 0.00 H new ATOM 0 H1' DA B 22 4.396 -14.838 -5.176 1.00 0.00 H new ATOM 0 H8 DA B 22 0.734 -14.676 -6.449 1.00 0.00 H new ATOM 0 H61 DA B 22 -0.244 -11.351 -1.300 1.00 0.00 H new ATOM 0 H62 DA B 22 -0.985 -11.999 -2.767 1.00 0.00 H new ATOM 0 H2 DA B 22 4.041 -12.655 -1.346 1.00 0.00 H new ATOM 693 P DG B 23 1.929 -19.371 -7.493 1.00 0.00 P ATOM 694 OP1 DG B 23 2.222 -20.280 -8.628 1.00 0.00 O ATOM 695 OP2 DG B 23 0.593 -18.727 -7.396 1.00 0.00 O ATOM 696 O5' DG B 23 2.189 -20.175 -6.142 1.00 0.00 O ATOM 697 C5' DG B 23 3.516 -20.413 -5.668 1.00 0.00 C ATOM 698 C4' DG B 23 3.630 -20.014 -4.215 1.00 0.00 C ATOM 699 O4' DG B 23 3.064 -18.702 -4.046 1.00 0.00 O ATOM 700 C3' DG B 23 2.866 -20.906 -3.239 1.00 0.00 C ATOM 701 O3' DG B 23 3.741 -21.894 -2.684 1.00 0.00 O ATOM 702 C2' DG B 23 2.397 -19.948 -2.152 1.00 0.00 C ATOM 703 C1' DG B 23 2.664 -18.548 -2.699 1.00 0.00 C ATOM 704 N9 DG B 23 1.505 -17.661 -2.675 1.00 0.00 N ATOM 705 C8 DG B 23 0.569 -17.487 -3.665 1.00 0.00 C ATOM 706 N7 DG B 23 -0.356 -16.622 -3.353 1.00 0.00 N ATOM 707 C5 DG B 23 -0.010 -16.199 -2.076 1.00 0.00 C ATOM 708 C6 DG B 23 -0.641 -15.264 -1.214 1.00 0.00 C ATOM 709 O6 DG B 23 -1.666 -14.602 -1.412 1.00 0.00 O ATOM 710 N1 DG B 23 0.044 -15.134 -0.010 1.00 0.00 N ATOM 711 C2 DG B 23 1.191 -15.821 0.324 1.00 0.00 C ATOM 712 N2 DG B 23 1.720 -15.579 1.533 1.00 0.00 N ATOM 713 N3 DG B 23 1.785 -16.692 -0.472 1.00 0.00 N ATOM 714 C4 DG B 23 1.136 -16.830 -1.646 1.00 0.00 C ATOM 0 H5' DG B 23 4.231 -19.847 -6.265 1.00 0.00 H new ATOM 0 H5'' DG B 23 3.768 -21.467 -5.784 1.00 0.00 H new ATOM 0 H4' DG B 23 4.694 -20.084 -3.990 1.00 0.00 H new ATOM 0 H3' DG B 23 2.043 -21.442 -3.712 1.00 0.00 H new ATOM 0 H2' DG B 23 1.338 -20.089 -1.935 1.00 0.00 H new ATOM 0 H2'' DG B 23 2.939 -20.115 -1.221 1.00 0.00 H new ATOM 0 H1' DG B 23 3.419 -18.087 -2.062 1.00 0.00 H new ATOM 0 H8 DG B 23 0.596 -18.014 -4.607 1.00 0.00 H new ATOM 0 H1 DG B 23 -0.331 -14.481 0.678 1.00 0.00 H new ATOM 0 H21 DG B 23 2.569 -16.064 1.825 1.00 0.00 H new ATOM 0 H22 DG B 23 1.273 -14.910 2.160 1.00 0.00 H new ATOM 726 P DG B 24 3.313 -23.446 -2.698 1.00 0.00 P ATOM 727 OP1 DG B 24 4.271 -24.183 -3.558 1.00 0.00 O ATOM 728 OP2 DG B 24 1.857 -23.524 -2.986 1.00 0.00 O ATOM 729 O5' DG B 24 3.530 -23.919 -1.191 1.00 0.00 O ATOM 730 C5' DG B 24 4.720 -23.579 -0.474 1.00 0.00 C ATOM 731 C4' DG B 24 4.466 -23.628 1.015 1.00 0.00 C ATOM 732 O4' DG B 24 4.113 -22.299 1.471 1.00 0.00 O ATOM 733 C3' DG B 24 3.314 -24.538 1.447 1.00 0.00 C ATOM 734 O3' DG B 24 3.808 -25.811 1.870 1.00 0.00 O ATOM 735 C2' DG B 24 2.700 -23.791 2.617 1.00 0.00 C ATOM 736 C1' DG B 24 2.912 -22.339 2.227 1.00 0.00 C ATOM 737 N9 DG B 24 1.849 -21.768 1.407 1.00 0.00 N ATOM 738 C8 DG B 24 1.555 -22.079 0.103 1.00 0.00 C ATOM 739 N7 DG B 24 0.550 -21.399 -0.377 1.00 0.00 N ATOM 740 C5 DG B 24 0.153 -20.589 0.679 1.00 0.00 C ATOM 741 C6 DG B 24 -0.891 -19.634 0.761 1.00 0.00 C ATOM 742 O6 DG B 24 -1.699 -19.299 -0.113 1.00 0.00 O ATOM 743 N1 DG B 24 -0.946 -19.043 2.018 1.00 0.00 N ATOM 744 C2 DG B 24 -0.105 -19.332 3.061 1.00 0.00 C ATOM 745 N2 DG B 24 -0.322 -18.653 4.190 1.00 0.00 N ATOM 746 N3 DG B 24 0.872 -20.220 3.002 1.00 0.00 N ATOM 747 C4 DG B 24 0.944 -20.807 1.788 1.00 0.00 C ATOM 0 H5' DG B 24 5.053 -22.581 -0.761 1.00 0.00 H new ATOM 0 H5'' DG B 24 5.521 -24.270 -0.736 1.00 0.00 H new ATOM 0 H4' DG B 24 5.386 -24.022 1.446 1.00 0.00 H new ATOM 0 H3' DG B 24 2.604 -24.739 0.645 1.00 0.00 H new ATOM 0 H2' DG B 24 1.643 -24.028 2.740 1.00 0.00 H new ATOM 0 H2'' DG B 24 3.193 -24.035 3.558 1.00 0.00 H new ATOM 0 HO3' DG B 24 3.058 -26.379 2.144 1.00 0.00 H new ATOM 0 H1' DG B 24 2.936 -21.751 3.145 1.00 0.00 H new ATOM 0 H8 DG B 24 2.101 -22.814 -0.469 1.00 0.00 H new ATOM 0 H1 DG B 24 -1.668 -18.340 2.176 1.00 0.00 H new ATOM 0 H21 DG B 24 0.267 -18.819 5.006 1.00 0.00 H new ATOM 0 H22 DG B 24 -1.077 -17.969 4.236 1.00 0.00 H new TER 760 DG B 24 HETATM 761 PT 1PT A 13 5.251 0.765 -1.460 1.00 0.00 PT HETATM 762 N1 1PT A 13 5.079 2.501 -0.431 1.00 0.00 N HETATM 763 N2 1PT A 13 5.944 -0.008 0.281 1.00 0.00 N HETATM 764 C1 1PT A 13 5.167 2.183 1.076 1.00 0.00 C HETATM 765 C2 1PT A 13 6.268 1.151 1.245 1.00 0.00 C HETATM 766 C3 1PT A 13 6.374 0.714 2.668 1.00 0.00 C HETATM 767 C4 1PT A 13 6.705 1.932 3.607 1.00 0.00 C HETATM 768 C5 1PT A 13 5.550 3.028 3.373 1.00 0.00 C HETATM 769 C6 1PT A 13 5.431 3.401 1.913 1.00 0.00 C HETATM 0 H62 1PT A 13 6.349 3.886 1.580 1.00 0.00 H new HETATM 0 H61 1PT A 13 4.624 4.122 1.781 1.00 0.00 H new HETATM 0 H52 1PT A 13 4.597 2.636 3.729 1.00 0.00 H new HETATM 0 H51 1PT A 13 5.768 3.919 3.961 1.00 0.00 H new HETATM 0 H42 1PT A 13 6.735 1.619 4.651 1.00 0.00 H new HETATM 0 H41 1PT A 13 7.685 2.347 3.371 1.00 0.00 H new HETATM 0 H32 1PT A 13 5.438 0.252 2.981 1.00 0.00 H new HETATM 0 H31 1PT A 13 7.151 -0.045 2.763 1.00 0.00 H new HETATM 0 H2 1PT A 13 7.246 1.564 0.999 1.00 0.00 H new HETATM 0 H1 1PT A 13 4.209 1.799 1.426 1.00 0.00 H new