USER MOD reduce.3.24.130724 H: found=0, std=0, add=518, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 530 hydrogens (300 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 13 CRH H6 : A 13 CRH C6 : A 12 DDA O1 :(H bumps) USER MOD NoAdj-H: A 13 CRH H21 : A 13 CRH C2 : A 14ADDA O1 :(H bumps) USER MOD NoAdj-H: B 17 CRH H6 : B 17 CRH C6 : B 16 DDA O1 :(H bumps) USER MOD NoAdj-H: B 17 CRH H21 : B 17 CRH C2 : B 18ADDA O1 :(H bumps) USER MOD NoAdj-H: B 23 CRH H6 : B 23 CRH C6 : B 22 DDA O1 :(H bumps) USER MOD NoAdj-H: B 23 CRH H21 : B 23 CRH C2 : B 24ADDA O1 :(H bumps) USER MOD NoAdj-H: A 27 CRH H6 : A 27 CRH C6 : A 26 DDA O1 :(H bumps) USER MOD NoAdj-H: A 27 CRH H21 : A 27 CRH C2 : A 28ADDA O1 :(H bumps) USER MOD Set 1.1: A 29CMDA O4 : rot 170:sc= -0.273 USER MOD Set 1.2: B 30CMDA O4 : rot 170:sc= -0.297 USER MOD Single : A 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 180:sc= -0.585 USER MOD Single : A 5 DT C7 :methyl 150:sc= -3.33! (180deg=-3.33!) USER MOD Single : A 9 DT C7 :methyl -30:sc= -2.16 (180deg=-2.7!) USER MOD Single : A 10 DA O3' : rot 180:sc= 0 USER MOD Single : A 11 DDA O3 : rot 10:sc= 0.317 USER MOD Single : A 11 DDA O4 : rot 26:sc= 0.0236 USER MOD Single : A 12 DDA O4 : rot 28:sc= 0.0379 USER MOD Single : A 13 CRH O3' : rot 34:sc= 0.351 USER MOD Single : A 13 CRH O4' : rot 26:sc= 0.13 USER MOD Single : A 13 CRH O8 : rot 162:sc= 1.87 USER MOD Single : A 14ADDA O4 : rot 28:sc= 0.0448 USER MOD Single : A 14BDDL O4 : rot -20:sc= 0.0394 USER MOD Single : A 18CMDA O3 : rot 119:sc= 0.018 USER MOD Single : A 18CMDA O4 : rot 150:sc= -0.135 USER MOD Single : A 25 DDA O3 : rot -86:sc= 0.874 USER MOD Single : A 25 DDA O4 : rot 24:sc= 0.00912 USER MOD Single : A 26 DDA O4 : rot 14:sc= 0.359 USER MOD Single : A 27 CRH O3' : rot 153:sc= 0.0887 USER MOD Single : A 27 CRH O4' : rot -172:sc= 0.742 USER MOD Single : A 27 CRH O8 : rot 173:sc= 1.51 USER MOD Single : A 28ADDA O4 : rot 36:sc= 0.881 USER MOD Single : A 28BDDL O4 : rot -25:sc= 0.0314 USER MOD Single : A 29CMDA O3 : rot 69:sc= -2.13! USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot 120:sc= -0.61 USER MOD Single : B 5 DT C7 :methyl 150:sc= -3.32! (180deg=-3.32!) USER MOD Single : B 9 DT C7 :methyl -30:sc= -2.17 (180deg=-2.77!) USER MOD Single : B 10 DA O3' : rot 180:sc= 0 USER MOD Single : B 15 DDA O3 : rot -86:sc= 0.857 USER MOD Single : B 15 DDA O4 : rot 25:sc= 0.00755 USER MOD Single : B 16 DDA O4 : rot 15:sc= 0.364 USER MOD Single : B 17 CRH O3' : rot 147:sc= 0.0832 USER MOD Single : B 17 CRH O4' : rot -171:sc= 0.756 USER MOD Single : B 17 CRH O8 : rot 176:sc= 1.65 USER MOD Single : B 18ADDA O4 : rot 37:sc= 0.955 USER MOD Single : B 18BDDL O4 : rot -31:sc= 0.0367 USER MOD Single : B 21 DDA O3 : rot 10:sc= 0.31 USER MOD Single : B 21 DDA O4 : rot 28:sc= 0.0199 USER MOD Single : B 22 DDA O4 : rot 28:sc= 0.0255 USER MOD Single : B 23 CRH O3' : rot 36:sc= 0.272 USER MOD Single : B 23 CRH O4' : rot 32:sc= 0.15 USER MOD Single : B 23 CRH O8 : rot 177:sc= 1.98 USER MOD Single : B 24ADDA O4 : rot 29:sc= 0.0428 USER MOD Single : B 24BDDL O4 : rot -21:sc= 0.0428 USER MOD Single : B 28CMDA O3 : rot 120:sc= 0.016 USER MOD Single : B 28CMDA O4 : rot 150:sc= -0.146 USER MOD Single : B 30CMDA O3 : rot 70:sc= -2.1! USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -7.738 11.258 -17.108 1.00 0.46 O ATOM 2 C5' DT A 1 -7.750 12.212 -18.180 1.00 0.42 C ATOM 3 C4' DT A 1 -6.329 12.604 -18.605 1.00 0.42 C ATOM 4 O4' DT A 1 -5.597 13.205 -17.519 1.00 0.42 O ATOM 5 C3' DT A 1 -5.486 11.419 -19.084 1.00 0.45 C ATOM 6 O3' DT A 1 -4.629 11.849 -20.151 1.00 0.51 O ATOM 7 C2' DT A 1 -4.726 11.049 -17.837 1.00 0.42 C ATOM 8 C1' DT A 1 -4.460 12.396 -17.186 1.00 0.39 C ATOM 9 N1 DT A 1 -4.402 12.311 -15.705 1.00 0.37 N ATOM 10 C2 DT A 1 -3.210 12.616 -15.076 1.00 0.39 C ATOM 11 O2 DT A 1 -2.181 12.936 -15.663 1.00 0.43 O ATOM 12 N3 DT A 1 -3.223 12.540 -13.709 1.00 0.39 N ATOM 13 C4 DT A 1 -4.274 12.198 -12.905 1.00 0.41 C ATOM 14 O4 DT A 1 -4.103 12.191 -11.687 1.00 0.46 O ATOM 15 C5 DT A 1 -5.489 11.891 -13.628 1.00 0.42 C ATOM 16 C7 DT A 1 -6.759 11.489 -12.867 1.00 0.52 C ATOM 17 C6 DT A 1 -5.513 11.957 -14.977 1.00 0.40 C ATOM 0 H5' DT A 1 -8.296 13.103 -17.869 1.00 0.42 H new ATOM 0 H5'' DT A 1 -8.283 11.794 -19.034 1.00 0.42 H new ATOM 0 H4' DT A 1 -6.480 13.305 -19.426 1.00 0.42 H new ATOM 0 H3' DT A 1 -6.047 10.576 -19.488 1.00 0.45 H new ATOM 0 H2' DT A 1 -5.309 10.395 -17.188 1.00 0.42 H new ATOM 0 H2'' DT A 1 -3.800 10.523 -18.070 1.00 0.42 H new ATOM 0 HO5' DT A 1 -8.659 11.032 -16.861 1.00 0.46 H new ATOM 0 H1' DT A 1 -3.504 12.787 -17.533 1.00 0.39 H new ATOM 0 H3 DT A 1 -2.348 12.764 -13.236 1.00 0.39 H new ATOM 0 H71 DT A 1 -7.637 11.804 -13.431 1.00 0.52 H new ATOM 0 H72 DT A 1 -6.779 10.407 -12.739 1.00 0.52 H new ATOM 0 H73 DT A 1 -6.765 11.970 -11.889 1.00 0.52 H new ATOM 0 H6 DT A 1 -6.430 11.725 -15.498 1.00 0.40 H new ATOM 31 P DA A 2 -3.835 10.786 -21.073 1.00 0.63 P ATOM 32 OP1 DA A 2 -3.216 11.526 -22.197 1.00 0.76 O ATOM 33 OP2 DA A 2 -4.743 9.650 -21.354 1.00 0.82 O ATOM 34 O5' DA A 2 -2.676 10.270 -20.076 1.00 0.54 O ATOM 35 C5' DA A 2 -1.311 10.710 -20.173 1.00 0.43 C ATOM 36 C4' DA A 2 -0.434 10.075 -19.093 1.00 0.31 C ATOM 37 O4' DA A 2 -0.772 10.478 -17.753 1.00 0.33 O ATOM 38 C3' DA A 2 -0.553 8.543 -19.078 1.00 0.30 C ATOM 39 O3' DA A 2 0.578 8.019 -19.785 1.00 0.28 O ATOM 40 C2' DA A 2 -0.640 8.205 -17.596 1.00 0.32 C ATOM 41 C1' DA A 2 -0.225 9.475 -16.889 1.00 0.28 C ATOM 42 N9 DA A 2 -0.831 9.593 -15.557 1.00 0.28 N ATOM 43 C8 DA A 2 -2.095 9.264 -15.163 1.00 0.34 C ATOM 44 N7 DA A 2 -2.338 9.504 -13.904 1.00 0.35 N ATOM 45 C5 DA A 2 -1.135 10.030 -13.438 1.00 0.29 C ATOM 46 C6 DA A 2 -0.716 10.490 -12.185 1.00 0.29 C ATOM 47 N6 DA A 2 -1.509 10.501 -11.120 1.00 0.34 N ATOM 48 N1 DA A 2 0.546 10.942 -12.076 1.00 0.26 N ATOM 49 C2 DA A 2 1.345 10.941 -13.140 1.00 0.23 C ATOM 50 N3 DA A 2 1.052 10.531 -14.365 1.00 0.22 N ATOM 51 C4 DA A 2 -0.216 10.084 -14.442 1.00 0.25 C ATOM 0 H5' DA A 2 -1.271 11.795 -20.082 1.00 0.43 H new ATOM 0 H5'' DA A 2 -0.916 10.458 -21.157 1.00 0.43 H new ATOM 0 H4' DA A 2 0.567 10.416 -19.358 1.00 0.31 H new ATOM 0 H3' DA A 2 -1.417 8.106 -19.580 1.00 0.30 H new ATOM 0 H2' DA A 2 -1.651 7.908 -17.316 1.00 0.32 H new ATOM 0 H2'' DA A 2 0.019 7.375 -17.339 1.00 0.32 H new ATOM 0 H1' DA A 2 0.851 9.535 -16.724 1.00 0.28 H new ATOM 0 H8 DA A 2 -2.829 8.842 -15.834 1.00 0.34 H new ATOM 0 H61 DA A 2 -1.158 10.846 -10.227 1.00 0.34 H new ATOM 0 H62 DA A 2 -2.469 10.164 -11.195 1.00 0.34 H new ATOM 0 H2 DA A 2 2.346 11.317 -12.988 1.00 0.23 H new ATOM 63 P DG A 3 1.106 6.499 -19.705 1.00 0.33 P ATOM 64 OP1 DG A 3 2.072 6.294 -20.805 1.00 0.37 O ATOM 65 OP2 DG A 3 -0.053 5.591 -19.557 1.00 0.47 O ATOM 66 O5' DG A 3 1.920 6.509 -18.311 1.00 0.31 O ATOM 67 C5' DG A 3 2.965 7.459 -18.069 1.00 0.25 C ATOM 68 C4' DG A 3 3.361 7.488 -16.596 1.00 0.27 C ATOM 69 O4' DG A 3 2.289 7.942 -15.737 1.00 0.29 O ATOM 70 C3' DG A 3 3.754 6.110 -16.057 1.00 0.31 C ATOM 71 O3' DG A 3 5.174 5.907 -16.095 1.00 0.32 O ATOM 72 C2' DG A 3 3.182 6.161 -14.651 1.00 0.33 C ATOM 73 C1' DG A 3 2.713 7.574 -14.416 1.00 0.29 C ATOM 74 N9 DG A 3 1.628 7.506 -13.412 1.00 0.30 N ATOM 75 C8 DG A 3 0.397 6.977 -13.617 1.00 0.35 C ATOM 76 N7 DG A 3 -0.395 7.008 -12.587 1.00 0.34 N ATOM 77 C5 DG A 3 0.380 7.612 -11.603 1.00 0.30 C ATOM 78 C6 DG A 3 0.060 7.920 -10.253 1.00 0.31 C ATOM 79 O6 DG A 3 -0.973 7.736 -9.615 1.00 0.35 O ATOM 80 N1 DG A 3 1.109 8.515 -9.611 1.00 0.30 N ATOM 81 C2 DG A 3 2.322 8.792 -10.172 1.00 0.29 C ATOM 82 N2 DG A 3 3.198 9.352 -9.364 1.00 0.30 N ATOM 83 N3 DG A 3 2.653 8.518 -11.435 1.00 0.27 N ATOM 84 C4 DG A 3 1.627 7.924 -12.096 1.00 0.28 C ATOM 0 H5' DG A 3 2.636 8.451 -18.378 1.00 0.25 H new ATOM 0 H5'' DG A 3 3.835 7.208 -18.676 1.00 0.25 H new ATOM 0 H4' DG A 3 4.206 8.176 -16.574 1.00 0.27 H new ATOM 0 H3' DG A 3 3.376 5.269 -16.638 1.00 0.31 H new ATOM 0 H2' DG A 3 2.356 5.458 -14.545 1.00 0.33 H new ATOM 0 H2'' DG A 3 3.937 5.878 -13.917 1.00 0.33 H new ATOM 0 H1' DG A 3 3.426 8.297 -14.020 1.00 0.29 H new ATOM 0 H8 DG A 3 0.096 6.560 -14.567 1.00 0.35 H new ATOM 0 H1 DG A 3 0.975 8.773 -8.633 1.00 0.30 H new ATOM 0 H21 DG A 3 4.129 9.590 -9.707 1.00 0.30 H new ATOM 0 H22 DG A 3 2.946 9.547 -8.395 1.00 0.30 H new ATOM 96 P DC A 4 5.839 4.552 -15.502 1.00 0.38 P ATOM 97 OP1 DC A 4 7.238 4.474 -15.976 1.00 0.47 O ATOM 98 OP2 DC A 4 4.915 3.423 -15.753 1.00 0.45 O ATOM 99 O5' DC A 4 5.860 4.854 -13.929 1.00 0.35 O ATOM 100 C5' DC A 4 6.774 5.811 -13.384 1.00 0.32 C ATOM 101 C4' DC A 4 6.477 6.052 -11.918 1.00 0.31 C ATOM 102 O4' DC A 4 5.138 6.542 -11.705 1.00 0.32 O ATOM 103 C3' DC A 4 6.517 4.779 -11.075 1.00 0.34 C ATOM 104 O3' DC A 4 7.874 4.409 -10.808 1.00 0.38 O ATOM 105 C2' DC A 4 5.815 5.249 -9.847 1.00 0.31 C ATOM 106 C1' DC A 4 4.742 6.204 -10.363 1.00 0.30 C ATOM 107 N1 DC A 4 3.356 5.676 -10.213 1.00 0.29 N ATOM 108 C2 DC A 4 2.800 5.734 -8.937 1.00 0.32 C ATOM 109 O2 DC A 4 3.427 6.182 -7.983 1.00 0.35 O ATOM 110 N3 DC A 4 1.542 5.275 -8.744 1.00 0.34 N ATOM 111 C4 DC A 4 0.836 4.774 -9.758 1.00 0.35 C ATOM 112 N4 DC A 4 -0.398 4.352 -9.505 1.00 0.36 N ATOM 113 C5 DC A 4 1.380 4.700 -11.082 1.00 0.36 C ATOM 114 C6 DC A 4 2.636 5.160 -11.267 1.00 0.32 C ATOM 0 H5' DC A 4 6.700 6.748 -13.935 1.00 0.32 H new ATOM 0 H5'' DC A 4 7.797 5.453 -13.500 1.00 0.32 H new ATOM 0 H4' DC A 4 7.248 6.764 -11.626 1.00 0.31 H new ATOM 0 H3' DC A 4 6.070 3.895 -11.530 1.00 0.34 H new ATOM 0 H2' DC A 4 5.375 4.417 -9.298 1.00 0.31 H new ATOM 0 H2'' DC A 4 6.501 5.753 -9.166 1.00 0.31 H new ATOM 0 H1' DC A 4 4.683 7.111 -9.762 1.00 0.30 H new ATOM 0 H41 DC A 4 -0.968 3.963 -10.256 1.00 0.36 H new ATOM 0 H42 DC A 4 -0.776 4.417 -8.560 1.00 0.36 H new ATOM 0 H5 DC A 4 0.807 4.292 -11.901 1.00 0.36 H new ATOM 0 H6 DC A 4 3.080 5.123 -12.251 1.00 0.32 H new ATOM 126 P DT A 5 8.226 3.168 -9.840 1.00 0.41 P ATOM 127 OP1 DT A 5 9.689 2.944 -9.889 1.00 0.52 O ATOM 128 OP2 DT A 5 7.298 2.058 -10.151 1.00 0.52 O ATOM 129 O5' DT A 5 7.832 3.747 -8.386 1.00 0.34 O ATOM 130 C5' DT A 5 8.637 4.707 -7.682 1.00 0.28 C ATOM 131 C4' DT A 5 8.537 4.482 -6.174 1.00 0.19 C ATOM 132 O4' DT A 5 7.196 4.685 -5.663 1.00 0.21 O ATOM 133 C3' DT A 5 8.925 3.045 -5.811 1.00 0.18 C ATOM 134 O3' DT A 5 9.749 3.006 -4.641 1.00 0.24 O ATOM 135 C2' DT A 5 7.596 2.370 -5.637 1.00 0.17 C ATOM 136 C1' DT A 5 6.701 3.466 -5.082 1.00 0.16 C ATOM 137 N1 DT A 5 5.322 3.200 -5.538 1.00 0.14 N ATOM 138 C2 DT A 5 4.299 3.115 -4.603 1.00 0.14 C ATOM 139 O2 DT A 5 4.438 3.278 -3.394 1.00 0.19 O ATOM 140 N3 DT A 5 3.057 2.827 -5.113 1.00 0.15 N ATOM 141 C4 DT A 5 2.745 2.619 -6.431 1.00 0.17 C ATOM 142 O4 DT A 5 1.584 2.373 -6.737 1.00 0.20 O ATOM 143 C5 DT A 5 3.858 2.724 -7.336 1.00 0.20 C ATOM 144 C7 DT A 5 3.638 2.470 -8.820 1.00 0.27 C ATOM 145 C6 DT A 5 5.088 3.011 -6.875 1.00 0.18 C ATOM 0 H5' DT A 5 8.309 5.717 -7.928 1.00 0.28 H new ATOM 0 H5'' DT A 5 9.676 4.623 -8.001 1.00 0.28 H new ATOM 0 H4' DT A 5 9.216 5.210 -5.729 1.00 0.19 H new ATOM 0 H3' DT A 5 9.535 2.546 -6.565 1.00 0.18 H new ATOM 0 H2' DT A 5 7.216 1.985 -6.583 1.00 0.17 H new ATOM 0 H2'' DT A 5 7.664 1.524 -4.953 1.00 0.17 H new ATOM 0 H1' DT A 5 6.702 3.520 -3.993 1.00 0.16 H new ATOM 0 H3 DT A 5 2.290 2.761 -4.444 1.00 0.15 H new ATOM 0 H71 DT A 5 4.343 3.065 -9.400 1.00 0.27 H new ATOM 0 H72 DT A 5 3.793 1.413 -9.035 1.00 0.27 H new ATOM 0 H73 DT A 5 2.620 2.750 -9.090 1.00 0.27 H new ATOM 0 H6 DT A 5 5.908 3.094 -7.573 1.00 0.18 H new ATOM 158 P DA A 6 10.419 1.610 -4.197 1.00 0.31 P ATOM 159 OP1 DA A 6 11.395 1.889 -3.119 1.00 0.44 O ATOM 160 OP2 DA A 6 10.854 0.886 -5.412 1.00 0.41 O ATOM 161 O5' DA A 6 9.151 0.830 -3.571 1.00 0.25 O ATOM 162 C5' DA A 6 8.786 1.002 -2.194 1.00 0.20 C ATOM 163 C4' DA A 6 7.717 0.008 -1.746 1.00 0.18 C ATOM 164 O4' DA A 6 6.424 0.365 -2.273 1.00 0.19 O ATOM 165 C3' DA A 6 7.968 -1.448 -2.183 1.00 0.21 C ATOM 166 O3' DA A 6 8.418 -2.241 -1.072 1.00 0.25 O ATOM 167 C2' DA A 6 6.626 -1.869 -2.760 1.00 0.19 C ATOM 168 C1' DA A 6 5.619 -0.814 -2.336 1.00 0.17 C ATOM 169 N9 DA A 6 4.625 -0.595 -3.398 1.00 0.14 N ATOM 170 C8 DA A 6 4.847 -0.355 -4.729 1.00 0.14 C ATOM 171 N7 DA A 6 3.760 -0.208 -5.431 1.00 0.13 N ATOM 172 C5 DA A 6 2.745 -0.362 -4.490 1.00 0.11 C ATOM 173 C6 DA A 6 1.354 -0.322 -4.587 1.00 0.13 C ATOM 174 N6 DA A 6 0.721 -0.117 -5.734 1.00 0.16 N ATOM 175 N1 DA A 6 0.642 -0.512 -3.466 1.00 0.14 N ATOM 176 C2 DA A 6 1.274 -0.731 -2.318 1.00 0.13 C ATOM 177 N3 DA A 6 2.576 -0.793 -2.101 1.00 0.12 N ATOM 178 C4 DA A 6 3.263 -0.597 -3.249 1.00 0.11 C ATOM 0 H5' DA A 6 8.420 2.018 -2.042 1.00 0.20 H new ATOM 0 H5'' DA A 6 9.671 0.885 -1.569 1.00 0.20 H new ATOM 0 H4' DA A 6 7.756 0.061 -0.658 1.00 0.18 H new ATOM 0 H3' DA A 6 8.763 -1.574 -2.918 1.00 0.21 H new ATOM 0 H2' DA A 6 6.677 -1.941 -3.846 1.00 0.19 H new ATOM 0 H2'' DA A 6 6.336 -2.852 -2.389 1.00 0.19 H new ATOM 0 H1' DA A 6 5.092 -1.081 -1.420 1.00 0.17 H new ATOM 0 H8 DA A 6 5.836 -0.293 -5.158 1.00 0.14 H new ATOM 0 H61 DA A 6 -0.299 -0.096 -5.757 1.00 0.16 H new ATOM 0 H62 DA A 6 1.254 0.020 -6.593 1.00 0.16 H new ATOM 0 H2 DA A 6 0.644 -0.877 -1.453 1.00 0.13 H new ATOM 190 P DG A 7 8.500 -3.856 -1.124 1.00 0.25 P ATOM 191 OP1 DG A 7 9.087 -4.336 0.149 1.00 0.31 O ATOM 192 OP2 DG A 7 9.080 -4.275 -2.420 1.00 0.32 O ATOM 193 O5' DG A 7 6.935 -4.239 -1.111 1.00 0.23 O ATOM 194 C5' DG A 7 6.177 -3.881 0.051 1.00 0.23 C ATOM 195 C4' DG A 7 4.696 -4.137 -0.063 1.00 0.21 C ATOM 196 O4' DG A 7 4.142 -3.365 -1.135 1.00 0.21 O ATOM 197 C3' DG A 7 4.363 -5.581 -0.419 1.00 0.20 C ATOM 198 O3' DG A 7 4.168 -6.408 0.736 1.00 0.23 O ATOM 199 C2' DG A 7 3.102 -5.418 -1.194 1.00 0.22 C ATOM 200 C1' DG A 7 2.867 -3.947 -1.402 1.00 0.20 C ATOM 201 N9 DG A 7 2.542 -3.780 -2.818 1.00 0.19 N ATOM 202 C8 DG A 7 3.452 -3.688 -3.805 1.00 0.21 C ATOM 203 N7 DG A 7 2.939 -3.536 -5.000 1.00 0.22 N ATOM 204 C5 DG A 7 1.561 -3.534 -4.760 1.00 0.21 C ATOM 205 C6 DG A 7 0.453 -3.407 -5.655 1.00 0.23 C ATOM 206 O6 DG A 7 0.417 -3.253 -6.873 1.00 0.27 O ATOM 207 N1 DG A 7 -0.747 -3.463 -4.984 1.00 0.23 N ATOM 208 C2 DG A 7 -0.887 -3.618 -3.632 1.00 0.21 C ATOM 209 N2 DG A 7 -2.118 -3.664 -3.174 1.00 0.23 N ATOM 210 N3 DG A 7 0.127 -3.733 -2.785 1.00 0.19 N ATOM 211 C4 DG A 7 1.319 -3.685 -3.418 1.00 0.18 C ATOM 0 H5' DG A 7 6.335 -2.823 0.260 1.00 0.23 H new ATOM 0 H5'' DG A 7 6.564 -4.436 0.906 1.00 0.23 H new ATOM 0 H4' DG A 7 4.289 -3.879 0.915 1.00 0.21 H new ATOM 0 H3' DG A 7 5.163 -6.084 -0.962 1.00 0.20 H new ATOM 0 H2' DG A 7 3.176 -5.931 -2.153 1.00 0.22 H new ATOM 0 H2'' DG A 7 2.265 -5.865 -0.657 1.00 0.22 H new ATOM 0 H1' DG A 7 2.078 -3.512 -0.789 1.00 0.20 H new ATOM 0 H8 DG A 7 4.516 -3.736 -3.626 1.00 0.21 H new ATOM 0 H1 DG A 7 -1.599 -3.383 -5.538 1.00 0.23 H new ATOM 0 H21 DG A 7 -2.286 -3.778 -2.174 1.00 0.23 H new ATOM 0 H22 DG A 7 -2.905 -3.585 -3.818 1.00 0.23 H new ATOM 223 P DC A 8 3.946 -8.006 0.587 1.00 0.26 P ATOM 224 OP1 DC A 8 3.995 -8.589 1.947 1.00 0.34 O ATOM 225 OP2 DC A 8 4.869 -8.509 -0.457 1.00 0.35 O ATOM 226 O5' DC A 8 2.431 -8.131 0.028 1.00 0.23 O ATOM 227 C5' DC A 8 1.294 -8.007 0.896 1.00 0.21 C ATOM 228 C4' DC A 8 -0.038 -8.054 0.148 1.00 0.19 C ATOM 229 O4' DC A 8 -0.184 -6.978 -0.790 1.00 0.21 O ATOM 230 C3' DC A 8 -0.261 -9.316 -0.700 1.00 0.21 C ATOM 231 O3' DC A 8 -0.650 -10.444 0.109 1.00 0.22 O ATOM 232 C2' DC A 8 -1.428 -8.821 -1.518 1.00 0.24 C ATOM 233 C1' DC A 8 -1.103 -7.378 -1.821 1.00 0.24 C ATOM 234 N1 DC A 8 -0.568 -7.131 -3.179 1.00 0.22 N ATOM 235 C2 DC A 8 -1.455 -7.130 -4.240 1.00 0.26 C ATOM 236 O2 DC A 8 -2.648 -7.362 -4.075 1.00 0.31 O ATOM 237 N3 DC A 8 -0.984 -6.872 -5.485 1.00 0.27 N ATOM 238 C4 DC A 8 0.311 -6.623 -5.687 1.00 0.26 C ATOM 239 N4 DC A 8 0.717 -6.367 -6.924 1.00 0.31 N ATOM 240 C5 DC A 8 1.239 -6.624 -4.600 1.00 0.24 C ATOM 241 C6 DC A 8 0.755 -6.884 -3.377 1.00 0.21 C ATOM 0 H5' DC A 8 1.363 -7.067 1.444 1.00 0.21 H new ATOM 0 H5'' DC A 8 1.318 -8.809 1.634 1.00 0.21 H new ATOM 0 H4' DC A 8 -0.754 -8.007 0.969 1.00 0.19 H new ATOM 0 H3' DC A 8 0.609 -9.671 -1.253 1.00 0.21 H new ATOM 0 H2' DC A 8 -1.543 -9.401 -2.434 1.00 0.24 H new ATOM 0 H2'' DC A 8 -2.364 -8.908 -0.965 1.00 0.24 H new ATOM 0 H1' DC A 8 -2.017 -6.784 -1.821 1.00 0.24 H new ATOM 0 H41 DC A 8 1.701 -6.173 -7.108 1.00 0.31 H new ATOM 0 H42 DC A 8 0.045 -6.364 -7.691 1.00 0.31 H new ATOM 0 H5 DC A 8 2.288 -6.423 -4.758 1.00 0.24 H new ATOM 0 H6 DC A 8 1.428 -6.898 -2.533 1.00 0.21 H new ATOM 253 P DT A 9 -1.185 -11.815 -0.574 1.00 0.20 P ATOM 254 OP1 DT A 9 -1.513 -12.798 0.481 1.00 0.24 O ATOM 255 OP2 DT A 9 -0.265 -12.186 -1.672 1.00 0.25 O ATOM 256 O5' DT A 9 -2.575 -11.338 -1.239 1.00 0.23 O ATOM 257 C5' DT A 9 -3.766 -11.020 -0.489 1.00 0.24 C ATOM 258 C4' DT A 9 -4.986 -11.355 -1.335 1.00 0.26 C ATOM 259 O4' DT A 9 -5.068 -10.558 -2.530 1.00 0.31 O ATOM 260 C3' DT A 9 -4.986 -12.807 -1.730 1.00 0.26 C ATOM 261 O3' DT A 9 -6.281 -13.299 -1.369 1.00 0.32 O ATOM 262 C2' DT A 9 -4.703 -12.770 -3.185 1.00 0.25 C ATOM 263 C1' DT A 9 -5.173 -11.418 -3.666 1.00 0.26 C ATOM 264 N1 DT A 9 -4.176 -10.950 -4.653 1.00 0.23 N ATOM 265 C2 DT A 9 -4.563 -10.611 -5.933 1.00 0.25 C ATOM 266 O2 DT A 9 -5.720 -10.651 -6.338 1.00 0.30 O ATOM 267 N3 DT A 9 -3.548 -10.207 -6.764 1.00 0.25 N ATOM 268 C4 DT A 9 -2.211 -10.112 -6.446 1.00 0.24 C ATOM 269 O4 DT A 9 -1.428 -9.725 -7.305 1.00 0.30 O ATOM 270 C5 DT A 9 -1.895 -10.485 -5.087 1.00 0.22 C ATOM 271 C7 DT A 9 -0.455 -10.462 -4.567 1.00 0.24 C ATOM 272 C6 DT A 9 -2.868 -10.880 -4.261 1.00 0.22 C ATOM 0 H5' DT A 9 -3.772 -9.963 -0.221 1.00 0.24 H new ATOM 0 H5'' DT A 9 -3.787 -11.585 0.443 1.00 0.24 H new ATOM 0 H4' DT A 9 -5.851 -11.133 -0.711 1.00 0.26 H new ATOM 0 H3' DT A 9 -4.259 -13.465 -1.255 1.00 0.26 H new ATOM 0 H2' DT A 9 -3.639 -12.905 -3.379 1.00 0.25 H new ATOM 0 H2'' DT A 9 -5.226 -13.573 -3.705 1.00 0.25 H new ATOM 0 H1' DT A 9 -6.177 -11.440 -4.089 1.00 0.26 H new ATOM 0 H3 DT A 9 -3.811 -9.951 -7.716 1.00 0.25 H new ATOM 0 H71 DT A 9 0.232 -10.667 -5.388 1.00 0.24 H new ATOM 0 H72 DT A 9 -0.236 -9.480 -4.147 1.00 0.24 H new ATOM 0 H73 DT A 9 -0.335 -11.222 -3.795 1.00 0.24 H new ATOM 0 H6 DT A 9 -2.612 -11.154 -3.248 1.00 0.22 H new ATOM 285 P DA A 10 -6.740 -14.824 -1.575 1.00 0.32 P ATOM 286 OP1 DA A 10 -8.098 -14.979 -1.008 1.00 0.39 O ATOM 287 OP2 DA A 10 -5.644 -15.715 -1.134 1.00 0.41 O ATOM 288 O5' DA A 10 -6.839 -14.903 -3.183 1.00 0.27 O ATOM 289 C5' DA A 10 -7.857 -14.227 -3.940 1.00 0.31 C ATOM 290 C4' DA A 10 -7.580 -14.345 -5.431 1.00 0.31 C ATOM 291 O4' DA A 10 -6.367 -13.680 -5.765 1.00 0.28 O ATOM 292 C3' DA A 10 -7.335 -15.803 -5.856 1.00 0.34 C ATOM 293 O3' DA A 10 -8.511 -16.474 -6.315 1.00 0.46 O ATOM 294 C2' DA A 10 -6.237 -15.695 -6.899 1.00 0.31 C ATOM 295 C1' DA A 10 -6.019 -14.203 -7.042 1.00 0.25 C ATOM 296 N9 DA A 10 -4.638 -13.805 -7.257 1.00 0.24 N ATOM 297 C8 DA A 10 -3.617 -13.900 -6.377 1.00 0.25 C ATOM 298 N7 DA A 10 -2.481 -13.430 -6.828 1.00 0.27 N ATOM 299 C5 DA A 10 -2.807 -12.995 -8.117 1.00 0.26 C ATOM 300 C6 DA A 10 -2.071 -12.393 -9.152 1.00 0.30 C ATOM 301 N6 DA A 10 -0.782 -12.079 -9.096 1.00 0.34 N ATOM 302 N1 DA A 10 -2.731 -12.109 -10.280 1.00 0.32 N ATOM 303 C2 DA A 10 -4.021 -12.392 -10.394 1.00 0.33 C ATOM 304 N3 DA A 10 -4.815 -12.951 -9.504 1.00 0.30 N ATOM 305 C4 DA A 10 -4.127 -13.228 -8.376 1.00 0.25 C ATOM 0 H5' DA A 10 -7.894 -13.176 -3.653 1.00 0.31 H new ATOM 0 H5'' DA A 10 -8.833 -14.655 -3.711 1.00 0.31 H new ATOM 0 H4' DA A 10 -8.454 -13.921 -5.925 1.00 0.31 H new ATOM 0 H3' DA A 10 -7.039 -16.433 -5.017 1.00 0.34 H new ATOM 0 H2' DA A 10 -5.328 -16.203 -6.577 1.00 0.31 H new ATOM 0 H2'' DA A 10 -6.537 -16.148 -7.844 1.00 0.31 H new ATOM 0 HO3' DA A 10 -8.285 -17.393 -6.570 1.00 0.46 H new ATOM 0 H1' DA A 10 -6.591 -13.853 -7.901 1.00 0.25 H new ATOM 0 H8 DA A 10 -3.728 -14.325 -5.390 1.00 0.25 H new ATOM 0 H61 DA A 10 -0.328 -11.643 -9.898 1.00 0.34 H new ATOM 0 H62 DA A 10 -0.246 -12.274 -8.250 1.00 0.34 H new ATOM 0 H2 DA A 10 -4.479 -12.131 -11.336 1.00 0.33 H new TER 318 DA A 10 ATOM 319 O5' DT B 1 -0.356 -10.577 -18.366 1.00 0.46 O ATOM 320 C5' DT B 1 -0.951 -11.629 -19.140 1.00 0.42 C ATOM 321 C4' DT B 1 -2.335 -12.015 -18.599 1.00 0.42 C ATOM 322 O4' DT B 1 -2.261 -12.484 -17.241 1.00 0.40 O ATOM 323 C3' DT B 1 -3.335 -10.856 -18.597 1.00 0.45 C ATOM 324 O3' DT B 1 -4.644 -11.360 -18.899 1.00 0.50 O ATOM 325 C2' DT B 1 -3.218 -10.343 -17.184 1.00 0.41 C ATOM 326 C1' DT B 1 -3.001 -11.612 -16.375 1.00 0.37 C ATOM 327 N1 DT B 1 -2.173 -11.383 -15.165 1.00 0.37 N ATOM 328 C2 DT B 1 -2.749 -11.586 -13.926 1.00 0.39 C ATOM 329 O2 DT B 1 -3.915 -11.928 -13.755 1.00 0.44 O ATOM 330 N3 DT B 1 -1.931 -11.378 -12.849 1.00 0.39 N ATOM 331 C4 DT B 1 -0.618 -10.994 -12.863 1.00 0.42 C ATOM 332 O4 DT B 1 -0.034 -10.863 -11.788 1.00 0.45 O ATOM 333 C5 DT B 1 -0.080 -10.797 -14.190 1.00 0.44 C ATOM 334 C7 DT B 1 1.380 -10.365 -14.375 1.00 0.54 C ATOM 335 C6 DT B 1 -0.858 -10.994 -15.276 1.00 0.40 C ATOM 0 H5' DT B 1 -0.299 -12.502 -19.130 1.00 0.42 H new ATOM 0 H5'' DT B 1 -1.041 -11.311 -20.179 1.00 0.42 H new ATOM 0 H4' DT B 1 -2.678 -12.796 -19.278 1.00 0.42 H new ATOM 0 H3' DT B 1 -3.150 -10.075 -19.335 1.00 0.45 H new ATOM 0 H2' DT B 1 -2.386 -9.648 -17.075 1.00 0.41 H new ATOM 0 H2'' DT B 1 -4.118 -9.814 -16.871 1.00 0.41 H new ATOM 0 HO5' DT B 1 0.490 -10.891 -17.983 1.00 0.46 H new ATOM 0 H1' DT B 1 -3.962 -12.005 -16.044 1.00 0.37 H new ATOM 0 H3 DT B 1 -2.348 -11.526 -11.930 1.00 0.39 H new ATOM 0 H71 DT B 1 1.760 -10.761 -15.317 1.00 0.54 H new ATOM 0 H72 DT B 1 1.438 -9.277 -14.389 1.00 0.54 H new ATOM 0 H73 DT B 1 1.981 -10.750 -13.551 1.00 0.54 H new ATOM 0 H6 DT B 1 -0.436 -10.842 -16.259 1.00 0.40 H new ATOM 349 P DA B 2 -5.863 -10.366 -19.268 1.00 0.63 P ATOM 350 OP1 DA B 2 -7.003 -11.191 -19.726 1.00 0.77 O ATOM 351 OP2 DA B 2 -5.335 -9.292 -20.140 1.00 0.81 O ATOM 352 O5' DA B 2 -6.219 -9.720 -17.832 1.00 0.54 O ATOM 353 C5' DA B 2 -7.360 -10.123 -17.057 1.00 0.42 C ATOM 354 C4' DA B 2 -7.446 -9.359 -15.736 1.00 0.32 C ATOM 355 O4' DA B 2 -6.365 -9.641 -14.827 1.00 0.32 O ATOM 356 C3' DA B 2 -7.391 -7.836 -15.943 1.00 0.32 C ATOM 357 O3' DA B 2 -8.736 -7.348 -15.888 1.00 0.28 O ATOM 358 C2' DA B 2 -6.451 -7.360 -14.843 1.00 0.31 C ATOM 359 C1' DA B 2 -6.326 -8.542 -13.909 1.00 0.27 C ATOM 360 N9 DA B 2 -5.045 -8.549 -13.192 1.00 0.28 N ATOM 361 C8 DA B 2 -3.804 -8.224 -13.659 1.00 0.33 C ATOM 362 N7 DA B 2 -2.854 -8.348 -12.774 1.00 0.33 N ATOM 363 C5 DA B 2 -3.529 -8.788 -11.637 1.00 0.28 C ATOM 364 C6 DA B 2 -3.109 -9.111 -10.341 1.00 0.28 C ATOM 365 N6 DA B 2 -1.838 -9.045 -9.960 1.00 0.33 N ATOM 366 N1 DA B 2 -4.044 -9.511 -9.463 1.00 0.26 N ATOM 367 C2 DA B 2 -5.319 -9.587 -9.839 1.00 0.23 C ATOM 368 N3 DA B 2 -5.822 -9.308 -11.031 1.00 0.23 N ATOM 369 C4 DA B 2 -4.862 -8.910 -11.888 1.00 0.25 C ATOM 0 H5' DA B 2 -7.303 -11.193 -16.855 1.00 0.42 H new ATOM 0 H5'' DA B 2 -8.269 -9.955 -17.634 1.00 0.42 H new ATOM 0 H4' DA B 2 -8.397 -9.692 -15.321 1.00 0.32 H new ATOM 0 H3' DA B 2 -7.009 -7.476 -16.898 1.00 0.32 H new ATOM 0 H2' DA B 2 -5.481 -7.071 -15.248 1.00 0.31 H new ATOM 0 H2'' DA B 2 -6.854 -6.488 -14.327 1.00 0.31 H new ATOM 0 H1' DA B 2 -7.093 -8.552 -13.134 1.00 0.27 H new ATOM 0 H8 DA B 2 -3.625 -7.894 -14.671 1.00 0.33 H new ATOM 0 H61 DA B 2 -1.579 -9.290 -9.004 1.00 0.33 H new ATOM 0 H62 DA B 2 -1.122 -8.749 -10.623 1.00 0.33 H new ATOM 0 H2 DA B 2 -6.022 -9.913 -9.087 1.00 0.23 H new ATOM 381 P DG B 3 -9.162 -5.811 -15.657 1.00 0.30 P ATOM 382 OP1 DG B 3 -10.598 -5.683 -15.985 1.00 0.37 O ATOM 383 OP2 DG B 3 -8.171 -4.931 -16.315 1.00 0.45 O ATOM 384 O5' DG B 3 -8.990 -5.660 -14.059 1.00 0.29 O ATOM 385 C5' DG B 3 -9.657 -6.549 -13.154 1.00 0.26 C ATOM 386 C4' DG B 3 -9.099 -6.423 -11.740 1.00 0.27 C ATOM 387 O4' DG B 3 -7.713 -6.825 -11.645 1.00 0.28 O ATOM 388 C3' DG B 3 -9.141 -4.986 -11.209 1.00 0.31 C ATOM 389 O3' DG B 3 -10.312 -4.743 -10.416 1.00 0.32 O ATOM 390 C2' DG B 3 -7.844 -4.919 -10.420 1.00 0.32 C ATOM 391 C1' DG B 3 -7.283 -6.317 -10.373 1.00 0.28 C ATOM 392 N9 DG B 3 -5.817 -6.187 -10.220 1.00 0.30 N ATOM 393 C8 DG B 3 -4.965 -5.720 -11.166 1.00 0.33 C ATOM 394 N7 DG B 3 -3.715 -5.676 -10.811 1.00 0.36 N ATOM 395 C5 DG B 3 -3.737 -6.157 -9.506 1.00 0.31 C ATOM 396 C6 DG B 3 -2.668 -6.343 -8.586 1.00 0.33 C ATOM 397 O6 DG B 3 -1.465 -6.132 -8.708 1.00 0.38 O ATOM 398 N1 DG B 3 -3.113 -6.839 -7.393 1.00 0.30 N ATOM 399 C2 DG B 3 -4.413 -7.130 -7.095 1.00 0.27 C ATOM 400 N2 DG B 3 -4.618 -7.582 -5.876 1.00 0.29 N ATOM 401 N3 DG B 3 -5.436 -6.970 -7.936 1.00 0.27 N ATOM 402 C4 DG B 3 -5.022 -6.475 -9.129 1.00 0.28 C ATOM 0 H5' DG B 3 -9.545 -7.576 -13.501 1.00 0.26 H new ATOM 0 H5'' DG B 3 -10.725 -6.330 -13.147 1.00 0.26 H new ATOM 0 H4' DG B 3 -9.742 -7.080 -11.154 1.00 0.27 H new ATOM 0 H3' DG B 3 -9.210 -4.217 -11.979 1.00 0.31 H new ATOM 0 H2' DG B 3 -7.139 -4.236 -10.895 1.00 0.32 H new ATOM 0 H2'' DG B 3 -8.024 -4.542 -9.413 1.00 0.32 H new ATOM 0 H1' DG B 3 -7.600 -6.975 -9.564 1.00 0.28 H new ATOM 0 H8 DG B 3 -5.301 -5.407 -12.144 1.00 0.33 H new ATOM 0 H1 DG B 3 -2.417 -7.005 -6.666 1.00 0.30 H new ATOM 0 H21 DG B 3 -5.562 -7.823 -5.573 1.00 0.29 H new ATOM 0 H22 DG B 3 -3.833 -7.691 -5.234 1.00 0.29 H new ATOM 414 P DC B 4 -10.538 -3.317 -9.680 1.00 0.37 P ATOM 415 OP1 DC B 4 -11.948 -3.240 -9.237 1.00 0.43 O ATOM 416 OP2 DC B 4 -9.980 -2.248 -10.538 1.00 0.48 O ATOM 417 O5' DC B 4 -9.614 -3.464 -8.380 1.00 0.34 O ATOM 418 C5' DC B 4 -9.994 -4.334 -7.309 1.00 0.30 C ATOM 419 C4' DC B 4 -8.877 -4.442 -6.290 1.00 0.28 C ATOM 420 O4' DC B 4 -7.659 -4.951 -6.868 1.00 0.26 O ATOM 421 C3' DC B 4 -8.451 -3.093 -5.718 1.00 0.33 C ATOM 422 O3' DC B 4 -9.396 -2.656 -4.734 1.00 0.37 O ATOM 423 C2' DC B 4 -7.142 -3.463 -5.107 1.00 0.28 C ATOM 424 C1' DC B 4 -6.554 -4.497 -6.062 1.00 0.29 C ATOM 425 N1 DC B 4 -5.368 -4.003 -6.817 1.00 0.32 N ATOM 426 C2 DC B 4 -4.163 -3.953 -6.121 1.00 0.34 C ATOM 427 O2 DC B 4 -4.085 -4.288 -4.943 1.00 0.36 O ATOM 428 N3 DC B 4 -3.051 -3.519 -6.759 1.00 0.36 N ATOM 429 C4 DC B 4 -3.099 -3.141 -8.035 1.00 0.35 C ATOM 430 N4 DC B 4 -1.970 -2.736 -8.606 1.00 0.37 N ATOM 431 C5 DC B 4 -4.325 -3.178 -8.778 1.00 0.36 C ATOM 432 C6 DC B 4 -5.431 -3.614 -8.136 1.00 0.34 C ATOM 0 H5' DC B 4 -10.232 -5.322 -7.703 1.00 0.30 H new ATOM 0 H5'' DC B 4 -10.897 -3.956 -6.829 1.00 0.30 H new ATOM 0 H4' DC B 4 -9.299 -5.098 -5.529 1.00 0.28 H new ATOM 0 H3' DC B 4 -8.391 -2.273 -6.434 1.00 0.33 H new ATOM 0 H2' DC B 4 -6.489 -2.595 -5.011 1.00 0.28 H new ATOM 0 H2'' DC B 4 -7.273 -3.876 -4.107 1.00 0.28 H new ATOM 0 H1' DC B 4 -6.120 -5.342 -5.527 1.00 0.29 H new ATOM 0 H41 DC B 4 -1.970 -2.439 -9.582 1.00 0.37 H new ATOM 0 H42 DC B 4 -1.103 -2.722 -8.068 1.00 0.37 H new ATOM 0 H5 DC B 4 -4.363 -2.869 -9.812 1.00 0.36 H new ATOM 0 H6 DC B 4 -6.373 -3.658 -8.662 1.00 0.34 H new ATOM 444 P DT B 5 -9.143 -1.316 -3.872 1.00 0.42 P ATOM 445 OP1 DT B 5 -10.356 -1.051 -3.065 1.00 0.52 O ATOM 446 OP2 DT B 5 -8.617 -0.271 -4.778 1.00 0.53 O ATOM 447 O5' DT B 5 -7.945 -1.762 -2.887 1.00 0.33 O ATOM 448 C5' DT B 5 -8.146 -2.624 -1.755 1.00 0.29 C ATOM 449 C4' DT B 5 -7.177 -2.259 -0.630 1.00 0.20 C ATOM 450 O4' DT B 5 -5.790 -2.455 -0.998 1.00 0.22 O ATOM 451 C3' DT B 5 -7.320 -0.781 -0.249 1.00 0.19 C ATOM 452 O3' DT B 5 -7.291 -0.604 1.170 1.00 0.26 O ATOM 453 C2' DT B 5 -6.170 -0.136 -0.963 1.00 0.17 C ATOM 454 C1' DT B 5 -5.085 -1.200 -0.946 1.00 0.16 C ATOM 455 N1 DT B 5 -4.256 -1.024 -2.154 1.00 0.14 N ATOM 456 C2 DT B 5 -2.880 -0.881 -2.021 1.00 0.14 C ATOM 457 O2 DT B 5 -2.270 -0.922 -0.956 1.00 0.16 O ATOM 458 N3 DT B 5 -2.192 -0.684 -3.194 1.00 0.17 N ATOM 459 C4 DT B 5 -2.729 -0.615 -4.452 1.00 0.18 C ATOM 460 O4 DT B 5 -1.985 -0.437 -5.409 1.00 0.22 O ATOM 461 C5 DT B 5 -4.159 -0.772 -4.504 1.00 0.19 C ATOM 462 C7 DT B 5 -4.871 -0.668 -5.845 1.00 0.26 C ATOM 463 C6 DT B 5 -4.865 -0.972 -3.380 1.00 0.18 C ATOM 0 H5' DT B 5 -7.997 -3.663 -2.050 1.00 0.29 H new ATOM 0 H5'' DT B 5 -9.173 -2.537 -1.401 1.00 0.29 H new ATOM 0 H4' DT B 5 -7.435 -2.919 0.199 1.00 0.20 H new ATOM 0 H3' DT B 5 -8.273 -0.337 -0.538 1.00 0.19 H new ATOM 0 H2' DT B 5 -6.439 0.144 -1.982 1.00 0.17 H new ATOM 0 H2'' DT B 5 -5.845 0.773 -0.457 1.00 0.17 H new ATOM 0 H1' DT B 5 -4.437 -1.148 -0.071 1.00 0.16 H new ATOM 0 H3 DT B 5 -1.180 -0.579 -3.120 1.00 0.17 H new ATOM 0 H71 DT B 5 -5.763 -1.294 -5.833 1.00 0.26 H new ATOM 0 H72 DT B 5 -5.157 0.368 -6.026 1.00 0.26 H new ATOM 0 H73 DT B 5 -4.203 -1.003 -6.638 1.00 0.26 H new ATOM 0 H6 DT B 5 -5.936 -1.095 -3.444 1.00 0.18 H new ATOM 476 P DA B 6 -7.611 0.850 1.789 1.00 0.32 P ATOM 477 OP1 DA B 6 -7.747 0.708 3.255 1.00 0.44 O ATOM 478 OP2 DA B 6 -8.705 1.467 1.004 1.00 0.42 O ATOM 479 O5' DA B 6 -6.244 1.646 1.461 1.00 0.25 O ATOM 480 C5' DA B 6 -5.129 1.597 2.361 1.00 0.18 C ATOM 481 C4' DA B 6 -4.034 2.596 1.988 1.00 0.17 C ATOM 482 O4' DA B 6 -3.295 2.148 0.836 1.00 0.19 O ATOM 483 C3' DA B 6 -4.541 4.009 1.648 1.00 0.19 C ATOM 484 O3' DA B 6 -4.270 4.920 2.725 1.00 0.23 O ATOM 485 C2' DA B 6 -3.817 4.329 0.351 1.00 0.19 C ATOM 486 C1' DA B 6 -2.724 3.289 0.194 1.00 0.18 C ATOM 487 N9 DA B 6 -2.545 2.936 -1.225 1.00 0.15 N ATOM 488 C8 DA B 6 -3.506 2.576 -2.132 1.00 0.18 C ATOM 489 N7 DA B 6 -3.044 2.327 -3.323 1.00 0.17 N ATOM 490 C5 DA B 6 -1.674 2.539 -3.190 1.00 0.14 C ATOM 491 C6 DA B 6 -0.611 2.445 -4.088 1.00 0.14 C ATOM 492 N6 DA B 6 -0.776 2.111 -5.360 1.00 0.16 N ATOM 493 N1 DA B 6 0.621 2.720 -3.632 1.00 0.16 N ATOM 494 C2 DA B 6 0.786 3.068 -2.362 1.00 0.15 C ATOM 495 N3 DA B 6 -0.135 3.194 -1.422 1.00 0.14 N ATOM 496 C4 DA B 6 -1.363 2.910 -1.913 1.00 0.13 C ATOM 0 H5' DA B 6 -4.712 0.590 2.364 1.00 0.18 H new ATOM 0 H5'' DA B 6 -5.474 1.802 3.374 1.00 0.18 H new ATOM 0 H4' DA B 6 -3.418 2.650 2.886 1.00 0.17 H new ATOM 0 H3' DA B 6 -5.621 4.088 1.521 1.00 0.19 H new ATOM 0 H2' DA B 6 -4.505 4.298 -0.494 1.00 0.19 H new ATOM 0 H2'' DA B 6 -3.394 5.333 0.381 1.00 0.19 H new ATOM 0 H1' DA B 6 -1.766 3.628 0.588 1.00 0.18 H new ATOM 0 H8 DA B 6 -4.554 2.505 -1.881 1.00 0.18 H new ATOM 0 H61 DA B 6 0.031 2.055 -5.981 1.00 0.16 H new ATOM 0 H62 DA B 6 -1.710 1.910 -5.718 1.00 0.16 H new ATOM 0 H2 DA B 6 1.802 3.274 -2.058 1.00 0.15 H new ATOM 508 P DG B 7 -4.418 6.525 2.576 1.00 0.23 P ATOM 509 OP1 DG B 7 -4.151 7.143 3.896 1.00 0.28 O ATOM 510 OP2 DG B 7 -5.667 6.835 1.845 1.00 0.30 O ATOM 511 O5' DG B 7 -3.164 6.857 1.622 1.00 0.22 O ATOM 512 C5' DG B 7 -1.852 6.588 2.136 1.00 0.24 C ATOM 513 C4' DG B 7 -0.738 6.785 1.142 1.00 0.22 C ATOM 514 O4' DG B 7 -0.904 5.895 0.030 1.00 0.23 O ATOM 515 C3' DG B 7 -0.728 8.176 0.519 1.00 0.21 C ATOM 516 O3' DG B 7 0.088 9.105 1.247 1.00 0.24 O ATOM 517 C2' DG B 7 -0.167 7.898 -0.833 1.00 0.22 C ATOM 518 C1' DG B 7 -0.054 6.409 -0.995 1.00 0.21 C ATOM 519 N9 DG B 7 -0.628 6.094 -2.303 1.00 0.19 N ATOM 520 C8 DG B 7 -1.941 5.936 -2.544 1.00 0.22 C ATOM 521 N7 DG B 7 -2.233 5.654 -3.789 1.00 0.23 N ATOM 522 C5 DG B 7 -0.983 5.631 -4.414 1.00 0.21 C ATOM 523 C6 DG B 7 -0.618 5.382 -5.775 1.00 0.24 C ATOM 524 O6 DG B 7 -1.307 5.111 -6.754 1.00 0.31 O ATOM 525 N1 DG B 7 0.742 5.465 -5.955 1.00 0.23 N ATOM 526 C2 DG B 7 1.652 5.745 -4.973 1.00 0.22 C ATOM 527 N2 DG B 7 2.914 5.797 -5.341 1.00 0.25 N ATOM 528 N3 DG B 7 1.336 5.975 -3.705 1.00 0.20 N ATOM 529 C4 DG B 7 0.004 5.903 -3.499 1.00 0.19 C ATOM 0 H5' DG B 7 -1.821 5.560 2.498 1.00 0.24 H new ATOM 0 H5'' DG B 7 -1.673 7.234 2.996 1.00 0.24 H new ATOM 0 H4' DG B 7 0.178 6.611 1.707 1.00 0.22 H new ATOM 0 H3' DG B 7 -1.710 8.649 0.510 1.00 0.21 H new ATOM 0 H2' DG B 7 -0.811 8.317 -1.606 1.00 0.22 H new ATOM 0 H2'' DG B 7 0.810 8.368 -0.943 1.00 0.22 H new ATOM 0 H1' DG B 7 0.959 6.013 -0.930 1.00 0.21 H new ATOM 0 H8 DG B 7 -2.693 6.034 -1.775 1.00 0.22 H new ATOM 0 H1 DG B 7 1.101 5.305 -6.896 1.00 0.23 H new ATOM 0 H21 DG B 7 3.638 6.002 -4.652 1.00 0.25 H new ATOM 0 H22 DG B 7 3.168 5.633 -6.315 1.00 0.25 H new ATOM 541 P DC B 8 0.127 10.673 0.842 1.00 0.25 P ATOM 542 OP1 DC B 8 0.876 11.386 1.900 1.00 0.35 O ATOM 543 OP2 DC B 8 -1.248 11.101 0.505 1.00 0.36 O ATOM 544 O5' DC B 8 1.012 10.694 -0.516 1.00 0.23 O ATOM 545 C5' DC B 8 2.445 10.618 -0.486 1.00 0.21 C ATOM 546 C4' DC B 8 3.070 10.551 -1.879 1.00 0.21 C ATOM 547 O4' DC B 8 2.666 9.386 -2.609 1.00 0.22 O ATOM 548 C3' DC B 8 2.707 11.717 -2.810 1.00 0.21 C ATOM 549 O3' DC B 8 3.464 12.904 -2.504 1.00 0.22 O ATOM 550 C2' DC B 8 3.175 11.108 -4.108 1.00 0.22 C ATOM 551 C1' DC B 8 2.781 9.654 -4.018 1.00 0.22 C ATOM 552 N1 DC B 8 1.553 9.295 -4.761 1.00 0.21 N ATOM 553 C2 DC B 8 1.637 9.162 -6.137 1.00 0.26 C ATOM 554 O2 DC B 8 2.686 9.371 -6.735 1.00 0.30 O ATOM 555 N3 DC B 8 0.528 8.800 -6.826 1.00 0.30 N ATOM 556 C4 DC B 8 -0.625 8.574 -6.196 1.00 0.28 C ATOM 557 N4 DC B 8 -1.678 8.212 -6.918 1.00 0.32 N ATOM 558 C5 DC B 8 -0.728 8.710 -4.776 1.00 0.24 C ATOM 559 C6 DC B 8 0.378 9.072 -4.111 1.00 0.20 C ATOM 0 H5' DC B 8 2.745 9.738 0.083 1.00 0.21 H new ATOM 0 H5'' DC B 8 2.838 11.487 0.041 1.00 0.21 H new ATOM 0 H4' DC B 8 4.134 10.562 -1.645 1.00 0.21 H new ATOM 0 H3' DC B 8 1.668 12.046 -2.769 1.00 0.21 H new ATOM 0 H2' DC B 8 2.705 11.593 -4.964 1.00 0.22 H new ATOM 0 H2'' DC B 8 4.252 11.219 -4.231 1.00 0.22 H new ATOM 0 H1' DC B 8 3.535 9.033 -4.503 1.00 0.22 H new ATOM 0 H41 DC B 8 -2.572 8.033 -6.461 1.00 0.32 H new ATOM 0 H42 DC B 8 -1.593 8.113 -7.930 1.00 0.32 H new ATOM 0 H5 DC B 8 -1.659 8.528 -4.260 1.00 0.24 H new ATOM 0 H6 DC B 8 0.336 9.189 -3.038 1.00 0.20 H new ATOM 571 P DT B 9 3.446 14.185 -3.500 1.00 0.21 P ATOM 572 OP1 DT B 9 4.305 15.254 -2.945 1.00 0.26 O ATOM 573 OP2 DT B 9 2.042 14.478 -3.867 1.00 0.27 O ATOM 574 O5' DT B 9 4.184 13.602 -4.809 1.00 0.22 O ATOM 575 C5' DT B 9 5.597 13.320 -4.885 1.00 0.23 C ATOM 576 C4' DT B 9 6.066 13.533 -6.318 1.00 0.25 C ATOM 577 O4' DT B 9 5.449 12.622 -7.244 1.00 0.28 O ATOM 578 C3' DT B 9 5.786 14.939 -6.774 1.00 0.25 C ATOM 579 O3' DT B 9 7.025 15.423 -7.301 1.00 0.31 O ATOM 580 C2' DT B 9 4.695 14.771 -7.765 1.00 0.23 C ATOM 581 C1' DT B 9 4.831 13.365 -8.298 1.00 0.25 C ATOM 582 N1 DT B 9 3.460 12.836 -8.450 1.00 0.24 N ATOM 583 C2 DT B 9 3.022 12.363 -9.670 1.00 0.26 C ATOM 584 O2 DT B 9 3.711 12.325 -10.684 1.00 0.31 O ATOM 585 N3 DT B 9 1.725 11.912 -9.691 1.00 0.26 N ATOM 586 C4 DT B 9 0.842 11.891 -8.635 1.00 0.24 C ATOM 587 O4 DT B 9 -0.286 11.448 -8.819 1.00 0.28 O ATOM 588 C5 DT B 9 1.382 12.405 -7.398 1.00 0.21 C ATOM 589 C7 DT B 9 0.532 12.477 -6.126 1.00 0.21 C ATOM 590 C6 DT B 9 2.643 12.845 -7.354 1.00 0.23 C ATOM 0 H5' DT B 9 5.794 12.295 -4.572 1.00 0.23 H new ATOM 0 H5'' DT B 9 6.148 13.972 -4.207 1.00 0.23 H new ATOM 0 H4' DT B 9 7.140 13.345 -6.311 1.00 0.25 H new ATOM 0 H3' DT B 9 5.463 15.663 -6.026 1.00 0.25 H new ATOM 0 H2' DT B 9 3.720 14.920 -7.301 1.00 0.23 H new ATOM 0 H2'' DT B 9 4.781 15.503 -8.568 1.00 0.23 H new ATOM 0 H1' DT B 9 5.387 13.314 -9.234 1.00 0.25 H new ATOM 0 H3 DT B 9 1.380 11.555 -10.582 1.00 0.26 H new ATOM 0 H71 DT B 9 -0.514 12.622 -6.395 1.00 0.21 H new ATOM 0 H72 DT B 9 0.637 11.548 -5.565 1.00 0.21 H new ATOM 0 H73 DT B 9 0.867 13.312 -5.511 1.00 0.21 H new ATOM 0 H6 DT B 9 3.031 13.221 -6.419 1.00 0.23 H new ATOM 603 P DA B 10 7.224 16.905 -7.886 1.00 0.30 P ATOM 604 OP1 DA B 10 8.648 17.070 -8.254 1.00 0.39 O ATOM 605 OP2 DA B 10 6.576 17.870 -6.971 1.00 0.39 O ATOM 606 O5' DA B 10 6.347 16.825 -9.238 1.00 0.26 O ATOM 607 C5' DA B 10 6.738 16.047 -10.381 1.00 0.29 C ATOM 608 C4' DA B 10 5.627 16.029 -11.419 1.00 0.30 C ATOM 609 O4' DA B 10 4.474 15.374 -10.901 1.00 0.27 O ATOM 610 C3' DA B 10 5.131 17.445 -11.754 1.00 0.31 C ATOM 611 O3' DA B 10 5.785 18.030 -12.885 1.00 0.46 O ATOM 612 C2' DA B 10 3.633 17.272 -11.927 1.00 0.30 C ATOM 613 C1' DA B 10 3.420 15.781 -11.768 1.00 0.27 C ATOM 614 N9 DA B 10 2.195 15.408 -11.082 1.00 0.26 N ATOM 615 C8 DA B 10 1.893 15.620 -9.781 1.00 0.26 C ATOM 616 N7 DA B 10 0.726 15.146 -9.423 1.00 0.28 N ATOM 617 C5 DA B 10 0.237 14.578 -10.604 1.00 0.28 C ATOM 618 C6 DA B 10 -0.950 13.902 -10.937 1.00 0.32 C ATOM 619 N6 DA B 10 -1.943 13.636 -10.097 1.00 0.36 N ATOM 620 N1 DA B 10 -1.078 13.490 -12.202 1.00 0.34 N ATOM 621 C2 DA B 10 -0.117 13.719 -13.086 1.00 0.34 C ATOM 622 N3 DA B 10 1.032 14.335 -12.900 1.00 0.32 N ATOM 623 C4 DA B 10 1.139 14.742 -11.617 1.00 0.28 C ATOM 0 H5' DA B 10 6.971 15.028 -10.072 1.00 0.29 H new ATOM 0 H5'' DA B 10 7.645 16.463 -10.818 1.00 0.29 H new ATOM 0 H4' DA B 10 6.050 15.531 -12.291 1.00 0.30 H new ATOM 0 H3' DA B 10 5.368 18.162 -10.968 1.00 0.31 H new ATOM 0 H2' DA B 10 3.076 17.837 -11.180 1.00 0.30 H new ATOM 0 H2'' DA B 10 3.300 17.622 -12.904 1.00 0.30 H new ATOM 0 HO3' DA B 10 5.423 18.927 -13.045 1.00 0.46 H new ATOM 0 H1' DA B 10 3.382 15.332 -12.760 1.00 0.27 H new ATOM 0 H8 DA B 10 2.554 16.134 -9.099 1.00 0.26 H new ATOM 0 H61 DA B 10 -2.770 13.139 -10.427 1.00 0.36 H new ATOM 0 H62 DA B 10 -1.879 13.929 -9.122 1.00 0.36 H new ATOM 0 H2 DA B 10 -0.300 13.354 -14.086 1.00 0.34 H new TER 636 DA B 10 HETATM 637 C1 DDA A 11 7.567 5.571 -19.061 1.00 0.33 C HETATM 638 C2 DDA A 11 6.091 5.771 -19.402 1.00 0.35 C HETATM 639 C3 DDA A 11 5.325 4.460 -19.235 1.00 0.40 C HETATM 640 C4 DDA A 11 5.997 3.438 -20.148 1.00 0.59 C HETATM 641 C5 DDA A 11 7.484 3.273 -19.796 1.00 0.67 C HETATM 642 C6 DDA A 11 8.197 2.290 -20.743 1.00 0.95 C HETATM 643 O5 DDA A 11 8.129 4.552 -19.895 1.00 0.54 O HETATM 644 O1 DDA A 11 8.285 6.800 -19.183 1.00 0.28 O HETATM 645 O3 DDA A 11 3.968 4.604 -19.612 1.00 0.47 O HETATM 646 O4 DDA A 11 5.314 2.199 -20.098 1.00 0.77 O HETATM 0 HO4 DDA A 11 4.379 2.351 -19.847 1.00 0.77 H new HETATM 0 HO3 DDA A 11 3.840 5.473 -20.047 1.00 0.47 H new HETATM 0 H63 DDA A 11 7.722 1.311 -20.677 1.00 0.95 H new HETATM 0 H62 DDA A 11 8.129 2.657 -21.767 1.00 0.95 H new HETATM 0 H61 DDA A 11 9.245 2.205 -20.457 1.00 0.95 H new HETATM 0 H5 DDA A 11 7.545 2.874 -18.784 1.00 0.67 H new HETATM 0 H4 DDA A 11 5.944 3.809 -21.171 1.00 0.59 H new HETATM 0 H3 DDA A 11 5.343 4.149 -18.191 1.00 0.40 H new HETATM 0 H22 DDA A 11 5.662 6.536 -18.755 1.00 0.35 H new HETATM 0 H21 DDA A 11 5.993 6.129 -20.427 1.00 0.35 H new HETATM 0 H1 DDA A 11 7.649 5.246 -18.024 1.00 0.33 H new HETATM 658 C1 DDA A 12 8.389 8.656 -15.835 1.00 0.24 C HETATM 659 C2 DDA A 12 7.816 7.884 -17.034 1.00 0.24 C HETATM 660 C3 DDA A 12 8.879 7.311 -17.976 1.00 0.26 C HETATM 661 C4 DDA A 12 9.783 8.462 -18.334 1.00 0.26 C HETATM 662 C5 DDA A 12 10.415 8.988 -17.040 1.00 0.26 C HETATM 663 C6 DDA A 12 11.614 9.887 -17.200 1.00 0.31 C HETATM 664 O5 DDA A 12 9.389 9.594 -16.252 1.00 0.26 O HETATM 665 O1 DDA A 12 7.356 9.271 -15.046 1.00 0.23 O HETATM 666 O4 DDA A 12 10.749 8.083 -19.296 1.00 0.35 O HETATM 0 HO4 DDA A 12 10.395 7.353 -19.845 1.00 0.35 H new HETATM 0 H63 DDA A 12 12.405 9.349 -17.722 1.00 0.31 H new HETATM 0 H62 DDA A 12 11.333 10.769 -17.776 1.00 0.31 H new HETATM 0 H61 DDA A 12 11.972 10.194 -16.217 1.00 0.31 H new HETATM 0 H5 DDA A 12 10.842 8.124 -16.532 1.00 0.26 H new HETATM 0 H4 DDA A 12 9.208 9.262 -18.801 1.00 0.26 H new HETATM 0 H22 DDA A 12 7.196 7.067 -16.664 1.00 0.24 H new HETATM 0 H21 DDA A 12 7.163 8.548 -17.601 1.00 0.24 H new HETATM 0 H1 DDA A 12 8.880 7.933 -15.183 1.00 0.24 H new HETATM 677 C1 DDA A 14A 11.295 7.686 -5.065 1.00 0.27 C HETATM 678 C2 DDA A 14A 11.112 6.746 -3.879 1.00 0.28 C HETATM 679 C3 DDA A 14A 11.043 7.550 -2.596 1.00 0.28 C HETATM 680 C4 DDA A 14A 12.196 8.544 -2.431 1.00 0.31 C HETATM 681 C5 DDA A 14A 12.210 9.419 -3.691 1.00 0.30 C HETATM 682 C6 DDA A 14A 13.271 10.490 -3.770 1.00 0.34 C HETATM 683 O5 DDA A 14A 12.380 8.574 -4.821 1.00 0.29 O HETATM 684 O1 DDA A 14A 11.499 6.966 -6.280 1.00 0.27 O HETATM 685 O3 DDA A 14A 10.993 6.645 -1.493 1.00 0.29 O HETATM 686 O4 DDA A 14A 11.989 9.326 -1.270 1.00 0.34 O HETATM 0 HO4 DDA A 14A 11.464 8.814 -0.620 1.00 0.34 H new HETATM 0 H63 DDA A 14A 13.153 11.181 -2.935 1.00 0.34 H new HETATM 0 H62 DDA A 14A 14.258 10.029 -3.723 1.00 0.34 H new HETATM 0 H61 DDA A 14A 13.169 11.034 -4.709 1.00 0.34 H new HETATM 0 H5 DDA A 14A 11.259 9.951 -3.660 1.00 0.30 H new HETATM 0 H4 DDA A 14A 13.153 8.035 -2.314 1.00 0.31 H new HETATM 0 H3 DDA A 14A 10.140 8.159 -2.636 1.00 0.28 H new HETATM 0 H22 DDA A 14A 10.200 6.162 -4.003 1.00 0.28 H new HETATM 0 H21 DDA A 14A 11.940 6.039 -3.832 1.00 0.28 H new HETATM 0 H1 DDA A 14A 10.379 8.266 -5.179 1.00 0.27 H new HETATM 697 C1 DDL A 14B 9.805 6.721 -0.714 1.00 0.23 C HETATM 698 C2 DDL A 14B 9.272 5.336 -0.405 1.00 0.24 C HETATM 699 C3 DDL A 14B 7.992 5.451 0.371 1.00 0.19 C HETATM 700 C4 DDL A 14B 8.196 6.302 1.605 1.00 0.16 C HETATM 701 C5 DDL A 14B 8.846 7.635 1.254 1.00 0.19 C HETATM 702 C6 DDL A 14B 9.159 8.447 2.514 1.00 0.30 C HETATM 703 O5 DDL A 14B 10.038 7.432 0.499 1.00 0.20 O HETATM 704 O3 DDL A 14B 7.594 4.108 0.694 1.00 0.28 O HETATM 705 O4 DDL A 14B 8.946 5.607 2.588 1.00 0.21 O HETATM 0 HO4 DDL A 14B 8.905 4.644 2.411 1.00 0.21 H new HETATM 0 H63 DDL A 14B 8.236 8.643 3.059 1.00 0.30 H new HETATM 0 H62 DDL A 14B 9.842 7.884 3.149 1.00 0.30 H new HETATM 0 H61 DDL A 14B 9.622 9.393 2.232 1.00 0.30 H new HETATM 0 H5 DDL A 14B 8.136 8.198 0.649 1.00 0.19 H new HETATM 0 H4 DDL A 14B 7.214 6.515 2.027 1.00 0.16 H new HETATM 0 H3 DDL A 14B 7.210 5.945 -0.205 1.00 0.19 H new HETATM 0 H22 DDL A 14B 9.100 4.787 -1.331 1.00 0.24 H new HETATM 0 H21 DDL A 14B 10.007 4.772 0.169 1.00 0.24 H new HETATM 716 C1 DDA B 15 0.521 9.440 4.726 1.00 0.19 C HETATM 717 C2 DDA B 15 -0.593 8.601 5.350 1.00 0.26 C HETATM 718 C3 DDA B 15 -1.882 9.405 5.458 1.00 0.33 C HETATM 719 C4 DDA B 15 -1.563 10.604 6.346 1.00 0.49 C HETATM 720 C5 DDA B 15 -0.434 11.430 5.702 1.00 0.61 C HETATM 721 C6 DDA B 15 -0.059 12.668 6.521 1.00 0.96 C HETATM 722 O5 DDA B 15 0.733 10.610 5.528 1.00 0.40 O HETATM 723 O1 DDA B 15 1.706 8.651 4.623 1.00 0.39 O HETATM 724 O3 DDA B 15 -2.915 8.617 6.019 1.00 0.39 O HETATM 725 O4 DDA B 15 -2.722 11.387 6.565 1.00 0.73 O HETATM 0 HO4 DDA B 15 -3.520 10.827 6.460 1.00 0.73 H new HETATM 0 HO3 DDA B 15 -3.356 8.103 5.311 1.00 0.39 H new HETATM 0 H63 DDA B 15 -0.930 13.317 6.619 1.00 0.96 H new HETATM 0 H62 DDA B 15 0.278 12.361 7.511 1.00 0.96 H new HETATM 0 H61 DDA B 15 0.742 13.209 6.017 1.00 0.96 H new HETATM 0 H5 DDA B 15 -0.809 11.776 4.739 1.00 0.61 H new HETATM 0 H4 DDA B 15 -1.223 10.254 7.321 1.00 0.49 H new HETATM 0 H3 DDA B 15 -2.233 9.728 4.478 1.00 0.33 H new HETATM 0 H22 DDA B 15 -0.765 7.710 4.746 1.00 0.26 H new HETATM 0 H21 DDA B 15 -0.287 8.261 6.340 1.00 0.26 H new HETATM 0 H1 DDA B 15 0.242 9.761 3.722 1.00 0.19 H new HETATM 737 C1 DDA B 16 4.277 8.555 1.900 1.00 0.19 C HETATM 738 C2 DDA B 16 3.057 8.156 2.708 1.00 0.23 C HETATM 739 C3 DDA B 16 2.753 9.177 3.792 1.00 0.26 C HETATM 740 C4 DDA B 16 4.004 9.416 4.640 1.00 0.29 C HETATM 741 C5 DDA B 16 5.201 9.771 3.747 1.00 0.25 C HETATM 742 C6 DDA B 16 6.474 9.989 4.554 1.00 0.38 C HETATM 743 O5 DDA B 16 5.398 8.719 2.781 1.00 0.20 O HETATM 744 O1 DDA B 16 4.452 7.542 0.901 1.00 0.21 O HETATM 745 O4 DDA B 16 3.762 10.429 5.601 1.00 0.41 O HETATM 0 HO4 DDA B 16 2.798 10.588 5.673 1.00 0.41 H new HETATM 0 H63 DDA B 16 6.323 10.807 5.259 1.00 0.38 H new HETATM 0 H62 DDA B 16 6.718 9.079 5.102 1.00 0.38 H new HETATM 0 H61 DDA B 16 7.294 10.238 3.880 1.00 0.38 H new HETATM 0 H5 DDA B 16 4.980 10.710 3.240 1.00 0.25 H new HETATM 0 H4 DDA B 16 4.247 8.497 5.173 1.00 0.29 H new HETATM 0 H22 DDA B 16 2.196 8.058 2.046 1.00 0.23 H new HETATM 0 H21 DDA B 16 3.223 7.179 3.162 1.00 0.23 H new HETATM 0 H1 DDA B 16 4.166 9.515 1.395 1.00 0.19 H new HETATM 756 C1 DDA B 18A 9.845 12.431 -7.114 1.00 0.24 C HETATM 757 C2 DDA B 18A 9.317 13.103 -8.375 1.00 0.27 C HETATM 758 C3 DDA B 18A 10.006 12.492 -9.608 1.00 0.26 C HETATM 759 C4 DDA B 18A 11.508 12.637 -9.358 1.00 0.28 C HETATM 760 C5 DDA B 18A 11.954 11.949 -8.062 1.00 0.26 C HETATM 761 C6 DDA B 18A 13.409 12.055 -7.681 1.00 0.34 C HETATM 762 O5 DDA B 18A 11.245 12.556 -6.999 1.00 0.25 O HETATM 763 O1 DDA B 18A 9.196 12.835 -5.921 1.00 0.26 O HETATM 764 O3 DDA B 18A 9.579 13.207 -10.783 1.00 0.29 O HETATM 765 O4 DDA B 18A 12.288 12.186 -10.448 1.00 0.33 O HETATM 0 HO4 DDA B 18A 11.843 12.422 -11.289 1.00 0.33 H new HETATM 0 H63 DDA B 18A 14.024 11.615 -8.466 1.00 0.34 H new HETATM 0 H62 DDA B 18A 13.677 13.104 -7.556 1.00 0.34 H new HETATM 0 H61 DDA B 18A 13.580 11.523 -6.745 1.00 0.34 H new HETATM 0 H5 DDA B 18A 11.761 10.891 -8.240 1.00 0.26 H new HETATM 0 H4 DDA B 18A 11.681 13.707 -9.247 1.00 0.28 H new HETATM 0 H3 DDA B 18A 9.754 11.443 -9.766 1.00 0.26 H new HETATM 0 H22 DDA B 18A 8.237 12.971 -8.446 1.00 0.27 H new HETATM 0 H21 DDA B 18A 9.505 14.176 -8.334 1.00 0.27 H new HETATM 0 H1 DDA B 18A 9.601 11.376 -7.238 1.00 0.24 H new HETATM 776 C1 DDL B 18B 9.504 12.465 -12.013 1.00 0.26 C HETATM 777 C2 DDL B 18B 8.417 13.079 -12.905 1.00 0.25 C HETATM 778 C3 DDL B 18B 8.350 12.465 -14.290 1.00 0.24 C HETATM 779 C4 DDL B 18B 9.708 12.562 -14.908 1.00 0.25 C HETATM 780 C5 DDL B 18B 10.748 11.892 -14.023 1.00 0.25 C HETATM 781 C6 DDL B 18B 12.117 12.027 -14.669 1.00 0.32 C HETATM 782 O5 DDL B 18B 10.760 12.476 -12.709 1.00 0.26 O HETATM 783 O3 DDL B 18B 7.399 13.189 -15.088 1.00 0.28 O HETATM 784 O4 DDL B 18B 10.053 13.909 -15.194 1.00 0.28 O HETATM 0 HO4 DDL B 18B 9.242 14.417 -15.404 1.00 0.28 H new HETATM 0 H63 DDL B 18B 12.106 11.547 -15.648 1.00 0.32 H new HETATM 0 H62 DDL B 18B 12.362 13.083 -14.785 1.00 0.32 H new HETATM 0 H61 DDL B 18B 12.866 11.548 -14.038 1.00 0.32 H new HETATM 0 H5 DDL B 18B 10.494 10.837 -13.918 1.00 0.25 H new HETATM 0 H4 DDL B 18B 9.686 12.030 -15.859 1.00 0.25 H new HETATM 0 H3 DDL B 18B 8.039 11.422 -14.231 1.00 0.24 H new HETATM 0 H22 DDL B 18B 7.449 12.961 -12.417 1.00 0.25 H new HETATM 0 H21 DDL B 18B 8.598 14.150 -13.000 1.00 0.25 H new HETATM 795 C1 DDA B 21 -14.008 -4.623 -11.401 1.00 0.32 C HETATM 796 C2 DDA B 21 -13.016 -4.901 -12.529 1.00 0.36 C HETATM 797 C3 DDA B 21 -12.343 -3.605 -12.976 1.00 0.41 C HETATM 798 C4 DDA B 21 -13.460 -2.656 -13.406 1.00 0.59 C HETATM 799 C5 DDA B 21 -14.452 -2.411 -12.259 1.00 0.66 C HETATM 800 C6 DDA B 21 -15.620 -1.503 -12.687 1.00 0.95 C HETATM 801 O5 DDA B 21 -14.988 -3.674 -11.832 1.00 0.55 O HETATM 802 O1 DDA B 21 -14.618 -5.837 -10.954 1.00 0.29 O HETATM 803 O3 DDA B 21 -11.471 -3.828 -14.068 1.00 0.48 O HETATM 804 O4 DDA B 21 -12.921 -1.441 -13.891 1.00 0.73 O HETATM 0 HO4 DDA B 21 -12.027 -1.603 -14.259 1.00 0.73 H new HETATM 0 HO3 DDA B 21 -11.598 -4.738 -14.408 1.00 0.48 H new HETATM 0 H63 DDA B 21 -15.231 -0.538 -13.011 1.00 0.95 H new HETATM 0 H62 DDA B 21 -16.161 -1.970 -13.510 1.00 0.95 H new HETATM 0 H61 DDA B 21 -16.296 -1.358 -11.844 1.00 0.95 H new HETATM 0 H5 DDA B 21 -13.914 -1.913 -11.452 1.00 0.66 H new HETATM 0 H4 DDA B 21 -14.013 -3.127 -14.219 1.00 0.59 H new HETATM 0 H3 DDA B 21 -11.748 -3.193 -12.161 1.00 0.41 H new HETATM 0 H22 DDA B 21 -12.262 -5.612 -12.192 1.00 0.36 H new HETATM 0 H21 DDA B 21 -13.533 -5.360 -13.372 1.00 0.36 H new HETATM 0 H1 DDA B 21 -13.470 -4.195 -10.555 1.00 0.32 H new HETATM 816 C1 DDA B 22 -12.656 -7.354 -8.037 1.00 0.26 C HETATM 817 C2 DDA B 22 -12.931 -6.721 -9.410 1.00 0.25 C HETATM 818 C3 DDA B 22 -14.364 -6.209 -9.587 1.00 0.26 C HETATM 819 C4 DDA B 22 -15.266 -7.360 -9.227 1.00 0.27 C HETATM 820 C5 DDA B 22 -14.990 -7.738 -7.767 1.00 0.26 C HETATM 821 C6 DDA B 22 -16.019 -8.611 -7.096 1.00 0.29 C HETATM 822 O5 DDA B 22 -13.676 -8.297 -7.687 1.00 0.28 O HETATM 823 O1 DDA B 22 -11.337 -7.921 -7.960 1.00 0.27 O HETATM 824 O4 DDA B 22 -16.627 -7.046 -9.459 1.00 0.36 O HETATM 0 HO4 DDA B 22 -16.692 -6.384 -10.179 1.00 0.36 H new HETATM 0 H63 DDA B 22 -16.983 -8.103 -7.096 1.00 0.29 H new HETATM 0 H62 DDA B 22 -16.106 -9.553 -7.637 1.00 0.29 H new HETATM 0 H61 DDA B 22 -15.713 -8.810 -6.069 1.00 0.29 H new HETATM 0 H5 DDA B 22 -15.061 -6.815 -7.192 1.00 0.26 H new HETATM 0 H4 DDA B 22 -15.054 -8.218 -9.865 1.00 0.27 H new HETATM 0 H22 DDA B 22 -12.239 -5.892 -9.561 1.00 0.25 H new HETATM 0 H21 DDA B 22 -12.721 -7.457 -10.186 1.00 0.25 H new HETATM 0 H1 DDA B 22 -12.689 -6.556 -7.295 1.00 0.26 H new HETATM 835 C1 DDA B 24A -8.637 -5.255 2.201 1.00 0.21 C HETATM 836 C2 DDA B 24A -7.817 -4.210 2.950 1.00 0.22 C HETATM 837 C3 DDA B 24A -6.975 -4.888 4.011 1.00 0.22 C HETATM 838 C4 DDA B 24A -7.772 -5.825 4.924 1.00 0.24 C HETATM 839 C5 DDA B 24A -8.502 -6.816 4.009 1.00 0.25 C HETATM 840 C6 DDA B 24A -9.367 -7.858 4.678 1.00 0.28 C HETATM 841 O5 DDA B 24A -9.337 -6.081 3.124 1.00 0.22 O HETATM 842 O1 DDA B 24A -9.546 -4.650 1.282 1.00 0.23 O HETATM 843 O3 DDA B 24A -6.309 -3.882 4.775 1.00 0.23 O HETATM 844 O4 DDA B 24A -6.891 -6.496 5.805 1.00 0.26 O HETATM 0 HO4 DDA B 24A -6.107 -5.933 5.975 1.00 0.26 H new HETATM 0 H63 DDA B 24A -8.754 -8.469 5.341 1.00 0.28 H new HETATM 0 H62 DDA B 24A -10.148 -7.365 5.257 1.00 0.28 H new HETATM 0 H61 DDA B 24A -9.824 -8.493 3.919 1.00 0.28 H new HETATM 0 H5 DDA B 24A -7.701 -7.370 3.521 1.00 0.25 H new HETATM 0 H4 DDA B 24A -8.489 -5.278 5.537 1.00 0.24 H new HETATM 0 H3 DDA B 24A -6.254 -5.527 3.502 1.00 0.22 H new HETATM 0 H22 DDA B 24A -7.176 -3.669 2.254 1.00 0.22 H new HETATM 0 H21 DDA B 24A -8.478 -3.476 3.411 1.00 0.22 H new HETATM 0 H1 DDA B 24A -7.948 -5.871 1.623 1.00 0.21 H new HETATM 855 C1 DDL B 24B -4.890 -3.919 4.702 1.00 0.19 C HETATM 856 C2 DDL B 24B -4.322 -2.529 4.499 1.00 0.20 C HETATM 857 C3 DDL B 24B -2.829 -2.607 4.371 1.00 0.20 C HETATM 858 C4 DDL B 24B -2.234 -3.328 5.561 1.00 0.22 C HETATM 859 C5 DDL B 24B -2.921 -4.668 5.793 1.00 0.23 C HETATM 860 C6 DDL B 24B -2.399 -5.345 7.065 1.00 0.35 C HETATM 861 O5 DDL B 24B -4.335 -4.502 5.878 1.00 0.22 O HETATM 862 O3 DDL B 24B -2.362 -1.252 4.264 1.00 0.28 O HETATM 863 O4 DDL B 24B -2.277 -2.518 6.723 1.00 0.27 O HETATM 0 HO4 DDL B 24B -2.364 -1.577 6.463 1.00 0.27 H new HETATM 0 H63 DDL B 24B -1.326 -5.516 6.972 1.00 0.35 H new HETATM 0 H62 DDL B 24B -2.591 -4.702 7.924 1.00 0.35 H new HETATM 0 H61 DDL B 24B -2.908 -6.299 7.204 1.00 0.35 H new HETATM 0 H5 DDL B 24B -2.690 -5.308 4.941 1.00 0.23 H new HETATM 0 H4 DDL B 24B -1.186 -3.530 5.338 1.00 0.22 H new HETATM 0 H3 DDL B 24B -2.524 -3.177 3.494 1.00 0.20 H new HETATM 0 H22 DDL B 24B -4.750 -2.078 3.604 1.00 0.20 H new HETATM 0 H21 DDL B 24B -4.592 -1.889 5.339 1.00 0.20 H new HETATM 874 C1 DDA A 25 5.894 -6.391 3.806 1.00 0.19 C HETATM 875 C2 DDA A 25 7.134 -5.532 3.562 1.00 0.31 C HETATM 876 C3 DDA A 25 8.260 -6.361 2.961 1.00 0.40 C HETATM 877 C4 DDA A 25 8.570 -7.459 3.976 1.00 0.52 C HETATM 878 C5 DDA A 25 7.306 -8.307 4.211 1.00 0.62 C HETATM 879 C6 DDA A 25 7.530 -9.447 5.208 1.00 0.97 C HETATM 880 O5 DDA A 25 6.238 -7.470 4.684 1.00 0.39 O HETATM 881 O1 DDA A 25 4.854 -5.579 4.349 1.00 0.36 O HETATM 882 O3 DDA A 25 9.399 -5.555 2.721 1.00 0.46 O HETATM 883 O4 DDA A 25 9.656 -8.252 3.539 1.00 0.79 O HETATM 0 HO4 DDA A 25 10.208 -7.735 2.916 1.00 0.79 H new HETATM 0 HO3 DDA A 25 9.317 -5.126 1.844 1.00 0.46 H new HETATM 0 H63 DDA A 25 8.309 -10.110 4.833 1.00 0.97 H new HETATM 0 H62 DDA A 25 7.836 -9.035 6.169 1.00 0.97 H new HETATM 0 H61 DDA A 25 6.604 -10.009 5.332 1.00 0.97 H new HETATM 0 H5 DDA A 25 7.047 -8.757 3.253 1.00 0.62 H new HETATM 0 H4 DDA A 25 8.865 -7.007 4.923 1.00 0.52 H new HETATM 0 H3 DDA A 25 7.971 -6.787 2.000 1.00 0.40 H new HETATM 0 H22 DDA A 25 6.885 -4.709 2.892 1.00 0.31 H new HETATM 0 H21 DDA A 25 7.465 -5.089 4.501 1.00 0.31 H new HETATM 0 H1 DDA A 25 5.532 -6.816 2.870 1.00 0.19 H new HETATM 895 C1 DDA A 26 1.167 -5.666 3.690 1.00 0.19 C HETATM 896 C2 DDA A 26 2.616 -5.229 3.573 1.00 0.24 C HETATM 897 C3 DDA A 26 3.536 -6.149 4.358 1.00 0.24 C HETATM 898 C4 DDA A 26 3.040 -6.266 5.799 1.00 0.26 C HETATM 899 C5 DDA A 26 1.560 -6.668 5.831 1.00 0.25 C HETATM 900 C6 DDA A 26 1.022 -6.766 7.252 1.00 0.37 C HETATM 901 O5 DDA A 26 0.795 -5.709 5.075 1.00 0.22 O HETATM 902 O1 DDA A 26 0.402 -4.750 2.896 1.00 0.20 O HETATM 903 O4 DDA A 26 3.839 -7.188 6.523 1.00 0.35 O HETATM 0 HO4 DDA A 26 4.655 -7.381 6.017 1.00 0.35 H new HETATM 0 H63 DDA A 26 1.588 -7.516 7.805 1.00 0.37 H new HETATM 0 H62 DDA A 26 1.121 -5.799 7.746 1.00 0.37 H new HETATM 0 H61 DDA A 26 -0.029 -7.053 7.224 1.00 0.37 H new HETATM 0 H5 DDA A 26 1.468 -7.659 5.386 1.00 0.25 H new HETATM 0 H4 DDA A 26 3.130 -5.292 6.279 1.00 0.26 H new HETATM 0 H22 DDA A 26 2.913 -5.223 2.524 1.00 0.24 H new HETATM 0 H21 DDA A 26 2.721 -4.208 3.939 1.00 0.24 H new HETATM 0 H1 DDA A 26 0.986 -6.673 3.315 1.00 0.19 H new HETATM 914 C1 DDA A 28A -8.532 -10.217 0.162 1.00 0.23 C HETATM 915 C2 DDA A 28A -8.835 -11.025 -1.095 1.00 0.24 C HETATM 916 C3 DDA A 28A -10.139 -10.515 -1.730 1.00 0.25 C HETATM 917 C4 DDA A 28A -11.196 -10.589 -0.625 1.00 0.27 C HETATM 918 C5 DDA A 28A -10.807 -9.764 0.609 1.00 0.25 C HETATM 919 C6 DDA A 28A -11.748 -9.787 1.786 1.00 0.31 C HETATM 920 O5 DDA A 28A -9.586 -10.288 1.097 1.00 0.25 O HETATM 921 O1 DDA A 28A -7.291 -10.526 0.769 1.00 0.23 O HETATM 922 O3 DDA A 28A -10.469 -11.355 -2.854 1.00 0.30 O HETATM 923 O4 DDA A 28A -12.484 -10.220 -1.077 1.00 0.34 O HETATM 0 HO4 DDA A 28A -12.611 -10.535 -1.996 1.00 0.34 H new HETATM 0 H63 DDA A 28A -12.722 -9.406 1.480 1.00 0.31 H new HETATM 0 H62 DDA A 28A -11.855 -10.810 2.146 1.00 0.31 H new HETATM 0 H61 DDA A 28A -11.348 -9.162 2.584 1.00 0.31 H new HETATM 0 H5 DDA A 28A -10.790 -8.735 0.250 1.00 0.25 H new HETATM 0 H4 DDA A 28A -11.237 -11.638 -0.331 1.00 0.27 H new HETATM 0 H3 DDA A 28A -10.064 -9.495 -2.106 1.00 0.25 H new HETATM 0 H22 DDA A 28A -8.013 -10.935 -1.805 1.00 0.24 H new HETATM 0 H21 DDA A 28A -8.928 -12.082 -0.847 1.00 0.24 H new HETATM 0 H1 DDA A 28A -8.443 -9.187 -0.183 1.00 0.23 H new HETATM 934 C1 DDL A 28B -11.163 -10.737 -3.953 1.00 0.25 C HETATM 935 C2 DDL A 28B -10.798 -11.470 -5.252 1.00 0.25 C HETATM 936 C3 DDL A 28B -11.587 -10.994 -6.458 1.00 0.24 C HETATM 937 C4 DDL A 28B -13.042 -11.108 -6.137 1.00 0.23 C HETATM 938 C5 DDL A 28B -13.374 -10.323 -4.877 1.00 0.24 C HETATM 939 C6 DDL A 28B -14.855 -10.476 -4.567 1.00 0.31 C HETATM 940 O5 DDL A 28B -12.586 -10.776 -3.764 1.00 0.26 O HETATM 941 O3 DDL A 28B -11.271 -11.821 -7.589 1.00 0.27 O HETATM 942 O4 DDL A 28B -13.445 -12.464 -6.030 1.00 0.26 O HETATM 0 HO4 DDL A 28B -12.839 -13.028 -6.555 1.00 0.26 H new HETATM 0 H63 DDL A 28B -15.443 -10.093 -5.401 1.00 0.31 H new HETATM 0 H62 DDL A 28B -15.087 -11.530 -4.413 1.00 0.31 H new HETATM 0 H61 DDL A 28B -15.098 -9.915 -3.665 1.00 0.31 H new HETATM 0 H5 DDL A 28B -13.140 -9.272 -5.046 1.00 0.24 H new HETATM 0 H4 DDL A 28B -13.606 -10.673 -6.962 1.00 0.23 H new HETATM 0 H3 DDL A 28B -11.337 -9.960 -6.696 1.00 0.24 H new HETATM 0 H22 DDL A 28B -9.734 -11.337 -5.448 1.00 0.25 H new HETATM 0 H21 DDL A 28B -10.966 -12.538 -5.116 1.00 0.25 H new HETATM 953 MG MG A 19 6.951 8.661 -6.910 1.00 0.26 MG HETATM 954 MG MG B 29 -6.206 -6.540 -1.756 1.00 0.24 MG HETATM 955 C1 CRH A 13 10.021 8.096 -7.832 1.00 0.23 C HETATM 956 C2 CRH A 13 11.477 7.795 -7.443 1.00 0.25 C HETATM 957 C3 CRH A 13 12.280 7.267 -8.664 1.00 0.28 C HETATM 958 C4 CRH A 13 12.147 8.276 -9.765 1.00 0.25 C HETATM 959 C5 CRH A 13 8.861 9.043 -13.166 1.00 0.24 C HETATM 960 C6 CRH A 13 7.586 9.239 -13.671 1.00 0.23 C HETATM 961 C7 CRH A 13 6.529 9.315 -12.775 1.00 0.23 C HETATM 962 C8 CRH A 13 6.765 9.177 -11.409 1.00 0.24 C HETATM 963 C9 CRH A 13 8.355 8.730 -9.557 1.00 0.23 C HETATM 964 C10 CRH A 13 10.393 8.674 -11.425 1.00 0.26 C HETATM 965 C11 CRH A 13 9.103 8.913 -11.825 1.00 0.25 C HETATM 966 C12 CRH A 13 8.058 8.959 -10.907 1.00 0.24 C HETATM 967 C13 CRH A 13 9.677 8.462 -9.133 1.00 0.23 C HETATM 968 C14 CRH A 13 10.680 8.452 -10.106 1.00 0.26 C HETATM 969 C15 CRH A 13 5.179 9.778 -13.298 1.00 0.22 C HETATM 970 O1 CRH A 13 9.139 7.997 -6.979 1.00 0.25 O HETATM 971 O8 CRH A 13 5.675 9.264 -10.574 1.00 0.25 O HETATM 972 O9 CRH A 13 7.298 8.766 -8.671 1.00 0.25 O HETATM 973 C1' CRH A 13 13.743 6.910 -8.344 1.00 0.37 C HETATM 974 C2' CRH A 13 14.337 5.976 -9.405 1.00 0.52 C HETATM 975 C3' CRH A 13 15.145 6.526 -10.586 1.00 0.65 C HETATM 976 C4' CRH A 13 16.652 6.239 -10.441 1.00 0.85 C HETATM 977 C1M CRH A 13 14.628 8.525 -6.732 1.00 0.45 C HETATM 978 C4M CRH A 13 17.006 4.758 -10.460 1.00 1.05 C HETATM 979 O1' CRH A 13 14.693 7.929 -8.021 1.00 0.47 O HETATM 980 O2' CRH A 13 14.161 4.761 -9.306 1.00 0.66 O HETATM 981 O3' CRH A 13 15.077 7.950 -10.725 1.00 0.60 O HETATM 982 O4' CRH A 13 17.251 6.732 -11.632 1.00 1.02 O HETATM 0 H4'3 CRH A 13 16.502 4.253 -9.636 1.00 1.05 H new HETATM 0 H4'2 CRH A 13 16.685 4.319 -11.405 1.00 1.05 H new HETATM 0 H4'1 CRH A 13 18.084 4.640 -10.353 1.00 1.05 H new HETATM 0 H153 CRH A 13 5.273 10.783 -13.709 1.00 0.22 H new HETATM 0 H152 CRH A 13 4.838 9.098 -14.079 1.00 0.22 H new HETATM 0 H151 CRH A 13 4.456 9.785 -12.482 1.00 0.22 H new HETATM 0 H1'3 CRH A 13 13.654 8.996 -6.598 1.00 0.45 H new HETATM 0 H1'2 CRH A 13 14.768 7.759 -5.969 1.00 0.45 H new HETATM 0 H1'1 CRH A 13 15.411 9.277 -6.639 1.00 0.45 H new HETATM 0 HO8 CRH A 13 5.900 8.878 -9.702 1.00 0.25 H new HETATM 0 HO4 CRH A 13 16.694 7.446 -12.007 1.00 1.02 H new HETATM 0 HO3 CRH A 13 15.021 8.363 -9.838 1.00 0.60 H new HETATM 0 H5 CRH A 13 9.700 8.991 -13.860 1.00 0.24 H new HETATM 0 H42 CRH A 13 12.577 9.228 -9.456 1.00 0.25 H new HETATM 0 H41 CRH A 13 12.700 7.947 -10.645 1.00 0.25 H new HETATM 0 H4' CRH A 13 16.976 6.678 -9.497 1.00 0.85 H new HETATM 0 H3' CRH A 13 14.695 6.025 -11.443 1.00 0.65 H new HETATM 0 H3 CRH A 13 11.859 6.313 -8.981 1.00 0.28 H new HETATM 0 H22 CRH A 13 11.948 8.698 -7.056 1.00 0.25 H new HETATM 0 H10 CRH A 13 11.195 8.661 -12.163 1.00 0.26 H new HETATM 0 H1' CRH A 13 13.597 6.429 -7.377 1.00 0.37 H new HETATM 1004 C1 MDA A 29C 6.208 3.936 0.869 1.00 0.21 C HETATM 1005 C2 MDA A 29C 5.727 2.596 0.317 1.00 0.20 C HETATM 1006 C3 MDA A 29C 4.204 2.611 0.251 1.00 0.19 C HETATM 1007 C4 MDA A 29C 3.740 2.842 1.718 1.00 0.25 C HETATM 1008 C5 MDA A 29C 4.326 4.165 2.288 1.00 0.25 C HETATM 1009 C6 MDA A 29C 3.961 4.535 3.724 1.00 0.31 C HETATM 1010 C3' MDA A 29C 3.706 1.331 -0.447 1.00 0.21 C HETATM 1011 O5 MDA A 29C 5.755 4.132 2.199 1.00 0.27 O HETATM 1012 O3 MDA A 29C 3.778 3.689 -0.558 1.00 0.22 O HETATM 1013 O4 MDA A 29C 2.326 2.869 1.806 1.00 0.27 O HETATM 0 H3'3 MDA A 29C 4.112 1.286 -1.457 1.00 0.21 H new HETATM 0 H3'2 MDA A 29C 4.036 0.458 0.116 1.00 0.21 H new HETATM 0 H3'1 MDA A 29C 2.617 1.342 -0.494 1.00 0.21 H new HETATM 0 HO4 MDA A 29C 2.057 2.853 2.748 1.00 0.27 H new HETATM 0 HO3 MDA A 29C 4.018 3.512 -1.492 1.00 0.22 H new HETATM 0 H63 MDA A 29C 2.879 4.638 3.809 1.00 0.31 H new HETATM 0 H62 MDA A 29C 4.305 3.752 4.400 1.00 0.31 H new HETATM 0 H61 MDA A 29C 4.438 5.479 3.989 1.00 0.31 H new HETATM 0 H5 MDA A 29C 3.862 4.931 1.667 1.00 0.25 H new HETATM 0 H4 MDA A 29C 4.113 2.008 2.313 1.00 0.25 H new HETATM 0 H22 MDA A 29C 6.146 2.424 -0.674 1.00 0.20 H new HETATM 0 H21 MDA A 29C 6.069 1.780 0.954 1.00 0.20 H new HETATM 1027 C1 CRH B 17 8.502 10.784 -4.886 1.00 0.21 C HETATM 1028 C2 CRH B 17 9.455 11.986 -4.800 1.00 0.21 C HETATM 1029 C3 CRH B 17 9.281 12.719 -3.457 1.00 0.20 C HETATM 1030 C4 CRH B 17 9.365 11.754 -2.318 1.00 0.18 C HETATM 1031 C5 CRH B 17 6.018 8.910 -0.268 1.00 0.16 C HETATM 1032 C6 CRH B 17 5.038 7.936 -0.287 1.00 0.18 C HETATM 1033 C7 CRH B 17 4.709 7.339 -1.498 1.00 0.16 C HETATM 1034 C8 CRH B 17 5.364 7.706 -2.662 1.00 0.16 C HETATM 1035 C9 CRH B 17 6.992 9.168 -3.806 1.00 0.18 C HETATM 1036 C10 CRH B 17 7.593 10.305 -1.353 1.00 0.15 C HETATM 1037 C11 CRH B 17 6.666 9.293 -1.424 1.00 0.15 C HETATM 1038 C12 CRH B 17 6.351 8.702 -2.652 1.00 0.16 C HETATM 1039 C13 CRH B 17 7.935 10.212 -3.745 1.00 0.17 C HETATM 1040 C14 CRH B 17 8.226 10.758 -2.488 1.00 0.15 C HETATM 1041 C15 CRH B 17 3.469 6.469 -1.622 1.00 0.18 C HETATM 1042 O1 CRH B 17 8.199 10.347 -5.993 1.00 0.25 O HETATM 1043 O8 CRH B 17 5.020 6.988 -3.792 1.00 0.21 O HETATM 1044 O9 CRH B 17 6.650 8.567 -5.003 1.00 0.25 O HETATM 1045 C1' CRH B 17 10.202 13.932 -3.449 1.00 0.21 C HETATM 1046 C2' CRH B 17 10.065 14.795 -2.187 1.00 0.21 C HETATM 1047 C3' CRH B 17 9.128 15.998 -2.226 1.00 0.24 C HETATM 1048 C4' CRH B 17 7.727 15.508 -2.606 1.00 0.21 C HETATM 1049 C1M CRH B 17 12.033 14.874 -4.600 1.00 0.27 C HETATM 1050 C4M CRH B 17 7.077 14.580 -1.572 1.00 0.25 C HETATM 1051 O1' CRH B 17 11.570 13.783 -3.812 1.00 0.25 O HETATM 1052 O2' CRH B 17 10.678 14.515 -1.155 1.00 0.25 O HETATM 1053 O3' CRH B 17 9.473 16.911 -3.270 1.00 0.35 O HETATM 1054 O4' CRH B 17 6.851 16.629 -2.626 1.00 0.25 O HETATM 0 H4'3 CRH B 17 7.697 13.694 -1.438 1.00 0.25 H new HETATM 0 H4'2 CRH B 17 6.982 15.104 -0.621 1.00 0.25 H new HETATM 0 H4'1 CRH B 17 6.089 14.281 -1.921 1.00 0.25 H new HETATM 0 H153 CRH B 17 3.545 5.627 -0.934 1.00 0.18 H new HETATM 0 H152 CRH B 17 2.585 7.058 -1.378 1.00 0.18 H new HETATM 0 H151 CRH B 17 3.387 6.096 -2.643 1.00 0.18 H new HETATM 0 H1'3 CRH B 17 11.443 14.939 -5.514 1.00 0.27 H new HETATM 0 H1'2 CRH B 17 11.929 15.801 -4.035 1.00 0.27 H new HETATM 0 H1'1 CRH B 17 13.082 14.720 -4.855 1.00 0.27 H new HETATM 0 HO8 CRH B 17 5.480 7.365 -4.571 1.00 0.21 H new HETATM 0 HO4 CRH B 17 5.927 16.320 -2.733 1.00 0.25 H new HETATM 0 HO3 CRH B 17 8.659 17.326 -3.624 1.00 0.35 H new HETATM 0 H5 CRH B 17 6.284 9.384 0.677 1.00 0.16 H new HETATM 0 H42 CRH B 17 10.327 11.242 -2.318 1.00 0.18 H new HETATM 0 H41 CRH B 17 9.281 12.276 -1.365 1.00 0.18 H new HETATM 0 H4' CRH B 17 7.857 14.984 -3.553 1.00 0.21 H new HETATM 0 H3' CRH B 17 9.188 16.479 -1.250 1.00 0.24 H new HETATM 0 H3 CRH B 17 8.284 13.138 -3.322 1.00 0.20 H new HETATM 0 H22 CRH B 17 10.486 11.648 -4.905 1.00 0.21 H new HETATM 0 H10 CRH B 17 7.829 10.753 -0.388 1.00 0.15 H new HETATM 0 H1' CRH B 17 9.791 14.453 -4.313 1.00 0.21 H new HETATM 1076 C1 MDA A 18C 6.341 12.394 -15.597 1.00 0.23 C HETATM 1077 C2 MDA A 18C 5.021 13.154 -15.576 1.00 0.22 C HETATM 1078 C3 MDA A 18C 3.868 12.286 -16.049 1.00 0.21 C HETATM 1079 C4 MDA A 18C 4.234 11.652 -17.384 1.00 0.21 C HETATM 1080 C5 MDA A 18C 5.602 10.947 -17.317 1.00 0.22 C HETATM 1081 C6 MDA A 18C 5.937 10.400 -18.690 1.00 0.25 C HETATM 1082 C3' MDA A 18C 2.622 13.159 -16.234 1.00 0.24 C HETATM 1083 O5 MDA A 18C 6.595 11.890 -16.908 1.00 0.24 O HETATM 1084 O3 MDA A 18C 3.670 11.286 -15.085 1.00 0.24 O HETATM 1085 O4 MDA A 18C 3.215 10.768 -17.828 1.00 0.24 O HETATM 0 H3'3 MDA A 18C 2.361 13.627 -15.285 1.00 0.24 H new HETATM 0 H3'2 MDA A 18C 2.826 13.931 -16.975 1.00 0.24 H new HETATM 0 H3'1 MDA A 18C 1.791 12.540 -16.574 1.00 0.24 H new HETATM 0 HO4 MDA A 18C 3.202 10.750 -18.808 1.00 0.24 H new HETATM 0 HO3 MDA A 18C 2.770 11.370 -14.707 1.00 0.24 H new HETATM 0 H63 MDA A 18C 5.170 9.689 -18.995 1.00 0.25 H new HETATM 0 H62 MDA A 18C 5.979 11.219 -19.408 1.00 0.25 H new HETATM 0 H61 MDA A 18C 6.904 9.898 -18.656 1.00 0.25 H new HETATM 0 H5 MDA A 18C 5.572 10.128 -16.599 1.00 0.22 H new HETATM 0 H4 MDA A 18C 4.318 12.454 -18.118 1.00 0.21 H new HETATM 0 H22 MDA A 18C 4.820 13.507 -14.565 1.00 0.22 H new HETATM 0 H21 MDA A 18C 5.098 14.036 -16.212 1.00 0.22 H new HETATM 1099 C1 CRH B 23 -9.239 -5.970 -0.727 1.00 0.21 C HETATM 1100 C2 CRH B 23 -10.191 -5.589 0.420 1.00 0.22 C HETATM 1101 C3 CRH B 23 -11.577 -5.156 -0.131 1.00 0.25 C HETATM 1102 C4 CRH B 23 -12.092 -6.271 -0.993 1.00 0.23 C HETATM 1103 C5 CRH B 23 -11.439 -7.466 -5.587 1.00 0.25 C HETATM 1104 C6 CRH B 23 -10.707 -7.749 -6.728 1.00 0.25 C HETATM 1105 C7 CRH B 23 -9.322 -7.771 -6.631 1.00 0.25 C HETATM 1106 C8 CRH B 23 -8.707 -7.493 -5.414 1.00 0.25 C HETATM 1107 C9 CRH B 23 -8.903 -6.820 -3.032 1.00 0.24 C HETATM 1108 C10 CRH B 23 -11.652 -6.883 -3.323 1.00 0.24 C HETATM 1109 C11 CRH B 23 -10.843 -7.199 -4.384 1.00 0.25 C HETATM 1110 C12 CRH B 23 -9.457 -7.188 -4.266 1.00 0.25 C HETATM 1111 C13 CRH B 23 -9.723 -6.471 -1.937 1.00 0.21 C HETATM 1112 C14 CRH B 23 -11.108 -6.525 -2.119 1.00 0.23 C HETATM 1113 C15 CRH B 23 -8.532 -8.325 -7.805 1.00 0.24 C HETATM 1114 O1 CRH B 23 -8.027 -5.817 -0.577 1.00 0.22 O HETATM 1115 O8 CRH B 23 -7.332 -7.534 -5.383 1.00 0.28 O HETATM 1116 O9 CRH B 23 -7.525 -6.803 -2.947 1.00 0.29 O HETATM 1117 C1' CRH B 23 -12.577 -4.725 0.958 1.00 0.35 C HETATM 1118 C2' CRH B 23 -13.714 -3.880 0.372 1.00 0.53 C HETATM 1119 C3' CRH B 23 -15.047 -4.517 -0.040 1.00 0.66 C HETATM 1120 C4' CRH B 23 -16.183 -4.169 0.943 1.00 0.88 C HETATM 1121 C1M CRH B 23 -12.279 -6.146 2.927 1.00 0.44 C HETATM 1122 C4M CRH B 23 -16.526 -2.688 0.995 1.00 1.07 C HETATM 1123 O1' CRH B 23 -13.115 -5.677 1.877 1.00 0.46 O HETATM 1124 O2' CRH B 23 -13.553 -2.667 0.230 1.00 0.67 O HETATM 1125 O3' CRH B 23 -15.027 -5.949 -0.053 1.00 0.63 O HETATM 1126 O4' CRH B 23 -17.355 -4.757 0.393 1.00 1.03 O HETATM 0 H4'3 CRH B 23 -15.648 -2.122 1.306 1.00 1.07 H new HETATM 0 H4'2 CRH B 23 -16.843 -2.353 0.007 1.00 1.07 H new HETATM 0 H4'1 CRH B 23 -17.334 -2.526 1.709 1.00 1.07 H new HETATM 0 H153 CRH B 23 -8.819 -9.362 -7.980 1.00 0.24 H new HETATM 0 H152 CRH B 23 -8.743 -7.735 -8.697 1.00 0.24 H new HETATM 0 H151 CRH B 23 -7.466 -8.276 -7.582 1.00 0.24 H new HETATM 0 H1'3 CRH B 23 -11.400 -6.632 2.503 1.00 0.44 H new HETATM 0 H1'2 CRH B 23 -11.966 -5.305 3.546 1.00 0.44 H new HETATM 0 H1'1 CRH B 23 -12.829 -6.861 3.538 1.00 0.44 H new HETATM 0 HO8 CRH B 23 -7.017 -7.279 -4.491 1.00 0.28 H new HETATM 0 HO4 CRH B 23 -17.115 -5.576 -0.089 1.00 1.03 H new HETATM 0 HO3 CRH B 23 -14.467 -6.275 0.682 1.00 0.63 H new HETATM 0 H5 CRH B 23 -12.527 -7.456 -5.649 1.00 0.25 H new HETATM 0 H42 CRH B 23 -12.224 -7.175 -0.399 1.00 0.23 H new HETATM 0 H41 CRH B 23 -13.069 -6.011 -1.400 1.00 0.23 H new HETATM 0 H4' CRH B 23 -15.870 -4.503 1.932 1.00 0.88 H new HETATM 0 H3' CRH B 23 -15.210 -4.117 -1.041 1.00 0.66 H new HETATM 0 H3 CRH B 23 -11.455 -4.251 -0.726 1.00 0.25 H new HETATM 0 H22 CRH B 23 -10.312 -6.437 1.094 1.00 0.22 H new HETATM 0 H10 CRH B 23 -12.735 -6.917 -3.439 1.00 0.24 H new HETATM 0 H1' CRH B 23 -11.903 -4.157 1.599 1.00 0.35 H new HETATM 1148 C1 MDA B 30C -1.148 -1.106 3.565 1.00 0.20 C HETATM 1149 C2 MDA B 30C -1.132 0.157 2.709 1.00 0.20 C HETATM 1150 C3 MDA B 30C 0.055 0.089 1.754 1.00 0.20 C HETATM 1151 C4 MDA B 30C 1.306 -0.013 2.673 1.00 0.22 C HETATM 1152 C5 MDA B 30C 1.215 -1.256 3.605 1.00 0.21 C HETATM 1153 C6 MDA B 30C 2.373 -1.497 4.572 1.00 0.28 C HETATM 1154 C3' MDA B 30C 0.000 1.279 0.777 1.00 0.23 C HETATM 1155 O5 MDA B 30C 0.012 -1.188 4.378 1.00 0.23 O HETATM 1156 O3 MDA B 30C -0.047 -1.076 0.958 1.00 0.22 O HETATM 1157 O4 MDA B 30C 2.496 -0.075 1.908 1.00 0.26 O HETATM 0 H3'3 MDA B 30C -0.927 1.238 0.206 1.00 0.23 H new HETATM 0 H3'2 MDA B 30C 0.040 2.213 1.338 1.00 0.23 H new HETATM 0 H3'1 MDA B 30C 0.849 1.229 0.095 1.00 0.23 H new HETATM 0 HO4 MDA B 30C 3.271 0.024 2.500 1.00 0.26 H new HETATM 0 HO3 MDA B 30C -0.790 -0.977 0.326 1.00 0.22 H new HETATM 0 H63 MDA B 30C 3.297 -1.626 4.008 1.00 0.28 H new HETATM 0 H62 MDA B 30C 2.473 -0.642 5.241 1.00 0.28 H new HETATM 0 H61 MDA B 30C 2.177 -2.395 5.158 1.00 0.28 H new HETATM 0 H5 MDA B 30C 1.244 -2.093 2.907 1.00 0.21 H new HETATM 0 H4 MDA B 30C 1.332 0.886 3.289 1.00 0.22 H new HETATM 0 H22 MDA B 30C -2.063 0.245 2.148 1.00 0.20 H new HETATM 0 H21 MDA B 30C -1.057 1.041 3.342 1.00 0.20 H new HETATM 1171 C1 CRH A 27 -6.184 -8.407 0.987 1.00 0.20 C HETATM 1172 C2 CRH A 27 -6.861 -9.564 1.738 1.00 0.19 C HETATM 1173 C3 CRH A 27 -5.901 -10.169 2.778 1.00 0.18 C HETATM 1174 C4 CRH A 27 -5.323 -9.096 3.645 1.00 0.19 C HETATM 1175 C5 CRH A 27 -1.506 -6.175 3.024 1.00 0.15 C HETATM 1176 C6 CRH A 27 -0.762 -5.239 2.333 1.00 0.16 C HETATM 1177 C7 CRH A 27 -1.234 -4.771 1.112 1.00 0.16 C HETATM 1178 C8 CRH A 27 -2.439 -5.229 0.605 1.00 0.17 C HETATM 1179 C9 CRH A 27 -4.381 -6.742 0.798 1.00 0.18 C HETATM 1180 C10 CRH A 27 -3.373 -7.617 3.225 1.00 0.16 C HETATM 1181 C11 CRH A 27 -2.701 -6.647 2.521 1.00 0.15 C HETATM 1182 C12 CRH A 27 -3.196 -6.187 1.296 1.00 0.17 C HETATM 1183 C13 CRH A 27 -5.069 -7.746 1.507 1.00 0.19 C HETATM 1184 C14 CRH A 27 -4.540 -8.157 2.737 1.00 0.18 C HETATM 1185 C15 CRH A 27 -0.338 -3.957 0.193 1.00 0.17 C HETATM 1186 O1 CRH A 27 -6.611 -8.090 -0.120 1.00 0.23 O HETATM 1187 O8 CRH A 27 -2.856 -4.635 -0.572 1.00 0.19 O HETATM 1188 O9 CRH A 27 -4.834 -6.270 -0.419 1.00 0.22 O HETATM 1189 C1' CRH A 27 -6.599 -11.346 3.448 1.00 0.20 C HETATM 1190 C2' CRH A 27 -5.712 -12.087 4.459 1.00 0.21 C HETATM 1191 C3' CRH A 27 -4.942 -13.317 3.987 1.00 0.26 C HETATM 1192 C4' CRH A 27 -4.056 -12.910 2.806 1.00 0.21 C HETATM 1193 C1M CRH A 27 -8.722 -12.337 3.704 1.00 0.27 C HETATM 1194 C4M CRH A 27 -2.949 -11.907 3.157 1.00 0.23 C HETATM 1195 O1' CRH A 27 -7.919 -11.190 3.955 1.00 0.26 O HETATM 1196 O2' CRH A 27 -5.599 -11.690 5.620 1.00 0.26 O HETATM 1197 O3' CRH A 27 -5.808 -14.314 3.445 1.00 0.37 O HETATM 1198 O4' CRH A 27 -3.328 -14.055 2.378 1.00 0.29 O HETATM 0 H4'3 CRH A 27 -3.397 -10.993 3.547 1.00 0.23 H new HETATM 0 H4'2 CRH A 27 -2.292 -12.340 3.911 1.00 0.23 H new HETATM 0 H4'1 CRH A 27 -2.371 -11.675 2.262 1.00 0.23 H new HETATM 0 H153 CRH A 27 -0.017 -3.051 0.707 1.00 0.17 H new HETATM 0 H152 CRH A 27 0.536 -4.548 -0.081 1.00 0.17 H new HETATM 0 H151 CRH A 27 -0.890 -3.687 -0.707 1.00 0.17 H new HETATM 0 H1'3 CRH A 27 -8.787 -12.507 2.629 1.00 0.27 H new HETATM 0 H1'2 CRH A 27 -8.273 -13.207 4.183 1.00 0.27 H new HETATM 0 H1'1 CRH A 27 -9.722 -12.176 4.107 1.00 0.27 H new HETATM 0 HO8 CRH A 27 -3.649 -5.101 -0.911 1.00 0.19 H new HETATM 0 HO4 CRH A 27 -2.669 -13.790 1.703 1.00 0.29 H new HETATM 0 HO3 CRH A 27 -5.318 -14.850 2.786 1.00 0.37 H new HETATM 0 H5 CRH A 27 -1.143 -6.547 3.982 1.00 0.15 H new HETATM 0 H42 CRH A 27 -6.113 -8.556 4.167 1.00 0.19 H new HETATM 0 H41 CRH A 27 -4.673 -9.526 4.407 1.00 0.19 H new HETATM 0 H4' CRH A 27 -4.739 -12.475 2.076 1.00 0.21 H new HETATM 0 H3' CRH A 27 -4.396 -13.700 4.849 1.00 0.26 H new HETATM 0 H3 CRH A 27 -5.005 -10.604 2.335 1.00 0.18 H new HETATM 0 H22 CRH A 27 -7.763 -9.205 2.233 1.00 0.19 H new HETATM 0 H10 CRH A 27 -2.977 -7.962 4.180 1.00 0.16 H new HETATM 0 H1' CRH A 27 -6.765 -11.961 2.563 1.00 0.20 H new HETATM 1220 C1 MDA B 28C -10.749 -11.113 -8.700 1.00 0.23 C HETATM 1221 C2 MDA B 28C -9.648 -11.909 -9.393 1.00 0.20 C HETATM 1222 C3 MDA B 28C -9.029 -11.127 -10.539 1.00 0.22 C HETATM 1223 C4 MDA B 28C -10.137 -10.613 -11.450 1.00 0.21 C HETATM 1224 C5 MDA B 28C -11.220 -9.863 -10.654 1.00 0.23 C HETATM 1225 C6 MDA B 28C -12.321 -9.441 -11.605 1.00 0.26 C HETATM 1226 C3' MDA B 28C -8.109 -12.053 -11.342 1.00 0.24 C HETATM 1227 O5 MDA B 28C -11.745 -10.730 -9.646 1.00 0.23 O HETATM 1228 O3 MDA B 28C -8.331 -10.046 -9.984 1.00 0.24 O HETATM 1229 O4 MDA B 28C -9.607 -9.810 -12.495 1.00 0.24 O HETATM 0 H3'3 MDA B 28C -7.321 -12.435 -10.693 1.00 0.24 H new HETATM 0 H3'2 MDA B 28C -8.688 -12.886 -11.739 1.00 0.24 H new HETATM 0 H3'1 MDA B 28C -7.662 -11.497 -12.166 1.00 0.24 H new HETATM 0 HO4 MDA B 28C -10.178 -9.886 -13.288 1.00 0.24 H new HETATM 0 HO3 MDA B 28C -7.385 -10.105 -10.233 1.00 0.24 H new HETATM 0 H63 MDA B 28C -11.908 -8.787 -12.373 1.00 0.26 H new HETATM 0 H62 MDA B 28C -12.754 -10.324 -12.075 1.00 0.26 H new HETATM 0 H61 MDA B 28C -13.095 -8.908 -11.052 1.00 0.26 H new HETATM 0 H5 MDA B 28C -10.797 -8.979 -10.177 1.00 0.23 H new HETATM 0 H4 MDA B 28C -10.617 -11.478 -11.909 1.00 0.21 H new HETATM 0 H22 MDA B 28C -8.875 -12.168 -8.669 1.00 0.20 H new HETATM 0 H21 MDA B 28C -10.058 -12.846 -9.771 1.00 0.20 H new