USER MOD reduce.3.24.130724 H: found=0, std=0, add=400, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 401 hydrogens (129 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: B 26 NBU H41 : B 26 NBU C4 : B 27 CCI CAN :(H bumps) USER MOD NoAdj-H: B 26 NBU H13 : B 26 NBU C1 : B 25 CCI O4D :(H bumps) USER MOD NoAdj-H: B 27 CCIHAN1 : B 27 CCI CAN : B 26 NBU C4 :(H bumps) USER MOD Single : A 1 DG O5' : rot 27:sc= 0.156 USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.0637 (180deg=-0.0637) USER MOD Single : A 7 DT C7 :methyl 150:sc= -0.0213 (180deg=-0.0213) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 29:sc= 0.111 USER MOD Single : B 22 DT C7 :methyl 150:sc= -0.384 (180deg=-0.384) USER MOD Single : B 24 DC O3' : rot 180:sc= 0 USER MOD Single : B 25 CCI O2D : rot 158:sc= -0.347 USER MOD Single : B 25 CCI O3A : rot -90:sc= 1.23 USER MOD Single : B 25 CCI O3B : rot 151:sc= 1.3 USER MOD Single : B 27 CCI O2D : rot 137:sc= 1.02 USER MOD Single : B 27 CCI O3A : rot -33:sc= 0.00403 USER MOD Single : B 27 CCI O3B : rot 63:sc= 1.04 USER MOD Single : B 27 CCI O4D : rot -25:sc=0.000627 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -6.684 16.312 3.126 1.00 0.00 O ATOM 2 C5' DG A 1 -7.456 16.691 4.240 1.00 0.00 C ATOM 3 C4' DG A 1 -8.529 15.624 4.449 1.00 0.00 C ATOM 4 O4' DG A 1 -9.192 15.381 3.221 1.00 0.00 O ATOM 5 C3' DG A 1 -7.974 14.284 4.966 1.00 0.00 C ATOM 6 O3' DG A 1 -8.757 13.943 6.099 1.00 0.00 O ATOM 7 C2' DG A 1 -8.220 13.382 3.759 1.00 0.00 C ATOM 8 C1' DG A 1 -9.489 14.003 3.188 1.00 0.00 C ATOM 9 N9 DG A 1 -9.849 13.587 1.815 1.00 0.00 N ATOM 10 C8 DG A 1 -9.042 13.434 0.718 1.00 0.00 C ATOM 11 N7 DG A 1 -9.680 13.327 -0.411 1.00 0.00 N ATOM 12 C5 DG A 1 -11.017 13.334 -0.028 1.00 0.00 C ATOM 13 C6 DG A 1 -12.201 13.218 -0.810 1.00 0.00 C ATOM 14 O6 DG A 1 -12.316 13.306 -2.030 1.00 0.00 O ATOM 15 N1 DG A 1 -13.332 12.998 -0.041 1.00 0.00 N ATOM 16 C2 DG A 1 -13.351 13.051 1.331 1.00 0.00 C ATOM 17 N2 DG A 1 -14.498 12.810 1.955 1.00 0.00 N ATOM 18 N3 DG A 1 -12.266 13.299 2.075 1.00 0.00 N ATOM 19 C4 DG A 1 -11.128 13.407 1.338 1.00 0.00 C ATOM 0 H5' DG A 1 -7.914 17.666 4.073 1.00 0.00 H new ATOM 0 H5'' DG A 1 -6.829 16.781 5.127 1.00 0.00 H new ATOM 0 H4' DG A 1 -9.206 16.015 5.209 1.00 0.00 H new ATOM 0 H3' DG A 1 -6.932 14.246 5.284 1.00 0.00 H new ATOM 0 H2' DG A 1 -7.393 13.407 3.050 1.00 0.00 H new ATOM 0 H2'' DG A 1 -8.363 12.340 4.045 1.00 0.00 H new ATOM 0 HO5' DG A 1 -7.228 15.765 2.522 1.00 0.00 H new ATOM 0 H1' DG A 1 -10.359 13.689 3.765 1.00 0.00 H new ATOM 0 H8 DG A 1 -7.964 13.405 0.785 1.00 0.00 H new ATOM 0 H1 DG A 1 -14.205 12.783 -0.524 1.00 0.00 H new ATOM 0 H21 DG A 1 -14.541 12.843 2.974 1.00 0.00 H new ATOM 0 H22 DG A 1 -15.336 12.592 1.416 1.00 0.00 H new ATOM 32 P DC A 2 -8.535 12.616 6.990 1.00 0.00 P ATOM 33 OP1 DC A 2 -8.365 13.017 8.404 1.00 0.00 O ATOM 34 OP2 DC A 2 -7.524 11.752 6.338 1.00 0.00 O ATOM 35 O5' DC A 2 -9.979 11.919 6.824 1.00 0.00 O ATOM 36 C5' DC A 2 -11.148 12.553 7.314 1.00 0.00 C ATOM 37 C4' DC A 2 -12.404 11.847 6.789 1.00 0.00 C ATOM 38 O4' DC A 2 -12.365 11.849 5.373 1.00 0.00 O ATOM 39 C3' DC A 2 -12.515 10.398 7.273 1.00 0.00 C ATOM 40 O3' DC A 2 -13.816 10.178 7.799 1.00 0.00 O ATOM 41 C2' DC A 2 -12.269 9.594 6.004 1.00 0.00 C ATOM 42 C1' DC A 2 -12.665 10.558 4.889 1.00 0.00 C ATOM 43 N1 DC A 2 -11.877 10.326 3.650 1.00 0.00 N ATOM 44 C2 DC A 2 -12.530 10.017 2.461 1.00 0.00 C ATOM 45 O2 DC A 2 -13.727 9.742 2.437 1.00 0.00 O ATOM 46 N3 DC A 2 -11.826 10.015 1.294 1.00 0.00 N ATOM 47 C4 DC A 2 -10.507 10.239 1.300 1.00 0.00 C ATOM 48 N4 DC A 2 -9.860 10.325 0.145 1.00 0.00 N ATOM 49 C5 DC A 2 -9.795 10.493 2.513 1.00 0.00 C ATOM 50 C6 DC A 2 -10.524 10.536 3.652 1.00 0.00 C ATOM 0 H5' DC A 2 -11.157 13.599 7.007 1.00 0.00 H new ATOM 0 H5'' DC A 2 -11.146 12.540 8.404 1.00 0.00 H new ATOM 0 H4' DC A 2 -13.270 12.388 7.171 1.00 0.00 H new ATOM 0 H3' DC A 2 -11.819 10.130 8.068 1.00 0.00 H new ATOM 0 H2' DC A 2 -11.226 9.288 5.919 1.00 0.00 H new ATOM 0 H2'' DC A 2 -12.871 8.685 5.982 1.00 0.00 H new ATOM 0 H1' DC A 2 -13.717 10.424 4.637 1.00 0.00 H new ATOM 0 H41 DC A 2 -8.854 10.496 0.135 1.00 0.00 H new ATOM 0 H42 DC A 2 -10.368 10.221 -0.733 1.00 0.00 H new ATOM 0 H5 DC A 2 -8.726 10.644 2.520 1.00 0.00 H new ATOM 0 H6 DC A 2 -10.025 10.741 4.588 1.00 0.00 H new ATOM 62 P DA A 3 -14.183 8.867 8.669 1.00 0.00 P ATOM 63 OP1 DA A 3 -15.419 9.152 9.435 1.00 0.00 O ATOM 64 OP2 DA A 3 -12.966 8.419 9.382 1.00 0.00 O ATOM 65 O5' DA A 3 -14.537 7.764 7.547 1.00 0.00 O ATOM 66 C5' DA A 3 -15.799 7.757 6.907 1.00 0.00 C ATOM 67 C4' DA A 3 -15.837 6.704 5.796 1.00 0.00 C ATOM 68 O4' DA A 3 -15.018 7.110 4.708 1.00 0.00 O ATOM 69 C3' DA A 3 -15.358 5.314 6.250 1.00 0.00 C ATOM 70 O3' DA A 3 -16.367 4.370 5.929 1.00 0.00 O ATOM 71 C2' DA A 3 -14.065 5.160 5.446 1.00 0.00 C ATOM 72 C1' DA A 3 -14.379 5.961 4.189 1.00 0.00 C ATOM 73 N9 DA A 3 -13.161 6.347 3.447 1.00 0.00 N ATOM 74 C8 DA A 3 -11.997 6.857 3.965 1.00 0.00 C ATOM 75 N7 DA A 3 -11.098 7.170 3.078 1.00 0.00 N ATOM 76 C5 DA A 3 -11.715 6.823 1.881 1.00 0.00 C ATOM 77 C6 DA A 3 -11.277 6.872 0.555 1.00 0.00 C ATOM 78 N6 DA A 3 -10.052 7.303 0.304 1.00 0.00 N ATOM 79 N1 DA A 3 -12.074 6.439 -0.442 1.00 0.00 N ATOM 80 C2 DA A 3 -13.261 5.949 -0.096 1.00 0.00 C ATOM 81 N3 DA A 3 -13.794 5.829 1.119 1.00 0.00 N ATOM 82 C4 DA A 3 -12.962 6.304 2.084 1.00 0.00 C ATOM 0 H5' DA A 3 -16.005 8.742 6.488 1.00 0.00 H new ATOM 0 H5'' DA A 3 -16.581 7.551 7.637 1.00 0.00 H new ATOM 0 H4' DA A 3 -16.884 6.624 5.503 1.00 0.00 H new ATOM 0 H3' DA A 3 -15.177 5.174 7.316 1.00 0.00 H new ATOM 0 H2' DA A 3 -13.202 5.559 5.980 1.00 0.00 H new ATOM 0 H2'' DA A 3 -13.846 4.116 5.221 1.00 0.00 H new ATOM 0 H1' DA A 3 -14.977 5.394 3.475 1.00 0.00 H new ATOM 0 H8 DA A 3 -11.840 6.988 5.025 1.00 0.00 H new ATOM 0 H61 DA A 3 -9.714 7.346 -0.657 1.00 0.00 H new ATOM 0 H62 DA A 3 -9.446 7.592 1.072 1.00 0.00 H new ATOM 0 H2 DA A 3 -13.877 5.601 -0.912 1.00 0.00 H new ATOM 94 P DC A 4 -16.181 2.785 6.136 1.00 0.00 P ATOM 95 OP1 DC A 4 -17.504 2.174 6.418 1.00 0.00 O ATOM 96 OP2 DC A 4 -15.045 2.543 7.049 1.00 0.00 O ATOM 97 O5' DC A 4 -15.751 2.346 4.654 1.00 0.00 O ATOM 98 C5' DC A 4 -16.655 2.508 3.577 1.00 0.00 C ATOM 99 C4' DC A 4 -16.053 1.957 2.289 1.00 0.00 C ATOM 100 O4' DC A 4 -14.920 2.716 1.927 1.00 0.00 O ATOM 101 C3' DC A 4 -15.622 0.492 2.443 1.00 0.00 C ATOM 102 O3' DC A 4 -16.216 -0.255 1.404 1.00 0.00 O ATOM 103 C2' DC A 4 -14.103 0.587 2.335 1.00 0.00 C ATOM 104 C1' DC A 4 -13.914 1.836 1.476 1.00 0.00 C ATOM 105 N1 DC A 4 -12.601 2.500 1.679 1.00 0.00 N ATOM 106 C2 DC A 4 -11.815 2.851 0.577 1.00 0.00 C ATOM 107 O2 DC A 4 -12.115 2.522 -0.568 1.00 0.00 O ATOM 108 N3 DC A 4 -10.674 3.572 0.780 1.00 0.00 N ATOM 109 C4 DC A 4 -10.326 3.941 2.019 1.00 0.00 C ATOM 110 N4 DC A 4 -9.252 4.698 2.183 1.00 0.00 N ATOM 111 C5 DC A 4 -11.152 3.664 3.153 1.00 0.00 C ATOM 112 C6 DC A 4 -12.268 2.943 2.928 1.00 0.00 C ATOM 0 H5' DC A 4 -16.895 3.564 3.451 1.00 0.00 H new ATOM 0 H5'' DC A 4 -17.590 1.993 3.798 1.00 0.00 H new ATOM 0 H4' DC A 4 -16.823 2.019 1.520 1.00 0.00 H new ATOM 0 H3' DC A 4 -15.921 -0.004 3.367 1.00 0.00 H new ATOM 0 H2' DC A 4 -13.632 0.691 3.312 1.00 0.00 H new ATOM 0 H2'' DC A 4 -13.673 -0.298 1.866 1.00 0.00 H new ATOM 0 H1' DC A 4 -13.963 1.573 0.419 1.00 0.00 H new ATOM 0 H41 DC A 4 -8.971 4.989 3.119 1.00 0.00 H new ATOM 0 H42 DC A 4 -8.705 4.990 1.373 1.00 0.00 H new ATOM 0 H5 DC A 4 -10.894 4.015 4.141 1.00 0.00 H new ATOM 0 H6 DC A 4 -12.918 2.709 3.758 1.00 0.00 H new ATOM 124 P DC A 5 -15.996 -1.836 1.227 1.00 0.00 P ATOM 125 OP1 DC A 5 -17.262 -2.412 0.724 1.00 0.00 O ATOM 126 OP2 DC A 5 -15.381 -2.372 2.463 1.00 0.00 O ATOM 127 O5' DC A 5 -14.901 -1.860 0.052 1.00 0.00 O ATOM 128 C5' DC A 5 -15.216 -1.349 -1.231 1.00 0.00 C ATOM 129 C4' DC A 5 -13.979 -1.346 -2.130 1.00 0.00 C ATOM 130 O4' DC A 5 -13.001 -0.477 -1.587 1.00 0.00 O ATOM 131 C3' DC A 5 -13.351 -2.734 -2.294 1.00 0.00 C ATOM 132 O3' DC A 5 -13.359 -3.089 -3.665 1.00 0.00 O ATOM 133 C2' DC A 5 -11.949 -2.538 -1.719 1.00 0.00 C ATOM 134 C1' DC A 5 -11.723 -1.030 -1.817 1.00 0.00 C ATOM 135 N1 DC A 5 -10.813 -0.519 -0.758 1.00 0.00 N ATOM 136 C2 DC A 5 -9.669 0.207 -1.096 1.00 0.00 C ATOM 137 O2 DC A 5 -9.285 0.315 -2.258 1.00 0.00 O ATOM 138 N3 DC A 5 -8.936 0.789 -0.103 1.00 0.00 N ATOM 139 C4 DC A 5 -9.310 0.663 1.177 1.00 0.00 C ATOM 140 N4 DC A 5 -8.589 1.251 2.122 1.00 0.00 N ATOM 141 C5 DC A 5 -10.464 -0.090 1.553 1.00 0.00 C ATOM 142 C6 DC A 5 -11.175 -0.658 0.555 1.00 0.00 C ATOM 0 H5' DC A 5 -15.607 -0.336 -1.138 1.00 0.00 H new ATOM 0 H5'' DC A 5 -16.001 -1.953 -1.686 1.00 0.00 H new ATOM 0 H4' DC A 5 -14.310 -1.011 -3.113 1.00 0.00 H new ATOM 0 H3' DC A 5 -13.873 -3.548 -1.790 1.00 0.00 H new ATOM 0 H2' DC A 5 -11.887 -2.886 -0.688 1.00 0.00 H new ATOM 0 H2'' DC A 5 -11.202 -3.092 -2.288 1.00 0.00 H new ATOM 0 H1' DC A 5 -11.272 -0.773 -2.776 1.00 0.00 H new ATOM 0 H41 DC A 5 -8.862 1.163 3.101 1.00 0.00 H new ATOM 0 H42 DC A 5 -7.761 1.791 1.870 1.00 0.00 H new ATOM 0 H5 DC A 5 -10.755 -0.200 2.587 1.00 0.00 H new ATOM 0 H6 DC A 5 -12.053 -1.238 0.799 1.00 0.00 H new ATOM 154 P DT A 6 -12.897 -4.547 -4.188 1.00 0.00 P ATOM 155 OP1 DT A 6 -13.493 -4.774 -5.521 1.00 0.00 O ATOM 156 OP2 DT A 6 -13.112 -5.528 -3.102 1.00 0.00 O ATOM 157 O5' DT A 6 -11.315 -4.339 -4.375 1.00 0.00 O ATOM 158 C5' DT A 6 -10.818 -3.484 -5.384 1.00 0.00 C ATOM 159 C4' DT A 6 -9.321 -3.243 -5.193 1.00 0.00 C ATOM 160 O4' DT A 6 -9.069 -2.547 -3.985 1.00 0.00 O ATOM 161 C3' DT A 6 -8.473 -4.523 -5.187 1.00 0.00 C ATOM 162 O3' DT A 6 -7.628 -4.523 -6.326 1.00 0.00 O ATOM 163 C2' DT A 6 -7.708 -4.401 -3.873 1.00 0.00 C ATOM 164 C1' DT A 6 -7.774 -2.909 -3.556 1.00 0.00 C ATOM 165 N1 DT A 6 -7.612 -2.606 -2.110 1.00 0.00 N ATOM 166 C2 DT A 6 -6.595 -1.744 -1.708 1.00 0.00 C ATOM 167 O2 DT A 6 -5.779 -1.248 -2.478 1.00 0.00 O ATOM 168 N3 DT A 6 -6.528 -1.471 -0.357 1.00 0.00 N ATOM 169 C4 DT A 6 -7.374 -1.945 0.618 1.00 0.00 C ATOM 170 C5 DT A 6 -8.388 -2.861 0.130 1.00 0.00 C ATOM 171 C6 DT A 6 -8.476 -3.148 -1.192 1.00 0.00 C ATOM 172 O4 DT A 6 -7.240 -1.572 1.782 1.00 0.00 O ATOM 185 C7 DT A 6 -9.320 -3.534 1.121 1.00 0.00 C ATOM 0 H5' DT A 6 -11.351 -2.534 -5.359 1.00 0.00 H new ATOM 0 H5'' DT A 6 -10.999 -3.925 -6.364 1.00 0.00 H new ATOM 0 H4' DT A 6 -9.026 -2.651 -6.059 1.00 0.00 H new ATOM 0 H3' DT A 6 -9.031 -5.458 -5.243 1.00 0.00 H new ATOM 0 H2' DT A 6 -8.166 -4.999 -3.085 1.00 0.00 H new ATOM 0 H2'' DT A 6 -6.678 -4.744 -3.975 1.00 0.00 H new ATOM 0 H1' DT A 6 -6.966 -2.363 -4.043 1.00 0.00 H new ATOM 0 H3 DT A 6 -5.775 -0.855 -0.051 1.00 0.00 H new ATOM 0 H71 DT A 6 -10.281 -3.728 0.643 1.00 0.00 H new ATOM 0 H72 DT A 6 -8.882 -4.476 1.450 1.00 0.00 H new ATOM 0 H73 DT A 6 -9.468 -2.882 1.982 1.00 0.00 H new ATOM 0 H6 DT A 6 -9.248 -3.822 -1.532 1.00 0.00 H new ATOM 186 P DT A 7 -6.636 -5.750 -6.673 1.00 0.00 P ATOM 187 OP1 DT A 7 -6.424 -5.773 -8.137 1.00 0.00 O ATOM 188 OP2 DT A 7 -7.112 -6.962 -5.973 1.00 0.00 O ATOM 189 O5' DT A 7 -5.262 -5.271 -5.981 1.00 0.00 O ATOM 190 C5' DT A 7 -4.571 -4.137 -6.467 1.00 0.00 C ATOM 191 C4' DT A 7 -3.390 -3.794 -5.562 1.00 0.00 C ATOM 192 O4' DT A 7 -3.875 -3.476 -4.270 1.00 0.00 O ATOM 193 C3' DT A 7 -2.392 -4.954 -5.420 1.00 0.00 C ATOM 194 O3' DT A 7 -1.094 -4.493 -5.764 1.00 0.00 O ATOM 195 C2' DT A 7 -2.521 -5.310 -3.943 1.00 0.00 C ATOM 196 C1' DT A 7 -2.957 -3.980 -3.328 1.00 0.00 C ATOM 197 N1 DT A 7 -3.625 -4.120 -2.008 1.00 0.00 N ATOM 198 C2 DT A 7 -3.159 -3.363 -0.936 1.00 0.00 C ATOM 199 O2 DT A 7 -2.172 -2.634 -0.988 1.00 0.00 O ATOM 200 N3 DT A 7 -3.869 -3.484 0.239 1.00 0.00 N ATOM 201 C4 DT A 7 -4.976 -4.270 0.456 1.00 0.00 C ATOM 202 C5 DT A 7 -5.368 -5.075 -0.687 1.00 0.00 C ATOM 203 C6 DT A 7 -4.702 -4.960 -1.863 1.00 0.00 C ATOM 204 O4 DT A 7 -5.558 -4.223 1.536 1.00 0.00 O ATOM 217 C7 DT A 7 -6.496 -6.083 -0.555 1.00 0.00 C ATOM 0 H5' DT A 7 -5.251 -3.287 -6.523 1.00 0.00 H new ATOM 0 H5'' DT A 7 -4.216 -4.328 -7.480 1.00 0.00 H new ATOM 0 H4' DT A 7 -2.870 -2.953 -6.021 1.00 0.00 H new ATOM 0 H3' DT A 7 -2.575 -5.814 -6.064 1.00 0.00 H new ATOM 0 H2' DT A 7 -3.257 -6.096 -3.776 1.00 0.00 H new ATOM 0 H2'' DT A 7 -1.578 -5.662 -3.525 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.096 -3.340 -3.135 1.00 0.00 H new ATOM 0 H3 DT A 7 -3.538 -2.932 1.031 1.00 0.00 H new ATOM 0 H71 DT A 7 -7.001 -6.192 -1.515 1.00 0.00 H new ATOM 0 H72 DT A 7 -6.089 -7.046 -0.247 1.00 0.00 H new ATOM 0 H73 DT A 7 -7.209 -5.735 0.192 1.00 0.00 H new ATOM 0 H6 DT A 7 -5.028 -5.546 -2.710 1.00 0.00 H new ATOM 218 P DC A 8 0.175 -5.482 -5.855 1.00 0.00 P ATOM 219 OP1 DC A 8 1.032 -5.004 -6.967 1.00 0.00 O ATOM 220 OP2 DC A 8 -0.313 -6.878 -5.859 1.00 0.00 O ATOM 221 O5' DC A 8 0.947 -5.224 -4.465 1.00 0.00 O ATOM 222 C5' DC A 8 1.640 -4.012 -4.223 1.00 0.00 C ATOM 223 C4' DC A 8 2.210 -3.992 -2.801 1.00 0.00 C ATOM 224 O4' DC A 8 1.145 -4.034 -1.872 1.00 0.00 O ATOM 225 C3' DC A 8 3.149 -5.168 -2.510 1.00 0.00 C ATOM 226 O3' DC A 8 4.388 -4.655 -2.054 1.00 0.00 O ATOM 227 C2' DC A 8 2.381 -5.938 -1.441 1.00 0.00 C ATOM 228 C1' DC A 8 1.530 -4.848 -0.785 1.00 0.00 C ATOM 229 N1 DC A 8 0.295 -5.370 -0.141 1.00 0.00 N ATOM 230 C2 DC A 8 -0.009 -5.029 1.175 1.00 0.00 C ATOM 231 O2 DC A 8 0.772 -4.383 1.868 1.00 0.00 O ATOM 232 N3 DC A 8 -1.193 -5.443 1.715 1.00 0.00 N ATOM 233 C4 DC A 8 -2.051 -6.163 0.984 1.00 0.00 C ATOM 234 N4 DC A 8 -3.186 -6.576 1.527 1.00 0.00 N ATOM 235 C5 DC A 8 -1.780 -6.498 -0.378 1.00 0.00 C ATOM 236 C6 DC A 8 -0.603 -6.078 -0.887 1.00 0.00 C ATOM 0 H5' DC A 8 0.966 -3.167 -4.362 1.00 0.00 H new ATOM 0 H5'' DC A 8 2.448 -3.898 -4.946 1.00 0.00 H new ATOM 0 H4' DC A 8 2.791 -3.074 -2.709 1.00 0.00 H new ATOM 0 H3' DC A 8 3.395 -5.805 -3.360 1.00 0.00 H new ATOM 0 H2' DC A 8 1.765 -6.726 -1.874 1.00 0.00 H new ATOM 0 H2'' DC A 8 3.051 -6.414 -0.725 1.00 0.00 H new ATOM 0 H1' DC A 8 2.093 -4.348 0.003 1.00 0.00 H new ATOM 0 H41 DC A 8 -3.845 -7.125 0.975 1.00 0.00 H new ATOM 0 H42 DC A 8 -3.401 -6.345 2.497 1.00 0.00 H new ATOM 0 H5 DC A 8 -2.484 -7.061 -0.972 1.00 0.00 H new ATOM 0 H6 DC A 8 -0.364 -6.309 -1.915 1.00 0.00 H new ATOM 248 P DC A 9 5.641 -5.600 -1.666 1.00 0.00 P ATOM 249 OP1 DC A 9 6.884 -4.905 -2.063 1.00 0.00 O ATOM 250 OP2 DC A 9 5.374 -6.970 -2.157 1.00 0.00 O ATOM 251 O5' DC A 9 5.552 -5.609 -0.058 1.00 0.00 O ATOM 252 C5' DC A 9 5.849 -4.439 0.678 1.00 0.00 C ATOM 253 C4' DC A 9 5.563 -4.634 2.169 1.00 0.00 C ATOM 254 O4' DC A 9 4.200 -4.972 2.332 1.00 0.00 O ATOM 255 C3' DC A 9 6.419 -5.737 2.806 1.00 0.00 C ATOM 256 O3' DC A 9 7.173 -5.172 3.867 1.00 0.00 O ATOM 257 C2' DC A 9 5.371 -6.749 3.268 1.00 0.00 C ATOM 258 C1' DC A 9 4.085 -5.926 3.366 1.00 0.00 C ATOM 259 N1 DC A 9 2.871 -6.741 3.098 1.00 0.00 N ATOM 260 C2 DC A 9 1.831 -6.786 4.026 1.00 0.00 C ATOM 261 O2 DC A 9 1.925 -6.274 5.139 1.00 0.00 O ATOM 262 N3 DC A 9 0.684 -7.447 3.700 1.00 0.00 N ATOM 263 C4 DC A 9 0.565 -8.056 2.515 1.00 0.00 C ATOM 264 N4 DC A 9 -0.566 -8.685 2.228 1.00 0.00 N ATOM 265 C5 DC A 9 1.617 -8.035 1.549 1.00 0.00 C ATOM 266 C6 DC A 9 2.742 -7.365 1.888 1.00 0.00 C ATOM 0 H5' DC A 9 5.257 -3.607 0.297 1.00 0.00 H new ATOM 0 H5'' DC A 9 6.897 -4.175 0.538 1.00 0.00 H new ATOM 0 H4' DC A 9 5.810 -3.698 2.669 1.00 0.00 H new ATOM 0 H3' DC A 9 7.153 -6.206 2.151 1.00 0.00 H new ATOM 0 H2' DC A 9 5.267 -7.570 2.558 1.00 0.00 H new ATOM 0 H2'' DC A 9 5.637 -7.190 4.228 1.00 0.00 H new ATOM 0 H1' DC A 9 3.977 -5.506 4.366 1.00 0.00 H new ATOM 0 H41 DC A 9 -0.674 -9.155 1.329 1.00 0.00 H new ATOM 0 H42 DC A 9 -1.328 -8.699 2.906 1.00 0.00 H new ATOM 0 H5 DC A 9 1.519 -8.530 0.594 1.00 0.00 H new ATOM 0 H6 DC A 9 3.560 -7.322 1.184 1.00 0.00 H new ATOM 278 P DT A 10 8.250 -6.024 4.718 1.00 0.00 P ATOM 279 OP1 DT A 10 9.239 -5.086 5.291 1.00 0.00 O ATOM 280 OP2 DT A 10 8.702 -7.172 3.901 1.00 0.00 O ATOM 281 O5' DT A 10 7.334 -6.583 5.914 1.00 0.00 O ATOM 282 C5' DT A 10 6.767 -5.691 6.855 1.00 0.00 C ATOM 283 C4' DT A 10 5.722 -6.406 7.710 1.00 0.00 C ATOM 284 O4' DT A 10 4.656 -6.889 6.908 1.00 0.00 O ATOM 285 C3' DT A 10 6.272 -7.586 8.525 1.00 0.00 C ATOM 286 O3' DT A 10 6.093 -7.323 9.907 1.00 0.00 O ATOM 287 C2' DT A 10 5.412 -8.747 8.026 1.00 0.00 C ATOM 288 C1' DT A 10 4.148 -8.044 7.539 1.00 0.00 C ATOM 289 N1 DT A 10 3.355 -8.858 6.582 1.00 0.00 N ATOM 290 C2 DT A 10 2.006 -9.096 6.844 1.00 0.00 C ATOM 291 O2 DT A 10 1.446 -8.733 7.873 1.00 0.00 O ATOM 292 N3 DT A 10 1.302 -9.779 5.872 1.00 0.00 N ATOM 293 C4 DT A 10 1.817 -10.270 4.692 1.00 0.00 C ATOM 294 C5 DT A 10 3.231 -10.013 4.499 1.00 0.00 C ATOM 295 C6 DT A 10 3.936 -9.330 5.432 1.00 0.00 C ATOM 296 O4 DT A 10 1.084 -10.830 3.884 1.00 0.00 O ATOM 309 C7 DT A 10 3.920 -10.530 3.250 1.00 0.00 C ATOM 0 H5' DT A 10 6.307 -4.850 6.336 1.00 0.00 H new ATOM 0 H5'' DT A 10 7.550 -5.282 7.494 1.00 0.00 H new ATOM 0 H4' DT A 10 5.378 -5.648 8.413 1.00 0.00 H new ATOM 0 H3' DT A 10 7.337 -7.784 8.405 1.00 0.00 H new ATOM 0 H2' DT A 10 5.903 -9.299 7.224 1.00 0.00 H new ATOM 0 H2'' DT A 10 5.197 -9.462 8.820 1.00 0.00 H new ATOM 0 H1' DT A 10 3.455 -7.843 8.356 1.00 0.00 H new ATOM 0 H3 DT A 10 0.309 -9.934 6.043 1.00 0.00 H new ATOM 0 H71 DT A 10 4.741 -9.863 2.985 1.00 0.00 H new ATOM 0 H72 DT A 10 4.311 -11.530 3.438 1.00 0.00 H new ATOM 0 H73 DT A 10 3.204 -10.568 2.429 1.00 0.00 H new ATOM 0 H6 DT A 10 4.988 -9.151 5.266 1.00 0.00 H new ATOM 310 P DG A 11 6.616 -8.327 11.058 1.00 0.00 P ATOM 311 OP1 DG A 11 6.935 -7.530 12.262 1.00 0.00 O ATOM 312 OP2 DG A 11 7.637 -9.227 10.477 1.00 0.00 O ATOM 313 O5' DG A 11 5.294 -9.196 11.368 1.00 0.00 O ATOM 314 C5' DG A 11 4.191 -8.615 12.037 1.00 0.00 C ATOM 315 C4' DG A 11 3.026 -9.600 12.140 1.00 0.00 C ATOM 316 O4' DG A 11 2.527 -9.894 10.844 1.00 0.00 O ATOM 317 C3' DG A 11 3.418 -10.931 12.801 1.00 0.00 C ATOM 318 O3' DG A 11 2.449 -11.231 13.790 1.00 0.00 O ATOM 319 C2' DG A 11 3.369 -11.885 11.613 1.00 0.00 C ATOM 320 C1' DG A 11 2.235 -11.274 10.803 1.00 0.00 C ATOM 321 N9 DG A 11 2.227 -11.767 9.409 1.00 0.00 N ATOM 322 C8 DG A 11 3.268 -11.815 8.524 1.00 0.00 C ATOM 323 N7 DG A 11 2.948 -12.266 7.342 1.00 0.00 N ATOM 324 C5 DG A 11 1.591 -12.574 7.464 1.00 0.00 C ATOM 325 C6 DG A 11 0.672 -13.143 6.530 1.00 0.00 C ATOM 326 O6 DG A 11 0.852 -13.404 5.344 1.00 0.00 O ATOM 327 N1 DG A 11 -0.564 -13.420 7.097 1.00 0.00 N ATOM 328 C2 DG A 11 -0.898 -13.146 8.400 1.00 0.00 C ATOM 329 N2 DG A 11 -2.098 -13.495 8.843 1.00 0.00 N ATOM 330 N3 DG A 11 -0.062 -12.575 9.269 1.00 0.00 N ATOM 331 C4 DG A 11 1.160 -12.313 8.741 1.00 0.00 C ATOM 0 H5' DG A 11 3.869 -7.721 11.504 1.00 0.00 H new ATOM 0 H5'' DG A 11 4.493 -8.299 13.036 1.00 0.00 H new ATOM 0 H4' DG A 11 2.274 -9.115 12.762 1.00 0.00 H new ATOM 0 H3' DG A 11 4.382 -10.959 13.309 1.00 0.00 H new ATOM 0 H2' DG A 11 4.308 -11.905 11.060 1.00 0.00 H new ATOM 0 H2'' DG A 11 3.155 -12.910 11.915 1.00 0.00 H new ATOM 0 H1' DG A 11 1.251 -11.526 11.199 1.00 0.00 H new ATOM 0 H8 DG A 11 4.270 -11.506 8.781 1.00 0.00 H new ATOM 0 H1 DG A 11 -1.272 -13.856 6.506 1.00 0.00 H new ATOM 0 H21 DG A 11 -2.362 -13.299 9.808 1.00 0.00 H new ATOM 0 H22 DG A 11 -2.757 -13.960 8.218 1.00 0.00 H new ATOM 343 P DC A 12 2.538 -12.533 14.740 1.00 0.00 P ATOM 344 OP1 DC A 12 2.153 -12.137 16.112 1.00 0.00 O ATOM 345 OP2 DC A 12 3.833 -13.207 14.505 1.00 0.00 O ATOM 346 O5' DC A 12 1.372 -13.475 14.136 1.00 0.00 O ATOM 347 C5' DC A 12 0.003 -13.142 14.301 1.00 0.00 C ATOM 348 C4' DC A 12 -0.888 -14.161 13.584 1.00 0.00 C ATOM 349 O4' DC A 12 -0.561 -14.166 12.211 1.00 0.00 O ATOM 350 C3' DC A 12 -0.702 -15.591 14.111 1.00 0.00 C ATOM 351 O3' DC A 12 -1.920 -16.101 14.610 1.00 0.00 O ATOM 352 C2' DC A 12 -0.267 -16.396 12.894 1.00 0.00 C ATOM 353 C1' DC A 12 -0.624 -15.488 11.717 1.00 0.00 C ATOM 354 N1 DC A 12 0.376 -15.615 10.628 1.00 0.00 N ATOM 355 C2 DC A 12 -0.001 -16.154 9.404 1.00 0.00 C ATOM 356 O2 DC A 12 -1.117 -16.637 9.230 1.00 0.00 O ATOM 357 N3 DC A 12 0.895 -16.146 8.375 1.00 0.00 N ATOM 358 C4 DC A 12 2.125 -15.654 8.556 1.00 0.00 C ATOM 359 N4 DC A 12 2.938 -15.591 7.509 1.00 0.00 N ATOM 360 C5 DC A 12 2.558 -15.152 9.822 1.00 0.00 C ATOM 361 C6 DC A 12 1.648 -15.151 10.822 1.00 0.00 C ATOM 0 H5' DC A 12 -0.185 -12.144 13.905 1.00 0.00 H new ATOM 0 H5'' DC A 12 -0.246 -13.116 15.362 1.00 0.00 H new ATOM 0 H4' DC A 12 -1.921 -13.863 13.762 1.00 0.00 H new ATOM 0 H3' DC A 12 0.020 -15.634 14.927 1.00 0.00 H new ATOM 0 H2' DC A 12 0.800 -16.618 12.920 1.00 0.00 H new ATOM 0 H2'' DC A 12 -0.790 -17.351 12.837 1.00 0.00 H new ATOM 0 HO3' DC A 12 -1.782 -17.014 14.940 1.00 0.00 H new ATOM 0 H1' DC A 12 -1.604 -15.752 11.320 1.00 0.00 H new ATOM 0 H41 DC A 12 3.882 -15.220 7.618 1.00 0.00 H new ATOM 0 H42 DC A 12 2.619 -15.913 6.595 1.00 0.00 H new ATOM 0 H5 DC A 12 3.564 -14.791 9.973 1.00 0.00 H new ATOM 0 H6 DC A 12 1.931 -14.776 11.794 1.00 0.00 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 -2.587 -19.283 -1.655 1.00 0.00 O ATOM 376 C5' DG B 13 -3.576 -19.992 -0.947 1.00 0.00 C ATOM 377 C4' DG B 13 -3.947 -19.169 0.285 1.00 0.00 C ATOM 378 O4' DG B 13 -2.776 -18.820 0.993 1.00 0.00 O ATOM 379 C3' DG B 13 -4.729 -17.882 -0.025 1.00 0.00 C ATOM 380 O3' DG B 13 -5.966 -17.991 0.662 1.00 0.00 O ATOM 381 C2' DG B 13 -3.793 -16.819 0.547 1.00 0.00 C ATOM 382 C1' DG B 13 -3.076 -17.607 1.639 1.00 0.00 C ATOM 383 N9 DG B 13 -1.852 -17.005 2.217 1.00 0.00 N ATOM 384 C8 DG B 13 -0.797 -16.403 1.580 1.00 0.00 C ATOM 385 N7 DG B 13 0.231 -16.165 2.346 1.00 0.00 N ATOM 386 C5 DG B 13 -0.192 -16.590 3.600 1.00 0.00 C ATOM 387 C6 DG B 13 0.467 -16.538 4.862 1.00 0.00 C ATOM 388 O6 DG B 13 1.643 -16.267 5.091 1.00 0.00 O ATOM 389 N1 DG B 13 -0.371 -16.850 5.920 1.00 0.00 N ATOM 390 C2 DG B 13 -1.668 -17.281 5.773 1.00 0.00 C ATOM 391 N2 DG B 13 -2.375 -17.542 6.866 1.00 0.00 N ATOM 392 N3 DG B 13 -2.270 -17.424 4.587 1.00 0.00 N ATOM 393 C4 DG B 13 -1.486 -17.044 3.543 1.00 0.00 C ATOM 0 H5' DG B 13 -3.206 -20.974 -0.653 1.00 0.00 H new ATOM 0 H5'' DG B 13 -4.452 -20.156 -1.575 1.00 0.00 H new ATOM 0 H4' DG B 13 -4.605 -19.806 0.877 1.00 0.00 H new ATOM 0 H3' DG B 13 -4.974 -17.668 -1.065 1.00 0.00 H new ATOM 0 H2' DG B 13 -3.102 -16.434 -0.203 1.00 0.00 H new ATOM 0 H2'' DG B 13 -4.338 -15.964 0.948 1.00 0.00 H new ATOM 0 HO5' DG B 13 -2.067 -18.736 -1.030 1.00 0.00 H new ATOM 0 H1' DG B 13 -3.715 -17.675 2.519 1.00 0.00 H new ATOM 0 H8 DG B 13 -0.816 -16.147 0.531 1.00 0.00 H new ATOM 0 H1 DG B 13 -0.003 -16.754 6.866 1.00 0.00 H new ATOM 0 H21 DG B 13 -3.340 -17.863 6.785 1.00 0.00 H new ATOM 0 H22 DG B 13 -1.953 -17.421 7.787 1.00 0.00 H new ATOM 406 P DC B 14 -7.136 -16.877 0.619 1.00 0.00 P ATOM 407 OP1 DC B 14 -8.391 -17.537 0.191 1.00 0.00 O ATOM 408 OP2 DC B 14 -6.641 -15.683 -0.100 1.00 0.00 O ATOM 409 O5' DC B 14 -7.254 -16.517 2.185 1.00 0.00 O ATOM 410 C5' DC B 14 -7.710 -17.480 3.119 1.00 0.00 C ATOM 411 C4' DC B 14 -7.433 -17.022 4.555 1.00 0.00 C ATOM 412 O4' DC B 14 -6.048 -16.759 4.679 1.00 0.00 O ATOM 413 C3' DC B 14 -8.200 -15.753 4.949 1.00 0.00 C ATOM 414 O3' DC B 14 -8.826 -15.958 6.206 1.00 0.00 O ATOM 415 C2' DC B 14 -7.107 -14.695 5.017 1.00 0.00 C ATOM 416 C1' DC B 14 -5.859 -15.517 5.326 1.00 0.00 C ATOM 417 N1 DC B 14 -4.636 -14.880 4.772 1.00 0.00 N ATOM 418 C2 DC B 14 -3.591 -14.541 5.620 1.00 0.00 C ATOM 419 O2 DC B 14 -3.702 -14.629 6.839 1.00 0.00 O ATOM 420 N3 DC B 14 -2.413 -14.104 5.087 1.00 0.00 N ATOM 421 C4 DC B 14 -2.287 -13.958 3.765 1.00 0.00 C ATOM 422 N4 DC B 14 -1.102 -13.624 3.269 1.00 0.00 N ATOM 423 C5 DC B 14 -3.358 -14.266 2.869 1.00 0.00 C ATOM 424 C6 DC B 14 -4.504 -14.723 3.421 1.00 0.00 C ATOM 0 H5' DC B 14 -7.215 -18.434 2.935 1.00 0.00 H new ATOM 0 H5'' DC B 14 -8.779 -17.645 2.985 1.00 0.00 H new ATOM 0 H4' DC B 14 -7.766 -17.821 5.218 1.00 0.00 H new ATOM 0 H3' DC B 14 -8.995 -15.470 4.259 1.00 0.00 H new ATOM 0 H2' DC B 14 -7.011 -14.152 4.077 1.00 0.00 H new ATOM 0 H2'' DC B 14 -7.307 -13.956 5.793 1.00 0.00 H new ATOM 0 H1' DC B 14 -5.725 -15.609 6.404 1.00 0.00 H new ATOM 0 H41 DC B 14 -0.985 -13.508 2.262 1.00 0.00 H new ATOM 0 H42 DC B 14 -0.309 -13.484 3.894 1.00 0.00 H new ATOM 0 H5 DC B 14 -3.256 -14.139 1.801 1.00 0.00 H new ATOM 0 H6 DC B 14 -5.336 -14.970 2.778 1.00 0.00 H new ATOM 436 P DA B 15 -9.887 -14.909 6.830 1.00 0.00 P ATOM 437 OP1 DA B 15 -10.702 -15.626 7.835 1.00 0.00 O ATOM 438 OP2 DA B 15 -10.552 -14.195 5.719 1.00 0.00 O ATOM 439 O5' DA B 15 -8.949 -13.853 7.611 1.00 0.00 O ATOM 440 C5' DA B 15 -8.360 -14.172 8.860 1.00 0.00 C ATOM 441 C4' DA B 15 -7.465 -13.026 9.351 1.00 0.00 C ATOM 442 O4' DA B 15 -6.329 -12.897 8.515 1.00 0.00 O ATOM 443 C3' DA B 15 -8.181 -11.666 9.367 1.00 0.00 C ATOM 444 O3' DA B 15 -8.101 -11.119 10.674 1.00 0.00 O ATOM 445 C2' DA B 15 -7.391 -10.858 8.340 1.00 0.00 C ATOM 446 C1' DA B 15 -6.022 -11.522 8.404 1.00 0.00 C ATOM 447 N9 DA B 15 -5.227 -11.306 7.179 1.00 0.00 N ATOM 448 C8 DA B 15 -5.586 -11.576 5.885 1.00 0.00 C ATOM 449 N7 DA B 15 -4.611 -11.502 5.020 1.00 0.00 N ATOM 450 C5 DA B 15 -3.537 -11.092 5.805 1.00 0.00 C ATOM 451 C6 DA B 15 -2.202 -10.786 5.508 1.00 0.00 C ATOM 452 N6 DA B 15 -1.728 -10.863 4.269 1.00 0.00 N ATOM 453 N1 DA B 15 -1.394 -10.344 6.485 1.00 0.00 N ATOM 454 C2 DA B 15 -1.890 -10.223 7.713 1.00 0.00 C ATOM 455 N3 DA B 15 -3.119 -10.496 8.133 1.00 0.00 N ATOM 456 C4 DA B 15 -3.907 -10.933 7.115 1.00 0.00 C ATOM 0 H5' DA B 15 -7.771 -15.084 8.767 1.00 0.00 H new ATOM 0 H5'' DA B 15 -9.140 -14.370 9.595 1.00 0.00 H new ATOM 0 H4' DA B 15 -7.185 -13.286 10.372 1.00 0.00 H new ATOM 0 H3' DA B 15 -9.243 -11.696 9.124 1.00 0.00 H new ATOM 0 H2' DA B 15 -7.830 -10.922 7.344 1.00 0.00 H new ATOM 0 H2'' DA B 15 -7.345 -9.801 8.600 1.00 0.00 H new ATOM 0 H1' DA B 15 -5.426 -11.119 9.223 1.00 0.00 H new ATOM 0 H8 DA B 15 -6.597 -11.830 5.602 1.00 0.00 H new ATOM 0 H61 DA B 15 -0.752 -10.634 4.081 1.00 0.00 H new ATOM 0 H62 DA B 15 -2.340 -11.151 3.506 1.00 0.00 H new ATOM 0 H2 DA B 15 -1.206 -9.856 8.464 1.00 0.00 H new ATOM 468 P DG B 16 -8.859 -9.754 11.095 1.00 0.00 P ATOM 469 OP1 DG B 16 -9.204 -9.843 12.531 1.00 0.00 O ATOM 470 OP2 DG B 16 -9.916 -9.473 10.097 1.00 0.00 O ATOM 471 O5' DG B 16 -7.700 -8.648 10.919 1.00 0.00 O ATOM 472 C5' DG B 16 -6.683 -8.498 11.891 1.00 0.00 C ATOM 473 C4' DG B 16 -5.673 -7.434 11.456 1.00 0.00 C ATOM 474 O4' DG B 16 -4.988 -7.881 10.300 1.00 0.00 O ATOM 475 C3' DG B 16 -6.324 -6.080 11.125 1.00 0.00 C ATOM 476 O3' DG B 16 -5.693 -5.056 11.876 1.00 0.00 O ATOM 477 C2' DG B 16 -6.050 -5.949 9.630 1.00 0.00 C ATOM 478 C1' DG B 16 -4.765 -6.757 9.476 1.00 0.00 C ATOM 479 N9 DG B 16 -4.539 -7.181 8.079 1.00 0.00 N ATOM 480 C8 DG B 16 -5.417 -7.808 7.239 1.00 0.00 C ATOM 481 N7 DG B 16 -4.926 -8.108 6.072 1.00 0.00 N ATOM 482 C5 DG B 16 -3.619 -7.635 6.138 1.00 0.00 C ATOM 483 C6 DG B 16 -2.585 -7.651 5.159 1.00 0.00 C ATOM 484 O6 DG B 16 -2.655 -8.046 3.998 1.00 0.00 O ATOM 485 N1 DG B 16 -1.385 -7.146 5.634 1.00 0.00 N ATOM 486 C2 DG B 16 -1.216 -6.607 6.886 1.00 0.00 C ATOM 487 N2 DG B 16 -0.042 -6.066 7.187 1.00 0.00 N ATOM 488 N3 DG B 16 -2.196 -6.532 7.792 1.00 0.00 N ATOM 489 C4 DG B 16 -3.369 -7.074 7.366 1.00 0.00 C ATOM 0 H5' DG B 16 -6.174 -9.450 12.042 1.00 0.00 H new ATOM 0 H5'' DG B 16 -7.125 -8.218 12.847 1.00 0.00 H new ATOM 0 H4' DG B 16 -4.997 -7.286 12.298 1.00 0.00 H new ATOM 0 H3' DG B 16 -7.385 -6.007 11.363 1.00 0.00 H new ATOM 0 H2' DG B 16 -6.863 -6.355 9.028 1.00 0.00 H new ATOM 0 H2'' DG B 16 -5.918 -4.910 9.328 1.00 0.00 H new ATOM 0 H1' DG B 16 -3.881 -6.180 9.748 1.00 0.00 H new ATOM 0 H8 DG B 16 -6.434 -8.036 7.521 1.00 0.00 H new ATOM 0 H1 DG B 16 -0.575 -7.177 5.014 1.00 0.00 H new ATOM 0 H21 DG B 16 0.110 -5.659 8.110 1.00 0.00 H new ATOM 0 H22 DG B 16 0.708 -6.058 6.496 1.00 0.00 H new ATOM 501 P DG B 17 -6.238 -3.533 11.898 1.00 0.00 P ATOM 502 OP1 DG B 17 -6.363 -3.109 13.310 1.00 0.00 O ATOM 503 OP2 DG B 17 -7.400 -3.428 10.991 1.00 0.00 O ATOM 504 O5' DG B 17 -5.015 -2.720 11.231 1.00 0.00 O ATOM 505 C5' DG B 17 -3.809 -2.515 11.946 1.00 0.00 C ATOM 506 C4' DG B 17 -2.741 -1.871 11.055 1.00 0.00 C ATOM 507 O4' DG B 17 -2.517 -2.703 9.927 1.00 0.00 O ATOM 508 C3' DG B 17 -3.105 -0.466 10.564 1.00 0.00 C ATOM 509 O3' DG B 17 -1.946 0.350 10.656 1.00 0.00 O ATOM 510 C2' DG B 17 -3.526 -0.754 9.130 1.00 0.00 C ATOM 511 C1' DG B 17 -2.626 -1.927 8.750 1.00 0.00 C ATOM 512 N9 DG B 17 -3.212 -2.751 7.669 1.00 0.00 N ATOM 513 C8 DG B 17 -4.495 -3.227 7.592 1.00 0.00 C ATOM 514 N7 DG B 17 -4.739 -3.966 6.551 1.00 0.00 N ATOM 515 C5 DG B 17 -3.526 -3.981 5.874 1.00 0.00 C ATOM 516 C6 DG B 17 -3.179 -4.604 4.640 1.00 0.00 C ATOM 517 O6 DG B 17 -3.893 -5.282 3.906 1.00 0.00 O ATOM 518 N1 DG B 17 -1.860 -4.391 4.282 1.00 0.00 N ATOM 519 C2 DG B 17 -0.974 -3.644 5.014 1.00 0.00 C ATOM 520 N2 DG B 17 0.250 -3.511 4.517 1.00 0.00 N ATOM 521 N3 DG B 17 -1.291 -3.030 6.162 1.00 0.00 N ATOM 522 C4 DG B 17 -2.580 -3.243 6.547 1.00 0.00 C ATOM 0 H5' DG B 17 -3.442 -3.468 12.327 1.00 0.00 H new ATOM 0 H5'' DG B 17 -3.999 -1.878 12.810 1.00 0.00 H new ATOM 0 H4' DG B 17 -1.847 -1.768 11.670 1.00 0.00 H new ATOM 0 H3' DG B 17 -3.879 0.064 11.119 1.00 0.00 H new ATOM 0 H2' DG B 17 -4.582 -1.014 9.062 1.00 0.00 H new ATOM 0 H2'' DG B 17 -3.367 0.106 8.480 1.00 0.00 H new ATOM 0 H1' DG B 17 -1.665 -1.570 8.379 1.00 0.00 H new ATOM 0 H8 DG B 17 -5.244 -3.005 8.338 1.00 0.00 H new ATOM 0 H1 DG B 17 -1.525 -4.817 3.418 1.00 0.00 H new ATOM 0 H21 DG B 17 0.949 -2.965 5.021 1.00 0.00 H new ATOM 0 H22 DG B 17 0.492 -3.955 3.631 1.00 0.00 H new ATOM 534 P DA B 18 -1.923 1.897 10.182 1.00 0.00 P ATOM 535 OP1 DA B 18 -1.105 2.670 11.139 1.00 0.00 O ATOM 536 OP2 DA B 18 -3.306 2.325 9.881 1.00 0.00 O ATOM 537 O5' DA B 18 -1.114 1.785 8.793 1.00 0.00 O ATOM 538 C5' DA B 18 0.214 1.296 8.749 1.00 0.00 C ATOM 539 C4' DA B 18 0.785 1.412 7.331 1.00 0.00 C ATOM 540 O4' DA B 18 0.047 0.546 6.499 1.00 0.00 O ATOM 541 C3' DA B 18 0.683 2.829 6.746 1.00 0.00 C ATOM 542 O3' DA B 18 1.835 3.061 5.951 1.00 0.00 O ATOM 543 C2' DA B 18 -0.579 2.737 5.904 1.00 0.00 C ATOM 544 C1' DA B 18 -0.491 1.290 5.432 1.00 0.00 C ATOM 545 N9 DA B 18 -1.795 0.689 5.102 1.00 0.00 N ATOM 546 C8 DA B 18 -2.951 0.751 5.834 1.00 0.00 C ATOM 547 N7 DA B 18 -3.890 -0.063 5.442 1.00 0.00 N ATOM 548 C5 DA B 18 -3.309 -0.705 4.353 1.00 0.00 C ATOM 549 C6 DA B 18 -3.767 -1.699 3.474 1.00 0.00 C ATOM 550 N6 DA B 18 -4.957 -2.279 3.594 1.00 0.00 N ATOM 551 N1 DA B 18 -2.956 -2.115 2.495 1.00 0.00 N ATOM 552 C2 DA B 18 -1.745 -1.587 2.389 1.00 0.00 C ATOM 553 N3 DA B 18 -1.183 -0.649 3.144 1.00 0.00 N ATOM 554 C4 DA B 18 -2.036 -0.246 4.126 1.00 0.00 C ATOM 0 H5' DA B 18 0.235 0.255 9.071 1.00 0.00 H new ATOM 0 H5'' DA B 18 0.837 1.858 9.445 1.00 0.00 H new ATOM 0 H4' DA B 18 1.843 1.157 7.382 1.00 0.00 H new ATOM 0 H3' DA B 18 0.635 3.640 7.472 1.00 0.00 H new ATOM 0 H2' DA B 18 -1.481 2.930 6.485 1.00 0.00 H new ATOM 0 H2'' DA B 18 -0.577 3.445 5.075 1.00 0.00 H new ATOM 0 H1' DA B 18 0.112 1.276 4.524 1.00 0.00 H new ATOM 0 H8 DA B 18 -3.075 1.422 6.671 1.00 0.00 H new ATOM 0 H61 DA B 18 -5.244 -2.997 2.929 1.00 0.00 H new ATOM 0 H62 DA B 18 -5.583 -2.006 4.351 1.00 0.00 H new ATOM 0 H2 DA B 18 -1.135 -1.969 1.584 1.00 0.00 H new ATOM 566 P DA B 19 2.123 4.462 5.207 1.00 0.00 P ATOM 567 OP1 DA B 19 3.588 4.647 5.133 1.00 0.00 O ATOM 568 OP2 DA B 19 1.278 5.508 5.827 1.00 0.00 O ATOM 569 O5' DA B 19 1.577 4.196 3.710 1.00 0.00 O ATOM 570 C5' DA B 19 2.351 3.488 2.754 1.00 0.00 C ATOM 571 C4' DA B 19 1.670 3.539 1.388 1.00 0.00 C ATOM 572 O4' DA B 19 0.482 2.774 1.445 1.00 0.00 O ATOM 573 C3' DA B 19 1.309 4.966 0.963 1.00 0.00 C ATOM 574 O3' DA B 19 1.778 5.163 -0.361 1.00 0.00 O ATOM 575 C2' DA B 19 -0.214 4.976 1.073 1.00 0.00 C ATOM 576 C1' DA B 19 -0.569 3.505 0.857 1.00 0.00 C ATOM 577 N9 DA B 19 -1.829 3.083 1.505 1.00 0.00 N ATOM 578 C8 DA B 19 -2.290 3.387 2.757 1.00 0.00 C ATOM 579 N7 DA B 19 -3.341 2.710 3.131 1.00 0.00 N ATOM 580 C5 DA B 19 -3.612 1.911 2.026 1.00 0.00 C ATOM 581 C6 DA B 19 -4.597 0.949 1.751 1.00 0.00 C ATOM 582 N6 DA B 19 -5.544 0.620 2.627 1.00 0.00 N ATOM 583 N1 DA B 19 -4.555 0.294 0.580 1.00 0.00 N ATOM 584 C2 DA B 19 -3.589 0.584 -0.285 1.00 0.00 C ATOM 585 N3 DA B 19 -2.624 1.483 -0.159 1.00 0.00 N ATOM 586 C4 DA B 19 -2.690 2.122 1.035 1.00 0.00 C ATOM 0 H5' DA B 19 2.474 2.452 3.069 1.00 0.00 H new ATOM 0 H5'' DA B 19 3.349 3.922 2.688 1.00 0.00 H new ATOM 0 H4' DA B 19 2.372 3.141 0.655 1.00 0.00 H new ATOM 0 H3' DA B 19 1.748 5.767 1.558 1.00 0.00 H new ATOM 0 H2' DA B 19 -0.549 5.336 2.046 1.00 0.00 H new ATOM 0 H2'' DA B 19 -0.671 5.619 0.321 1.00 0.00 H new ATOM 0 H1' DA B 19 -0.704 3.336 -0.211 1.00 0.00 H new ATOM 0 H8 DA B 19 -1.821 4.129 3.386 1.00 0.00 H new ATOM 0 H61 DA B 19 -6.240 -0.085 2.385 1.00 0.00 H new ATOM 0 H62 DA B 19 -5.573 1.073 3.540 1.00 0.00 H new ATOM 0 H2 DA B 19 -3.591 0.017 -1.204 1.00 0.00 H new ATOM 598 P DG B 20 1.707 6.594 -1.099 1.00 0.00 P ATOM 599 OP1 DG B 20 2.908 6.742 -1.949 1.00 0.00 O ATOM 600 OP2 DG B 20 1.375 7.630 -0.095 1.00 0.00 O ATOM 601 O5' DG B 20 0.435 6.392 -2.054 1.00 0.00 O ATOM 602 C5' DG B 20 0.539 5.629 -3.241 1.00 0.00 C ATOM 603 C4' DG B 20 -0.843 5.422 -3.863 1.00 0.00 C ATOM 604 O4' DG B 20 -1.676 4.701 -2.970 1.00 0.00 O ATOM 605 C3' DG B 20 -1.540 6.751 -4.185 1.00 0.00 C ATOM 606 O3' DG B 20 -1.909 6.753 -5.550 1.00 0.00 O ATOM 607 C2' DG B 20 -2.737 6.722 -3.239 1.00 0.00 C ATOM 608 C1' DG B 20 -2.982 5.225 -3.075 1.00 0.00 C ATOM 609 N9 DG B 20 -3.753 4.899 -1.854 1.00 0.00 N ATOM 610 C8 DG B 20 -3.540 5.351 -0.578 1.00 0.00 C ATOM 611 N7 DG B 20 -4.322 4.831 0.320 1.00 0.00 N ATOM 612 C5 DG B 20 -5.137 3.979 -0.416 1.00 0.00 C ATOM 613 C6 DG B 20 -6.222 3.162 0.010 1.00 0.00 C ATOM 614 O6 DG B 20 -6.678 3.055 1.145 1.00 0.00 O ATOM 615 N1 DG B 20 -6.785 2.431 -1.021 1.00 0.00 N ATOM 616 C2 DG B 20 -6.380 2.509 -2.330 1.00 0.00 C ATOM 617 N2 DG B 20 -7.053 1.805 -3.233 1.00 0.00 N ATOM 618 N3 DG B 20 -5.388 3.303 -2.753 1.00 0.00 N ATOM 619 C4 DG B 20 -4.799 4.008 -1.747 1.00 0.00 C ATOM 0 H5' DG B 20 0.995 4.663 -3.022 1.00 0.00 H new ATOM 0 H5'' DG B 20 1.192 6.136 -3.951 1.00 0.00 H new ATOM 0 H4' DG B 20 -0.688 4.869 -4.790 1.00 0.00 H new ATOM 0 H3' DG B 20 -0.939 7.650 -4.047 1.00 0.00 H new ATOM 0 H2' DG B 20 -2.516 7.205 -2.287 1.00 0.00 H new ATOM 0 H2'' DG B 20 -3.602 7.232 -3.662 1.00 0.00 H new ATOM 0 H1' DG B 20 -3.570 4.820 -3.898 1.00 0.00 H new ATOM 0 H8 DG B 20 -2.782 6.082 -0.338 1.00 0.00 H new ATOM 0 H1 DG B 20 -7.549 1.794 -0.794 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.779 1.840 -4.215 1.00 0.00 H new ATOM 0 H22 DG B 20 -7.844 1.229 -2.945 1.00 0.00 H new ATOM 631 P DG B 21 -2.571 8.037 -6.269 1.00 0.00 P ATOM 632 OP1 DG B 21 -1.827 8.306 -7.520 1.00 0.00 O ATOM 633 OP2 DG B 21 -2.759 9.112 -5.270 1.00 0.00 O ATOM 634 O5' DG B 21 -4.017 7.448 -6.651 1.00 0.00 O ATOM 635 C5' DG B 21 -4.139 6.425 -7.618 1.00 0.00 C ATOM 636 C4' DG B 21 -5.594 5.975 -7.747 1.00 0.00 C ATOM 637 O4' DG B 21 -6.035 5.424 -6.514 1.00 0.00 O ATOM 638 C3' DG B 21 -6.534 7.119 -8.130 1.00 0.00 C ATOM 639 O3' DG B 21 -7.354 6.699 -9.206 1.00 0.00 O ATOM 640 C2' DG B 21 -7.307 7.343 -6.836 1.00 0.00 C ATOM 641 C1' DG B 21 -7.282 5.979 -6.145 1.00 0.00 C ATOM 642 N9 DG B 21 -7.293 6.112 -4.666 1.00 0.00 N ATOM 643 C8 DG B 21 -6.423 6.861 -3.918 1.00 0.00 C ATOM 644 N7 DG B 21 -6.567 6.748 -2.634 1.00 0.00 N ATOM 645 C5 DG B 21 -7.623 5.856 -2.506 1.00 0.00 C ATOM 646 C6 DG B 21 -8.237 5.349 -1.326 1.00 0.00 C ATOM 647 O6 DG B 21 -7.915 5.559 -0.161 1.00 0.00 O ATOM 648 N1 DG B 21 -9.313 4.521 -1.586 1.00 0.00 N ATOM 649 C2 DG B 21 -9.696 4.148 -2.850 1.00 0.00 C ATOM 650 N2 DG B 21 -10.703 3.286 -2.929 1.00 0.00 N ATOM 651 N3 DG B 21 -9.108 4.587 -3.974 1.00 0.00 N ATOM 652 C4 DG B 21 -8.079 5.450 -3.738 1.00 0.00 C ATOM 0 H5' DG B 21 -3.514 5.577 -7.338 1.00 0.00 H new ATOM 0 H5'' DG B 21 -3.777 6.783 -8.582 1.00 0.00 H new ATOM 0 H4' DG B 21 -5.625 5.232 -8.544 1.00 0.00 H new ATOM 0 H3' DG B 21 -6.053 8.034 -8.477 1.00 0.00 H new ATOM 0 H2' DG B 21 -6.839 8.111 -6.220 1.00 0.00 H new ATOM 0 H2'' DG B 21 -8.328 7.671 -7.033 1.00 0.00 H new ATOM 0 H1' DG B 21 -8.149 5.384 -6.431 1.00 0.00 H new ATOM 0 H8 DG B 21 -5.673 7.498 -4.364 1.00 0.00 H new ATOM 0 H1 DG B 21 -9.852 4.168 -0.795 1.00 0.00 H new ATOM 0 H21 DG B 21 -11.034 2.970 -3.841 1.00 0.00 H new ATOM 0 H22 DG B 21 -11.146 2.939 -2.078 1.00 0.00 H new ATOM 664 P DT B 22 -8.393 7.706 -9.925 1.00 0.00 P ATOM 665 OP1 DT B 22 -8.382 7.437 -11.379 1.00 0.00 O ATOM 666 OP2 DT B 22 -8.167 9.078 -9.421 1.00 0.00 O ATOM 667 O5' DT B 22 -9.781 7.170 -9.318 1.00 0.00 O ATOM 668 C5' DT B 22 -10.196 5.844 -9.576 1.00 0.00 C ATOM 669 C4' DT B 22 -11.461 5.486 -8.836 1.00 0.00 C ATOM 670 O4' DT B 22 -11.189 5.602 -7.453 1.00 0.00 O ATOM 671 C3' DT B 22 -12.611 6.444 -9.201 1.00 0.00 C ATOM 672 O3' DT B 22 -13.808 5.726 -9.437 1.00 0.00 O ATOM 673 C2' DT B 22 -12.686 7.316 -7.954 1.00 0.00 C ATOM 674 C1' DT B 22 -12.225 6.347 -6.867 1.00 0.00 C ATOM 675 N1 DT B 22 -11.698 6.992 -5.633 1.00 0.00 N ATOM 676 C2 DT B 22 -12.135 6.531 -4.395 1.00 0.00 C ATOM 677 O2 DT B 22 -13.103 5.798 -4.273 1.00 0.00 O ATOM 678 N3 DT B 22 -11.462 6.963 -3.269 1.00 0.00 N ATOM 679 C4 DT B 22 -10.419 7.873 -3.296 1.00 0.00 C ATOM 680 C5 DT B 22 -10.091 8.405 -4.602 1.00 0.00 C ATOM 681 C6 DT B 22 -10.722 7.949 -5.710 1.00 0.00 C ATOM 682 O4 DT B 22 -9.818 8.164 -2.272 1.00 0.00 O ATOM 695 C7 DT B 22 -9.058 9.514 -4.704 1.00 0.00 C ATOM 0 H5' DT B 22 -9.402 5.155 -9.289 1.00 0.00 H new ATOM 0 H5'' DT B 22 -10.356 5.717 -10.647 1.00 0.00 H new ATOM 0 H4' DT B 22 -11.767 4.475 -9.105 1.00 0.00 H new ATOM 0 H3' DT B 22 -12.458 7.017 -10.116 1.00 0.00 H new ATOM 0 H2' DT B 22 -12.037 8.189 -8.026 1.00 0.00 H new ATOM 0 H2'' DT B 22 -13.696 7.684 -7.772 1.00 0.00 H new ATOM 0 H1' DT B 22 -13.085 5.762 -6.540 1.00 0.00 H new ATOM 0 H3 DT B 22 -11.750 6.590 -2.365 1.00 0.00 H new ATOM 0 H71 DT B 22 -8.542 9.444 -5.662 1.00 0.00 H new ATOM 0 H72 DT B 22 -9.554 10.482 -4.629 1.00 0.00 H new ATOM 0 H73 DT B 22 -8.335 9.414 -3.894 1.00 0.00 H new ATOM 0 H6 DT B 22 -10.449 8.349 -6.675 1.00 0.00 H new ATOM 696 P DG B 23 -15.185 6.447 -9.892 1.00 0.00 P ATOM 697 OP1 DG B 23 -15.990 5.458 -10.641 1.00 0.00 O ATOM 698 OP2 DG B 23 -14.855 7.750 -10.506 1.00 0.00 O ATOM 699 O5' DG B 23 -15.910 6.723 -8.480 1.00 0.00 O ATOM 700 C5' DG B 23 -16.449 5.652 -7.731 1.00 0.00 C ATOM 701 C4' DG B 23 -16.872 6.092 -6.334 1.00 0.00 C ATOM 702 O4' DG B 23 -15.742 6.568 -5.620 1.00 0.00 O ATOM 703 C3' DG B 23 -17.938 7.198 -6.313 1.00 0.00 C ATOM 704 O3' DG B 23 -18.967 6.779 -5.427 1.00 0.00 O ATOM 705 C2' DG B 23 -17.137 8.375 -5.776 1.00 0.00 C ATOM 706 C1' DG B 23 -16.171 7.661 -4.840 1.00 0.00 C ATOM 707 N9 DG B 23 -15.029 8.509 -4.467 1.00 0.00 N ATOM 708 C8 DG B 23 -14.190 9.204 -5.292 1.00 0.00 C ATOM 709 N7 DG B 23 -13.211 9.806 -4.678 1.00 0.00 N ATOM 710 C5 DG B 23 -13.444 9.524 -3.335 1.00 0.00 C ATOM 711 C6 DG B 23 -12.734 9.920 -2.162 1.00 0.00 C ATOM 712 O6 DG B 23 -11.650 10.489 -2.083 1.00 0.00 O ATOM 713 N1 DG B 23 -13.388 9.562 -0.995 1.00 0.00 N ATOM 714 C2 DG B 23 -14.547 8.833 -0.950 1.00 0.00 C ATOM 715 N2 DG B 23 -15.101 8.596 0.231 1.00 0.00 N ATOM 716 N3 DG B 23 -15.182 8.390 -2.037 1.00 0.00 N ATOM 717 C4 DG B 23 -14.584 8.771 -3.195 1.00 0.00 C ATOM 0 H5' DG B 23 -15.709 4.855 -7.652 1.00 0.00 H new ATOM 0 H5'' DG B 23 -17.309 5.238 -8.257 1.00 0.00 H new ATOM 0 H4' DG B 23 -17.311 5.207 -5.873 1.00 0.00 H new ATOM 0 H3' DG B 23 -18.425 7.435 -7.259 1.00 0.00 H new ATOM 0 H2' DG B 23 -16.620 8.918 -6.567 1.00 0.00 H new ATOM 0 H2'' DG B 23 -17.764 9.096 -5.251 1.00 0.00 H new ATOM 0 H1' DG B 23 -16.633 7.381 -3.893 1.00 0.00 H new ATOM 0 H8 DG B 23 -14.327 9.250 -6.362 1.00 0.00 H new ATOM 0 H1 DG B 23 -12.979 9.861 -0.110 1.00 0.00 H new ATOM 0 H21 DG B 23 -15.964 8.056 0.290 1.00 0.00 H new ATOM 0 H22 DG B 23 -14.664 8.954 1.080 1.00 0.00 H new ATOM 729 P DC B 24 -20.266 7.675 -5.083 1.00 0.00 P ATOM 730 OP1 DC B 24 -21.437 6.777 -4.996 1.00 0.00 O ATOM 731 OP2 DC B 24 -20.294 8.842 -5.991 1.00 0.00 O ATOM 732 O5' DC B 24 -19.926 8.196 -3.596 1.00 0.00 O ATOM 733 C5' DC B 24 -19.892 7.290 -2.508 1.00 0.00 C ATOM 734 C4' DC B 24 -19.584 7.990 -1.179 1.00 0.00 C ATOM 735 O4' DC B 24 -18.320 8.621 -1.264 1.00 0.00 O ATOM 736 C3' DC B 24 -20.619 9.060 -0.808 1.00 0.00 C ATOM 737 O3' DC B 24 -20.973 8.956 0.558 1.00 0.00 O ATOM 738 C2' DC B 24 -19.877 10.367 -1.036 1.00 0.00 C ATOM 739 C1' DC B 24 -18.421 9.956 -0.810 1.00 0.00 C ATOM 740 N1 DC B 24 -17.471 10.793 -1.583 1.00 0.00 N ATOM 741 C2 DC B 24 -16.478 11.507 -0.919 1.00 0.00 C ATOM 742 O2 DC B 24 -16.459 11.597 0.306 1.00 0.00 O ATOM 743 N3 DC B 24 -15.502 12.118 -1.648 1.00 0.00 N ATOM 744 C4 DC B 24 -15.525 12.066 -2.985 1.00 0.00 C ATOM 745 N4 DC B 24 -14.502 12.583 -3.649 1.00 0.00 N ATOM 746 C5 DC B 24 -16.562 11.387 -3.695 1.00 0.00 C ATOM 747 C6 DC B 24 -17.504 10.763 -2.951 1.00 0.00 C ATOM 0 H5' DC B 24 -19.138 6.526 -2.697 1.00 0.00 H new ATOM 0 H5'' DC B 24 -20.852 6.779 -2.433 1.00 0.00 H new ATOM 0 H4' DC B 24 -19.604 7.218 -0.409 1.00 0.00 H new ATOM 0 H3' DC B 24 -21.539 8.970 -1.386 1.00 0.00 H new ATOM 0 H2' DC B 24 -20.039 10.757 -2.041 1.00 0.00 H new ATOM 0 H2'' DC B 24 -20.194 11.142 -0.338 1.00 0.00 H new ATOM 0 HO3' DC B 24 -21.632 9.647 0.779 1.00 0.00 H new ATOM 0 H1' DC B 24 -18.166 10.075 0.243 1.00 0.00 H new ATOM 0 H41 DC B 24 -14.491 12.558 -4.669 1.00 0.00 H new ATOM 0 H42 DC B 24 -13.725 13.006 -3.141 1.00 0.00 H new ATOM 0 H5 DC B 24 -16.593 11.372 -4.774 1.00 0.00 H new ATOM 0 H6 DC B 24 -18.300 10.229 -3.448 1.00 0.00 H new TER 760 DC B 24 HETATM 761 C1D CCI B 25 -9.056 2.230 -10.985 1.00 0.00 C HETATM 762 C2D CCI B 25 -8.139 3.008 -10.042 1.00 0.00 C HETATM 763 C3D CCI B 25 -6.838 2.213 -9.888 1.00 0.00 C HETATM 764 C4D CCI B 25 -6.212 2.027 -11.280 1.00 0.00 C HETATM 765 C5D CCI B 25 -7.240 1.324 -12.184 1.00 0.00 C HETATM 766 C6D CCI B 25 -6.750 1.147 -13.616 1.00 0.00 C HETATM 767 OCD CCI B 25 -9.347 0.938 -10.474 1.00 0.00 O HETATM 768 O2D CCI B 25 -7.827 4.268 -10.607 1.00 0.00 O HETATM 769 O3D CCI B 25 -5.930 2.837 -8.998 1.00 0.00 O HETATM 770 O4D CCI B 25 -5.043 1.227 -11.159 1.00 0.00 O HETATM 771 OD CCI B 25 -8.441 2.079 -12.250 1.00 0.00 O HETATM 772 C7D CCI B 25 -6.230 2.599 -7.634 1.00 0.00 C HETATM 773 C4C CCI B 25 -10.116 0.783 -9.272 1.00 0.00 C HETATM 774 C5C CCI B 25 -11.458 1.160 -9.277 1.00 0.00 C HETATM 775 C6C CCI B 25 -12.118 1.383 -8.058 1.00 0.00 C HETATM 776 C1C CCI B 25 -11.435 1.221 -6.822 1.00 0.00 C HETATM 777 C2C CCI B 25 -10.117 0.669 -6.847 1.00 0.00 C HETATM 778 I CCI B 25 -7.078 -1.468 -8.241 1.00 0.00 I HETATM 779 O5C CCI B 25 -12.111 1.429 -10.547 1.00 0.00 O HETATM 780 C8C CCI B 25 -12.108 0.487 -11.610 1.00 0.00 C HETATM 781 O6C CCI B 25 -13.524 1.711 -8.127 1.00 0.00 O HETATM 782 C9C CCI B 25 -13.929 2.968 -8.619 1.00 0.00 C HETATM 783 C7C CCI B 25 -9.276 0.508 -5.593 1.00 0.00 C HETATM 784 CBC CCI B 25 -12.025 1.623 -5.596 1.00 0.00 C HETATM 785 OBC CCI B 25 -11.665 1.170 -4.512 1.00 0.00 O HETATM 786 SBC CCI B 25 -13.296 2.871 -5.397 1.00 0.00 S HETATM 787 C1B CCI B 25 -16.760 2.413 -2.402 1.00 0.00 C HETATM 788 C2B CCI B 25 -15.463 3.096 -1.930 1.00 0.00 C HETATM 789 C3B CCI B 25 -14.628 3.622 -3.092 1.00 0.00 C HETATM 790 C4B CCI B 25 -14.338 2.407 -3.983 1.00 0.00 C HETATM 791 C5B CCI B 25 -15.664 1.767 -4.416 1.00 0.00 C HETATM 792 C6B CCI B 25 -15.466 0.577 -5.361 1.00 0.00 C HETATM 793 OAB CCI B 25 -17.342 2.032 -1.118 1.00 0.00 O HETATM 794 O3B CCI B 25 -15.411 4.579 -3.774 1.00 0.00 O HETATM 795 OB CCI B 25 -16.350 1.327 -3.252 1.00 0.00 O HETATM 796 C1A CCI B 25 -20.681 1.812 1.650 1.00 0.00 C HETATM 797 C2A CCI B 25 -20.278 0.381 1.242 1.00 0.00 C HETATM 798 C3A CCI B 25 -19.257 0.413 0.097 1.00 0.00 C HETATM 799 C4A CCI B 25 -19.560 1.456 -0.994 1.00 0.00 C HETATM 800 C5A CCI B 25 -19.930 2.804 -0.356 1.00 0.00 C HETATM 801 C6A CCI B 25 -20.386 3.826 -1.406 1.00 0.00 C HETATM 802 ORA CCI B 25 -21.771 1.821 2.555 1.00 0.00 O HETATM 803 OEA CCI B 25 -19.597 -0.272 2.312 1.00 0.00 O HETATM 804 O3A CCI B 25 -19.172 -0.869 -0.491 1.00 0.00 O HETATM 805 NAB CCI B 25 -18.410 1.619 -1.870 1.00 0.00 N HETATM 806 OA CCI B 25 -21.012 2.614 0.529 1.00 0.00 O HETATM 807 CAN CCI B 25 -22.956 1.278 1.998 1.00 0.00 C HETATM 808 C1E CCI B 25 -20.344 -1.250 3.022 1.00 0.00 C HETATM 809 C2E CCI B 25 -19.382 -2.087 3.873 1.00 0.00 C HETATM 810 C3E CCI B 25 -18.768 -1.231 4.988 1.00 0.00 C HETATM 811 C4E CCI B 25 -19.901 -0.609 5.804 1.00 0.00 C HETATM 812 C5E CCI B 25 -20.809 0.185 4.860 1.00 0.00 C HETATM 813 O3E CCI B 25 -18.000 -1.991 5.906 1.00 0.00 O HETATM 814 C6E CCI B 25 -16.784 -2.487 5.375 1.00 0.00 C HETATM 815 N4E CCI B 25 -19.333 0.204 6.904 1.00 0.00 N HETATM 816 C7E CCI B 25 -20.304 0.735 7.889 1.00 0.00 C HETATM 817 C8E CCI B 25 -19.599 1.417 9.070 1.00 0.00 C HETATM 818 OE CCI B 25 -21.334 -0.670 3.854 1.00 0.00 O HETATM 819 C3C CCI B 25 -9.487 0.408 -8.082 1.00 0.00 C HETATM 0 HOD2 CCI B 25 -7.561 4.888 -9.896 1.00 0.00 H new HETATM 0 HOB3 CCI B 25 -14.824 5.242 -4.195 1.00 0.00 H new HETATM 0 HOA3 CCI B 25 -18.481 -1.393 -0.035 1.00 0.00 H new HETATM 0 HNE2 CCI B 25 -18.332 0.387 6.979 1.00 0.00 H new HETATM 0 HAN3 CCI B 25 -23.247 1.860 1.123 1.00 0.00 H new HETATM 0 HAN2 CCI B 25 -22.779 0.244 1.703 1.00 0.00 H new HETATM 0 HAN1 CCI B 25 -23.755 1.312 2.739 1.00 0.00 H new HETATM 0 H9C3 CCI B 25 -13.504 3.756 -7.997 1.00 0.00 H new HETATM 0 H9C2 CCI B 25 -13.580 3.087 -9.645 1.00 0.00 H new HETATM 0 H9C1 CCI B 25 -15.017 3.034 -8.596 1.00 0.00 H new HETATM 0 H8E3 CCI B 25 -18.957 0.696 9.576 1.00 0.00 H new HETATM 0 H8E2 CCI B 25 -18.994 2.246 8.703 1.00 0.00 H new HETATM 0 H8E1 CCI B 25 -20.344 1.793 9.771 1.00 0.00 H new HETATM 0 H8C3 CCI B 25 -11.080 0.275 -11.906 1.00 0.00 H new HETATM 0 H8C2 CCI B 25 -12.588 -0.435 -11.281 1.00 0.00 H new HETATM 0 H8C1 CCI B 25 -12.653 0.896 -12.460 1.00 0.00 H new HETATM 0 H7E2 CCI B 25 -20.966 1.449 7.399 1.00 0.00 H new HETATM 0 H7E1 CCI B 25 -20.929 -0.078 8.258 1.00 0.00 H new HETATM 0 H7D3 CCI B 25 -7.226 2.981 -7.408 1.00 0.00 H new HETATM 0 H7D2 CCI B 25 -6.199 1.528 -7.436 1.00 0.00 H new HETATM 0 H7D1 CCI B 25 -5.496 3.105 -7.006 1.00 0.00 H new HETATM 0 H7C3 CCI B 25 -8.916 -0.519 -5.525 1.00 0.00 H new HETATM 0 H7C2 CCI B 25 -8.425 1.188 -5.636 1.00 0.00 H new HETATM 0 H7C1 CCI B 25 -9.882 0.739 -4.717 1.00 0.00 H new HETATM 0 H6E3 CCI B 25 -16.996 -3.134 4.523 1.00 0.00 H new HETATM 0 H6E2 CCI B 25 -16.161 -1.653 5.051 1.00 0.00 H new HETATM 0 H6E1 CCI B 25 -16.258 -3.057 6.141 1.00 0.00 H new HETATM 0 H6D3 CCI B 25 -6.539 2.124 -14.052 1.00 0.00 H new HETATM 0 H6D2 CCI B 25 -5.841 0.545 -13.618 1.00 0.00 H new HETATM 0 H6D1 CCI B 25 -7.519 0.646 -14.204 1.00 0.00 H new HETATM 0 H6B3 CCI B 25 -14.947 0.909 -6.260 1.00 0.00 H new HETATM 0 H6B2 CCI B 25 -14.873 -0.189 -4.862 1.00 0.00 H new HETATM 0 H6B1 CCI B 25 -16.437 0.164 -5.634 1.00 0.00 H new HETATM 0 H6A3 CCI B 25 -19.582 3.996 -2.122 1.00 0.00 H new HETATM 0 H6A2 CCI B 25 -21.262 3.444 -1.929 1.00 0.00 H new HETATM 0 H6A1 CCI B 25 -20.638 4.765 -0.914 1.00 0.00 H new HETATM 0 H5E2 CCI B 25 -21.624 0.640 5.423 1.00 0.00 H new HETATM 0 H5E1 CCI B 25 -20.247 0.998 4.400 1.00 0.00 H new HETATM 0 H2E2 CCI B 25 -19.914 -2.934 4.307 1.00 0.00 H new HETATM 0 H2E1 CCI B 25 -18.592 -2.496 3.243 1.00 0.00 H new HETATM 0 H2B2 CCI B 25 -15.712 3.921 -1.262 1.00 0.00 H new HETATM 0 H2B1 CCI B 25 -14.871 2.386 -1.353 1.00 0.00 H new HETATM 0 HAB CCI B 25 -18.400 1.453 -2.876 1.00 0.00 H new HETATM 0 H5D CCI B 25 -7.402 0.344 -11.736 1.00 0.00 H new HETATM 0 H5B CCI B 25 -16.237 2.518 -4.960 1.00 0.00 H new HETATM 0 H5A CCI B 25 -19.042 3.177 0.153 1.00 0.00 H new HETATM 0 H4E CCI B 25 -20.517 -1.374 6.276 1.00 0.00 H new HETATM 0 H4D CCI B 25 -5.941 2.990 -11.712 1.00 0.00 H new HETATM 0 H4B CCI B 25 -13.774 1.665 -3.418 1.00 0.00 H new HETATM 0 H4A CCI B 25 -20.405 1.103 -1.585 1.00 0.00 H new HETATM 0 H3E CCI B 25 -18.126 -0.496 4.502 1.00 0.00 H new HETATM 0 H3D CCI B 25 -7.069 1.242 -9.451 1.00 0.00 H new HETATM 0 H3B CCI B 25 -13.694 4.092 -2.784 1.00 0.00 H new HETATM 0 H3A CCI B 25 -18.308 0.709 0.545 1.00 0.00 H new HETATM 0 H2D CCI B 25 -8.632 3.153 -9.081 1.00 0.00 H new HETATM 0 H2A CCI B 25 -21.198 -0.132 0.962 1.00 0.00 H new HETATM 0 H1E CCI B 25 -20.860 -1.876 2.293 1.00 0.00 H new HETATM 0 H1D CCI B 25 -9.982 2.797 -11.077 1.00 0.00 H new HETATM 0 H1B CCI B 25 -17.481 2.979 -2.991 1.00 0.00 H new HETATM 0 H1A CCI B 25 -19.805 2.233 2.143 1.00 0.00 H new HETATM 881 C1 NBU B 26 -3.859 2.007 -11.237 1.00 0.00 C HETATM 882 C2 NBU B 26 -2.630 1.230 -10.758 1.00 0.00 C HETATM 883 C3 NBU B 26 -2.616 1.044 -9.233 1.00 0.00 C HETATM 884 C4 NBU B 26 -1.219 0.596 -8.791 1.00 0.00 C HETATM 0 H43 NBU B 26 -0.969 -0.348 -9.276 1.00 0.00 H new HETATM 0 H42 NBU B 26 -0.488 1.354 -9.073 1.00 0.00 H new HETATM 0 H32 NBU B 26 -2.885 1.978 -8.739 1.00 0.00 H new HETATM 0 H31 NBU B 26 -3.359 0.302 -8.939 1.00 0.00 H new HETATM 0 H22 NBU B 26 -2.609 0.253 -11.241 1.00 0.00 H new HETATM 0 H21 NBU B 26 -1.727 1.757 -11.066 1.00 0.00 H new HETATM 0 H12 NBU B 26 -3.867 2.995 -10.777 1.00 0.00 H new HETATM 0 H11 NBU B 26 -3.823 2.112 -12.321 1.00 0.00 H new HETATM 893 C1D CCI B 27 2.866 0.129 11.268 1.00 0.00 C HETATM 894 C2D CCI B 27 1.527 -0.585 11.476 1.00 0.00 C HETATM 895 C3D CCI B 27 1.669 -1.663 12.553 1.00 0.00 C HETATM 896 C4D CCI B 27 2.212 -1.010 13.828 1.00 0.00 C HETATM 897 C5D CCI B 27 3.537 -0.309 13.496 1.00 0.00 C HETATM 898 C6D CCI B 27 4.118 0.404 14.720 1.00 0.00 C HETATM 899 OCD CCI B 27 3.826 -0.738 10.690 1.00 0.00 O HETATM 900 O2D CCI B 27 0.557 0.359 11.875 1.00 0.00 O HETATM 901 O3D CCI B 27 0.426 -2.310 12.794 1.00 0.00 O HETATM 902 O4D CCI B 27 2.452 -2.006 14.801 1.00 0.00 O HETATM 903 OD CCI B 27 3.351 0.667 12.485 1.00 0.00 O HETATM 904 C7D CCI B 27 0.209 -3.425 11.941 1.00 0.00 C HETATM 905 C4C CCI B 27 3.751 -1.082 9.289 1.00 0.00 C HETATM 906 C5C CCI B 27 4.164 -0.152 8.329 1.00 0.00 C HETATM 907 C6C CCI B 27 4.229 -0.519 6.974 1.00 0.00 C HETATM 908 C1C CCI B 27 3.705 -1.771 6.537 1.00 0.00 C HETATM 909 C2C CCI B 27 3.314 -2.712 7.538 1.00 0.00 C HETATM 910 I CCI B 27 3.883 -4.624 10.945 1.00 0.00 I HETATM 911 O5C CCI B 27 4.583 1.173 8.745 1.00 0.00 O HETATM 912 C8C CCI B 27 5.823 1.372 9.394 1.00 0.00 C HETATM 913 O6C CCI B 27 5.019 0.340 6.112 1.00 0.00 O HETATM 914 C9C CCI B 27 4.471 1.494 5.516 1.00 0.00 C HETATM 915 C7C CCI B 27 2.842 -4.113 7.198 1.00 0.00 C HETATM 916 CBC CCI B 27 3.627 -2.100 5.152 1.00 0.00 C HETATM 917 OBC CCI B 27 2.975 -3.050 4.729 1.00 0.00 O HETATM 918 SBC CCI B 27 4.486 -1.235 3.843 1.00 0.00 S HETATM 919 C1B CCI B 27 2.204 -0.091 -0.021 1.00 0.00 C HETATM 920 C2B CCI B 27 1.559 -1.139 0.891 1.00 0.00 C HETATM 921 C3B CCI B 27 2.112 -1.180 2.318 1.00 0.00 C HETATM 922 C4B CCI B 27 3.636 -1.264 2.232 1.00 0.00 C HETATM 923 C5B CCI B 27 4.137 -0.103 1.362 1.00 0.00 C HETATM 924 C6B CCI B 27 5.663 -0.043 1.274 1.00 0.00 C HETATM 925 OAB CCI B 27 1.663 -0.503 -1.318 1.00 0.00 O HETATM 926 O3B CCI B 27 1.675 -0.049 3.032 1.00 0.00 O HETATM 927 OB CCI B 27 3.623 -0.269 0.054 1.00 0.00 O HETATM 928 C1A CCI B 27 0.583 -0.020 -5.619 1.00 0.00 C HETATM 929 C2A CCI B 27 2.114 -0.016 -5.463 1.00 0.00 C HETATM 930 C3A CCI B 27 2.510 -0.156 -3.991 1.00 0.00 C HETATM 931 C4A CCI B 27 1.773 0.878 -3.137 1.00 0.00 C HETATM 932 C5A CCI B 27 0.266 0.696 -3.387 1.00 0.00 C HETATM 933 C6A CCI B 27 -0.547 1.658 -2.527 1.00 0.00 C HETATM 934 ORA CCI B 27 0.286 0.287 -6.970 1.00 0.00 O HETATM 935 OEA CCI B 27 2.712 -1.124 -6.130 1.00 0.00 O HETATM 936 O3A CCI B 27 3.907 0.009 -3.850 1.00 0.00 O HETATM 937 NAB CCI B 27 2.102 0.725 -1.730 1.00 0.00 N HETATM 938 OA CCI B 27 -0.007 0.943 -4.757 1.00 0.00 O HETATM 939 CAN CCI B 27 -1.095 0.430 -7.272 1.00 0.00 C HETATM 940 C1E CCI B 27 3.473 -0.786 -7.284 1.00 0.00 C HETATM 941 C2E CCI B 27 4.455 -1.918 -7.588 1.00 0.00 C HETATM 942 C3E CCI B 27 3.681 -3.190 -7.950 1.00 0.00 C HETATM 943 C4E CCI B 27 2.716 -2.893 -9.099 1.00 0.00 C HETATM 944 C5E CCI B 27 1.839 -1.689 -8.734 1.00 0.00 C HETATM 945 O3E CCI B 27 4.521 -4.252 -8.381 1.00 0.00 O HETATM 946 C6E CCI B 27 5.397 -4.742 -7.378 1.00 0.00 C HETATM 947 N4E CCI B 27 1.947 -4.121 -9.398 1.00 0.00 N HETATM 948 C7E CCI B 27 0.943 -4.062 -10.485 1.00 0.00 C HETATM 949 C8E CCI B 27 -0.475 -3.781 -9.963 1.00 0.00 C HETATM 950 OE CCI B 27 2.644 -0.565 -8.410 1.00 0.00 O HETATM 951 C3C CCI B 27 3.454 -2.394 8.907 1.00 0.00 C HETATM 0 HOD4 CCI B 27 1.880 -2.782 14.623 1.00 0.00 H new HETATM 0 HOD2 CCI B 27 -0.278 0.196 11.389 1.00 0.00 H new HETATM 0 HOB3 CCI B 27 0.698 -0.064 3.102 1.00 0.00 H new HETATM 0 HOA3 CCI B 27 4.360 -0.343 -4.645 1.00 0.00 H new HETATM 0 HNE2 CCI B 27 2.103 -4.981 -8.872 1.00 0.00 H new HETATM 0 HAN3 CCI B 27 -1.615 -0.501 -7.046 1.00 0.00 H new HETATM 0 HAN2 CCI B 27 -1.517 1.237 -6.672 1.00 0.00 H new HETATM 0 H9C3 CCI B 27 3.631 1.212 4.881 1.00 0.00 H new HETATM 0 H9C2 CCI B 27 4.125 2.175 6.293 1.00 0.00 H new HETATM 0 H9C1 CCI B 27 5.232 1.988 4.913 1.00 0.00 H new HETATM 0 H8E3 CCI B 27 -0.773 -4.572 -9.275 1.00 0.00 H new HETATM 0 H8E2 CCI B 27 -0.488 -2.823 -9.443 1.00 0.00 H new HETATM 0 H8E1 CCI B 27 -1.171 -3.748 -10.801 1.00 0.00 H new HETATM 0 H8C3 CCI B 27 5.846 0.796 10.319 1.00 0.00 H new HETATM 0 H8C2 CCI B 27 6.632 1.043 8.742 1.00 0.00 H new HETATM 0 H8C1 CCI B 27 5.949 2.430 9.622 1.00 0.00 H new HETATM 0 H7E2 CCI B 27 1.226 -3.284 -11.195 1.00 0.00 H new HETATM 0 H7E1 CCI B 27 0.946 -5.006 -11.029 1.00 0.00 H new HETATM 0 H7D3 CCI B 27 0.215 -3.095 10.902 1.00 0.00 H new HETATM 0 H7D2 CCI B 27 1.000 -4.159 12.093 1.00 0.00 H new HETATM 0 H7D1 CCI B 27 -0.755 -3.878 12.172 1.00 0.00 H new HETATM 0 H7C3 CCI B 27 3.549 -4.842 7.596 1.00 0.00 H new HETATM 0 H7C2 CCI B 27 1.860 -4.283 7.638 1.00 0.00 H new HETATM 0 H7C1 CCI B 27 2.778 -4.223 6.115 1.00 0.00 H new HETATM 0 H6E3 CCI B 27 6.048 -3.936 -7.038 1.00 0.00 H new HETATM 0 H6E2 CCI B 27 4.814 -5.116 -6.537 1.00 0.00 H new HETATM 0 H6E1 CCI B 27 6.003 -5.550 -7.787 1.00 0.00 H new HETATM 0 H6D3 CCI B 27 3.411 1.154 15.074 1.00 0.00 H new HETATM 0 H6D2 CCI B 27 4.302 -0.323 15.511 1.00 0.00 H new HETATM 0 H6D1 CCI B 27 5.055 0.889 14.448 1.00 0.00 H new HETATM 0 H6B3 CCI B 27 6.080 0.086 2.273 1.00 0.00 H new HETATM 0 H6B2 CCI B 27 6.039 -0.970 0.840 1.00 0.00 H new HETATM 0 H6B1 CCI B 27 5.958 0.798 0.646 1.00 0.00 H new HETATM 0 H6A3 CCI B 27 -0.341 1.468 -1.474 1.00 0.00 H new HETATM 0 H6A2 CCI B 27 -0.273 2.684 -2.771 1.00 0.00 H new HETATM 0 H6A1 CCI B 27 -1.609 1.511 -2.721 1.00 0.00 H new HETATM 0 H5E2 CCI B 27 1.182 -1.444 -9.569 1.00 0.00 H new HETATM 0 H5E1 CCI B 27 1.199 -1.941 -7.888 1.00 0.00 H new HETATM 0 H2E2 CCI B 27 5.110 -1.633 -8.411 1.00 0.00 H new HETATM 0 H2E1 CCI B 27 5.092 -2.102 -6.723 1.00 0.00 H new HETATM 0 H2B2 CCI B 27 0.487 -0.948 0.938 1.00 0.00 H new HETATM 0 H2B1 CCI B 27 1.688 -2.122 0.438 1.00 0.00 H new HETATM 0 HAB CCI B 27 2.579 1.415 -1.149 1.00 0.00 H new HETATM 0 H5D CCI B 27 4.222 -1.087 13.159 1.00 0.00 H new HETATM 0 H5B CCI B 27 3.795 0.824 1.823 1.00 0.00 H new HETATM 0 H5A CCI B 27 -0.015 -0.324 -3.123 1.00 0.00 H new HETATM 0 H4E CCI B 27 3.249 -2.617 -10.009 1.00 0.00 H new HETATM 0 H4D CCI B 27 1.489 -0.291 14.212 1.00 0.00 H new HETATM 0 H4B CCI B 27 3.875 -2.233 1.794 1.00 0.00 H new HETATM 0 H4A CCI B 27 2.078 1.887 -3.415 1.00 0.00 H new HETATM 0 H3E CCI B 27 3.164 -3.498 -7.041 1.00 0.00 H new HETATM 0 H3D CCI B 27 2.365 -2.431 12.214 1.00 0.00 H new HETATM 0 H3B CCI B 27 1.746 -2.053 2.859 1.00 0.00 H new HETATM 0 H3A CCI B 27 2.231 -1.152 -3.649 1.00 0.00 H new HETATM 0 H2D CCI B 27 1.220 -1.058 10.543 1.00 0.00 H new HETATM 0 H2A CCI B 27 2.457 0.928 -5.888 1.00 0.00 H new HETATM 0 H1E CCI B 27 4.011 0.139 -7.078 1.00 0.00 H new HETATM 0 H1D CCI B 27 2.694 0.953 10.575 1.00 0.00 H new HETATM 0 H1B CCI B 27 2.011 0.957 0.208 1.00 0.00 H new HETATM 0 H1A CCI B 27 0.180 -0.997 -5.352 1.00 0.00 H new