USER MOD reduce.3.24.130724 H: found=0, std=0, add=253, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 253 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 Single : A 1 DC O5' : rot 180:sc= 0 USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.3 (180deg=-1.3) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.604 (180deg=-0.965) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : B 12 DG O5' : rot 28:sc= 0.0132 USER MOD Single : B 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 19 DT C7 :methyl 150:sc= -0.256 (180deg=-0.256) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 7.606 -13.962 0.072 1.00 0.00 O ATOM 2 C5' DC A 1 7.933 -14.869 -0.960 1.00 0.00 C ATOM 3 C4' DC A 1 7.035 -14.670 -2.188 1.00 0.00 C ATOM 4 O4' DC A 1 5.699 -14.891 -1.768 1.00 0.00 O ATOM 5 C3' DC A 1 7.116 -13.244 -2.750 1.00 0.00 C ATOM 6 O3' DC A 1 7.208 -13.319 -4.163 1.00 0.00 O ATOM 7 C2' DC A 1 5.792 -12.639 -2.290 1.00 0.00 C ATOM 8 C1' DC A 1 4.891 -13.870 -2.320 1.00 0.00 C ATOM 9 N1 DC A 1 3.677 -13.723 -1.468 1.00 0.00 N ATOM 10 C2 DC A 1 2.418 -13.745 -2.073 1.00 0.00 C ATOM 11 O2 DC A 1 2.297 -13.819 -3.293 1.00 0.00 O ATOM 12 N3 DC A 1 1.310 -13.683 -1.278 1.00 0.00 N ATOM 13 C4 DC A 1 1.417 -13.560 0.054 1.00 0.00 C ATOM 14 N4 DC A 1 0.302 -13.503 0.788 1.00 0.00 N ATOM 15 C5 DC A 1 2.701 -13.513 0.696 1.00 0.00 C ATOM 16 C6 DC A 1 3.790 -13.602 -0.102 1.00 0.00 C ATOM 0 H5' DC A 1 7.830 -15.891 -0.594 1.00 0.00 H new ATOM 0 H5'' DC A 1 8.977 -14.736 -1.246 1.00 0.00 H new ATOM 0 H4' DC A 1 7.360 -15.358 -2.969 1.00 0.00 H new ATOM 0 H3' DC A 1 7.973 -12.657 -2.420 1.00 0.00 H new ATOM 0 H2' DC A 1 5.861 -12.201 -1.294 1.00 0.00 H new ATOM 0 H2'' DC A 1 5.441 -11.854 -2.960 1.00 0.00 H new ATOM 0 HO5' DC A 1 8.194 -14.115 0.841 1.00 0.00 H new ATOM 0 H1' DC A 1 4.533 -14.059 -3.332 1.00 0.00 H new ATOM 0 H41 DC A 1 0.363 -13.410 1.802 1.00 0.00 H new ATOM 0 H42 DC A 1 -0.610 -13.553 0.334 1.00 0.00 H new ATOM 0 H5 DC A 1 2.793 -13.411 1.767 1.00 0.00 H new ATOM 0 H6 DC A 1 4.773 -13.577 0.345 1.00 0.00 H new ATOM 29 P DG A 2 7.426 -12.008 -5.085 1.00 0.00 P ATOM 30 OP1 DG A 2 8.205 -12.413 -6.275 1.00 0.00 O ATOM 31 OP2 DG A 2 7.920 -10.910 -4.225 1.00 0.00 O ATOM 32 O5' DG A 2 5.930 -11.632 -5.560 1.00 0.00 O ATOM 33 C5' DG A 2 5.270 -12.362 -6.578 1.00 0.00 C ATOM 34 C4' DG A 2 3.931 -11.707 -6.939 1.00 0.00 C ATOM 35 O4' DG A 2 3.045 -11.867 -5.843 1.00 0.00 O ATOM 36 C3' DG A 2 4.074 -10.201 -7.209 1.00 0.00 C ATOM 37 O3' DG A 2 3.291 -9.921 -8.359 1.00 0.00 O ATOM 38 C2' DG A 2 3.494 -9.620 -5.920 1.00 0.00 C ATOM 39 C1' DG A 2 2.419 -10.621 -5.623 1.00 0.00 C ATOM 40 N9 DG A 2 1.857 -10.596 -4.260 1.00 0.00 N ATOM 41 C8 DG A 2 2.495 -10.370 -3.071 1.00 0.00 C ATOM 42 N7 DG A 2 1.738 -10.526 -2.020 1.00 0.00 N ATOM 43 C5 DG A 2 0.493 -10.847 -2.555 1.00 0.00 C ATOM 44 C6 DG A 2 -0.753 -11.100 -1.905 1.00 0.00 C ATOM 45 O6 DG A 2 -0.970 -11.203 -0.702 1.00 0.00 O ATOM 46 N1 DG A 2 -1.807 -11.236 -2.805 1.00 0.00 N ATOM 47 C2 DG A 2 -1.670 -11.183 -4.181 1.00 0.00 C ATOM 48 N2 DG A 2 -2.777 -11.321 -4.917 1.00 0.00 N ATOM 49 N3 DG A 2 -0.490 -11.003 -4.795 1.00 0.00 N ATOM 50 C4 DG A 2 0.546 -10.836 -3.928 1.00 0.00 C ATOM 0 H5' DG A 2 5.101 -13.386 -6.246 1.00 0.00 H new ATOM 0 H5'' DG A 2 5.904 -12.415 -7.463 1.00 0.00 H new ATOM 0 H4' DG A 2 3.559 -12.186 -7.845 1.00 0.00 H new ATOM 0 H3' DG A 2 5.071 -9.809 -7.412 1.00 0.00 H new ATOM 0 H2' DG A 2 4.235 -9.560 -5.123 1.00 0.00 H new ATOM 0 H2'' DG A 2 3.096 -8.615 -6.061 1.00 0.00 H new ATOM 0 H1' DG A 2 1.557 -10.402 -6.253 1.00 0.00 H new ATOM 0 H8 DG A 2 3.535 -10.087 -3.008 1.00 0.00 H new ATOM 0 H1 DG A 2 -2.742 -11.384 -2.425 1.00 0.00 H new ATOM 0 H21 DG A 2 -2.720 -11.288 -5.935 1.00 0.00 H new ATOM 0 H22 DG A 2 -3.679 -11.459 -4.461 1.00 0.00 H new ATOM 62 P DC A 3 3.040 -8.434 -8.939 1.00 0.00 P ATOM 63 OP1 DC A 3 3.264 -8.468 -10.402 1.00 0.00 O ATOM 64 OP2 DC A 3 3.768 -7.451 -8.107 1.00 0.00 O ATOM 65 O5' DC A 3 1.458 -8.257 -8.672 1.00 0.00 O ATOM 66 C5' DC A 3 0.515 -9.096 -9.318 1.00 0.00 C ATOM 67 C4' DC A 3 -0.929 -8.675 -9.019 1.00 0.00 C ATOM 68 O4' DC A 3 -1.164 -8.851 -7.631 1.00 0.00 O ATOM 69 C3' DC A 3 -1.176 -7.202 -9.353 1.00 0.00 C ATOM 70 O3' DC A 3 -2.466 -7.114 -9.939 1.00 0.00 O ATOM 71 C2' DC A 3 -1.104 -6.545 -7.976 1.00 0.00 C ATOM 72 C1' DC A 3 -1.681 -7.649 -7.087 1.00 0.00 C ATOM 73 N1 DC A 3 -1.224 -7.629 -5.669 1.00 0.00 N ATOM 74 C2 DC A 3 -2.138 -7.941 -4.657 1.00 0.00 C ATOM 75 O2 DC A 3 -3.319 -8.165 -4.911 1.00 0.00 O ATOM 76 N3 DC A 3 -1.697 -7.993 -3.366 1.00 0.00 N ATOM 77 C4 DC A 3 -0.410 -7.765 -3.068 1.00 0.00 C ATOM 78 N4 DC A 3 -0.021 -7.823 -1.791 1.00 0.00 N ATOM 79 C5 DC A 3 0.559 -7.515 -4.095 1.00 0.00 C ATOM 80 C6 DC A 3 0.106 -7.458 -5.369 1.00 0.00 C ATOM 0 H5' DC A 3 0.666 -10.126 -8.996 1.00 0.00 H new ATOM 0 H5'' DC A 3 0.685 -9.070 -10.394 1.00 0.00 H new ATOM 0 H4' DC A 3 -1.594 -9.285 -9.630 1.00 0.00 H new ATOM 0 H3' DC A 3 -0.483 -6.736 -10.053 1.00 0.00 H new ATOM 0 H2' DC A 3 -0.083 -6.285 -7.698 1.00 0.00 H new ATOM 0 H2'' DC A 3 -1.692 -5.628 -7.927 1.00 0.00 H new ATOM 0 H1' DC A 3 -2.765 -7.532 -7.073 1.00 0.00 H new ATOM 0 H41 DC A 3 0.954 -7.652 -1.547 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.700 -8.038 -1.060 1.00 0.00 H new ATOM 0 H5 DC A 3 1.605 -7.378 -3.862 1.00 0.00 H new ATOM 0 H6 DC A 3 0.807 -7.274 -6.170 1.00 0.00 H new ATOM 92 P DA A 4 -3.130 -5.713 -10.397 1.00 0.00 P ATOM 93 OP1 DA A 4 -4.086 -5.992 -11.492 1.00 0.00 O ATOM 94 OP2 DA A 4 -2.050 -4.722 -10.599 1.00 0.00 O ATOM 95 O5' DA A 4 -3.969 -5.289 -9.086 1.00 0.00 O ATOM 96 C5' DA A 4 -5.173 -5.946 -8.742 1.00 0.00 C ATOM 97 C4' DA A 4 -5.738 -5.374 -7.441 1.00 0.00 C ATOM 98 O4' DA A 4 -4.981 -5.785 -6.327 1.00 0.00 O ATOM 99 C3' DA A 4 -5.915 -3.854 -7.429 1.00 0.00 C ATOM 100 O3' DA A 4 -7.285 -3.506 -7.262 1.00 0.00 O ATOM 101 C2' DA A 4 -5.084 -3.581 -6.218 1.00 0.00 C ATOM 102 C1' DA A 4 -5.213 -4.799 -5.350 1.00 0.00 C ATOM 103 N9 DA A 4 -4.113 -4.892 -4.395 1.00 0.00 N ATOM 104 C8 DA A 4 -2.803 -4.810 -4.722 1.00 0.00 C ATOM 105 N7 DA A 4 -1.980 -4.902 -3.716 1.00 0.00 N ATOM 106 C5 DA A 4 -2.839 -5.078 -2.632 1.00 0.00 C ATOM 107 C6 DA A 4 -2.619 -5.259 -1.252 1.00 0.00 C ATOM 108 N6 DA A 4 -1.396 -5.318 -0.717 1.00 0.00 N ATOM 109 N1 DA A 4 -3.689 -5.381 -0.445 1.00 0.00 N ATOM 110 C2 DA A 4 -4.911 -5.338 -0.970 1.00 0.00 C ATOM 111 N3 DA A 4 -5.252 -5.189 -2.247 1.00 0.00 N ATOM 112 C4 DA A 4 -4.152 -5.066 -3.037 1.00 0.00 C ATOM 0 H5' DA A 4 -4.992 -7.015 -8.629 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.901 -5.829 -9.545 1.00 0.00 H new ATOM 0 H4' DA A 4 -6.743 -5.790 -7.375 1.00 0.00 H new ATOM 0 H3' DA A 4 -5.632 -3.303 -8.326 1.00 0.00 H new ATOM 0 H2' DA A 4 -4.044 -3.403 -6.490 1.00 0.00 H new ATOM 0 H2'' DA A 4 -5.434 -2.690 -5.696 1.00 0.00 H new ATOM 0 H1' DA A 4 -6.141 -4.842 -4.779 1.00 0.00 H new ATOM 0 H8 DA A 4 -2.465 -4.678 -5.739 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.285 -5.450 0.288 1.00 0.00 H new ATOM 0 H62 DA A 4 -0.574 -5.231 -1.314 1.00 0.00 H new ATOM 0 H2 DA A 4 -5.729 -5.436 -0.271 1.00 0.00 H new ATOM 124 P DT A 5 -7.788 -1.981 -7.019 1.00 0.00 P ATOM 125 OP1 DT A 5 -9.169 -1.869 -7.538 1.00 0.00 O ATOM 126 OP2 DT A 5 -6.743 -1.059 -7.517 1.00 0.00 O ATOM 127 O5' DT A 5 -7.846 -1.842 -5.404 1.00 0.00 O ATOM 128 C5' DT A 5 -8.835 -2.518 -4.649 1.00 0.00 C ATOM 129 C4' DT A 5 -8.704 -2.271 -3.140 1.00 0.00 C ATOM 130 O4' DT A 5 -7.488 -2.786 -2.666 1.00 0.00 O ATOM 131 C3' DT A 5 -8.828 -0.808 -2.689 1.00 0.00 C ATOM 132 O3' DT A 5 -9.951 -0.721 -1.822 1.00 0.00 O ATOM 133 C2' DT A 5 -7.514 -0.563 -1.957 1.00 0.00 C ATOM 134 C1' DT A 5 -7.075 -1.974 -1.586 1.00 0.00 C ATOM 135 N1 DT A 5 -5.603 -2.043 -1.621 1.00 0.00 N ATOM 136 C2 DT A 5 -4.903 -2.221 -0.440 1.00 0.00 C ATOM 137 O2 DT A 5 -5.443 -2.521 0.621 1.00 0.00 O ATOM 138 N3 DT A 5 -3.534 -2.033 -0.524 1.00 0.00 N ATOM 139 C4 DT A 5 -2.801 -1.877 -1.691 1.00 0.00 C ATOM 140 O4 DT A 5 -1.572 -1.871 -1.638 1.00 0.00 O ATOM 141 C5 DT A 5 -3.613 -1.732 -2.892 1.00 0.00 C ATOM 142 C7 DT A 5 -2.924 -1.498 -4.224 1.00 0.00 C ATOM 143 C6 DT A 5 -4.971 -1.799 -2.812 1.00 0.00 C ATOM 0 H5' DT A 5 -8.766 -3.588 -4.845 1.00 0.00 H new ATOM 0 H5'' DT A 5 -9.822 -2.196 -4.981 1.00 0.00 H new ATOM 0 H4' DT A 5 -9.561 -2.790 -2.710 1.00 0.00 H new ATOM 0 H3' DT A 5 -8.981 -0.079 -3.484 1.00 0.00 H new ATOM 0 H2' DT A 5 -6.782 -0.064 -2.593 1.00 0.00 H new ATOM 0 H2'' DT A 5 -7.651 0.064 -1.076 1.00 0.00 H new ATOM 0 H1' DT A 5 -7.470 -2.262 -0.612 1.00 0.00 H new ATOM 0 H3 DT A 5 -3.016 -2.007 0.354 1.00 0.00 H new ATOM 0 H71 DT A 5 -3.527 -1.924 -5.026 1.00 0.00 H new ATOM 0 H72 DT A 5 -2.805 -0.427 -4.389 1.00 0.00 H new ATOM 0 H73 DT A 5 -1.944 -1.974 -4.215 1.00 0.00 H new ATOM 0 H6 DT A 5 -5.561 -1.657 -3.705 1.00 0.00 H new ATOM 156 P DA A 6 -10.402 0.645 -1.078 1.00 0.00 P ATOM 157 OP1 DA A 6 -11.794 0.466 -0.609 1.00 0.00 O ATOM 158 OP2 DA A 6 -10.069 1.784 -1.961 1.00 0.00 O ATOM 159 O5' DA A 6 -9.443 0.722 0.223 1.00 0.00 O ATOM 160 C5' DA A 6 -9.498 -0.243 1.260 1.00 0.00 C ATOM 161 C4' DA A 6 -8.482 0.069 2.372 1.00 0.00 C ATOM 162 O4' DA A 6 -7.212 -0.431 1.991 1.00 0.00 O ATOM 163 C3' DA A 6 -8.317 1.567 2.697 1.00 0.00 C ATOM 164 O3' DA A 6 -8.975 1.880 3.915 1.00 0.00 O ATOM 165 C2' DA A 6 -6.815 1.634 2.785 1.00 0.00 C ATOM 166 C1' DA A 6 -6.256 0.254 2.774 1.00 0.00 C ATOM 167 N9 DA A 6 -4.979 0.328 2.031 1.00 0.00 N ATOM 168 C8 DA A 6 -4.856 0.566 0.700 1.00 0.00 C ATOM 169 N7 DA A 6 -3.651 0.698 0.242 1.00 0.00 N ATOM 170 C5 DA A 6 -2.898 0.528 1.386 1.00 0.00 C ATOM 171 C6 DA A 6 -1.515 0.423 1.589 1.00 0.00 C ATOM 172 N6 DA A 6 -0.652 0.363 0.571 1.00 0.00 N ATOM 173 N1 DA A 6 -1.075 0.303 2.852 1.00 0.00 N ATOM 174 C2 DA A 6 -1.965 0.280 3.842 1.00 0.00 C ATOM 175 N3 DA A 6 -3.289 0.326 3.785 1.00 0.00 N ATOM 176 C4 DA A 6 -3.699 0.432 2.501 1.00 0.00 C ATOM 0 H5' DA A 6 -9.297 -1.233 0.849 1.00 0.00 H new ATOM 0 H5'' DA A 6 -10.503 -0.270 1.681 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.876 -0.409 3.269 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.745 2.276 1.989 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.416 2.206 1.948 1.00 0.00 H new ATOM 0 H2'' DA A 6 -6.516 2.152 3.696 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.081 -0.203 3.748 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.719 0.642 0.055 1.00 0.00 H new ATOM 0 H61 DA A 6 0.348 0.287 0.754 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.994 0.393 -0.390 1.00 0.00 H new ATOM 0 H2 DA A 6 -1.548 0.214 4.836 1.00 0.00 H new ATOM 188 P DT A 7 -8.941 3.355 4.584 1.00 0.00 P ATOM 189 OP1 DT A 7 -9.944 3.383 5.672 1.00 0.00 O ATOM 190 OP2 DT A 7 -9.008 4.361 3.501 1.00 0.00 O ATOM 191 O5' DT A 7 -7.477 3.446 5.258 1.00 0.00 O ATOM 192 C5' DT A 7 -7.044 2.499 6.218 1.00 0.00 C ATOM 193 C4' DT A 7 -5.586 2.747 6.623 1.00 0.00 C ATOM 194 O4' DT A 7 -4.765 2.484 5.494 1.00 0.00 O ATOM 195 C3' DT A 7 -5.357 4.204 7.041 1.00 0.00 C ATOM 196 O3' DT A 7 -4.758 4.237 8.326 1.00 0.00 O ATOM 197 C2' DT A 7 -4.424 4.708 5.943 1.00 0.00 C ATOM 198 C1' DT A 7 -3.722 3.437 5.474 1.00 0.00 C ATOM 199 N1 DT A 7 -3.192 3.565 4.100 1.00 0.00 N ATOM 200 C2 DT A 7 -1.824 3.406 3.875 1.00 0.00 C ATOM 201 O2 DT A 7 -0.998 3.250 4.771 1.00 0.00 O ATOM 202 N3 DT A 7 -1.419 3.431 2.550 1.00 0.00 N ATOM 203 C4 DT A 7 -2.237 3.648 1.452 1.00 0.00 C ATOM 204 O4 DT A 7 -1.748 3.635 0.325 1.00 0.00 O ATOM 205 C5 DT A 7 -3.637 3.874 1.786 1.00 0.00 C ATOM 206 C7 DT A 7 -4.652 4.151 0.701 1.00 0.00 C ATOM 207 C6 DT A 7 -4.056 3.821 3.074 1.00 0.00 C ATOM 0 H5' DT A 7 -7.145 1.493 5.811 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.683 2.552 7.099 1.00 0.00 H new ATOM 0 H4' DT A 7 -5.346 2.100 7.466 1.00 0.00 H new ATOM 0 H3' DT A 7 -6.257 4.812 7.128 1.00 0.00 H new ATOM 0 H2' DT A 7 -4.976 5.186 5.133 1.00 0.00 H new ATOM 0 H2'' DT A 7 -3.715 5.443 6.323 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.863 3.186 6.096 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.428 3.275 2.366 1.00 0.00 H new ATOM 0 H71 DT A 7 -4.165 4.657 -0.132 1.00 0.00 H new ATOM 0 H72 DT A 7 -5.080 3.210 0.354 1.00 0.00 H new ATOM 0 H73 DT A 7 -5.445 4.785 1.098 1.00 0.00 H new ATOM 0 H6 DT A 7 -5.100 3.986 3.295 1.00 0.00 H new ATOM 220 P DA A 8 -4.501 5.621 9.126 1.00 0.00 P ATOM 221 OP1 DA A 8 -4.477 5.316 10.574 1.00 0.00 O ATOM 222 OP2 DA A 8 -5.434 6.648 8.609 1.00 0.00 O ATOM 223 O5' DA A 8 -3.009 6.028 8.672 1.00 0.00 O ATOM 224 C5' DA A 8 -1.878 5.366 9.202 1.00 0.00 C ATOM 225 C4' DA A 8 -0.591 5.895 8.567 1.00 0.00 C ATOM 226 O4' DA A 8 -0.518 5.482 7.214 1.00 0.00 O ATOM 227 C3' DA A 8 -0.468 7.427 8.594 1.00 0.00 C ATOM 228 O3' DA A 8 0.725 7.788 9.273 1.00 0.00 O ATOM 229 C2' DA A 8 -0.444 7.730 7.121 1.00 0.00 C ATOM 230 C1' DA A 8 0.188 6.503 6.546 1.00 0.00 C ATOM 231 N9 DA A 8 -0.041 6.409 5.098 1.00 0.00 N ATOM 232 C8 DA A 8 -1.220 6.580 4.437 1.00 0.00 C ATOM 233 N7 DA A 8 -1.146 6.421 3.145 1.00 0.00 N ATOM 234 C5 DA A 8 0.200 6.135 2.938 1.00 0.00 C ATOM 235 C6 DA A 8 0.955 5.826 1.788 1.00 0.00 C ATOM 236 N6 DA A 8 0.415 5.672 0.572 1.00 0.00 N ATOM 237 N1 DA A 8 2.284 5.661 1.930 1.00 0.00 N ATOM 238 C2 DA A 8 2.833 5.760 3.139 1.00 0.00 C ATOM 239 N3 DA A 8 2.229 5.996 4.298 1.00 0.00 N ATOM 240 C4 DA A 8 0.892 6.173 4.124 1.00 0.00 C ATOM 0 H5' DA A 8 -1.962 4.294 9.024 1.00 0.00 H new ATOM 0 H5'' DA A 8 -1.841 5.508 10.282 1.00 0.00 H new ATOM 0 H4' DA A 8 0.222 5.484 9.165 1.00 0.00 H new ATOM 0 H3' DA A 8 -1.252 7.973 9.118 1.00 0.00 H new ATOM 0 H2' DA A 8 -1.446 7.894 6.724 1.00 0.00 H new ATOM 0 H2'' DA A 8 0.136 8.626 6.901 1.00 0.00 H new ATOM 0 H1' DA A 8 1.270 6.471 6.674 1.00 0.00 H new ATOM 0 H8 DA A 8 -2.142 6.827 4.943 1.00 0.00 H new ATOM 0 H61 DA A 8 1.010 5.448 -0.226 1.00 0.00 H new ATOM 0 H62 DA A 8 -0.591 5.778 0.444 1.00 0.00 H new ATOM 0 H2 DA A 8 3.905 5.632 3.183 1.00 0.00 H new ATOM 252 P DG A 9 1.152 9.326 9.542 1.00 0.00 P ATOM 253 OP1 DG A 9 1.533 9.456 10.966 1.00 0.00 O ATOM 254 OP2 DG A 9 0.121 10.222 8.973 1.00 0.00 O ATOM 255 O5' DG A 9 2.485 9.475 8.645 1.00 0.00 O ATOM 256 C5' DG A 9 3.659 8.752 8.960 1.00 0.00 C ATOM 257 C4' DG A 9 4.856 9.185 8.104 1.00 0.00 C ATOM 258 O4' DG A 9 4.600 8.862 6.747 1.00 0.00 O ATOM 259 C3' DG A 9 5.130 10.689 8.172 1.00 0.00 C ATOM 260 O3' DG A 9 6.544 10.802 8.089 1.00 0.00 O ATOM 261 C2' DG A 9 4.356 11.207 6.964 1.00 0.00 C ATOM 262 C1' DG A 9 4.478 10.049 5.977 1.00 0.00 C ATOM 263 N9 DG A 9 3.336 9.810 5.068 1.00 0.00 N ATOM 264 C8 DG A 9 1.997 10.053 5.246 1.00 0.00 C ATOM 265 N7 DG A 9 1.266 9.776 4.200 1.00 0.00 N ATOM 266 C5 DG A 9 2.182 9.315 3.258 1.00 0.00 C ATOM 267 C6 DG A 9 2.000 8.933 1.892 1.00 0.00 C ATOM 268 O6 DG A 9 0.951 8.866 1.257 1.00 0.00 O ATOM 269 N1 DG A 9 3.200 8.610 1.260 1.00 0.00 N ATOM 270 C2 DG A 9 4.432 8.604 1.884 1.00 0.00 C ATOM 271 N2 DG A 9 5.497 8.294 1.139 1.00 0.00 N ATOM 272 N3 DG A 9 4.602 8.945 3.170 1.00 0.00 N ATOM 273 C4 DG A 9 3.446 9.298 3.796 1.00 0.00 C ATOM 0 H5' DG A 9 3.477 7.687 8.815 1.00 0.00 H new ATOM 0 H5'' DG A 9 3.899 8.894 10.014 1.00 0.00 H new ATOM 0 H4' DG A 9 5.726 8.659 8.498 1.00 0.00 H new ATOM 0 H3' DG A 9 4.825 11.247 9.057 1.00 0.00 H new ATOM 0 H2' DG A 9 3.316 11.424 7.210 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.788 12.126 6.568 1.00 0.00 H new ATOM 0 H1' DG A 9 5.324 10.313 5.343 1.00 0.00 H new ATOM 0 H8 DG A 9 1.585 10.438 6.167 1.00 0.00 H new ATOM 0 H1 DG A 9 3.166 8.362 0.271 1.00 0.00 H new ATOM 0 H21 DG A 9 6.426 8.278 1.559 1.00 0.00 H new ATOM 0 H22 DG A 9 5.381 8.074 0.150 1.00 0.00 H new ATOM 285 P DC A 10 7.359 12.164 7.781 1.00 0.00 P ATOM 286 OP1 DC A 10 8.614 12.132 8.564 1.00 0.00 O ATOM 287 OP2 DC A 10 6.450 13.326 7.900 1.00 0.00 O ATOM 288 O5' DC A 10 7.732 11.942 6.223 1.00 0.00 O ATOM 289 C5' DC A 10 8.479 10.804 5.823 1.00 0.00 C ATOM 290 C4' DC A 10 8.853 10.824 4.335 1.00 0.00 C ATOM 291 O4' DC A 10 7.646 10.600 3.641 1.00 0.00 O ATOM 292 C3' DC A 10 9.456 12.156 3.862 1.00 0.00 C ATOM 293 O3' DC A 10 10.777 11.952 3.381 1.00 0.00 O ATOM 294 C2' DC A 10 8.507 12.586 2.745 1.00 0.00 C ATOM 295 C1' DC A 10 7.626 11.389 2.473 1.00 0.00 C ATOM 296 N1 DC A 10 6.214 11.779 2.230 1.00 0.00 N ATOM 297 C2 DC A 10 5.694 11.689 0.939 1.00 0.00 C ATOM 298 O2 DC A 10 6.428 11.482 -0.024 1.00 0.00 O ATOM 299 N3 DC A 10 4.347 11.837 0.764 1.00 0.00 N ATOM 300 C4 DC A 10 3.539 12.084 1.808 1.00 0.00 C ATOM 301 N4 DC A 10 2.222 12.198 1.603 1.00 0.00 N ATOM 302 C5 DC A 10 4.067 12.223 3.135 1.00 0.00 C ATOM 303 C6 DC A 10 5.398 12.078 3.291 1.00 0.00 C ATOM 0 H5' DC A 10 7.901 9.904 6.034 1.00 0.00 H new ATOM 0 H5'' DC A 10 9.389 10.746 6.420 1.00 0.00 H new ATOM 0 H4' DC A 10 9.619 10.071 4.151 1.00 0.00 H new ATOM 0 H3' DC A 10 9.542 12.907 4.647 1.00 0.00 H new ATOM 0 H2' DC A 10 7.913 13.449 3.047 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.060 12.876 1.852 1.00 0.00 H new ATOM 0 H1' DC A 10 7.996 10.871 1.588 1.00 0.00 H new ATOM 0 H41 DC A 10 1.598 12.385 2.388 1.00 0.00 H new ATOM 0 H42 DC A 10 1.842 12.097 0.662 1.00 0.00 H new ATOM 0 H5 DC A 10 3.423 12.435 3.976 1.00 0.00 H new ATOM 0 H6 DC A 10 5.831 12.200 4.273 1.00 0.00 H new ATOM 315 P DC A 11 11.748 13.172 2.923 1.00 0.00 P ATOM 316 OP1 DC A 11 13.130 12.647 2.862 1.00 0.00 O ATOM 317 OP2 DC A 11 11.451 14.350 3.769 1.00 0.00 O ATOM 318 O5' DC A 11 11.285 13.495 1.406 1.00 0.00 O ATOM 319 C5' DC A 11 10.809 14.772 1.017 1.00 0.00 C ATOM 320 C4' DC A 11 10.258 14.694 -0.413 1.00 0.00 C ATOM 321 O4' DC A 11 9.111 13.867 -0.441 1.00 0.00 O ATOM 322 C3' DC A 11 9.852 16.049 -0.991 1.00 0.00 C ATOM 323 O3' DC A 11 10.940 16.692 -1.620 1.00 0.00 O ATOM 324 C2' DC A 11 8.804 15.620 -2.010 1.00 0.00 C ATOM 325 C1' DC A 11 8.192 14.349 -1.409 1.00 0.00 C ATOM 326 N1 DC A 11 6.913 14.633 -0.701 1.00 0.00 N ATOM 327 C2 DC A 11 5.712 14.466 -1.394 1.00 0.00 C ATOM 328 O2 DC A 11 5.698 14.118 -2.573 1.00 0.00 O ATOM 329 N3 DC A 11 4.541 14.700 -0.734 1.00 0.00 N ATOM 330 C4 DC A 11 4.531 15.091 0.549 1.00 0.00 C ATOM 331 N4 DC A 11 3.356 15.293 1.152 1.00 0.00 N ATOM 332 C5 DC A 11 5.753 15.287 1.277 1.00 0.00 C ATOM 333 C6 DC A 11 6.906 15.050 0.609 1.00 0.00 C ATOM 0 H5' DC A 11 11.615 15.504 1.069 1.00 0.00 H new ATOM 0 H5'' DC A 11 10.029 15.106 1.702 1.00 0.00 H new ATOM 0 H4' DC A 11 11.072 14.294 -1.018 1.00 0.00 H new ATOM 0 H3' DC A 11 9.501 16.767 -0.250 1.00 0.00 H new ATOM 0 H2' DC A 11 8.051 16.394 -2.156 1.00 0.00 H new ATOM 0 H2'' DC A 11 9.253 15.424 -2.984 1.00 0.00 H new ATOM 0 HO3' DC A 11 10.646 17.555 -1.980 1.00 0.00 H new ATOM 0 H1' DC A 11 7.995 13.637 -2.211 1.00 0.00 H new ATOM 0 H41 DC A 11 3.328 15.591 2.127 1.00 0.00 H new ATOM 0 H42 DC A 11 2.487 15.150 0.637 1.00 0.00 H new ATOM 0 H5 DC A 11 5.752 15.608 2.308 1.00 0.00 H new ATOM 0 H6 DC A 11 7.847 15.192 1.119 1.00 0.00 H new TER 346 DC A 11 ATOM 347 O5' DG B 12 -5.260 14.149 -5.772 1.00 0.00 O ATOM 348 C5' DG B 12 -4.719 14.737 -6.937 1.00 0.00 C ATOM 349 C4' DG B 12 -3.296 14.227 -7.191 1.00 0.00 C ATOM 350 O4' DG B 12 -2.516 14.576 -6.062 1.00 0.00 O ATOM 351 C3' DG B 12 -3.240 12.699 -7.342 1.00 0.00 C ATOM 352 O3' DG B 12 -2.585 12.393 -8.562 1.00 0.00 O ATOM 353 C2' DG B 12 -2.432 12.272 -6.118 1.00 0.00 C ATOM 354 C1' DG B 12 -1.615 13.516 -5.823 1.00 0.00 C ATOM 355 N9 DG B 12 -1.184 13.600 -4.410 1.00 0.00 N ATOM 356 C8 DG B 12 -1.968 13.665 -3.284 1.00 0.00 C ATOM 357 N7 DG B 12 -1.302 13.829 -2.177 1.00 0.00 N ATOM 358 C5 DG B 12 0.024 13.870 -2.590 1.00 0.00 C ATOM 359 C6 DG B 12 1.215 14.041 -1.822 1.00 0.00 C ATOM 360 O6 DG B 12 1.316 14.192 -0.608 1.00 0.00 O ATOM 361 N1 DG B 12 2.362 14.022 -2.611 1.00 0.00 N ATOM 362 C2 DG B 12 2.365 13.841 -3.982 1.00 0.00 C ATOM 363 N2 DG B 12 3.555 13.809 -4.589 1.00 0.00 N ATOM 364 N3 DG B 12 1.244 13.683 -4.706 1.00 0.00 N ATOM 365 C4 DG B 12 0.109 13.710 -3.954 1.00 0.00 C ATOM 0 H5' DG B 12 -4.708 15.822 -6.831 1.00 0.00 H new ATOM 0 H5'' DG B 12 -5.352 14.506 -7.794 1.00 0.00 H new ATOM 0 H4' DG B 12 -2.931 14.672 -8.117 1.00 0.00 H new ATOM 0 H3' DG B 12 -4.205 12.194 -7.382 1.00 0.00 H new ATOM 0 H2' DG B 12 -3.075 11.999 -5.281 1.00 0.00 H new ATOM 0 H2'' DG B 12 -1.799 11.410 -6.328 1.00 0.00 H new ATOM 0 HO5' DG B 12 -4.535 13.925 -5.152 1.00 0.00 H new ATOM 0 H1' DG B 12 -0.709 13.528 -6.428 1.00 0.00 H new ATOM 0 H8 DG B 12 -3.045 13.587 -3.314 1.00 0.00 H new ATOM 0 H1 DG B 12 3.261 14.150 -2.146 1.00 0.00 H new ATOM 0 H21 DG B 12 3.609 13.678 -5.599 1.00 0.00 H new ATOM 0 H22 DG B 12 4.409 13.916 -4.042 1.00 0.00 H new ATOM 378 P DG B 13 -2.376 10.875 -9.080 1.00 0.00 P ATOM 379 OP1 DG B 13 -2.346 10.896 -10.559 1.00 0.00 O ATOM 380 OP2 DG B 13 -3.340 10.000 -8.377 1.00 0.00 O ATOM 381 O5' DG B 13 -0.895 10.514 -8.550 1.00 0.00 O ATOM 382 C5' DG B 13 0.250 11.154 -9.079 1.00 0.00 C ATOM 383 C4' DG B 13 1.545 10.583 -8.489 1.00 0.00 C ATOM 384 O4' DG B 13 1.590 10.898 -7.106 1.00 0.00 O ATOM 385 C3' DG B 13 1.625 9.059 -8.613 1.00 0.00 C ATOM 386 O3' DG B 13 2.998 8.770 -8.827 1.00 0.00 O ATOM 387 C2' DG B 13 1.131 8.603 -7.238 1.00 0.00 C ATOM 388 C1' DG B 13 1.702 9.698 -6.358 1.00 0.00 C ATOM 389 N9 DG B 13 1.078 9.957 -5.043 1.00 0.00 N ATOM 390 C8 DG B 13 -0.226 9.847 -4.631 1.00 0.00 C ATOM 391 N7 DG B 13 -0.416 10.167 -3.379 1.00 0.00 N ATOM 392 C5 DG B 13 0.853 10.506 -2.920 1.00 0.00 C ATOM 393 C6 DG B 13 1.302 10.887 -1.618 1.00 0.00 C ATOM 394 O6 DG B 13 0.630 11.075 -0.608 1.00 0.00 O ATOM 395 N1 DG B 13 2.685 11.051 -1.556 1.00 0.00 N ATOM 396 C2 DG B 13 3.535 10.917 -2.637 1.00 0.00 C ATOM 397 N2 DG B 13 4.838 11.116 -2.427 1.00 0.00 N ATOM 398 N3 DG B 13 3.112 10.591 -3.865 1.00 0.00 N ATOM 399 C4 DG B 13 1.769 10.390 -3.938 1.00 0.00 C ATOM 0 H5' DG B 13 0.197 12.223 -8.873 1.00 0.00 H new ATOM 0 H5'' DG B 13 0.263 11.039 -10.163 1.00 0.00 H new ATOM 0 H4' DG B 13 2.375 11.020 -9.044 1.00 0.00 H new ATOM 0 H3' DG B 13 1.055 8.583 -9.411 1.00 0.00 H new ATOM 0 H2' DG B 13 0.043 8.554 -7.184 1.00 0.00 H new ATOM 0 H2'' DG B 13 1.508 7.617 -6.969 1.00 0.00 H new ATOM 0 H1' DG B 13 2.706 9.356 -6.108 1.00 0.00 H new ATOM 0 H8 DG B 13 -1.024 9.525 -5.283 1.00 0.00 H new ATOM 0 H1 DG B 13 3.097 11.285 -0.653 1.00 0.00 H new ATOM 0 H21 DG B 13 5.499 11.027 -3.199 1.00 0.00 H new ATOM 0 H22 DG B 13 5.173 11.358 -1.494 1.00 0.00 H new ATOM 411 P DC B 14 3.590 7.283 -9.050 1.00 0.00 P ATOM 412 OP1 DC B 14 4.313 7.261 -10.341 1.00 0.00 O ATOM 413 OP2 DC B 14 2.533 6.283 -8.780 1.00 0.00 O ATOM 414 O5' DC B 14 4.674 7.216 -7.856 1.00 0.00 O ATOM 415 C5' DC B 14 5.820 8.049 -7.869 1.00 0.00 C ATOM 416 C4' DC B 14 6.681 7.850 -6.617 1.00 0.00 C ATOM 417 O4' DC B 14 5.917 8.264 -5.495 1.00 0.00 O ATOM 418 C3' DC B 14 7.066 6.381 -6.410 1.00 0.00 C ATOM 419 O3' DC B 14 8.438 6.344 -6.055 1.00 0.00 O ATOM 420 C2' DC B 14 6.139 5.967 -5.267 1.00 0.00 C ATOM 421 C1' DC B 14 6.020 7.274 -4.487 1.00 0.00 C ATOM 422 N1 DC B 14 4.774 7.358 -3.670 1.00 0.00 N ATOM 423 C2 DC B 14 4.864 7.602 -2.294 1.00 0.00 C ATOM 424 O2 DC B 14 5.950 7.711 -1.731 1.00 0.00 O ATOM 425 N3 DC B 14 3.711 7.721 -1.569 1.00 0.00 N ATOM 426 C4 DC B 14 2.513 7.612 -2.159 1.00 0.00 C ATOM 427 N4 DC B 14 1.404 7.734 -1.423 1.00 0.00 N ATOM 428 C5 DC B 14 2.398 7.405 -3.572 1.00 0.00 C ATOM 429 C6 DC B 14 3.543 7.293 -4.280 1.00 0.00 C ATOM 0 H5' DC B 14 5.511 9.092 -7.936 1.00 0.00 H new ATOM 0 H5'' DC B 14 6.415 7.836 -8.757 1.00 0.00 H new ATOM 0 H4' DC B 14 7.597 8.429 -6.734 1.00 0.00 H new ATOM 0 H3' DC B 14 6.956 5.721 -7.271 1.00 0.00 H new ATOM 0 H2' DC B 14 5.173 5.615 -5.629 1.00 0.00 H new ATOM 0 H2'' DC B 14 6.564 5.166 -4.663 1.00 0.00 H new ATOM 0 H1' DC B 14 6.862 7.376 -3.802 1.00 0.00 H new ATOM 0 H41 DC B 14 0.488 7.652 -1.864 1.00 0.00 H new ATOM 0 H42 DC B 14 1.474 7.909 -0.420 1.00 0.00 H new ATOM 0 H5 DC B 14 1.433 7.341 -4.053 1.00 0.00 H new ATOM 0 H6 DC B 14 3.491 7.149 -5.349 1.00 0.00 H new ATOM 441 P DT B 15 9.239 4.963 -5.816 1.00 0.00 P ATOM 442 OP1 DT B 15 10.684 5.232 -5.991 1.00 0.00 O ATOM 443 OP2 DT B 15 8.589 3.895 -6.607 1.00 0.00 O ATOM 444 O5' DT B 15 8.964 4.674 -4.256 1.00 0.00 O ATOM 445 C5' DT B 15 9.534 5.483 -3.246 1.00 0.00 C ATOM 446 C4' DT B 15 9.075 5.021 -1.859 1.00 0.00 C ATOM 447 O4' DT B 15 7.705 5.317 -1.753 1.00 0.00 O ATOM 448 C3' DT B 15 9.206 3.510 -1.616 1.00 0.00 C ATOM 449 O3' DT B 15 10.340 3.290 -0.788 1.00 0.00 O ATOM 450 C2' DT B 15 7.879 3.129 -0.964 1.00 0.00 C ATOM 451 C1' DT B 15 7.178 4.464 -0.764 1.00 0.00 C ATOM 452 N1 DT B 15 5.736 4.374 -1.062 1.00 0.00 N ATOM 453 C2 DT B 15 4.831 4.854 -0.126 1.00 0.00 C ATOM 454 O2 DT B 15 5.164 5.271 0.980 1.00 0.00 O ATOM 455 N3 DT B 15 3.503 4.838 -0.509 1.00 0.00 N ATOM 456 C4 DT B 15 3.003 4.387 -1.719 1.00 0.00 C ATOM 457 O4 DT B 15 1.793 4.440 -1.926 1.00 0.00 O ATOM 458 C5 DT B 15 4.014 3.883 -2.635 1.00 0.00 C ATOM 459 C7 DT B 15 3.595 3.358 -3.993 1.00 0.00 C ATOM 460 C6 DT B 15 5.326 3.890 -2.280 1.00 0.00 C ATOM 0 H5' DT B 15 9.248 6.523 -3.402 1.00 0.00 H new ATOM 0 H5'' DT B 15 10.621 5.439 -3.308 1.00 0.00 H new ATOM 0 H4' DT B 15 9.711 5.530 -1.135 1.00 0.00 H new ATOM 0 H3' DT B 15 9.370 2.904 -2.507 1.00 0.00 H new ATOM 0 H2' DT B 15 7.297 2.463 -1.601 1.00 0.00 H new ATOM 0 H2'' DT B 15 8.032 2.612 -0.017 1.00 0.00 H new ATOM 0 H1' DT B 15 7.319 4.795 0.265 1.00 0.00 H new ATOM 0 H3 DT B 15 2.825 5.193 0.165 1.00 0.00 H new ATOM 0 H71 DT B 15 4.399 3.523 -4.711 1.00 0.00 H new ATOM 0 H72 DT B 15 3.385 2.291 -3.922 1.00 0.00 H new ATOM 0 H73 DT B 15 2.699 3.882 -4.325 1.00 0.00 H new ATOM 0 H6 DT B 15 6.062 3.507 -2.971 1.00 0.00 H new ATOM 473 P DA B 16 10.790 1.828 -0.263 1.00 0.00 P ATOM 474 OP1 DA B 16 12.180 1.927 0.234 1.00 0.00 O ATOM 475 OP2 DA B 16 10.452 0.835 -1.308 1.00 0.00 O ATOM 476 O5' DA B 16 9.823 1.570 1.005 1.00 0.00 O ATOM 477 C5' DA B 16 9.960 2.284 2.223 1.00 0.00 C ATOM 478 C4' DA B 16 8.765 2.030 3.161 1.00 0.00 C ATOM 479 O4' DA B 16 7.589 2.515 2.558 1.00 0.00 O ATOM 480 C3' DA B 16 8.467 0.569 3.440 1.00 0.00 C ATOM 481 O3' DA B 16 9.002 0.120 4.677 1.00 0.00 O ATOM 482 C2' DA B 16 6.997 0.333 3.202 1.00 0.00 C ATOM 483 C1' DA B 16 6.547 1.754 3.129 1.00 0.00 C ATOM 484 N9 DA B 16 5.357 1.871 2.283 1.00 0.00 N ATOM 485 C8 DA B 16 5.334 1.550 0.966 1.00 0.00 C ATOM 486 N7 DA B 16 4.183 1.743 0.382 1.00 0.00 N ATOM 487 C5 DA B 16 3.363 2.165 1.430 1.00 0.00 C ATOM 488 C6 DA B 16 1.993 2.504 1.511 1.00 0.00 C ATOM 489 N6 DA B 16 1.201 2.619 0.437 1.00 0.00 N ATOM 490 N1 DA B 16 1.459 2.719 2.729 1.00 0.00 N ATOM 491 C2 DA B 16 2.245 2.650 3.804 1.00 0.00 C ATOM 492 N3 DA B 16 3.553 2.406 3.856 1.00 0.00 N ATOM 493 C4 DA B 16 4.059 2.170 2.616 1.00 0.00 C ATOM 0 H5' DA B 16 10.040 3.351 2.014 1.00 0.00 H new ATOM 0 H5'' DA B 16 10.884 1.986 2.719 1.00 0.00 H new ATOM 0 H4' DA B 16 9.044 2.525 4.091 1.00 0.00 H new ATOM 0 H3' DA B 16 8.997 -0.078 2.742 1.00 0.00 H new ATOM 0 H2' DA B 16 6.802 -0.219 2.283 1.00 0.00 H new ATOM 0 H2'' DA B 16 6.522 -0.219 4.013 1.00 0.00 H new ATOM 0 H1' DA B 16 6.303 2.111 4.130 1.00 0.00 H new ATOM 0 H8 DA B 16 6.197 1.166 0.443 1.00 0.00 H new ATOM 0 H61 DA B 16 0.218 2.866 0.552 1.00 0.00 H new ATOM 0 H62 DA B 16 1.581 2.459 -0.496 1.00 0.00 H new ATOM 0 H2 DA B 16 1.758 2.813 4.754 1.00 0.00 H new HETATM 505 N1 T41 B 17 3.284 -1.036 4.359 1.00 0.00 N HETATM 506 C2 T41 B 17 1.987 -0.618 4.070 1.00 0.00 C HETATM 507 N3 T41 B 17 1.633 -0.606 2.729 1.00 0.00 N HETATM 508 C4 T41 B 17 2.437 -0.969 1.661 1.00 0.00 C HETATM 509 C5 T41 B 17 3.759 -1.413 2.050 1.00 0.00 C HETATM 510 C5M T41 B 17 4.742 -1.892 1.011 1.00 0.00 C HETATM 511 C6 T41 B 17 4.126 -1.427 3.350 1.00 0.00 C HETATM 512 O2 T41 B 17 1.177 -0.273 4.927 1.00 0.00 O HETATM 513 O4 T41 B 17 2.011 -0.896 0.512 1.00 0.00 O HETATM 514 C1' T41 B 17 3.733 -1.020 5.777 1.00 0.00 C HETATM 515 C2' T41 B 17 4.186 -2.310 6.384 1.00 0.00 C HETATM 516 O2' T41 B 17 5.057 -3.026 5.561 1.00 0.00 O HETATM 517 C3' T41 B 17 4.959 -1.854 7.613 1.00 0.00 C HETATM 518 C4' T41 B 17 5.474 -0.474 7.172 1.00 0.00 C HETATM 519 O3' T41 B 17 4.136 -1.662 8.755 1.00 0.00 O HETATM 520 O4' T41 B 17 4.794 -0.108 5.978 1.00 0.00 O HETATM 521 C5' T41 B 17 6.979 -0.445 6.876 1.00 0.00 C HETATM 522 O5' T41 B 17 7.341 -1.382 5.879 1.00 0.00 O HETATM 523 C6' T41 B 17 4.642 -4.349 5.607 1.00 0.00 C HETATM 524 P T41 B 17 8.820 -1.393 5.230 1.00 0.00 P HETATM 525 O1P T41 B 17 9.796 -1.599 6.323 1.00 0.00 O HETATM 526 O2P T41 B 17 8.806 -2.315 4.073 1.00 0.00 O HETATM 0 H5M3 T41 B 17 4.326 -2.751 0.485 1.00 0.00 H new HETATM 0 H5M2 T41 B 17 4.938 -1.090 0.299 1.00 0.00 H new HETATM 0 H5M1 T41 B 17 5.674 -2.181 1.497 1.00 0.00 H new HETATM 0 H5'2 T41 B 17 7.266 0.556 6.554 1.00 0.00 H new HETATM 0 H5'1 T41 B 17 7.533 -0.657 7.791 1.00 0.00 H new HETATM 0 H2'1 T41 B 17 3.341 -2.971 6.575 1.00 0.00 H new HETATM 0 H6 T41 B 17 5.131 -1.762 3.607 1.00 0.00 H new HETATM 0 H4' T41 B 17 5.288 0.213 7.997 1.00 0.00 H new HETATM 0 H3' T41 B 17 5.711 -2.587 7.904 1.00 0.00 H new HETATM 0 H3 T41 B 17 0.686 -0.299 2.507 1.00 0.00 H new HETATM 0 H13 T41 B 17 4.691 -4.710 6.634 1.00 0.00 H new HETATM 0 H12 T41 B 17 3.616 -4.421 5.246 1.00 0.00 H new HETATM 0 H11 T41 B 17 5.292 -4.956 4.977 1.00 0.00 H new HETATM 0 H1' T41 B 17 2.806 -0.739 6.277 1.00 0.00 H new ATOM 541 P DA B 18 3.468 -2.881 9.579 1.00 0.00 P ATOM 542 OP1 DA B 18 3.401 -2.484 11.003 1.00 0.00 O ATOM 543 OP2 DA B 18 4.152 -4.137 9.203 1.00 0.00 O ATOM 544 O5' DA B 18 1.961 -2.939 9.002 1.00 0.00 O ATOM 545 C5' DA B 18 0.967 -2.013 9.411 1.00 0.00 C ATOM 546 C4' DA B 18 -0.375 -2.377 8.766 1.00 0.00 C ATOM 547 O4' DA B 18 -0.229 -2.240 7.373 1.00 0.00 O ATOM 548 C3' DA B 18 -0.790 -3.825 9.060 1.00 0.00 C ATOM 549 O3' DA B 18 -2.018 -3.794 9.771 1.00 0.00 O ATOM 550 C2' DA B 18 -0.910 -4.410 7.653 1.00 0.00 C ATOM 551 C1' DA B 18 -1.091 -3.185 6.794 1.00 0.00 C ATOM 552 N9 DA B 18 -0.622 -3.354 5.404 1.00 0.00 N ATOM 553 C8 DA B 18 0.659 -3.641 5.004 1.00 0.00 C ATOM 554 N7 DA B 18 0.844 -3.609 3.717 1.00 0.00 N ATOM 555 C5 DA B 18 -0.406 -3.262 3.224 1.00 0.00 C ATOM 556 C6 DA B 18 -0.876 -3.017 1.921 1.00 0.00 C ATOM 557 N6 DA B 18 -0.107 -3.048 0.828 1.00 0.00 N ATOM 558 N1 DA B 18 -2.159 -2.666 1.774 1.00 0.00 N ATOM 559 C2 DA B 18 -2.961 -2.557 2.824 1.00 0.00 C ATOM 560 N3 DA B 18 -2.637 -2.755 4.104 1.00 0.00 N ATOM 561 C4 DA B 18 -1.322 -3.112 4.241 1.00 0.00 C ATOM 0 H5' DA B 18 1.257 -1.002 9.124 1.00 0.00 H new ATOM 0 H5'' DA B 18 0.874 -2.021 10.497 1.00 0.00 H new ATOM 0 H4' DA B 18 -1.142 -1.719 9.174 1.00 0.00 H new ATOM 0 H3' DA B 18 -0.110 -4.413 9.677 1.00 0.00 H new ATOM 0 H2' DA B 18 -0.020 -4.973 7.372 1.00 0.00 H new ATOM 0 H2'' DA B 18 -1.757 -5.091 7.569 1.00 0.00 H new ATOM 0 H1' DA B 18 -2.150 -2.929 6.753 1.00 0.00 H new ATOM 0 H8 DA B 18 1.450 -3.875 5.702 1.00 0.00 H new ATOM 0 H61 DA B 18 -0.515 -2.860 -0.088 1.00 0.00 H new ATOM 0 H62 DA B 18 0.887 -3.260 0.910 1.00 0.00 H new ATOM 0 H2 DA B 18 -3.985 -2.279 2.623 1.00 0.00 H new ATOM 573 P DT B 19 -2.849 -5.127 10.152 1.00 0.00 P ATOM 574 OP1 DT B 19 -3.668 -4.834 11.349 1.00 0.00 O ATOM 575 OP2 DT B 19 -1.923 -6.281 10.155 1.00 0.00 O ATOM 576 O5' DT B 19 -3.838 -5.273 8.886 1.00 0.00 O ATOM 577 C5' DT B 19 -4.803 -4.279 8.595 1.00 0.00 C ATOM 578 C4' DT B 19 -5.595 -4.639 7.334 1.00 0.00 C ATOM 579 O4' DT B 19 -4.705 -4.534 6.235 1.00 0.00 O ATOM 580 C3' DT B 19 -6.137 -6.078 7.367 1.00 0.00 C ATOM 581 O3' DT B 19 -7.529 -6.052 7.091 1.00 0.00 O ATOM 582 C2' DT B 19 -5.341 -6.761 6.255 1.00 0.00 C ATOM 583 C1' DT B 19 -4.999 -5.598 5.357 1.00 0.00 C ATOM 584 N1 DT B 19 -3.881 -5.824 4.421 1.00 0.00 N ATOM 585 C2 DT B 19 -4.043 -5.667 3.048 1.00 0.00 C ATOM 586 O2 DT B 19 -5.107 -5.354 2.519 1.00 0.00 O ATOM 587 N3 DT B 19 -2.906 -5.890 2.284 1.00 0.00 N ATOM 588 C4 DT B 19 -1.656 -6.264 2.759 1.00 0.00 C ATOM 589 O4 DT B 19 -0.720 -6.412 1.977 1.00 0.00 O ATOM 590 C5 DT B 19 -1.595 -6.443 4.199 1.00 0.00 C ATOM 591 C7 DT B 19 -0.310 -6.918 4.846 1.00 0.00 C ATOM 592 C6 DT B 19 -2.696 -6.205 4.954 1.00 0.00 C ATOM 0 H5' DT B 19 -4.310 -3.317 8.457 1.00 0.00 H new ATOM 0 H5'' DT B 19 -5.485 -4.170 9.439 1.00 0.00 H new ATOM 0 H4' DT B 19 -6.448 -3.964 7.259 1.00 0.00 H new ATOM 0 H3' DT B 19 -6.028 -6.592 8.322 1.00 0.00 H new ATOM 0 H2' DT B 19 -4.449 -7.258 6.637 1.00 0.00 H new ATOM 0 H2'' DT B 19 -5.930 -7.518 5.737 1.00 0.00 H new ATOM 0 H1' DT B 19 -5.841 -5.405 4.693 1.00 0.00 H new ATOM 0 H3 DT B 19 -2.998 -5.767 1.276 1.00 0.00 H new ATOM 0 H71 DT B 19 -0.238 -6.511 5.855 1.00 0.00 H new ATOM 0 H72 DT B 19 -0.307 -8.007 4.893 1.00 0.00 H new ATOM 0 H73 DT B 19 0.541 -6.578 4.256 1.00 0.00 H new ATOM 0 H6 DT B 19 -2.625 -6.324 6.025 1.00 0.00 H new ATOM 605 P DG B 20 -8.432 -7.395 7.051 1.00 0.00 P ATOM 606 OP1 DG B 20 -9.800 -7.042 7.492 1.00 0.00 O ATOM 607 OP2 DG B 20 -7.697 -8.480 7.740 1.00 0.00 O ATOM 608 O5' DG B 20 -8.485 -7.750 5.476 1.00 0.00 O ATOM 609 C5' DG B 20 -9.212 -6.945 4.567 1.00 0.00 C ATOM 610 C4' DG B 20 -9.235 -7.554 3.160 1.00 0.00 C ATOM 611 O4' DG B 20 -7.939 -7.464 2.592 1.00 0.00 O ATOM 612 C3' DG B 20 -9.622 -9.039 3.165 1.00 0.00 C ATOM 613 O3' DG B 20 -10.541 -9.202 2.097 1.00 0.00 O ATOM 614 C2' DG B 20 -8.271 -9.721 2.943 1.00 0.00 C ATOM 615 C1' DG B 20 -7.625 -8.715 2.006 1.00 0.00 C ATOM 616 N9 DG B 20 -6.155 -8.785 1.912 1.00 0.00 N ATOM 617 C8 DG B 20 -5.255 -8.998 2.915 1.00 0.00 C ATOM 618 N7 DG B 20 -4.008 -8.958 2.537 1.00 0.00 N ATOM 619 C5 DG B 20 -4.087 -8.716 1.168 1.00 0.00 C ATOM 620 C6 DG B 20 -3.054 -8.622 0.186 1.00 0.00 C ATOM 621 O6 DG B 20 -1.840 -8.630 0.365 1.00 0.00 O ATOM 622 N1 DG B 20 -3.555 -8.511 -1.110 1.00 0.00 N ATOM 623 C2 DG B 20 -4.901 -8.454 -1.421 1.00 0.00 C ATOM 624 N2 DG B 20 -5.235 -8.369 -2.711 1.00 0.00 N ATOM 625 N3 DG B 20 -5.872 -8.490 -0.495 1.00 0.00 N ATOM 626 C4 DG B 20 -5.401 -8.631 0.773 1.00 0.00 C ATOM 0 H5' DG B 20 -8.767 -5.951 4.526 1.00 0.00 H new ATOM 0 H5'' DG B 20 -10.234 -6.822 4.927 1.00 0.00 H new ATOM 0 H4' DG B 20 -9.978 -6.997 2.589 1.00 0.00 H new ATOM 0 H3' DG B 20 -10.104 -9.441 4.056 1.00 0.00 H new ATOM 0 H2' DG B 20 -7.711 -9.849 3.869 1.00 0.00 H new ATOM 0 H2'' DG B 20 -8.371 -10.708 2.492 1.00 0.00 H new ATOM 0 H1' DG B 20 -7.991 -8.896 0.995 1.00 0.00 H new ATOM 0 H8 DG B 20 -5.551 -9.184 3.937 1.00 0.00 H new ATOM 0 H1 DG B 20 -2.886 -8.469 -1.878 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.217 -8.325 -2.982 1.00 0.00 H new ATOM 0 H22 DG B 20 -4.508 -8.348 -3.426 1.00 0.00 H new ATOM 638 P DC B 21 -11.111 -10.626 1.595 1.00 0.00 P ATOM 639 OP1 DC B 21 -12.551 -10.466 1.292 1.00 0.00 O ATOM 640 OP2 DC B 21 -10.668 -11.690 2.522 1.00 0.00 O ATOM 641 O5' DC B 21 -10.317 -10.791 0.200 1.00 0.00 O ATOM 642 C5' DC B 21 -10.473 -9.836 -0.837 1.00 0.00 C ATOM 643 C4' DC B 21 -9.766 -10.263 -2.129 1.00 0.00 C ATOM 644 O4' DC B 21 -8.372 -10.195 -1.887 1.00 0.00 O ATOM 645 C3' DC B 21 -10.108 -11.704 -2.531 1.00 0.00 C ATOM 646 O3' DC B 21 -10.288 -11.743 -3.938 1.00 0.00 O ATOM 647 C2' DC B 21 -8.861 -12.457 -2.075 1.00 0.00 C ATOM 648 C1' DC B 21 -7.777 -11.407 -2.307 1.00 0.00 C ATOM 649 N1 DC B 21 -6.586 -11.617 -1.441 1.00 0.00 N ATOM 650 C2 DC B 21 -5.313 -11.646 -2.014 1.00 0.00 C ATOM 651 O2 DC B 21 -5.154 -11.584 -3.231 1.00 0.00 O ATOM 652 N3 DC B 21 -4.229 -11.746 -1.191 1.00 0.00 N ATOM 653 C4 DC B 21 -4.375 -11.821 0.140 1.00 0.00 C ATOM 654 N4 DC B 21 -3.281 -11.888 0.904 1.00 0.00 N ATOM 655 C5 DC B 21 -5.671 -11.760 0.750 1.00 0.00 C ATOM 656 C6 DC B 21 -6.735 -11.658 -0.077 1.00 0.00 C ATOM 0 H5' DC B 21 -10.075 -8.876 -0.507 1.00 0.00 H new ATOM 0 H5'' DC B 21 -11.534 -9.690 -1.037 1.00 0.00 H new ATOM 0 H4' DC B 21 -10.088 -9.605 -2.936 1.00 0.00 H new ATOM 0 H3' DC B 21 -11.019 -12.121 -2.101 1.00 0.00 H new ATOM 0 H2' DC B 21 -8.923 -12.760 -1.030 1.00 0.00 H new ATOM 0 H2'' DC B 21 -8.690 -13.361 -2.659 1.00 0.00 H new ATOM 0 H1' DC B 21 -7.445 -11.435 -3.345 1.00 0.00 H new ATOM 0 H41 DC B 21 -3.370 -11.946 1.918 1.00 0.00 H new ATOM 0 H42 DC B 21 -2.357 -11.882 0.473 1.00 0.00 H new ATOM 0 H5 DC B 21 -5.792 -11.794 1.823 1.00 0.00 H new ATOM 0 H6 DC B 21 -7.727 -11.607 0.346 1.00 0.00 H new ATOM 668 P DG B 22 -10.661 -13.101 -4.732 1.00 0.00 P ATOM 669 OP1 DG B 22 -11.445 -12.735 -5.932 1.00 0.00 O ATOM 670 OP2 DG B 22 -11.207 -14.082 -3.768 1.00 0.00 O ATOM 671 O5' DG B 22 -9.215 -13.626 -5.216 1.00 0.00 O ATOM 672 C5' DG B 22 -8.510 -12.968 -6.252 1.00 0.00 C ATOM 673 C4' DG B 22 -7.158 -13.643 -6.496 1.00 0.00 C ATOM 674 O4' DG B 22 -6.382 -13.501 -5.320 1.00 0.00 O ATOM 675 C3' DG B 22 -7.284 -15.150 -6.768 1.00 0.00 C ATOM 676 O3' DG B 22 -6.680 -15.472 -8.003 1.00 0.00 O ATOM 677 C2' DG B 22 -6.499 -15.783 -5.627 1.00 0.00 C ATOM 678 C1' DG B 22 -5.571 -14.651 -5.232 1.00 0.00 C ATOM 679 N9 DG B 22 -5.037 -14.751 -3.855 1.00 0.00 N ATOM 680 C8 DG B 22 -5.714 -14.909 -2.671 1.00 0.00 C ATOM 681 N7 DG B 22 -4.952 -14.887 -1.613 1.00 0.00 N ATOM 682 C5 DG B 22 -3.672 -14.703 -2.128 1.00 0.00 C ATOM 683 C6 DG B 22 -2.419 -14.563 -1.457 1.00 0.00 C ATOM 684 O6 DG B 22 -2.202 -14.567 -0.248 1.00 0.00 O ATOM 685 N1 DG B 22 -1.355 -14.405 -2.342 1.00 0.00 N ATOM 686 C2 DG B 22 -1.482 -14.382 -3.718 1.00 0.00 C ATOM 687 N2 DG B 22 -0.369 -14.212 -4.437 1.00 0.00 N ATOM 688 N3 DG B 22 -2.662 -14.484 -4.349 1.00 0.00 N ATOM 689 C4 DG B 22 -3.714 -14.639 -3.500 1.00 0.00 C ATOM 0 H5' DG B 22 -8.358 -11.921 -5.988 1.00 0.00 H new ATOM 0 H5'' DG B 22 -9.101 -12.983 -7.168 1.00 0.00 H new ATOM 0 H4' DG B 22 -6.709 -13.170 -7.370 1.00 0.00 H new ATOM 0 H3' DG B 22 -8.318 -15.490 -6.820 1.00 0.00 H new ATOM 0 H2' DG B 22 -7.146 -16.089 -4.805 1.00 0.00 H new ATOM 0 H2'' DG B 22 -5.951 -16.669 -5.948 1.00 0.00 H new ATOM 0 HO3' DG B 22 -6.764 -16.435 -8.167 1.00 0.00 H new ATOM 0 H1' DG B 22 -4.693 -14.653 -5.877 1.00 0.00 H new ATOM 0 H8 DG B 22 -6.785 -15.040 -2.620 1.00 0.00 H new ATOM 0 H1 DG B 22 -0.420 -14.299 -1.948 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.418 -14.189 -5.456 1.00 0.00 H new ATOM 0 H22 DG B 22 0.530 -14.105 -3.967 1.00 0.00 H new TER 702 DG B 22