USER MOD reduce.3.24.130724 H: found=0, std=0, add=294, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 294 hydrogens (44 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 DA O5' : rot 58:sc= 0.212 USER MOD Single : A 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= -11.3! (180deg=-11.3!) USER MOD Single : A 11 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DT C7 :methyl 150:sc= -0.062 (180deg=-0.062) USER MOD Single : A 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 18 DT C7 :methyl 150:sc= -0.0287 (180deg=-0.0287) USER MOD Single : A 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DA A 1 -2.204 14.585 10.420 1.00 1.06 O ATOM 2 C5' DA A 1 -1.502 15.356 9.441 1.00 0.92 C ATOM 3 C4' DA A 1 -2.210 15.325 8.089 1.00 0.77 C ATOM 4 O4' DA A 1 -1.568 16.225 7.160 1.00 0.80 O ATOM 5 C3' DA A 1 -2.191 13.924 7.485 1.00 0.67 C ATOM 6 O3' DA A 1 -3.515 13.386 7.397 1.00 0.76 O ATOM 7 C2' DA A 1 -1.583 14.076 6.119 1.00 0.62 C ATOM 8 C1' DA A 1 -1.195 15.527 5.954 1.00 0.70 C ATOM 9 N9 DA A 1 0.250 15.664 5.693 1.00 0.64 N ATOM 10 C8 DA A 1 1.220 16.218 6.461 1.00 0.60 C ATOM 11 N7 DA A 1 2.412 16.273 5.969 1.00 0.57 N ATOM 12 C5 DA A 1 2.227 15.682 4.715 1.00 0.59 C ATOM 13 C6 DA A 1 3.098 15.418 3.653 1.00 0.63 C ATOM 14 N6 DA A 1 4.389 15.750 3.670 1.00 0.63 N ATOM 15 N1 DA A 1 2.584 14.820 2.564 1.00 0.71 N ATOM 16 C2 DA A 1 1.290 14.501 2.517 1.00 0.76 C ATOM 17 N3 DA A 1 0.376 14.707 3.460 1.00 0.74 N ATOM 18 C4 DA A 1 0.915 15.306 4.541 1.00 0.65 C ATOM 0 H5' DA A 1 -0.489 14.970 9.331 1.00 0.92 H new ATOM 0 H5'' DA A 1 -1.415 16.387 9.783 1.00 0.92 H new ATOM 0 H4' DA A 1 -3.241 15.633 8.261 1.00 0.77 H new ATOM 0 H3' DA A 1 -1.618 13.232 8.103 1.00 0.67 H new ATOM 0 H2' DA A 1 -0.710 13.431 6.014 1.00 0.62 H new ATOM 0 H2'' DA A 1 -2.294 13.779 5.348 1.00 0.62 H new ATOM 0 HO5' DA A 1 -2.293 13.661 10.106 1.00 1.06 H new ATOM 0 H1' DA A 1 -1.714 15.955 5.096 1.00 0.70 H new ATOM 0 H8 DA A 1 1.003 16.599 7.448 1.00 0.60 H new ATOM 0 H61 DA A 1 4.982 15.534 2.868 1.00 0.63 H new ATOM 0 H62 DA A 1 4.784 16.220 4.485 1.00 0.63 H new ATOM 0 H2 DA A 1 0.946 14.022 1.612 1.00 0.76 H new ATOM 31 P DG A 2 -3.910 12.051 8.207 1.00 0.92 P ATOM 32 OP1 DG A 2 -5.330 12.159 8.612 1.00 1.12 O ATOM 33 OP2 DG A 2 -2.869 11.803 9.228 1.00 1.10 O ATOM 34 O5' DG A 2 -3.794 10.905 7.080 1.00 0.86 O ATOM 35 C5' DG A 2 -2.650 10.846 6.217 1.00 0.78 C ATOM 36 C4' DG A 2 -3.013 11.030 4.757 1.00 0.70 C ATOM 37 O4' DG A 2 -1.859 10.892 3.917 1.00 0.70 O ATOM 38 C3' DG A 2 -4.010 10.004 4.237 1.00 0.70 C ATOM 39 O3' DG A 2 -5.373 10.352 4.498 1.00 0.72 O ATOM 40 C2' DG A 2 -3.721 9.968 2.759 1.00 0.61 C ATOM 41 C1' DG A 2 -2.317 10.496 2.615 1.00 0.61 C ATOM 42 N9 DG A 2 -1.398 9.564 1.949 1.00 0.51 N ATOM 43 C8 DG A 2 -0.135 9.197 2.288 1.00 0.46 C ATOM 44 N7 DG A 2 0.555 8.542 1.413 1.00 0.40 N ATOM 45 C5 DG A 2 -0.353 8.449 0.353 1.00 0.44 C ATOM 46 C6 DG A 2 -0.206 7.845 -0.920 1.00 0.43 C ATOM 47 O6 DG A 2 0.776 7.267 -1.380 1.00 0.40 O ATOM 48 N1 DG A 2 -1.361 7.978 -1.681 1.00 0.51 N ATOM 49 C2 DG A 2 -2.513 8.605 -1.285 1.00 0.57 C ATOM 50 N2 DG A 2 -3.508 8.610 -2.180 1.00 0.65 N ATOM 51 N3 DG A 2 -2.666 9.179 -0.089 1.00 0.59 N ATOM 52 C4 DG A 2 -1.551 9.065 0.677 1.00 0.51 C ATOM 0 H5' DG A 2 -2.151 9.885 6.346 1.00 0.78 H new ATOM 0 H5'' DG A 2 -1.937 11.617 6.511 1.00 0.78 H new ATOM 0 H4' DG A 2 -3.449 12.028 4.717 1.00 0.70 H new ATOM 0 H3' DG A 2 -3.896 9.039 4.731 1.00 0.70 H new ATOM 0 H2' DG A 2 -3.802 8.954 2.367 1.00 0.61 H new ATOM 0 H2'' DG A 2 -4.431 10.582 2.204 1.00 0.61 H new ATOM 0 H1' DG A 2 -2.333 11.358 1.948 1.00 0.61 H new ATOM 0 H8 DG A 2 0.278 9.444 3.255 1.00 0.46 H new ATOM 0 H1 DG A 2 -1.350 7.573 -2.617 1.00 0.51 H new ATOM 0 H21 DG A 2 -4.395 9.059 -1.953 1.00 0.65 H new ATOM 0 H22 DG A 2 -3.379 8.165 -3.089 1.00 0.65 H new ATOM 64 P DG A 3 -6.446 9.193 4.849 1.00 0.65 P ATOM 65 OP1 DG A 3 -7.757 9.837 5.083 1.00 0.74 O ATOM 66 OP2 DG A 3 -5.859 8.323 5.892 1.00 0.77 O ATOM 67 O5' DG A 3 -6.543 8.339 3.478 1.00 0.73 O ATOM 68 C5' DG A 3 -5.753 7.147 3.277 1.00 0.67 C ATOM 69 C4' DG A 3 -5.534 6.857 1.801 1.00 0.57 C ATOM 70 O4' DG A 3 -4.186 6.429 1.512 1.00 0.59 O ATOM 71 C3' DG A 3 -6.404 5.733 1.229 1.00 0.57 C ATOM 72 O3' DG A 3 -7.734 6.129 0.838 1.00 0.54 O ATOM 73 C2' DG A 3 -5.633 5.316 0.017 1.00 0.64 C ATOM 74 C1' DG A 3 -4.278 5.944 0.176 1.00 0.61 C ATOM 75 N9 DG A 3 -3.218 5.061 -0.310 1.00 0.54 N ATOM 76 C8 DG A 3 -3.208 4.496 -1.523 1.00 0.55 C ATOM 77 N7 DG A 3 -2.148 3.916 -1.914 1.00 0.52 N ATOM 78 C5 DG A 3 -1.309 4.088 -0.838 1.00 0.49 C ATOM 79 C6 DG A 3 0.007 3.643 -0.701 1.00 0.48 C ATOM 80 O6 DG A 3 0.623 2.927 -1.481 1.00 0.48 O ATOM 81 N1 DG A 3 0.548 4.007 0.520 1.00 0.49 N ATOM 82 C2 DG A 3 -0.120 4.709 1.506 1.00 0.51 C ATOM 83 N2 DG A 3 0.581 4.934 2.624 1.00 0.55 N ATOM 84 N3 DG A 3 -1.403 5.137 1.387 1.00 0.52 N ATOM 85 C4 DG A 3 -1.937 4.792 0.182 1.00 0.50 C ATOM 0 H5' DG A 3 -6.251 6.298 3.744 1.00 0.67 H new ATOM 0 H5'' DG A 3 -4.789 7.262 3.772 1.00 0.67 H new ATOM 0 H4' DG A 3 -5.787 7.815 1.347 1.00 0.57 H new ATOM 0 H3' DG A 3 -6.574 4.961 1.979 1.00 0.57 H new ATOM 0 H2' DG A 3 -5.559 4.230 -0.048 1.00 0.64 H new ATOM 0 H2'' DG A 3 -6.120 5.657 -0.896 1.00 0.64 H new ATOM 0 H1' DG A 3 -4.134 6.815 -0.463 1.00 0.61 H new ATOM 0 H8 DG A 3 -4.082 4.532 -2.156 1.00 0.55 H new ATOM 0 H1 DG A 3 1.514 3.737 0.707 1.00 0.49 H new ATOM 0 H21 DG A 3 0.157 5.446 3.398 1.00 0.55 H new ATOM 0 H22 DG A 3 1.539 4.594 2.702 1.00 0.55 H new ATOM 97 P DG A 4 -9.035 5.865 1.763 1.00 0.53 P ATOM 98 OP1 DG A 4 -10.154 6.649 1.193 1.00 0.62 O ATOM 99 OP2 DG A 4 -8.636 6.096 3.169 1.00 0.61 O ATOM 100 O5' DG A 4 -9.414 4.271 1.609 1.00 0.54 O ATOM 101 C5' DG A 4 -8.463 3.168 1.474 1.00 0.53 C ATOM 102 C4' DG A 4 -7.885 2.634 2.780 1.00 0.51 C ATOM 103 O4' DG A 4 -6.613 2.017 2.603 1.00 0.55 O ATOM 104 C3' DG A 4 -7.752 3.628 3.924 1.00 0.49 C ATOM 105 O3' DG A 4 -8.817 3.332 4.842 1.00 0.64 O ATOM 106 C2' DG A 4 -6.347 3.385 4.481 1.00 0.50 C ATOM 107 C1' DG A 4 -5.945 2.075 3.863 1.00 0.50 C ATOM 108 N9 DG A 4 -4.520 1.743 3.678 1.00 0.46 N ATOM 109 C8 DG A 4 -3.436 1.762 4.499 1.00 0.51 C ATOM 110 N7 DG A 4 -2.355 1.157 4.070 1.00 0.50 N ATOM 111 C5 DG A 4 -2.776 0.684 2.812 1.00 0.43 C ATOM 112 C6 DG A 4 -2.091 -0.079 1.793 1.00 0.41 C ATOM 113 O6 DG A 4 -0.901 -0.364 1.696 1.00 0.45 O ATOM 114 N1 DG A 4 -2.909 -0.360 0.729 1.00 0.41 N ATOM 115 C2 DG A 4 -4.228 0.085 0.627 1.00 0.42 C ATOM 116 N2 DG A 4 -4.873 -0.192 -0.462 1.00 0.49 N ATOM 117 N3 DG A 4 -4.848 0.791 1.542 1.00 0.42 N ATOM 118 C4 DG A 4 -4.086 1.048 2.596 1.00 0.41 C ATOM 0 H5' DG A 4 -7.639 3.497 0.841 1.00 0.53 H new ATOM 0 H5'' DG A 4 -8.957 2.347 0.954 1.00 0.53 H new ATOM 0 H4' DG A 4 -8.647 1.911 3.070 1.00 0.51 H new ATOM 0 H3' DG A 4 -7.844 4.683 3.664 1.00 0.49 H new ATOM 0 H2' DG A 4 -5.662 4.186 4.204 1.00 0.50 H new ATOM 0 H2'' DG A 4 -6.351 3.331 5.570 1.00 0.50 H new ATOM 0 H1' DG A 4 -6.230 1.326 4.602 1.00 0.50 H new ATOM 0 H8 DG A 4 -3.464 2.253 5.460 1.00 0.51 H new ATOM 0 H1 DG A 4 -2.532 -0.926 -0.031 1.00 0.41 H new ATOM 0 H21 DG A 4 -5.839 0.116 -0.575 1.00 0.49 H new ATOM 0 H22 DG A 4 -4.415 -0.718 -1.206 1.00 0.49 H new ATOM 130 P DT A 5 -10.361 3.245 4.295 1.00 0.80 P ATOM 131 OP1 DT A 5 -10.693 4.545 3.671 1.00 1.15 O ATOM 132 OP2 DT A 5 -11.204 2.730 5.396 1.00 0.80 O ATOM 133 O5' DT A 5 -10.339 2.110 3.116 1.00 1.04 O ATOM 134 C5' DT A 5 -11.279 2.126 2.003 1.00 1.14 C ATOM 135 C4' DT A 5 -11.204 0.824 1.151 1.00 1.21 C ATOM 136 O4' DT A 5 -12.057 -0.194 1.719 1.00 1.41 O ATOM 137 C3' DT A 5 -11.620 1.021 -0.301 1.00 1.15 C ATOM 138 O3' DT A 5 -10.564 0.527 -1.183 1.00 1.56 O ATOM 139 C2' DT A 5 -12.915 0.265 -0.454 1.00 1.03 C ATOM 140 C1' DT A 5 -13.081 -0.582 0.782 1.00 1.23 C ATOM 141 N1 DT A 5 -14.417 -0.426 1.386 1.00 1.22 N ATOM 142 C2 DT A 5 -14.583 0.586 2.314 1.00 1.40 C ATOM 143 O2 DT A 5 -13.696 1.402 2.558 1.00 1.70 O ATOM 144 N3 DT A 5 -15.813 0.635 2.945 1.00 1.50 N ATOM 145 C4 DT A 5 -16.875 -0.225 2.727 1.00 1.45 C ATOM 146 O4 DT A 5 -17.921 -0.104 3.362 1.00 1.64 O ATOM 147 C5 DT A 5 -16.611 -1.241 1.735 1.00 1.46 C ATOM 148 C7 DT A 5 -17.685 -2.273 1.411 1.00 1.89 C ATOM 149 C6 DT A 5 -15.422 -1.309 1.106 1.00 1.35 C ATOM 0 H5' DT A 5 -11.072 2.987 1.367 1.00 1.14 H new ATOM 0 H5'' DT A 5 -12.292 2.249 2.387 1.00 1.14 H new ATOM 0 H4' DT A 5 -10.156 0.525 1.166 1.00 1.21 H new ATOM 0 H3' DT A 5 -11.767 2.067 -0.569 1.00 1.15 H new ATOM 0 H2' DT A 5 -13.753 0.954 -0.565 1.00 1.03 H new ATOM 0 H2'' DT A 5 -12.894 -0.358 -1.348 1.00 1.03 H new ATOM 0 H1' DT A 5 -12.985 -1.634 0.513 1.00 1.23 H new ATOM 0 H3 DT A 5 -15.950 1.374 3.635 1.00 1.50 H new ATOM 0 H71 DT A 5 -17.585 -2.588 0.372 1.00 1.89 H new ATOM 0 H72 DT A 5 -17.569 -3.137 2.065 1.00 1.89 H new ATOM 0 H73 DT A 5 -18.670 -1.833 1.563 1.00 1.89 H new ATOM 0 H6 DT A 5 -15.259 -2.077 0.365 1.00 1.35 H new ATOM 162 P DT A 6 -10.466 -1.003 -1.761 1.00 1.90 P ATOM 163 OP1 DT A 6 -9.626 -0.972 -2.977 1.00 2.36 O ATOM 164 OP2 DT A 6 -11.832 -1.564 -1.835 1.00 2.54 O ATOM 165 O5' DT A 6 -9.654 -1.824 -0.623 1.00 1.37 O ATOM 166 C5' DT A 6 -8.460 -2.595 -0.920 1.00 1.28 C ATOM 167 C4' DT A 6 -8.712 -3.695 -1.963 1.00 0.93 C ATOM 168 O4' DT A 6 -7.482 -4.364 -2.386 1.00 0.73 O ATOM 169 C3' DT A 6 -9.635 -4.805 -1.426 1.00 0.75 C ATOM 170 O3' DT A 6 -10.879 -4.827 -2.144 1.00 0.82 O ATOM 171 C2' DT A 6 -8.884 -6.080 -1.685 1.00 0.66 C ATOM 172 C1' DT A 6 -7.886 -5.695 -2.728 1.00 0.70 C ATOM 173 N1 DT A 6 -6.809 -6.702 -2.929 1.00 0.70 N ATOM 174 C2 DT A 6 -7.256 -7.980 -3.214 1.00 0.77 C ATOM 175 O2 DT A 6 -8.414 -8.324 -2.994 1.00 0.84 O ATOM 176 N3 DT A 6 -6.334 -8.853 -3.749 1.00 0.81 N ATOM 177 C4 DT A 6 -5.013 -8.577 -4.027 1.00 0.78 C ATOM 178 O4 DT A 6 -4.288 -9.436 -4.524 1.00 0.86 O ATOM 179 C5 DT A 6 -4.597 -7.235 -3.685 1.00 0.72 C ATOM 180 C7 DT A 6 -3.173 -6.764 -4.093 1.00 0.78 C ATOM 181 C6 DT A 6 -5.492 -6.355 -3.134 1.00 0.68 C ATOM 0 H5' DT A 6 -8.087 -3.049 -0.002 1.00 1.28 H new ATOM 0 H5'' DT A 6 -7.681 -1.926 -1.284 1.00 1.28 H new ATOM 0 H4' DT A 6 -9.172 -3.171 -2.800 1.00 0.93 H new ATOM 0 H3' DT A 6 -9.875 -4.657 -0.373 1.00 0.75 H new ATOM 0 H2' DT A 6 -8.398 -6.449 -0.782 1.00 0.66 H new ATOM 0 H2'' DT A 6 -9.546 -6.871 -2.037 1.00 0.66 H new ATOM 0 H1' DT A 6 -8.309 -5.688 -3.732 1.00 0.70 H new ATOM 0 H3 DT A 6 -6.661 -9.796 -3.960 1.00 0.81 H new ATOM 0 H71 DT A 6 -3.182 -5.688 -4.267 1.00 0.78 H new ATOM 0 H72 DT A 6 -2.470 -6.997 -3.293 1.00 0.78 H new ATOM 0 H73 DT A 6 -2.868 -7.277 -5.005 1.00 0.78 H new ATOM 0 H6 DT A 6 -5.157 -5.367 -2.854 1.00 0.68 H new ATOM 194 P DA A 7 -10.911 -5.144 -3.735 1.00 0.83 P ATOM 195 OP1 DA A 7 -10.143 -4.087 -4.429 1.00 1.11 O ATOM 196 OP2 DA A 7 -12.316 -5.405 -4.123 1.00 1.07 O ATOM 197 O5' DA A 7 -10.088 -6.533 -3.870 1.00 0.80 O ATOM 198 C5' DA A 7 -9.758 -7.085 -5.161 1.00 0.83 C ATOM 199 C4' DA A 7 -9.015 -6.079 -6.033 1.00 0.70 C ATOM 200 O4' DA A 7 -7.629 -5.880 -5.590 1.00 0.57 O ATOM 201 C3' DA A 7 -8.934 -6.550 -7.505 1.00 0.71 C ATOM 202 O3' DA A 7 -9.345 -5.510 -8.456 1.00 0.85 O ATOM 203 C2' DA A 7 -7.471 -6.833 -7.691 1.00 0.60 C ATOM 204 C1' DA A 7 -6.865 -5.822 -6.794 1.00 0.51 C ATOM 205 N9 DA A 7 -5.400 -5.878 -6.686 1.00 0.47 N ATOM 206 C8 DA A 7 -4.532 -5.161 -5.887 1.00 0.53 C ATOM 207 N7 DA A 7 -3.303 -5.097 -6.278 1.00 0.59 N ATOM 208 C5 DA A 7 -3.320 -5.852 -7.445 1.00 0.52 C ATOM 209 C6 DA A 7 -2.323 -6.180 -8.368 1.00 0.57 C ATOM 210 N6 DA A 7 -1.072 -5.731 -8.275 1.00 0.69 N ATOM 211 N1 DA A 7 -2.675 -6.946 -9.415 1.00 0.53 N ATOM 212 C2 DA A 7 -3.935 -7.361 -9.550 1.00 0.49 C ATOM 213 N3 DA A 7 -4.955 -7.105 -8.738 1.00 0.47 N ATOM 214 C4 DA A 7 -4.576 -6.338 -7.696 1.00 0.46 C ATOM 0 H5' DA A 7 -10.671 -7.399 -5.666 1.00 0.83 H new ATOM 0 H5'' DA A 7 -9.144 -7.976 -5.029 1.00 0.83 H new ATOM 0 H4' DA A 7 -9.583 -5.153 -5.946 1.00 0.70 H new ATOM 0 H3' DA A 7 -9.594 -7.398 -7.689 1.00 0.71 H new ATOM 0 H2' DA A 7 -7.209 -7.850 -7.401 1.00 0.60 H new ATOM 0 H2'' DA A 7 -7.156 -6.706 -8.727 1.00 0.60 H new ATOM 0 H1' DA A 7 -6.934 -4.815 -7.206 1.00 0.51 H new ATOM 0 H8 DA A 7 -4.864 -4.678 -4.980 1.00 0.53 H new ATOM 0 H61 DA A 7 -0.380 -6.000 -8.975 1.00 0.69 H new ATOM 0 H62 DA A 7 -0.806 -5.119 -7.504 1.00 0.69 H new ATOM 0 H2 DA A 7 -4.150 -7.972 -10.414 1.00 0.49 H new ATOM 226 P DG A 8 -9.298 -3.887 -8.163 1.00 0.58 P ATOM 227 OP1 DG A 8 -8.968 -3.651 -6.743 1.00 0.73 O ATOM 228 OP2 DG A 8 -10.548 -3.311 -8.706 1.00 0.63 O ATOM 229 O5' DG A 8 -8.065 -3.307 -9.077 1.00 0.75 O ATOM 230 C5' DG A 8 -6.777 -2.818 -8.557 1.00 0.74 C ATOM 231 C4' DG A 8 -6.763 -2.446 -7.060 1.00 0.65 C ATOM 232 O4' DG A 8 -5.557 -2.893 -6.370 1.00 0.73 O ATOM 233 C3' DG A 8 -6.826 -0.986 -6.719 1.00 0.70 C ATOM 234 O3' DG A 8 -8.112 -0.382 -6.944 1.00 0.87 O ATOM 235 C2' DG A 8 -6.515 -1.065 -5.239 1.00 0.63 C ATOM 236 C1' DG A 8 -5.722 -2.346 -5.065 1.00 0.65 C ATOM 237 N9 DG A 8 -4.566 -2.076 -4.195 1.00 0.52 N ATOM 238 C8 DG A 8 -4.734 -1.453 -3.039 1.00 0.47 C ATOM 239 N7 DG A 8 -3.784 -1.419 -2.215 1.00 0.45 N ATOM 240 C5 DG A 8 -2.800 -2.097 -2.851 1.00 0.43 C ATOM 241 C6 DG A 8 -1.525 -2.356 -2.362 1.00 0.44 C ATOM 242 O6 DG A 8 -1.116 -2.156 -1.207 1.00 0.49 O ATOM 243 N1 DG A 8 -0.775 -3.057 -3.275 1.00 0.45 N ATOM 244 C2 DG A 8 -1.194 -3.488 -4.502 1.00 0.53 C ATOM 245 N2 DG A 8 -0.249 -4.199 -5.168 1.00 0.61 N ATOM 246 N3 DG A 8 -2.451 -3.245 -5.006 1.00 0.58 N ATOM 247 C4 DG A 8 -3.215 -2.534 -4.111 1.00 0.50 C ATOM 0 H5' DG A 8 -6.481 -1.942 -9.134 1.00 0.74 H new ATOM 0 H5'' DG A 8 -6.021 -3.584 -8.730 1.00 0.74 H new ATOM 0 H4' DG A 8 -7.677 -2.948 -6.741 1.00 0.65 H new ATOM 0 H3' DG A 8 -6.165 -0.367 -7.326 1.00 0.70 H new ATOM 0 H2' DG A 8 -5.940 -0.199 -4.911 1.00 0.63 H new ATOM 0 H2'' DG A 8 -7.429 -1.084 -4.645 1.00 0.63 H new ATOM 0 H1' DG A 8 -6.198 -3.156 -4.512 1.00 0.65 H new ATOM 0 H8 DG A 8 -5.676 -0.979 -2.806 1.00 0.47 H new ATOM 0 H1 DG A 8 0.186 -3.277 -3.012 1.00 0.45 H new ATOM 0 H21 DG A 8 -0.451 -4.572 -6.096 1.00 0.61 H new ATOM 0 H22 DG A 8 0.663 -4.361 -4.741 1.00 0.61 H new ATOM 259 P DG A 9 -8.534 0.199 -8.386 1.00 0.98 P ATOM 260 OP1 DG A 9 -10.009 0.142 -8.487 1.00 1.06 O ATOM 261 OP2 DG A 9 -7.706 -0.478 -9.409 1.00 1.24 O ATOM 262 O5' DG A 9 -8.096 1.766 -8.344 1.00 0.87 O ATOM 263 C5' DG A 9 -6.834 2.248 -7.809 1.00 0.78 C ATOM 264 C4' DG A 9 -5.691 2.266 -8.832 1.00 0.67 C ATOM 265 O4' DG A 9 -4.400 2.333 -8.212 1.00 0.56 O ATOM 266 C3' DG A 9 -5.654 1.047 -9.779 1.00 0.67 C ATOM 267 O3' DG A 9 -6.210 1.332 -11.110 1.00 0.77 O ATOM 268 C2' DG A 9 -4.192 0.625 -9.845 1.00 0.60 C ATOM 269 C1' DG A 9 -3.447 1.670 -9.066 1.00 0.51 C ATOM 270 N9 DG A 9 -2.275 1.268 -8.281 1.00 0.43 N ATOM 271 C8 DG A 9 -1.101 0.686 -8.654 1.00 0.46 C ATOM 272 N7 DG A 9 -0.119 0.722 -7.800 1.00 0.44 N ATOM 273 C5 DG A 9 -0.709 1.404 -6.734 1.00 0.39 C ATOM 274 C6 DG A 9 -0.155 1.736 -5.469 1.00 0.39 C ATOM 275 O6 DG A 9 0.938 1.425 -5.031 1.00 0.44 O ATOM 276 N1 DG A 9 -1.066 2.402 -4.661 1.00 0.39 N ATOM 277 C2 DG A 9 -2.368 2.698 -5.047 1.00 0.40 C ATOM 278 N2 DG A 9 -3.113 3.342 -4.178 1.00 0.44 N ATOM 279 N3 DG A 9 -2.889 2.372 -6.229 1.00 0.41 N ATOM 280 C4 DG A 9 -2.013 1.729 -7.017 1.00 0.39 C ATOM 0 H5' DG A 9 -6.544 1.620 -6.966 1.00 0.78 H new ATOM 0 H5'' DG A 9 -6.977 3.256 -7.421 1.00 0.78 H new ATOM 0 H4' DG A 9 -5.905 3.165 -9.411 1.00 0.67 H new ATOM 0 H3' DG A 9 -6.287 0.245 -9.398 1.00 0.67 H new ATOM 0 H2' DG A 9 -4.048 -0.366 -9.414 1.00 0.60 H new ATOM 0 H2'' DG A 9 -3.842 0.578 -10.876 1.00 0.60 H new ATOM 0 H1' DG A 9 -2.999 2.308 -9.828 1.00 0.51 H new ATOM 0 H8 DG A 9 -0.990 0.214 -9.619 1.00 0.46 H new ATOM 0 H1 DG A 9 -0.763 2.691 -3.731 1.00 0.39 H new ATOM 0 H21 DG A 9 -4.076 3.583 -4.412 1.00 0.44 H new ATOM 0 H22 DG A 9 -2.729 3.601 -3.269 1.00 0.44 H new ATOM 292 P DG A 10 -6.194 2.793 -11.862 1.00 0.96 P ATOM 293 OP1 DG A 10 -7.358 2.852 -12.775 1.00 1.24 O ATOM 294 OP2 DG A 10 -4.832 3.021 -12.394 1.00 0.97 O ATOM 295 O5' DG A 10 -6.448 3.854 -10.650 1.00 1.06 O ATOM 296 C5' DG A 10 -6.391 5.297 -10.820 1.00 0.99 C ATOM 297 C4' DG A 10 -5.082 5.919 -10.338 1.00 0.90 C ATOM 298 O4' DG A 10 -5.071 6.291 -8.920 1.00 0.90 O ATOM 299 C3' DG A 10 -3.902 4.964 -10.529 1.00 0.89 C ATOM 300 O3' DG A 10 -3.045 5.415 -11.592 1.00 0.82 O ATOM 301 C2' DG A 10 -3.196 4.983 -9.196 1.00 0.89 C ATOM 302 C1' DG A 10 -3.683 6.231 -8.580 1.00 0.85 C ATOM 303 N9 DG A 10 -3.286 6.374 -7.168 1.00 0.70 N ATOM 304 C8 DG A 10 -3.860 7.036 -6.125 1.00 0.71 C ATOM 305 N7 DG A 10 -3.136 7.212 -5.055 1.00 0.61 N ATOM 306 C5 DG A 10 -1.932 6.587 -5.425 1.00 0.51 C ATOM 307 C6 DG A 10 -0.709 6.425 -4.706 1.00 0.46 C ATOM 308 O6 DG A 10 -0.426 6.803 -3.579 1.00 0.57 O ATOM 309 N1 DG A 10 0.239 5.742 -5.448 1.00 0.46 N ATOM 310 C2 DG A 10 0.056 5.267 -6.721 1.00 0.52 C ATOM 311 N2 DG A 10 1.092 4.630 -7.259 1.00 0.61 N ATOM 312 N3 DG A 10 -1.078 5.409 -7.407 1.00 0.60 N ATOM 313 C4 DG A 10 -2.026 6.075 -6.705 1.00 0.57 C ATOM 0 H5' DG A 10 -7.220 5.751 -10.278 1.00 0.99 H new ATOM 0 H5'' DG A 10 -6.530 5.536 -11.874 1.00 0.99 H new ATOM 0 H4' DG A 10 -4.991 6.818 -10.947 1.00 0.90 H new ATOM 0 H3' DG A 10 -4.212 3.958 -10.814 1.00 0.89 H new ATOM 0 H2' DG A 10 -3.448 4.110 -8.593 1.00 0.89 H new ATOM 0 H2'' DG A 10 -2.112 4.987 -9.313 1.00 0.89 H new ATOM 0 H1' DG A 10 -3.210 7.134 -8.966 1.00 0.85 H new ATOM 0 H8 DG A 10 -4.875 7.401 -6.182 1.00 0.71 H new ATOM 0 H1 DG A 10 1.147 5.579 -5.013 1.00 0.46 H new ATOM 0 H21 DG A 10 1.023 4.251 -8.204 1.00 0.61 H new ATOM 0 H22 DG A 10 1.955 4.520 -6.727 1.00 0.61 H new ATOM 325 P DT A 11 -1.891 6.514 -11.340 1.00 0.89 P ATOM 326 OP1 DT A 11 -1.406 6.984 -12.656 1.00 1.00 O ATOM 327 OP2 DT A 11 -0.934 5.961 -10.356 1.00 1.05 O ATOM 328 O5' DT A 11 -2.689 7.724 -10.638 1.00 0.87 O ATOM 329 C5' DT A 11 -2.496 9.071 -11.080 1.00 0.94 C ATOM 330 C4' DT A 11 -1.547 9.840 -10.162 1.00 1.04 C ATOM 331 O4' DT A 11 -2.279 10.811 -9.382 1.00 0.98 O ATOM 332 C3' DT A 11 -0.823 8.904 -9.199 1.00 1.12 C ATOM 333 O3' DT A 11 0.594 8.959 -9.402 1.00 1.26 O ATOM 334 C2' DT A 11 -1.184 9.375 -7.819 1.00 1.00 C ATOM 335 C1' DT A 11 -2.104 10.564 -7.972 1.00 0.95 C ATOM 336 N1 DT A 11 -3.405 10.322 -7.321 1.00 0.88 N ATOM 337 C2 DT A 11 -3.470 10.479 -5.950 1.00 0.97 C ATOM 338 O2 DT A 11 -2.480 10.749 -5.275 1.00 1.08 O ATOM 339 N3 DT A 11 -4.717 10.305 -5.378 1.00 0.99 N ATOM 340 C4 DT A 11 -5.886 9.991 -6.051 1.00 0.93 C ATOM 341 O4 DT A 11 -6.947 9.872 -5.442 1.00 1.02 O ATOM 342 C5 DT A 11 -5.719 9.841 -7.479 1.00 0.82 C ATOM 343 C7 DT A 11 -6.928 9.501 -8.344 1.00 0.83 C ATOM 344 C6 DT A 11 -4.513 10.005 -8.059 1.00 0.81 C ATOM 0 H5' DT A 11 -3.458 9.582 -11.118 1.00 0.94 H new ATOM 0 H5'' DT A 11 -2.097 9.067 -12.094 1.00 0.94 H new ATOM 0 H4' DT A 11 -0.816 10.337 -10.800 1.00 1.04 H new ATOM 0 H3' DT A 11 -1.118 7.866 -9.356 1.00 1.12 H new ATOM 0 H2' DT A 11 -1.675 8.580 -7.259 1.00 1.00 H new ATOM 0 H2'' DT A 11 -0.289 9.652 -7.262 1.00 1.00 H new ATOM 0 H1' DT A 11 -1.663 11.435 -7.486 1.00 0.95 H new ATOM 0 H3 DT A 11 -4.782 10.418 -4.366 1.00 0.99 H new ATOM 0 H71 DT A 11 -6.795 9.927 -9.339 1.00 0.83 H new ATOM 0 H72 DT A 11 -7.026 8.418 -8.423 1.00 0.83 H new ATOM 0 H73 DT A 11 -7.828 9.915 -7.890 1.00 0.83 H new ATOM 0 H6 DT A 11 -4.419 9.884 -9.128 1.00 0.81 H new ATOM 357 P DT A 12 1.418 10.308 -9.090 1.00 1.80 P ATOM 358 OP1 DT A 12 0.666 11.090 -8.083 1.00 2.59 O ATOM 359 OP2 DT A 12 1.791 10.931 -10.380 1.00 2.12 O ATOM 360 O5' DT A 12 2.759 9.749 -8.394 1.00 1.40 O ATOM 361 C5' DT A 12 3.061 10.074 -7.034 1.00 1.32 C ATOM 362 C4' DT A 12 4.175 11.116 -6.939 1.00 0.91 C ATOM 363 O4' DT A 12 3.635 12.450 -7.061 1.00 0.80 O ATOM 364 C3' DT A 12 4.910 11.021 -5.606 1.00 0.84 C ATOM 365 O3' DT A 12 6.259 10.580 -5.794 1.00 0.73 O ATOM 366 C2' DT A 12 4.877 12.405 -5.021 1.00 0.87 C ATOM 367 C1' DT A 12 4.080 13.276 -5.963 1.00 0.67 C ATOM 368 N1 DT A 12 2.933 13.899 -5.275 1.00 0.67 N ATOM 369 C2 DT A 12 3.182 15.030 -4.521 1.00 0.86 C ATOM 370 O2 DT A 12 4.317 15.479 -4.373 1.00 1.15 O ATOM 371 N3 DT A 12 2.080 15.624 -3.935 1.00 0.87 N ATOM 372 C4 DT A 12 0.770 15.189 -4.035 1.00 0.72 C ATOM 373 O4 DT A 12 -0.138 15.803 -3.480 1.00 0.75 O ATOM 374 C5 DT A 12 0.607 13.997 -4.836 1.00 0.80 C ATOM 375 C7 DT A 12 -0.786 13.410 -5.033 1.00 1.18 C ATOM 376 C6 DT A 12 1.666 13.400 -5.418 1.00 0.78 C ATOM 0 H5' DT A 12 3.360 9.171 -6.501 1.00 1.32 H new ATOM 0 H5'' DT A 12 2.165 10.452 -6.542 1.00 1.32 H new ATOM 0 H4' DT A 12 4.871 10.915 -7.754 1.00 0.91 H new ATOM 0 H3' DT A 12 4.439 10.295 -4.944 1.00 0.84 H new ATOM 0 H2' DT A 12 4.420 12.392 -4.031 1.00 0.87 H new ATOM 0 H2'' DT A 12 5.888 12.795 -4.901 1.00 0.87 H new ATOM 0 H1' DT A 12 4.705 14.089 -6.332 1.00 0.67 H new ATOM 0 H3 DT A 12 2.248 16.461 -3.377 1.00 0.87 H new ATOM 0 H71 DT A 12 -0.837 12.911 -6.001 1.00 1.18 H new ATOM 0 H72 DT A 12 -0.992 12.689 -4.242 1.00 1.18 H new ATOM 0 H73 DT A 12 -1.526 14.209 -4.998 1.00 1.18 H new ATOM 0 H6 DT A 12 1.512 12.510 -6.009 1.00 0.78 H new ATOM 389 P DA A 13 6.573 9.057 -6.212 1.00 0.66 P ATOM 390 OP1 DA A 13 7.392 9.075 -7.444 1.00 0.93 O ATOM 391 OP2 DA A 13 5.303 8.298 -6.182 1.00 0.95 O ATOM 392 O5' DA A 13 7.498 8.539 -4.999 1.00 0.48 O ATOM 393 C5' DA A 13 7.166 7.338 -4.297 1.00 0.41 C ATOM 394 C4' DA A 13 8.217 6.250 -4.509 1.00 0.43 C ATOM 395 O4' DA A 13 7.867 5.423 -5.640 1.00 0.46 O ATOM 396 C3' DA A 13 9.595 6.850 -4.767 1.00 0.47 C ATOM 397 O3' DA A 13 10.511 6.486 -3.727 1.00 0.56 O ATOM 398 C2' DA A 13 10.042 6.297 -6.091 1.00 0.45 C ATOM 399 C1' DA A 13 8.946 5.387 -6.595 1.00 0.45 C ATOM 400 N9 DA A 13 8.474 5.798 -7.930 1.00 0.44 N ATOM 401 C8 DA A 13 7.360 6.489 -8.279 1.00 0.46 C ATOM 402 N7 DA A 13 7.123 6.643 -9.539 1.00 0.55 N ATOM 403 C5 DA A 13 8.212 5.979 -10.113 1.00 0.56 C ATOM 404 C6 DA A 13 8.590 5.752 -11.440 1.00 0.68 C ATOM 405 N6 DA A 13 7.869 6.161 -12.484 1.00 0.81 N ATOM 406 N1 DA A 13 9.726 5.062 -11.651 1.00 0.71 N ATOM 407 C2 DA A 13 10.447 4.618 -10.621 1.00 0.64 C ATOM 408 N3 DA A 13 10.180 4.772 -9.327 1.00 0.55 N ATOM 409 C4 DA A 13 9.040 5.467 -9.141 1.00 0.49 C ATOM 0 H5' DA A 13 6.195 6.976 -4.634 1.00 0.41 H new ATOM 0 H5'' DA A 13 7.074 7.553 -3.232 1.00 0.41 H new ATOM 0 H4' DA A 13 8.247 5.653 -3.598 1.00 0.43 H new ATOM 0 H3' DA A 13 9.560 7.939 -4.782 1.00 0.47 H new ATOM 0 H2' DA A 13 10.228 7.103 -6.801 1.00 0.45 H new ATOM 0 H2'' DA A 13 10.977 5.747 -5.981 1.00 0.45 H new ATOM 0 H1' DA A 13 9.331 4.372 -6.697 1.00 0.45 H new ATOM 0 H8 DA A 13 6.696 6.895 -7.531 1.00 0.46 H new ATOM 0 H61 DA A 13 8.191 5.969 -13.433 1.00 0.81 H new ATOM 0 H62 DA A 13 6.996 6.666 -12.334 1.00 0.81 H new ATOM 0 H2 DA A 13 11.347 4.073 -10.864 1.00 0.64 H new ATOM 421 P DG A 14 10.969 4.952 -3.542 1.00 0.47 P ATOM 422 OP1 DG A 14 12.031 4.664 -4.531 1.00 0.67 O ATOM 423 OP2 DG A 14 9.753 4.109 -3.499 1.00 0.58 O ATOM 424 O5' DG A 14 11.634 4.953 -2.075 1.00 0.42 O ATOM 425 C5' DG A 14 11.112 4.107 -1.040 1.00 0.39 C ATOM 426 C4' DG A 14 10.570 4.905 0.137 1.00 0.42 C ATOM 427 O4' DG A 14 9.528 5.814 -0.281 1.00 0.44 O ATOM 428 C3' DG A 14 9.972 4.007 1.204 1.00 0.53 C ATOM 429 O3' DG A 14 10.895 3.779 2.276 1.00 0.60 O ATOM 430 C2' DG A 14 8.764 4.762 1.674 1.00 0.50 C ATOM 431 C1' DG A 14 8.351 5.641 0.547 1.00 0.40 C ATOM 432 N9 DG A 14 7.254 5.205 -0.318 1.00 0.33 N ATOM 433 C8 DG A 14 7.341 4.618 -1.538 1.00 0.33 C ATOM 434 N7 DG A 14 6.317 4.676 -2.310 1.00 0.32 N ATOM 435 C5 DG A 14 5.408 5.378 -1.532 1.00 0.29 C ATOM 436 C6 DG A 14 4.085 5.765 -1.842 1.00 0.32 C ATOM 437 O6 DG A 14 3.469 5.566 -2.886 1.00 0.35 O ATOM 438 N1 DG A 14 3.497 6.459 -0.792 1.00 0.36 N ATOM 439 C2 DG A 14 4.111 6.744 0.413 1.00 0.40 C ATOM 440 N2 DG A 14 3.376 7.415 1.306 1.00 0.50 N ATOM 441 N3 DG A 14 5.369 6.380 0.710 1.00 0.38 N ATOM 442 C4 DG A 14 5.958 5.702 -0.305 1.00 0.31 C ATOM 0 H5' DG A 14 11.897 3.436 -0.691 1.00 0.39 H new ATOM 0 H5'' DG A 14 10.318 3.483 -1.450 1.00 0.39 H new ATOM 0 H4' DG A 14 11.422 5.452 0.541 1.00 0.42 H new ATOM 0 H3' DG A 14 9.725 3.015 0.824 1.00 0.53 H new ATOM 0 H2' DG A 14 7.961 4.078 1.947 1.00 0.50 H new ATOM 0 H2'' DG A 14 8.996 5.351 2.561 1.00 0.50 H new ATOM 0 H1' DG A 14 7.954 6.539 1.020 1.00 0.40 H new ATOM 0 H8 DG A 14 8.245 4.117 -1.851 1.00 0.33 H new ATOM 0 H1 DG A 14 2.538 6.783 -0.920 1.00 0.36 H new ATOM 0 H21 DG A 14 3.772 7.656 2.215 1.00 0.50 H new ATOM 0 H22 DG A 14 2.419 7.686 1.079 1.00 0.50 H new ATOM 454 P DG A 15 11.745 2.412 2.346 1.00 0.84 P ATOM 455 OP1 DG A 15 13.102 2.736 2.839 1.00 1.04 O ATOM 456 OP2 DG A 15 11.578 1.698 1.060 1.00 0.98 O ATOM 457 O5' DG A 15 10.980 1.574 3.490 1.00 0.83 O ATOM 458 C5' DG A 15 9.547 1.548 3.540 1.00 0.80 C ATOM 459 C4' DG A 15 8.987 2.589 4.506 1.00 0.69 C ATOM 460 O4' DG A 15 8.169 3.545 3.813 1.00 0.68 O ATOM 461 C3' DG A 15 8.096 2.001 5.581 1.00 0.58 C ATOM 462 O3' DG A 15 8.820 1.582 6.754 1.00 0.58 O ATOM 463 C2' DG A 15 7.132 3.115 5.882 1.00 0.52 C ATOM 464 C1' DG A 15 6.989 3.845 4.595 1.00 0.56 C ATOM 465 N9 DG A 15 5.784 3.556 3.806 1.00 0.56 N ATOM 466 C8 DG A 15 4.520 4.056 3.928 1.00 0.64 C ATOM 467 N7 DG A 15 3.718 3.924 2.917 1.00 0.64 N ATOM 468 C5 DG A 15 4.541 3.247 2.003 1.00 0.55 C ATOM 469 C6 DG A 15 4.266 2.799 0.686 1.00 0.53 C ATOM 470 O6 DG A 15 3.170 2.745 0.110 1.00 0.58 O ATOM 471 N1 DG A 15 5.357 2.156 0.121 1.00 0.51 N ATOM 472 C2 DG A 15 6.572 1.962 0.739 1.00 0.53 C ATOM 473 N2 DG A 15 7.497 1.309 0.036 1.00 0.61 N ATOM 474 N3 DG A 15 6.843 2.381 1.975 1.00 0.51 N ATOM 475 C4 DG A 15 5.791 3.011 2.547 1.00 0.51 C ATOM 0 H5' DG A 15 9.213 0.556 3.844 1.00 0.80 H new ATOM 0 H5'' DG A 15 9.147 1.728 2.542 1.00 0.80 H new ATOM 0 H4' DG A 15 9.870 3.041 4.959 1.00 0.69 H new ATOM 0 H3' DG A 15 7.605 1.086 5.248 1.00 0.58 H new ATOM 0 H2' DG A 15 6.173 2.727 6.227 1.00 0.52 H new ATOM 0 H2'' DG A 15 7.513 3.767 6.668 1.00 0.52 H new ATOM 0 H1' DG A 15 6.881 4.901 4.845 1.00 0.56 H new ATOM 0 H8 DG A 15 4.198 4.545 4.836 1.00 0.64 H new ATOM 0 H1 DG A 15 5.251 1.798 -0.828 1.00 0.51 H new ATOM 0 H21 DG A 15 8.417 1.135 0.441 1.00 0.61 H new ATOM 0 H22 DG A 15 7.285 0.983 -0.907 1.00 0.61 H new ATOM 487 P DG A 16 10.222 0.774 6.666 1.00 0.48 P ATOM 488 OP1 DG A 16 10.607 0.381 8.040 1.00 0.66 O ATOM 489 OP2 DG A 16 11.159 1.575 5.846 1.00 0.61 O ATOM 490 O5' DG A 16 9.869 -0.576 5.843 1.00 0.44 O ATOM 491 C5' DG A 16 8.915 -1.545 6.325 1.00 0.38 C ATOM 492 C4' DG A 16 7.559 -0.910 6.539 1.00 0.37 C ATOM 493 O4' DG A 16 6.899 -0.677 5.284 1.00 0.43 O ATOM 494 C3' DG A 16 6.582 -1.705 7.374 1.00 0.44 C ATOM 495 O3' DG A 16 6.811 -1.522 8.775 1.00 0.69 O ATOM 496 C2' DG A 16 5.262 -1.109 6.941 1.00 0.42 C ATOM 497 C1' DG A 16 5.485 -0.623 5.529 1.00 0.40 C ATOM 498 N9 DG A 16 4.708 -1.282 4.459 1.00 0.32 N ATOM 499 C8 DG A 16 5.120 -1.990 3.370 1.00 0.30 C ATOM 500 N7 DG A 16 4.266 -2.163 2.403 1.00 0.28 N ATOM 501 C5 DG A 16 3.136 -1.500 2.897 1.00 0.28 C ATOM 502 C6 DG A 16 1.830 -1.304 2.323 1.00 0.32 C ATOM 503 O6 DG A 16 1.352 -1.720 1.228 1.00 0.35 O ATOM 504 N1 DG A 16 1.032 -0.564 3.194 1.00 0.39 N ATOM 505 C2 DG A 16 1.400 -0.085 4.431 1.00 0.43 C ATOM 506 N2 DG A 16 0.470 0.593 5.106 1.00 0.55 N ATOM 507 N3 DG A 16 2.595 -0.267 4.963 1.00 0.40 N ATOM 508 C4 DG A 16 3.409 -0.972 4.158 1.00 0.31 C ATOM 0 H5' DG A 16 9.270 -1.976 7.261 1.00 0.38 H new ATOM 0 H5'' DG A 16 8.829 -2.363 5.610 1.00 0.38 H new ATOM 0 H4' DG A 16 7.803 0.005 7.079 1.00 0.37 H new ATOM 0 H3' DG A 16 6.651 -2.783 7.230 1.00 0.44 H new ATOM 0 H2' DG A 16 4.464 -1.851 6.980 1.00 0.42 H new ATOM 0 H2'' DG A 16 4.967 -0.290 7.597 1.00 0.42 H new ATOM 0 H1' DG A 16 5.093 0.393 5.478 1.00 0.40 H new ATOM 0 H8 DG A 16 6.120 -2.393 3.311 1.00 0.30 H new ATOM 0 H1 DG A 16 0.082 -0.357 2.884 1.00 0.39 H new ATOM 0 H21 DG A 16 0.684 0.972 6.028 1.00 0.55 H new ATOM 0 H22 DG A 16 -0.455 0.732 4.700 1.00 0.55 H new ATOM 520 P DT A 17 6.495 -2.711 9.813 1.00 0.88 P ATOM 521 OP1 DT A 17 5.029 -2.913 9.853 1.00 1.18 O ATOM 522 OP2 DT A 17 7.238 -2.444 11.065 1.00 1.20 O ATOM 523 O5' DT A 17 7.160 -3.990 9.095 1.00 0.77 O ATOM 524 C5' DT A 17 7.845 -4.979 9.866 1.00 0.76 C ATOM 525 C4' DT A 17 7.422 -6.393 9.472 1.00 0.68 C ATOM 526 O4' DT A 17 6.787 -7.059 10.585 1.00 0.74 O ATOM 527 C3' DT A 17 6.440 -6.373 8.305 1.00 0.60 C ATOM 528 O3' DT A 17 6.999 -7.021 7.157 1.00 0.61 O ATOM 529 C2' DT A 17 5.216 -7.099 8.787 1.00 0.61 C ATOM 530 C1' DT A 17 5.462 -7.499 10.223 1.00 0.63 C ATOM 531 N1 DT A 17 4.450 -6.912 11.124 1.00 0.68 N ATOM 532 C2 DT A 17 4.820 -5.806 11.866 1.00 0.77 C ATOM 533 O2 DT A 17 5.924 -5.278 11.751 1.00 0.88 O ATOM 534 N3 DT A 17 3.868 -5.318 12.743 1.00 0.92 N ATOM 535 C4 DT A 17 2.598 -5.832 12.935 1.00 1.00 C ATOM 536 O4 DT A 17 1.833 -5.325 13.753 1.00 1.22 O ATOM 537 C5 DT A 17 2.299 -6.982 12.112 1.00 1.03 C ATOM 538 C7 DT A 17 0.934 -7.652 12.226 1.00 1.41 C ATOM 539 C6 DT A 17 3.210 -7.477 11.250 1.00 0.90 C ATOM 0 H5' DT A 17 7.642 -4.820 10.925 1.00 0.76 H new ATOM 0 H5'' DT A 17 8.920 -4.869 9.727 1.00 0.76 H new ATOM 0 H4' DT A 17 8.325 -6.928 9.177 1.00 0.68 H new ATOM 0 H3' DT A 17 6.204 -5.354 8.000 1.00 0.60 H new ATOM 0 H2' DT A 17 4.337 -6.459 8.712 1.00 0.61 H new ATOM 0 H2'' DT A 17 5.024 -7.978 8.172 1.00 0.61 H new ATOM 0 H1' DT A 17 5.383 -8.582 10.323 1.00 0.63 H new ATOM 0 H3 DT A 17 4.126 -4.503 13.300 1.00 0.92 H new ATOM 0 H71 DT A 17 0.664 -8.094 11.267 1.00 1.41 H new ATOM 0 H72 DT A 17 0.974 -8.432 12.987 1.00 1.41 H new ATOM 0 H73 DT A 17 0.187 -6.910 12.506 1.00 1.41 H new ATOM 0 H6 DT A 17 2.956 -8.336 10.647 1.00 0.90 H new ATOM 552 P DT A 18 6.079 -7.369 5.882 1.00 0.63 P ATOM 553 OP1 DT A 18 6.301 -6.330 4.852 1.00 0.74 O ATOM 554 OP2 DT A 18 4.708 -7.650 6.363 1.00 0.91 O ATOM 555 O5' DT A 18 6.719 -8.749 5.352 1.00 0.49 O ATOM 556 C5' DT A 18 6.895 -9.855 6.242 1.00 0.54 C ATOM 557 C4' DT A 18 6.603 -11.187 5.553 1.00 0.47 C ATOM 558 O4' DT A 18 5.470 -11.836 6.168 1.00 0.45 O ATOM 559 C3' DT A 18 6.292 -10.989 4.072 1.00 0.41 C ATOM 560 O3' DT A 18 7.282 -11.621 3.253 1.00 0.50 O ATOM 561 C2' DT A 18 4.941 -11.608 3.851 1.00 0.37 C ATOM 562 C1' DT A 18 4.453 -12.120 5.185 1.00 0.37 C ATOM 563 N1 DT A 18 3.173 -11.492 5.562 1.00 0.35 N ATOM 564 C2 DT A 18 2.029 -11.955 4.939 1.00 0.36 C ATOM 565 O2 DT A 18 2.064 -12.815 4.062 1.00 0.42 O ATOM 566 N3 DT A 18 0.840 -11.385 5.355 1.00 0.40 N ATOM 567 C4 DT A 18 0.699 -10.407 6.324 1.00 0.48 C ATOM 568 O4 DT A 18 -0.412 -9.978 6.626 1.00 0.61 O ATOM 569 C5 DT A 18 1.949 -9.983 6.915 1.00 0.50 C ATOM 570 C7 DT A 18 1.940 -8.912 8.001 1.00 0.69 C ATOM 571 C6 DT A 18 3.121 -10.522 6.526 1.00 0.41 C ATOM 0 H5' DT A 18 6.236 -9.738 7.102 1.00 0.54 H new ATOM 0 H5'' DT A 18 7.917 -9.858 6.621 1.00 0.54 H new ATOM 0 H4' DT A 18 7.495 -11.804 5.657 1.00 0.47 H new ATOM 0 H3' DT A 18 6.296 -9.933 3.802 1.00 0.41 H new ATOM 0 H2' DT A 18 4.245 -10.874 3.444 1.00 0.37 H new ATOM 0 H2'' DT A 18 5.005 -12.421 3.128 1.00 0.37 H new ATOM 0 H1' DT A 18 4.274 -13.194 5.125 1.00 0.37 H new ATOM 0 H3 DT A 18 -0.013 -11.716 4.905 1.00 0.40 H new ATOM 0 H71 DT A 18 2.778 -9.074 8.679 1.00 0.69 H new ATOM 0 H72 DT A 18 2.030 -7.928 7.542 1.00 0.69 H new ATOM 0 H73 DT A 18 1.006 -8.968 8.559 1.00 0.69 H new ATOM 0 H6 DT A 18 4.038 -10.182 6.984 1.00 0.41 H new ATOM 584 P DA A 19 8.561 -10.794 2.731 1.00 0.56 P ATOM 585 OP1 DA A 19 9.779 -11.423 3.289 1.00 0.71 O ATOM 586 OP2 DA A 19 8.304 -9.355 2.956 1.00 0.71 O ATOM 587 O5' DA A 19 8.535 -11.069 1.144 1.00 0.51 O ATOM 588 C5' DA A 19 9.406 -10.345 0.269 1.00 0.45 C ATOM 589 C4' DA A 19 8.761 -9.048 -0.217 1.00 0.41 C ATOM 590 O4' DA A 19 8.244 -8.292 0.900 1.00 0.44 O ATOM 591 C3' DA A 19 9.767 -8.173 -0.961 1.00 0.37 C ATOM 592 O3' DA A 19 9.368 -7.983 -2.325 1.00 0.42 O ATOM 593 C2' DA A 19 9.793 -6.865 -0.222 1.00 0.38 C ATOM 594 C1' DA A 19 8.814 -6.967 0.922 1.00 0.39 C ATOM 595 N9 DA A 19 9.473 -6.701 2.215 1.00 0.38 N ATOM 596 C8 DA A 19 10.090 -7.557 3.067 1.00 0.39 C ATOM 597 N7 DA A 19 10.514 -7.080 4.189 1.00 0.44 N ATOM 598 C5 DA A 19 10.142 -5.736 4.083 1.00 0.44 C ATOM 599 C6 DA A 19 10.289 -4.641 4.941 1.00 0.51 C ATOM 600 N6 DA A 19 10.848 -4.730 6.147 1.00 0.61 N ATOM 601 N1 DA A 19 9.811 -3.456 4.520 1.00 0.50 N ATOM 602 C2 DA A 19 9.220 -3.351 3.329 1.00 0.44 C ATOM 603 N3 DA A 19 9.024 -4.321 2.441 1.00 0.42 N ATOM 604 C4 DA A 19 9.513 -5.497 2.883 1.00 0.39 C ATOM 0 H5' DA A 19 9.663 -10.968 -0.588 1.00 0.45 H new ATOM 0 H5'' DA A 19 10.337 -10.117 0.788 1.00 0.45 H new ATOM 0 H4' DA A 19 7.952 -9.325 -0.893 1.00 0.41 H new ATOM 0 H3' DA A 19 10.754 -8.634 -0.991 1.00 0.37 H new ATOM 0 H2' DA A 19 10.796 -6.655 0.150 1.00 0.38 H new ATOM 0 H2'' DA A 19 9.521 -6.045 -0.886 1.00 0.38 H new ATOM 0 H1' DA A 19 8.031 -6.217 0.807 1.00 0.39 H new ATOM 0 H8 DA A 19 10.222 -8.599 2.816 1.00 0.39 H new ATOM 0 H61 DA A 19 10.931 -3.899 6.733 1.00 0.61 H new ATOM 0 H62 DA A 19 11.193 -5.629 6.484 1.00 0.61 H new ATOM 0 H2 DA A 19 8.861 -2.370 3.056 1.00 0.44 H new ATOM 616 P DG A 20 10.456 -7.615 -3.456 1.00 0.50 P ATOM 617 OP1 DG A 20 10.752 -8.840 -4.232 1.00 0.69 O ATOM 618 OP2 DG A 20 11.558 -6.865 -2.813 1.00 0.55 O ATOM 619 O5' DG A 20 9.645 -6.599 -4.408 1.00 0.53 O ATOM 620 C5' DG A 20 8.499 -5.899 -3.906 1.00 0.46 C ATOM 621 C4' DG A 20 7.211 -6.328 -4.579 1.00 0.44 C ATOM 622 O4' DG A 20 6.084 -6.063 -3.733 1.00 0.44 O ATOM 623 C3' DG A 20 6.901 -5.593 -5.878 1.00 0.43 C ATOM 624 O3' DG A 20 7.545 -6.146 -7.039 1.00 0.49 O ATOM 625 C2' DG A 20 5.403 -5.739 -5.982 1.00 0.39 C ATOM 626 C1' DG A 20 4.930 -6.019 -4.579 1.00 0.39 C ATOM 627 N9 DG A 20 3.888 -5.091 -4.105 1.00 0.35 N ATOM 628 C8 DG A 20 2.643 -4.897 -4.613 1.00 0.37 C ATOM 629 N7 DG A 20 1.781 -4.270 -3.901 1.00 0.39 N ATOM 630 C5 DG A 20 2.541 -3.979 -2.751 1.00 0.35 C ATOM 631 C6 DG A 20 2.162 -3.302 -1.558 1.00 0.38 C ATOM 632 O6 DG A 20 1.037 -2.928 -1.247 1.00 0.43 O ATOM 633 N1 DG A 20 3.205 -3.205 -0.650 1.00 0.35 N ATOM 634 C2 DG A 20 4.473 -3.716 -0.849 1.00 0.34 C ATOM 635 N2 DG A 20 5.333 -3.579 0.161 1.00 0.39 N ATOM 636 N3 DG A 20 4.842 -4.370 -1.970 1.00 0.35 N ATOM 637 C4 DG A 20 3.832 -4.464 -2.879 1.00 0.33 C ATOM 0 H5' DG A 20 8.640 -4.828 -4.051 1.00 0.46 H new ATOM 0 H5'' DG A 20 8.417 -6.068 -2.832 1.00 0.46 H new ATOM 0 H4' DG A 20 7.366 -7.388 -4.782 1.00 0.44 H new ATOM 0 H3' DG A 20 7.265 -4.566 -5.852 1.00 0.43 H new ATOM 0 H2' DG A 20 4.946 -4.831 -6.377 1.00 0.39 H new ATOM 0 H2'' DG A 20 5.133 -6.551 -6.657 1.00 0.39 H new ATOM 0 H1' DG A 20 4.423 -6.983 -4.556 1.00 0.39 H new ATOM 0 H8 DG A 20 2.385 -5.263 -5.596 1.00 0.37 H new ATOM 0 H1 DG A 20 3.023 -2.721 0.229 1.00 0.35 H new ATOM 0 H21 DG A 20 6.284 -3.937 0.073 1.00 0.39 H new ATOM 0 H22 DG A 20 5.039 -3.117 1.022 1.00 0.39 H new ATOM 649 P DG A 21 9.026 -5.686 -7.489 1.00 0.54 P ATOM 650 OP1 DG A 21 9.587 -6.752 -8.349 1.00 0.79 O ATOM 651 OP2 DG A 21 9.762 -5.269 -6.276 1.00 0.70 O ATOM 652 O5' DG A 21 8.815 -4.358 -8.416 1.00 0.56 O ATOM 653 C5' DG A 21 7.831 -3.315 -8.169 1.00 0.52 C ATOM 654 C4' DG A 21 8.289 -2.217 -7.202 1.00 0.40 C ATOM 655 O4' DG A 21 7.201 -1.579 -6.494 1.00 0.40 O ATOM 656 C3' DG A 21 9.301 -2.647 -6.128 1.00 0.43 C ATOM 657 O3' DG A 21 10.629 -2.241 -6.510 1.00 0.44 O ATOM 658 C2' DG A 21 8.853 -1.921 -4.888 1.00 0.46 C ATOM 659 C1' DG A 21 7.841 -0.939 -5.390 1.00 0.36 C ATOM 660 N9 DG A 21 6.951 -0.401 -4.346 1.00 0.36 N ATOM 661 C8 DG A 21 7.287 0.008 -3.097 1.00 0.45 C ATOM 662 N7 DG A 21 6.400 0.629 -2.407 1.00 0.45 N ATOM 663 C5 DG A 21 5.318 0.651 -3.286 1.00 0.38 C ATOM 664 C6 DG A 21 4.029 1.203 -3.103 1.00 0.43 C ATOM 665 O6 DG A 21 3.592 1.793 -2.116 1.00 0.49 O ATOM 666 N1 DG A 21 3.227 1.015 -4.220 1.00 0.47 N ATOM 667 C2 DG A 21 3.613 0.372 -5.385 1.00 0.45 C ATOM 668 N2 DG A 21 2.690 0.279 -6.360 1.00 0.57 N ATOM 669 N3 DG A 21 4.839 -0.152 -5.566 1.00 0.38 N ATOM 670 C4 DG A 21 5.638 0.020 -4.481 1.00 0.34 C ATOM 0 H5' DG A 21 6.926 -3.775 -7.772 1.00 0.52 H new ATOM 0 H5'' DG A 21 7.564 -2.854 -9.120 1.00 0.52 H new ATOM 0 H4' DG A 21 8.776 -1.529 -7.893 1.00 0.40 H new ATOM 0 H3' DG A 21 9.336 -3.727 -5.983 1.00 0.43 H new ATOM 0 H2' DG A 21 8.418 -2.606 -4.160 1.00 0.46 H new ATOM 0 H2'' DG A 21 9.686 -1.419 -4.396 1.00 0.46 H new ATOM 0 H1' DG A 21 8.311 -0.015 -5.728 1.00 0.36 H new ATOM 0 H8 DG A 21 8.271 -0.183 -2.695 1.00 0.45 H new ATOM 0 H1 DG A 21 2.275 1.380 -4.180 1.00 0.47 H new ATOM 0 H21 DG A 21 2.921 -0.185 -7.239 1.00 0.57 H new ATOM 0 H22 DG A 21 1.759 0.672 -6.220 1.00 0.57 H new ATOM 682 P DG A 22 10.967 -0.686 -6.838 1.00 0.58 P ATOM 683 OP1 DG A 22 12.404 -0.589 -7.178 1.00 0.76 O ATOM 684 OP2 DG A 22 10.413 0.146 -5.745 1.00 0.89 O ATOM 685 O5' DG A 22 10.107 -0.389 -8.184 1.00 0.68 O ATOM 686 C5' DG A 22 9.493 0.902 -8.409 1.00 0.59 C ATOM 687 C4' DG A 22 8.144 0.797 -9.124 1.00 0.46 C ATOM 688 O4' DG A 22 7.068 1.181 -8.262 1.00 0.46 O ATOM 689 C3' DG A 22 8.012 1.677 -10.357 1.00 0.44 C ATOM 690 O3' DG A 22 8.509 1.015 -11.526 1.00 0.60 O ATOM 691 C2' DG A 22 6.518 1.918 -10.452 1.00 0.42 C ATOM 692 C1' DG A 22 5.963 1.558 -9.093 1.00 0.42 C ATOM 693 N9 DG A 22 5.111 2.559 -8.434 1.00 0.38 N ATOM 694 C8 DG A 22 3.843 2.942 -8.738 1.00 0.46 C ATOM 695 N7 DG A 22 3.180 3.593 -7.848 1.00 0.45 N ATOM 696 C5 DG A 22 4.102 3.673 -6.807 1.00 0.34 C ATOM 697 C6 DG A 22 3.973 4.270 -5.525 1.00 0.31 C ATOM 698 O6 DG A 22 2.999 4.847 -5.048 1.00 0.38 O ATOM 699 N1 DG A 22 5.134 4.127 -4.779 1.00 0.27 N ATOM 700 C2 DG A 22 6.285 3.486 -5.214 1.00 0.29 C ATOM 701 N2 DG A 22 7.312 3.446 -4.365 1.00 0.37 N ATOM 702 N3 DG A 22 6.408 2.923 -6.417 1.00 0.30 N ATOM 703 C4 DG A 22 5.289 3.051 -7.159 1.00 0.31 C ATOM 0 H5' DG A 22 10.166 1.522 -9.001 1.00 0.59 H new ATOM 0 H5'' DG A 22 9.354 1.406 -7.452 1.00 0.59 H new ATOM 0 H4' DG A 22 8.095 -0.251 -9.420 1.00 0.46 H new ATOM 0 H3' DG A 22 8.589 2.599 -10.286 1.00 0.44 H new ATOM 0 H2' DG A 22 6.303 2.957 -10.701 1.00 0.42 H new ATOM 0 H2'' DG A 22 6.070 1.304 -11.234 1.00 0.42 H new ATOM 0 HO3' DG A 22 8.409 1.604 -12.303 1.00 0.60 H new ATOM 0 H1' DG A 22 5.264 0.737 -9.254 1.00 0.42 H new ATOM 0 H8 DG A 22 3.405 2.707 -9.697 1.00 0.46 H new ATOM 0 H1 DG A 22 5.142 4.523 -3.839 1.00 0.27 H new ATOM 0 H21 DG A 22 8.181 2.986 -4.637 1.00 0.37 H new ATOM 0 H22 DG A 22 7.229 3.875 -3.443 1.00 0.37 H new TER 716 DG A 22 HETATM 717 RU3 RUL A 101 -6.116 -3.339 5.038 1.00 0.00 RU HETATM 718 RU4 RUL A 101 1.404 -9.353 -3.441 1.00 0.00 RU HETATM 719 N15 RUL A 101 -4.200 -2.933 4.522 1.00 0.00 N HETATM 720 C65 RUL A 101 -3.306 -2.120 5.178 1.00 0.00 C HETATM 721 C66 RUL A 101 -1.910 -2.098 4.888 1.00 0.00 C HETATM 722 C67 RUL A 101 -1.384 -2.943 3.837 1.00 0.00 C HETATM 723 C68 RUL A 101 -2.302 -3.727 3.062 1.00 0.00 C HETATM 724 C69 RUL A 101 -3.719 -3.749 3.501 1.00 0.00 C HETATM 725 C70 RUL A 101 -1.962 -4.536 1.842 1.00 0.00 C HETATM 726 N16 RUL A 101 -0.624 -4.782 1.290 1.00 0.00 N HETATM 727 N17 RUL A 101 -5.989 -4.510 3.425 1.00 0.00 N HETATM 728 C71 RUL A 101 -6.975 -5.346 2.895 1.00 0.00 C HETATM 729 C72 RUL A 101 -6.707 -6.269 1.876 1.00 0.00 C HETATM 730 C73 RUL A 101 -5.369 -6.336 1.370 1.00 0.00 C HETATM 731 C74 RUL A 101 -4.350 -5.419 1.821 1.00 0.00 C HETATM 732 C75 RUL A 101 -4.683 -4.587 2.902 1.00 0.00 C HETATM 733 C76 RUL A 101 -3.061 -5.274 1.200 1.00 0.00 C HETATM 734 N18 RUL A 101 -2.889 -5.897 0.001 1.00 0.00 N HETATM 735 N19 RUL A 101 -8.056 -3.973 5.591 1.00 0.00 N HETATM 736 C77 RUL A 101 -9.228 -3.695 4.987 1.00 0.00 C HETATM 737 C78 RUL A 101 -10.485 -3.883 5.707 1.00 0.00 C HETATM 738 C79 RUL A 101 -10.414 -4.642 6.822 1.00 0.00 C HETATM 739 C80 RUL A 101 -9.232 -5.049 7.466 1.00 0.00 C HETATM 740 C81 RUL A 101 -7.996 -4.803 6.702 1.00 0.00 C HETATM 741 N20 RUL A 101 -5.696 -4.974 6.147 1.00 0.00 N HETATM 742 C82 RUL A 101 -4.609 -5.867 5.932 1.00 0.00 C HETATM 743 C83 RUL A 101 -4.670 -7.221 6.549 1.00 0.00 C HETATM 744 C84 RUL A 101 -5.631 -7.384 7.537 1.00 0.00 C HETATM 745 C85 RUL A 101 -6.506 -6.415 7.949 1.00 0.00 C HETATM 746 C86 RUL A 101 -6.762 -5.376 6.980 1.00 0.00 C HETATM 747 N21 RUL A 101 -6.852 -1.739 4.112 1.00 0.00 N HETATM 748 C87 RUL A 101 -7.208 -1.725 2.756 1.00 0.00 C HETATM 749 C88 RUL A 101 -8.424 -1.213 2.333 1.00 0.00 C HETATM 750 C89 RUL A 101 -9.300 -0.760 3.334 1.00 0.00 C HETATM 751 C90 RUL A 101 -8.896 -0.423 4.610 1.00 0.00 C HETATM 752 C91 RUL A 101 -7.666 -0.966 5.045 1.00 0.00 C HETATM 753 N22 RUL A 101 -6.233 -1.953 6.610 1.00 0.00 N HETATM 754 C92 RUL A 101 -5.676 -2.145 7.892 1.00 0.00 C HETATM 755 C93 RUL A 101 -5.953 -1.168 8.950 1.00 0.00 C HETATM 756 C94 RUL A 101 -6.781 -0.163 8.631 1.00 0.00 C HETATM 757 C95 RUL A 101 -7.425 0.017 7.389 1.00 0.00 C HETATM 758 C96 RUL A 101 -7.099 -0.954 6.368 1.00 0.00 C HETATM 759 N23 RUL A 101 1.814 -7.707 -2.299 1.00 0.00 N HETATM 760 C97 RUL A 101 3.068 -7.268 -1.861 1.00 0.00 C HETATM 761 C98 RUL A 101 3.271 -6.414 -0.736 1.00 0.00 C HETATM 762 C99 RUL A 101 2.173 -5.882 -0.049 1.00 0.00 C HETATM 763 C100 RUL A 101 0.839 -6.293 -0.399 1.00 0.00 C HETATM 764 C101 RUL A 101 0.709 -7.323 -1.454 1.00 0.00 C HETATM 765 C102 RUL A 101 -0.466 -5.788 0.199 1.00 0.00 C HETATM 766 N24 RUL A 101 -0.525 -8.996 -2.695 1.00 0.00 N HETATM 767 C103 RUL A 101 -1.705 -9.748 -2.893 1.00 0.00 C HETATM 768 C104 RUL A 101 -2.891 -9.490 -2.183 1.00 0.00 C HETATM 769 C105 RUL A 101 -2.896 -8.444 -1.211 1.00 0.00 C HETATM 770 C106 RUL A 101 -1.677 -7.629 -1.019 1.00 0.00 C HETATM 771 C107 RUL A 101 -0.555 -7.988 -1.683 1.00 0.00 C HETATM 772 C108 RUL A 101 -1.692 -6.402 -0.253 1.00 0.00 C HETATM 773 N25 RUL A 101 3.405 -9.761 -4.009 1.00 0.00 N HETATM 774 C109 RUL A 101 3.686 -10.078 -5.257 1.00 0.00 C HETATM 775 C110 RUL A 101 5.114 -10.386 -5.588 1.00 0.00 C HETATM 776 C111 RUL A 101 5.826 -10.586 -4.498 1.00 0.00 C HETATM 777 C112 RUL A 101 5.629 -10.481 -3.244 1.00 0.00 C HETATM 778 C113 RUL A 101 4.074 -10.209 -2.958 1.00 0.00 C HETATM 779 N26 RUL A 101 2.026 -10.449 -1.882 1.00 0.00 N HETATM 780 C114 RUL A 101 1.254 -10.918 -0.973 1.00 0.00 C HETATM 781 C115 RUL A 101 1.867 -11.373 0.314 1.00 0.00 C HETATM 782 C116 RUL A 101 3.322 -11.120 0.381 1.00 0.00 C HETATM 783 C117 RUL A 101 4.030 -10.739 -0.602 1.00 0.00 C HETATM 784 C118 RUL A 101 3.526 -10.445 -1.879 1.00 0.00 C HETATM 785 N27 RUL A 101 0.879 -11.071 -4.530 1.00 0.00 N HETATM 786 C119 RUL A 101 1.130 -12.354 -4.048 1.00 0.00 C HETATM 787 C120 RUL A 101 0.317 -13.485 -4.611 1.00 0.00 C HETATM 788 C121 RUL A 101 -0.519 -13.177 -5.556 1.00 0.00 C HETATM 789 C122 RUL A 101 -0.755 -11.894 -6.112 1.00 0.00 C HETATM 790 C123 RUL A 101 0.073 -10.825 -5.544 1.00 0.00 C HETATM 791 N28 RUL A 101 0.875 -8.594 -5.259 1.00 0.00 N HETATM 792 C124 RUL A 101 1.725 -7.764 -6.102 1.00 0.00 C HETATM 793 C125 RUL A 101 1.444 -7.471 -7.392 1.00 0.00 C HETATM 794 C126 RUL A 101 0.253 -8.159 -8.030 1.00 0.00 C HETATM 795 C127 RUL A 101 -0.478 -9.098 -7.252 1.00 0.00 C HETATM 796 C128 RUL A 101 0.031 -9.511 -6.070 1.00 0.00 C HETATM 0 H88 RUL A 101 -1.436 -9.480 -7.604 1.00 0.00 H new HETATM 0 H87 RUL A 101 -0.035 -7.939 -9.058 1.00 0.00 H new HETATM 0 H86 RUL A 101 2.054 -6.764 -7.954 1.00 0.00 H new HETATM 0 H85 RUL A 101 2.638 -7.356 -5.669 1.00 0.00 H new HETATM 0 H84 RUL A 101 -1.491 -11.717 -6.896 1.00 0.00 H new HETATM 0 H83 RUL A 101 -1.106 -13.998 -5.969 1.00 0.00 H new HETATM 0 H82 RUL A 101 0.423 -14.507 -4.247 1.00 0.00 H new HETATM 0 H81 RUL A 101 1.891 -12.531 -3.288 1.00 0.00 H new HETATM 0 H80 RUL A 101 5.103 -10.633 -0.443 1.00 0.00 H new HETATM 0 H79 RUL A 101 3.821 -11.271 1.338 1.00 0.00 H new HETATM 0 H78 RUL A 101 1.300 -11.842 1.118 1.00 0.00 H new HETATM 0 H77 RUL A 101 0.178 -10.984 -1.133 1.00 0.00 H new HETATM 0 H76 RUL A 101 6.401 -10.564 -2.479 1.00 0.00 H new HETATM 0 H75 RUL A 101 6.836 -10.926 -4.726 1.00 0.00 H new HETATM 0 H74 RUL A 101 5.513 -10.438 -6.601 1.00 0.00 H new HETATM 0 H73 RUL A 101 2.908 -10.115 -6.020 1.00 0.00 H new HETATM 0 H72 RUL A 101 -3.789 -8.248 -0.617 1.00 0.00 H new HETATM 0 H71 RUL A 101 -3.790 -10.077 -2.371 1.00 0.00 H new HETATM 0 H70 RUL A 101 -1.695 -10.558 -3.623 1.00 0.00 H new HETATM 0 H69 RUL A 101 2.329 -5.157 0.750 1.00 0.00 H new HETATM 0 H68 RUL A 101 4.283 -6.175 -0.411 1.00 0.00 H new HETATM 0 H67 RUL A 101 3.946 -7.600 -2.415 1.00 0.00 H new HETATM 0 H66 RUL A 101 -8.123 0.835 7.210 1.00 0.00 H new HETATM 0 H65 RUL A 101 -6.974 0.583 9.402 1.00 0.00 H new HETATM 0 H64 RUL A 101 -5.510 -1.254 9.942 1.00 0.00 H new HETATM 0 H63 RUL A 101 -5.046 -3.011 8.094 1.00 0.00 H new HETATM 0 H62 RUL A 101 -9.494 0.227 5.248 1.00 0.00 H new HETATM 0 H61 RUL A 101 -10.358 -0.670 3.089 1.00 0.00 H new HETATM 0 H60 RUL A 101 -8.688 -1.164 1.277 1.00 0.00 H new HETATM 0 H59 RUL A 101 -6.513 -2.126 2.018 1.00 0.00 H new HETATM 0 H58 RUL A 101 -6.974 -6.427 8.934 1.00 0.00 H new HETATM 0 H57 RUL A 101 -5.694 -8.358 8.022 1.00 0.00 H new HETATM 0 H56 RUL A 101 -4.005 -8.029 6.245 1.00 0.00 H new HETATM 0 H55 RUL A 101 -3.752 -5.567 5.330 1.00 0.00 H new HETATM 0 H54 RUL A 101 -9.230 -5.511 8.453 1.00 0.00 H new HETATM 0 H53 RUL A 101 -11.357 -4.968 7.262 1.00 0.00 H new HETATM 0 H52 RUL A 101 -11.420 -3.439 5.366 1.00 0.00 H new HETATM 0 H51 RUL A 101 -9.238 -3.329 3.960 1.00 0.00 H new HETATM 0 H50 RUL A 101 -5.115 -7.095 0.630 1.00 0.00 H new HETATM 0 H49 RUL A 101 -7.491 -6.915 1.481 1.00 0.00 H new HETATM 0 H48 RUL A 101 -7.989 -5.278 3.289 1.00 0.00 H new HETATM 0 H47 RUL A 101 -0.313 -2.983 3.639 1.00 0.00 H new HETATM 0 H46 RUL A 101 -1.243 -1.449 5.455 1.00 0.00 H new HETATM 0 H45 RUL A 101 -3.683 -1.459 5.959 1.00 0.00 H new