USER MOD reduce.3.24.130724 H: found=0, std=0, add=195, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 196 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 1 PSO H3 : B 1 PSO C3 : B 12 DT C6 :(H bumps) USER MOD Single : A 1 DG O5' : rot 35:sc= 0.0635 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.78! (180deg=-1.78!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.399 USER MOD Single : B 9 DG O5' : rot -34:sc= 0.0312 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.69 (180deg=-1.69) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -1.213 -10.851 9.228 1.00 0.00 O ATOM 2 C5' DG A 1 -0.070 -11.311 9.914 1.00 0.00 C ATOM 3 C4' DG A 1 1.187 -11.012 9.091 1.00 0.00 C ATOM 4 O4' DG A 1 1.019 -11.527 7.777 1.00 0.00 O ATOM 5 C3' DG A 1 1.470 -9.508 8.970 1.00 0.00 C ATOM 6 O3' DG A 1 2.862 -9.318 9.147 1.00 0.00 O ATOM 7 C2' DG A 1 0.996 -9.209 7.551 1.00 0.00 C ATOM 8 C1' DG A 1 1.319 -10.516 6.831 1.00 0.00 C ATOM 9 N9 DG A 1 0.506 -10.723 5.610 1.00 0.00 N ATOM 10 C8 DG A 1 -0.860 -10.683 5.482 1.00 0.00 C ATOM 11 N7 DG A 1 -1.298 -10.974 4.291 1.00 0.00 N ATOM 12 C5 DG A 1 -0.140 -11.242 3.569 1.00 0.00 C ATOM 13 C6 DG A 1 0.029 -11.605 2.198 1.00 0.00 C ATOM 14 O6 DG A 1 -0.838 -11.786 1.348 1.00 0.00 O ATOM 15 N1 DG A 1 1.360 -11.758 1.843 1.00 0.00 N ATOM 16 C2 DG A 1 2.414 -11.576 2.706 1.00 0.00 C ATOM 17 N2 DG A 1 3.648 -11.737 2.242 1.00 0.00 N ATOM 18 N3 DG A 1 2.271 -11.231 3.991 1.00 0.00 N ATOM 19 C4 DG A 1 0.970 -11.083 4.363 1.00 0.00 C ATOM 0 H5' DG A 1 -0.150 -12.383 10.095 1.00 0.00 H new ATOM 0 H5'' DG A 1 -0.001 -10.828 10.888 1.00 0.00 H new ATOM 0 H4' DG A 1 2.024 -11.481 9.608 1.00 0.00 H new ATOM 0 H3' DG A 1 0.982 -8.858 9.696 1.00 0.00 H new ATOM 0 H2' DG A 1 -0.068 -8.975 7.516 1.00 0.00 H new ATOM 0 H2'' DG A 1 1.523 -8.361 7.114 1.00 0.00 H new ATOM 0 HO5' DG A 1 -1.086 -10.971 8.264 1.00 0.00 H new ATOM 0 H1' DG A 1 2.356 -10.519 6.495 1.00 0.00 H new ATOM 0 H8 DG A 1 -1.517 -10.431 6.301 1.00 0.00 H new ATOM 0 H1 DG A 1 1.571 -12.022 0.881 1.00 0.00 H new ATOM 0 H21 DG A 1 4.447 -11.608 2.863 1.00 0.00 H new ATOM 0 H22 DG A 1 3.797 -11.990 1.265 1.00 0.00 H new ATOM 32 P DC A 2 3.565 -7.868 9.113 1.00 0.00 P ATOM 33 OP1 DC A 2 4.531 -7.801 10.230 1.00 0.00 O ATOM 34 OP2 DC A 2 2.515 -6.834 8.983 1.00 0.00 O ATOM 35 O5' DC A 2 4.380 -7.937 7.727 1.00 0.00 O ATOM 36 C5' DC A 2 5.432 -8.867 7.566 1.00 0.00 C ATOM 37 C4' DC A 2 6.096 -8.715 6.195 1.00 0.00 C ATOM 38 O4' DC A 2 5.195 -9.062 5.164 1.00 0.00 O ATOM 39 C3' DC A 2 6.574 -7.283 5.933 1.00 0.00 C ATOM 40 O3' DC A 2 7.917 -7.411 5.508 1.00 0.00 O ATOM 41 C2' DC A 2 5.586 -6.762 4.875 1.00 0.00 C ATOM 42 C1' DC A 2 5.170 -8.049 4.174 1.00 0.00 C ATOM 43 N1 DC A 2 3.782 -8.012 3.643 1.00 0.00 N ATOM 44 C2 DC A 2 3.549 -8.387 2.324 1.00 0.00 C ATOM 45 O2 DC A 2 4.479 -8.607 1.554 1.00 0.00 O ATOM 46 N3 DC A 2 2.268 -8.514 1.876 1.00 0.00 N ATOM 47 C4 DC A 2 1.245 -8.243 2.696 1.00 0.00 C ATOM 48 N4 DC A 2 0.015 -8.470 2.259 1.00 0.00 N ATOM 49 C5 DC A 2 1.447 -7.888 4.065 1.00 0.00 C ATOM 50 C6 DC A 2 2.726 -7.797 4.490 1.00 0.00 C ATOM 0 H5' DC A 2 5.046 -9.880 7.676 1.00 0.00 H new ATOM 0 H5'' DC A 2 6.174 -8.721 8.351 1.00 0.00 H new ATOM 0 H4' DC A 2 6.957 -9.383 6.201 1.00 0.00 H new ATOM 0 H3' DC A 2 6.579 -6.582 6.768 1.00 0.00 H new ATOM 0 H2' DC A 2 4.736 -6.250 5.327 1.00 0.00 H new ATOM 0 H2'' DC A 2 6.056 -6.057 4.189 1.00 0.00 H new ATOM 0 H1' DC A 2 5.844 -8.211 3.333 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.785 -8.273 2.861 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.132 -8.841 1.321 1.00 0.00 H new ATOM 0 H5 DC A 2 0.616 -7.701 4.729 1.00 0.00 H new ATOM 0 H6 DC A 2 2.921 -7.549 5.523 1.00 0.00 H new ATOM 62 P DG A 3 8.895 -6.152 5.347 1.00 0.00 P ATOM 63 OP1 DG A 3 10.279 -6.653 5.212 1.00 0.00 O ATOM 64 OP2 DG A 3 8.562 -5.161 6.392 1.00 0.00 O ATOM 65 O5' DG A 3 8.399 -5.594 3.934 1.00 0.00 O ATOM 66 C5' DG A 3 8.619 -6.319 2.743 1.00 0.00 C ATOM 67 C4' DG A 3 7.942 -5.590 1.584 1.00 0.00 C ATOM 68 O4' DG A 3 6.593 -5.918 1.390 1.00 0.00 O ATOM 69 C3' DG A 3 7.991 -4.071 1.728 1.00 0.00 C ATOM 70 O3' DG A 3 8.370 -3.551 0.492 1.00 0.00 O ATOM 71 C2' DG A 3 6.548 -3.765 2.056 1.00 0.00 C ATOM 72 C1' DG A 3 5.918 -4.722 1.055 1.00 0.00 C ATOM 73 N9 DG A 3 4.508 -5.018 1.190 1.00 0.00 N ATOM 74 C8 DG A 3 3.792 -4.849 2.305 1.00 0.00 C ATOM 75 N7 DG A 3 2.550 -5.226 2.228 1.00 0.00 N ATOM 76 C5 DG A 3 2.440 -5.635 0.896 1.00 0.00 C ATOM 77 C6 DG A 3 1.303 -6.015 0.127 1.00 0.00 C ATOM 78 O6 DG A 3 0.162 -6.239 0.516 1.00 0.00 O ATOM 79 N1 DG A 3 1.589 -6.128 -1.222 1.00 0.00 N ATOM 80 C2 DG A 3 2.849 -6.050 -1.761 1.00 0.00 C ATOM 81 N2 DG A 3 2.992 -6.251 -3.065 1.00 0.00 N ATOM 82 N3 DG A 3 3.941 -5.787 -1.042 1.00 0.00 N ATOM 83 C4 DG A 3 3.655 -5.543 0.261 1.00 0.00 C ATOM 0 H5' DG A 3 8.219 -7.329 2.838 1.00 0.00 H new ATOM 0 H5'' DG A 3 9.688 -6.416 2.554 1.00 0.00 H new ATOM 0 H4' DG A 3 8.525 -5.930 0.728 1.00 0.00 H new ATOM 0 H3' DG A 3 8.682 -3.666 2.467 1.00 0.00 H new ATOM 0 H2' DG A 3 6.286 -3.992 3.089 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.280 -2.723 1.880 1.00 0.00 H new ATOM 0 H1' DG A 3 6.002 -4.296 0.055 1.00 0.00 H new ATOM 0 H8 DG A 3 4.215 -4.429 3.206 1.00 0.00 H new ATOM 0 H1 DG A 3 0.809 -6.280 -1.861 1.00 0.00 H new ATOM 0 H21 DG A 3 3.917 -6.199 -3.491 1.00 0.00 H new ATOM 0 H22 DG A 3 2.176 -6.458 -3.642 1.00 0.00 H new ATOM 95 P DT A 4 9.880 -3.572 -0.028 1.00 0.00 P ATOM 96 OP1 DT A 4 10.033 -4.696 -0.974 1.00 0.00 O ATOM 97 OP2 DT A 4 10.775 -3.444 1.142 1.00 0.00 O ATOM 98 O5' DT A 4 9.827 -2.185 -0.811 1.00 0.00 O ATOM 99 C5' DT A 4 8.694 -1.841 -1.583 1.00 0.00 C ATOM 100 C4' DT A 4 7.527 -1.215 -0.778 1.00 0.00 C ATOM 101 O4' DT A 4 6.405 -2.094 -0.654 1.00 0.00 O ATOM 102 C3' DT A 4 7.762 -0.736 0.685 1.00 0.00 C ATOM 103 O3' DT A 4 9.024 -0.071 0.882 1.00 0.00 O ATOM 104 C2' DT A 4 6.258 -0.399 0.744 1.00 0.00 C ATOM 105 C1' DT A 4 5.385 -1.291 -0.099 1.00 0.00 C ATOM 106 N1 DT A 4 4.193 -1.843 0.678 1.00 0.00 N ATOM 107 C2 DT A 4 3.184 -2.473 -0.040 1.00 0.00 C ATOM 108 O2 DT A 4 3.351 -2.836 -1.199 1.00 0.00 O ATOM 109 N3 DT A 4 1.968 -2.691 0.579 1.00 0.00 N ATOM 110 C4 DT A 4 1.581 -2.357 1.856 1.00 0.00 C ATOM 111 O4 DT A 4 0.521 -2.776 2.314 1.00 0.00 O ATOM 112 C5 DT A 4 2.488 -1.460 2.689 1.00 0.00 C ATOM 113 C7 DT A 4 2.725 -1.972 4.112 1.00 0.00 C ATOM 114 C6 DT A 4 3.804 -1.154 1.974 1.00 0.00 C ATOM 0 H5' DT A 4 8.330 -2.736 -2.088 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.000 -1.139 -2.359 1.00 0.00 H new ATOM 0 H4' DT A 4 7.379 -0.336 -1.405 1.00 0.00 H new ATOM 0 H3' DT A 4 8.069 -1.194 1.625 1.00 0.00 H new ATOM 0 H2' DT A 4 5.925 -0.460 1.780 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.117 0.633 0.424 1.00 0.00 H new ATOM 0 H1' DT A 4 4.766 -0.889 -0.901 1.00 0.00 H new ATOM 0 H3 DT A 4 1.263 -3.163 0.013 1.00 0.00 H new ATOM 0 H71 DT A 4 3.710 -1.653 4.454 1.00 0.00 H new ATOM 0 H72 DT A 4 1.961 -1.567 4.776 1.00 0.00 H new ATOM 0 H73 DT A 4 2.673 -3.061 4.120 1.00 0.00 H new ATOM 0 H6 DT A 4 4.477 -0.426 2.403 1.00 0.00 H new ATOM 127 P DA A 5 9.813 1.013 -0.065 1.00 0.00 P ATOM 128 OP1 DA A 5 11.047 0.362 -0.548 1.00 0.00 O ATOM 129 OP2 DA A 5 9.914 2.269 0.710 1.00 0.00 O ATOM 130 O5' DA A 5 8.895 1.321 -1.345 1.00 0.00 O ATOM 131 C5' DA A 5 7.750 2.114 -1.190 1.00 0.00 C ATOM 132 C4' DA A 5 6.720 1.844 -2.303 1.00 0.00 C ATOM 133 O4' DA A 5 5.423 1.575 -1.784 1.00 0.00 O ATOM 134 C3' DA A 5 6.647 3.007 -3.259 1.00 0.00 C ATOM 135 O3' DA A 5 6.451 2.640 -4.614 1.00 0.00 O ATOM 136 C2' DA A 5 5.462 3.675 -2.661 1.00 0.00 C ATOM 137 C1' DA A 5 4.549 2.639 -2.097 1.00 0.00 C ATOM 138 N9 DA A 5 3.939 3.179 -0.861 1.00 0.00 N ATOM 139 C8 DA A 5 4.578 3.770 0.194 1.00 0.00 C ATOM 140 N7 DA A 5 3.811 4.177 1.160 1.00 0.00 N ATOM 141 C5 DA A 5 2.548 3.859 0.680 1.00 0.00 C ATOM 142 C6 DA A 5 1.259 4.054 1.193 1.00 0.00 C ATOM 143 N6 DA A 5 1.044 4.459 2.438 1.00 0.00 N ATOM 144 N1 DA A 5 0.218 3.883 0.371 1.00 0.00 N ATOM 145 C2 DA A 5 0.457 3.441 -0.853 1.00 0.00 C ATOM 146 N3 DA A 5 1.596 3.133 -1.438 1.00 0.00 N ATOM 147 C4 DA A 5 2.617 3.363 -0.595 1.00 0.00 C ATOM 0 H5' DA A 5 8.031 3.167 -1.201 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.298 1.915 -0.218 1.00 0.00 H new ATOM 0 H4' DA A 5 7.062 0.956 -2.834 1.00 0.00 H new ATOM 0 H3' DA A 5 7.556 3.602 -3.342 1.00 0.00 H new ATOM 0 H2' DA A 5 5.775 4.366 -1.878 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.941 4.264 -3.416 1.00 0.00 H new ATOM 0 H1' DA A 5 3.742 2.338 -2.765 1.00 0.00 H new ATOM 0 H8 DA A 5 5.651 3.890 0.222 1.00 0.00 H new ATOM 0 H61 DA A 5 0.090 4.589 2.774 1.00 0.00 H new ATOM 0 H62 DA A 5 1.833 4.640 3.059 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.420 3.313 -1.470 1.00 0.00 H new ATOM 159 P DC A 6 6.471 3.738 -5.805 1.00 0.00 P ATOM 160 OP1 DC A 6 6.390 3.012 -7.090 1.00 0.00 O ATOM 161 OP2 DC A 6 7.611 4.645 -5.549 1.00 0.00 O ATOM 162 O5' DC A 6 5.106 4.586 -5.613 1.00 0.00 O ATOM 163 C5' DC A 6 3.849 4.047 -5.974 1.00 0.00 C ATOM 164 C4' DC A 6 2.680 4.910 -5.474 1.00 0.00 C ATOM 165 O4' DC A 6 2.523 4.851 -4.060 1.00 0.00 O ATOM 166 C3' DC A 6 2.765 6.410 -5.831 1.00 0.00 C ATOM 167 O3' DC A 6 1.707 6.715 -6.728 1.00 0.00 O ATOM 168 C2' DC A 6 2.595 7.057 -4.453 1.00 0.00 C ATOM 169 C1' DC A 6 1.781 6.008 -3.721 1.00 0.00 C ATOM 170 N1 DC A 6 1.718 6.328 -2.273 1.00 0.00 N ATOM 171 C2 DC A 6 0.489 6.673 -1.700 1.00 0.00 C ATOM 172 O2 DC A 6 -0.558 6.657 -2.344 1.00 0.00 O ATOM 173 N3 DC A 6 0.438 7.039 -0.390 1.00 0.00 N ATOM 174 C4 DC A 6 1.564 7.124 0.321 1.00 0.00 C ATOM 175 N4 DC A 6 1.487 7.407 1.612 1.00 0.00 N ATOM 176 C5 DC A 6 2.823 6.747 -0.230 1.00 0.00 C ATOM 177 C6 DC A 6 2.860 6.352 -1.515 1.00 0.00 C ATOM 0 H5' DC A 6 3.756 3.041 -5.565 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.793 3.956 -7.059 1.00 0.00 H new ATOM 0 H4' DC A 6 1.833 4.468 -5.998 1.00 0.00 H new ATOM 0 H3' DC A 6 3.675 6.744 -6.330 1.00 0.00 H new ATOM 0 H2' DC A 6 3.553 7.245 -3.968 1.00 0.00 H new ATOM 0 H2'' DC A 6 2.074 8.013 -4.511 1.00 0.00 H new ATOM 0 H1' DC A 6 0.727 5.915 -3.983 1.00 0.00 H new ATOM 0 H41 DC A 6 2.338 7.476 2.171 1.00 0.00 H new ATOM 0 H42 DC A 6 0.577 7.556 2.048 1.00 0.00 H new ATOM 0 H5 DC A 6 3.722 6.778 0.368 1.00 0.00 H new ATOM 0 H6 DC A 6 3.799 6.051 -1.954 1.00 0.00 H new ATOM 189 P DG A 7 1.341 8.220 -7.202 1.00 0.00 P ATOM 190 OP1 DG A 7 1.007 8.168 -8.641 1.00 0.00 O ATOM 191 OP2 DG A 7 2.405 9.133 -6.732 1.00 0.00 O ATOM 192 O5' DG A 7 -0.012 8.540 -6.371 1.00 0.00 O ATOM 193 C5' DG A 7 -1.201 7.828 -6.661 1.00 0.00 C ATOM 194 C4' DG A 7 -2.444 8.310 -5.902 1.00 0.00 C ATOM 195 O4' DG A 7 -2.198 8.264 -4.508 1.00 0.00 O ATOM 196 C3' DG A 7 -2.862 9.746 -6.246 1.00 0.00 C ATOM 197 O3' DG A 7 -4.279 9.821 -6.207 1.00 0.00 O ATOM 198 C2' DG A 7 -2.177 10.509 -5.130 1.00 0.00 C ATOM 199 C1' DG A 7 -2.396 9.554 -3.959 1.00 0.00 C ATOM 200 N9 DG A 7 -1.440 9.770 -2.859 1.00 0.00 N ATOM 201 C8 DG A 7 -0.080 9.897 -2.944 1.00 0.00 C ATOM 202 N7 DG A 7 0.516 10.031 -1.793 1.00 0.00 N ATOM 203 C5 DG A 7 -0.527 9.949 -0.869 1.00 0.00 C ATOM 204 C6 DG A 7 -0.516 9.980 0.559 1.00 0.00 C ATOM 205 O6 DG A 7 0.429 10.200 1.309 1.00 0.00 O ATOM 206 N1 DG A 7 -1.761 9.719 1.115 1.00 0.00 N ATOM 207 C2 DG A 7 -2.911 9.575 0.387 1.00 0.00 C ATOM 208 N2 DG A 7 -4.051 9.379 1.041 1.00 0.00 N ATOM 209 N3 DG A 7 -2.951 9.618 -0.948 1.00 0.00 N ATOM 210 C4 DG A 7 -1.724 9.766 -1.515 1.00 0.00 C ATOM 0 H5' DG A 7 -1.041 6.774 -6.434 1.00 0.00 H new ATOM 0 H5'' DG A 7 -1.397 7.897 -7.731 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.251 7.642 -6.203 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.589 10.124 -7.231 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.120 10.679 -5.333 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.630 11.486 -4.958 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.385 9.702 -3.526 1.00 0.00 H new ATOM 0 H8 DG A 7 0.453 9.887 -3.883 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.823 9.629 2.129 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.923 9.268 0.524 1.00 0.00 H new ATOM 0 H22 DG A 7 -4.054 9.339 2.060 1.00 0.00 H new ATOM 222 P DC A 8 -5.096 11.159 -6.601 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.235 10.763 -7.455 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.127 12.164 -7.090 1.00 0.00 O ATOM 225 O5' DC A 8 -5.665 11.663 -5.181 1.00 0.00 O ATOM 226 C5' DC A 8 -6.828 11.086 -4.618 1.00 0.00 C ATOM 227 C4' DC A 8 -7.016 11.568 -3.178 1.00 0.00 C ATOM 228 O4' DC A 8 -5.897 11.213 -2.394 1.00 0.00 O ATOM 229 C3' DC A 8 -7.117 13.084 -3.031 1.00 0.00 C ATOM 230 O3' DC A 8 -8.409 13.563 -3.331 1.00 0.00 O ATOM 231 C2' DC A 8 -6.771 13.256 -1.557 1.00 0.00 C ATOM 232 C1' DC A 8 -5.874 12.049 -1.246 1.00 0.00 C ATOM 233 N1 DC A 8 -4.477 12.465 -0.948 1.00 0.00 N ATOM 234 C2 DC A 8 -4.096 12.618 0.382 1.00 0.00 C ATOM 235 O2 DC A 8 -4.916 12.528 1.291 1.00 0.00 O ATOM 236 N3 DC A 8 -2.790 12.872 0.679 1.00 0.00 N ATOM 237 C4 DC A 8 -1.897 13.024 -0.304 1.00 0.00 C ATOM 238 N4 DC A 8 -0.623 13.187 0.028 1.00 0.00 N ATOM 239 C5 DC A 8 -2.266 12.929 -1.684 1.00 0.00 C ATOM 240 C6 DC A 8 -3.561 12.644 -1.952 1.00 0.00 C ATOM 0 H5' DC A 8 -6.749 9.999 -4.637 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.700 11.353 -5.215 1.00 0.00 H new ATOM 0 H4' DC A 8 -7.948 11.100 -2.860 1.00 0.00 H new ATOM 0 H3' DC A 8 -6.474 13.642 -3.711 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.252 14.197 -1.375 1.00 0.00 H new ATOM 0 H2'' DC A 8 -7.666 13.260 -0.934 1.00 0.00 H new ATOM 0 HO3' DC A 8 -8.430 14.537 -3.223 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.243 11.529 -0.362 1.00 0.00 H new ATOM 0 H41 DC A 8 0.082 13.306 -0.699 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.349 13.194 1.010 1.00 0.00 H new ATOM 0 H5 DC A 8 -1.545 13.078 -2.474 1.00 0.00 H new ATOM 0 H6 DC A 8 -3.880 12.556 -2.980 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 -0.014 13.505 9.931 1.00 0.00 O ATOM 255 C5' DG B 9 0.176 12.145 10.252 1.00 0.00 C ATOM 256 C4' DG B 9 -1.187 11.445 10.241 1.00 0.00 C ATOM 257 O4' DG B 9 -1.819 11.600 8.980 1.00 0.00 O ATOM 258 C3' DG B 9 -1.079 9.936 10.442 1.00 0.00 C ATOM 259 O3' DG B 9 -2.340 9.531 10.941 1.00 0.00 O ATOM 260 C2' DG B 9 -0.758 9.478 9.015 1.00 0.00 C ATOM 261 C1' DG B 9 -1.540 10.477 8.154 1.00 0.00 C ATOM 262 N9 DG B 9 -0.849 10.963 6.932 1.00 0.00 N ATOM 263 C8 DG B 9 0.488 11.179 6.699 1.00 0.00 C ATOM 264 N7 DG B 9 0.753 11.709 5.539 1.00 0.00 N ATOM 265 C5 DG B 9 -0.497 11.866 4.950 1.00 0.00 C ATOM 266 C6 DG B 9 -0.859 12.374 3.666 1.00 0.00 C ATOM 267 O6 DG B 9 -0.128 12.851 2.802 1.00 0.00 O ATOM 268 N1 DG B 9 -2.220 12.292 3.418 1.00 0.00 N ATOM 269 C2 DG B 9 -3.141 11.842 4.333 1.00 0.00 C ATOM 270 N2 DG B 9 -4.421 11.824 3.983 1.00 0.00 N ATOM 271 N3 DG B 9 -2.819 11.390 5.551 1.00 0.00 N ATOM 272 C4 DG B 9 -1.482 11.417 5.795 1.00 0.00 C ATOM 0 H5' DG B 9 0.642 12.049 11.232 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.848 11.677 9.532 1.00 0.00 H new ATOM 0 H4' DG B 9 -1.747 11.904 11.056 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.341 9.540 11.139 1.00 0.00 H new ATOM 0 H2' DG B 9 0.312 9.517 8.809 1.00 0.00 H new ATOM 0 H2'' DG B 9 -1.080 8.452 8.837 1.00 0.00 H new ATOM 0 HO5' DG B 9 -0.746 13.589 9.285 1.00 0.00 H new ATOM 0 H1' DG B 9 -2.422 9.950 7.792 1.00 0.00 H new ATOM 0 H8 DG B 9 1.255 10.930 7.418 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.558 12.583 2.501 1.00 0.00 H new ATOM 0 H21 DG B 9 -5.126 11.495 4.643 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.700 12.139 3.054 1.00 0.00 H new ATOM 285 P DC B 10 -2.751 7.997 11.174 1.00 0.00 P ATOM 286 OP1 DC B 10 -3.609 7.923 12.376 1.00 0.00 O ATOM 287 OP2 DC B 10 -1.532 7.165 11.084 1.00 0.00 O ATOM 288 O5' DC B 10 -3.653 7.725 9.872 1.00 0.00 O ATOM 289 C5' DC B 10 -4.923 8.331 9.725 1.00 0.00 C ATOM 290 C4' DC B 10 -5.547 7.959 8.375 1.00 0.00 C ATOM 291 O4' DC B 10 -4.817 8.577 7.318 1.00 0.00 O ATOM 292 C3' DC B 10 -5.530 6.440 8.139 1.00 0.00 C ATOM 293 O3' DC B 10 -6.747 6.084 7.534 1.00 0.00 O ATOM 294 C2' DC B 10 -4.311 6.343 7.225 1.00 0.00 C ATOM 295 C1' DC B 10 -4.446 7.595 6.368 1.00 0.00 C ATOM 296 N1 DC B 10 -3.186 7.945 5.661 1.00 0.00 N ATOM 297 C2 DC B 10 -3.206 8.536 4.399 1.00 0.00 C ATOM 298 O2 DC B 10 -4.264 8.750 3.811 1.00 0.00 O ATOM 299 N3 DC B 10 -2.021 8.885 3.803 1.00 0.00 N ATOM 300 C4 DC B 10 -0.859 8.597 4.410 1.00 0.00 C ATOM 301 N4 DC B 10 0.277 9.016 3.868 1.00 0.00 N ATOM 302 C5 DC B 10 -0.819 7.933 5.673 1.00 0.00 C ATOM 303 C6 DC B 10 -1.995 7.634 6.233 1.00 0.00 C ATOM 0 H5' DC B 10 -4.826 9.414 9.800 1.00 0.00 H new ATOM 0 H5'' DC B 10 -5.579 8.013 10.535 1.00 0.00 H new ATOM 0 H4' DC B 10 -6.580 8.305 8.391 1.00 0.00 H new ATOM 0 H3' DC B 10 -5.452 5.779 9.002 1.00 0.00 H new ATOM 0 H2' DC B 10 -3.379 6.336 7.790 1.00 0.00 H new ATOM 0 H2'' DC B 10 -4.326 5.435 6.623 1.00 0.00 H new ATOM 0 H1' DC B 10 -5.166 7.481 5.558 1.00 0.00 H new ATOM 0 H41 DC B 10 1.166 8.804 4.320 1.00 0.00 H new ATOM 0 H42 DC B 10 0.261 9.551 2.999 1.00 0.00 H new ATOM 0 H5 DC B 10 0.116 7.684 6.153 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.998 7.122 7.184 1.00 0.00 H new ATOM 315 P DG B 11 -7.178 4.558 7.305 1.00 0.00 P ATOM 316 OP1 DG B 11 -8.425 4.308 8.059 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.998 3.691 7.507 1.00 0.00 O ATOM 318 O5' DG B 11 -7.505 4.609 5.740 1.00 0.00 O ATOM 319 C5' DG B 11 -8.464 5.512 5.235 1.00 0.00 C ATOM 320 C4' DG B 11 -8.554 5.368 3.717 1.00 0.00 C ATOM 321 O4' DG B 11 -7.381 5.899 3.133 1.00 0.00 O ATOM 322 C3' DG B 11 -8.673 3.901 3.296 1.00 0.00 C ATOM 323 O3' DG B 11 -9.642 3.845 2.268 1.00 0.00 O ATOM 324 C2' DG B 11 -7.242 3.549 2.880 1.00 0.00 C ATOM 325 C1' DG B 11 -6.677 4.897 2.424 1.00 0.00 C ATOM 326 N9 DG B 11 -5.242 5.062 2.734 1.00 0.00 N ATOM 327 C8 DG B 11 -4.620 4.870 3.941 1.00 0.00 C ATOM 328 N7 DG B 11 -3.383 5.265 3.976 1.00 0.00 N ATOM 329 C5 DG B 11 -3.150 5.715 2.681 1.00 0.00 C ATOM 330 C6 DG B 11 -1.952 6.195 2.087 1.00 0.00 C ATOM 331 O6 DG B 11 -0.868 6.375 2.628 1.00 0.00 O ATOM 332 N1 DG B 11 -2.087 6.473 0.741 1.00 0.00 N ATOM 333 C2 DG B 11 -3.259 6.351 0.041 1.00 0.00 C ATOM 334 N2 DG B 11 -3.216 6.595 -1.263 1.00 0.00 N ATOM 335 N3 DG B 11 -4.400 5.902 0.586 1.00 0.00 N ATOM 336 C4 DG B 11 -4.277 5.593 1.907 1.00 0.00 C ATOM 0 H5' DG B 11 -8.190 6.534 5.498 1.00 0.00 H new ATOM 0 H5'' DG B 11 -9.436 5.316 5.687 1.00 0.00 H new ATOM 0 H4' DG B 11 -9.442 5.903 3.382 1.00 0.00 H new ATOM 0 H3' DG B 11 -9.012 3.187 4.046 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.671 3.132 3.710 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.224 2.811 2.078 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.789 4.962 1.342 1.00 0.00 H new ATOM 0 H8 DG B 11 -5.117 4.427 4.791 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.260 6.790 0.235 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.064 6.517 -1.825 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.335 6.861 -1.703 1.00 0.00 H new ATOM 348 P DT B 12 -10.223 2.455 1.710 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.534 2.723 1.080 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.110 1.438 2.777 1.00 0.00 O ATOM 351 O5' DT B 12 -9.157 2.121 0.566 1.00 0.00 O ATOM 352 C5' DT B 12 -9.121 2.869 -0.631 1.00 0.00 C ATOM 353 C4' DT B 12 -7.882 2.480 -1.434 1.00 0.00 C ATOM 354 O4' DT B 12 -6.694 2.855 -0.772 1.00 0.00 O ATOM 355 C3' DT B 12 -7.759 0.971 -1.644 1.00 0.00 C ATOM 356 O3' DT B 12 -8.477 0.626 -2.812 1.00 0.00 O ATOM 357 C2' DT B 12 -6.239 0.772 -1.705 1.00 0.00 C ATOM 358 C1' DT B 12 -5.655 2.166 -1.436 1.00 0.00 C ATOM 359 N1 DT B 12 -4.426 2.211 -0.606 1.00 0.00 N ATOM 360 C2 DT B 12 -3.434 3.163 -0.798 1.00 0.00 C ATOM 361 O2 DT B 12 -3.365 3.845 -1.815 1.00 0.00 O ATOM 362 N3 DT B 12 -2.512 3.314 0.222 1.00 0.00 N ATOM 363 C4 DT B 12 -2.477 2.622 1.405 1.00 0.00 C ATOM 364 O4 DT B 12 -1.780 3.012 2.337 1.00 0.00 O ATOM 365 C5 DT B 12 -3.317 1.359 1.547 1.00 0.00 C ATOM 366 C7 DT B 12 -4.246 1.384 2.766 1.00 0.00 C ATOM 367 C6 DT B 12 -4.231 1.121 0.364 1.00 0.00 C ATOM 0 H5' DT B 12 -9.102 3.935 -0.406 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.021 2.682 -1.217 1.00 0.00 H new ATOM 0 H4' DT B 12 -8.005 2.998 -2.385 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.183 0.324 -0.876 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.903 0.051 -0.960 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.928 0.393 -2.678 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.336 2.599 -2.384 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.783 4.013 0.079 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.138 0.794 2.556 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.727 0.963 3.627 1.00 0.00 H new ATOM 0 H73 DT B 12 -4.534 2.413 2.983 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.729 0.172 0.234 1.00 0.00 H new ATOM 380 P DA B 13 -8.812 -0.901 -3.201 1.00 0.00 P ATOM 381 OP1 DA B 13 -9.871 -0.884 -4.232 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.016 -1.665 -1.951 1.00 0.00 O ATOM 383 O5' DA B 13 -7.449 -1.398 -3.880 1.00 0.00 O ATOM 384 C5' DA B 13 -6.945 -0.761 -5.035 1.00 0.00 C ATOM 385 C4' DA B 13 -5.621 -1.416 -5.420 1.00 0.00 C ATOM 386 O4' DA B 13 -4.724 -1.378 -4.330 1.00 0.00 O ATOM 387 C3' DA B 13 -5.809 -2.879 -5.833 1.00 0.00 C ATOM 388 O3' DA B 13 -5.028 -3.142 -6.980 1.00 0.00 O ATOM 389 C2' DA B 13 -5.271 -3.585 -4.599 1.00 0.00 C ATOM 390 C1' DA B 13 -4.136 -2.651 -4.180 1.00 0.00 C ATOM 391 N9 DA B 13 -3.759 -2.869 -2.773 1.00 0.00 N ATOM 392 C8 DA B 13 -4.603 -2.847 -1.698 1.00 0.00 C ATOM 393 N7 DA B 13 -4.072 -3.295 -0.594 1.00 0.00 N ATOM 394 C5 DA B 13 -2.731 -3.445 -0.936 1.00 0.00 C ATOM 395 C6 DA B 13 -1.586 -3.715 -0.169 1.00 0.00 C ATOM 396 N6 DA B 13 -1.650 -4.064 1.112 1.00 0.00 N ATOM 397 N1 DA B 13 -0.381 -3.480 -0.702 1.00 0.00 N ATOM 398 C2 DA B 13 -0.302 -3.109 -1.970 1.00 0.00 C ATOM 399 N3 DA B 13 -1.294 -2.916 -2.838 1.00 0.00 N ATOM 400 C4 DA B 13 -2.506 -3.084 -2.240 1.00 0.00 C ATOM 0 H5' DA B 13 -6.799 0.303 -4.846 1.00 0.00 H new ATOM 0 H5'' DA B 13 -7.659 -0.844 -5.854 1.00 0.00 H new ATOM 0 H4' DA B 13 -5.223 -0.856 -6.266 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.823 -3.179 -6.098 1.00 0.00 H new ATOM 0 H2' DA B 13 -6.028 -3.684 -3.821 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.913 -4.589 -4.825 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.224 -2.796 -4.760 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.621 -2.490 -1.758 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.793 -4.251 1.633 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.556 -4.144 1.574 1.00 0.00 H new ATOM 0 H2 DA B 13 0.695 -2.941 -2.350 1.00 0.00 H new ATOM 412 P DC B 14 -5.279 -4.441 -7.902 1.00 0.00 P ATOM 413 OP1 DC B 14 -6.641 -4.320 -8.464 1.00 0.00 O ATOM 414 OP2 DC B 14 -4.926 -5.648 -7.125 1.00 0.00 O ATOM 415 O5' DC B 14 -4.221 -4.279 -9.110 1.00 0.00 O ATOM 416 C5' DC B 14 -2.963 -3.648 -8.949 1.00 0.00 C ATOM 417 C4' DC B 14 -1.940 -4.431 -8.113 1.00 0.00 C ATOM 418 O4' DC B 14 -2.252 -4.516 -6.731 1.00 0.00 O ATOM 419 C3' DC B 14 -1.698 -5.875 -8.593 1.00 0.00 C ATOM 420 O3' DC B 14 -0.415 -5.912 -9.197 1.00 0.00 O ATOM 421 C2' DC B 14 -1.772 -6.661 -7.278 1.00 0.00 C ATOM 422 C1' DC B 14 -1.437 -5.575 -6.261 1.00 0.00 C ATOM 423 N1 DC B 14 -1.684 -5.973 -4.845 1.00 0.00 N ATOM 424 C2 DC B 14 -0.604 -6.017 -3.966 1.00 0.00 C ATOM 425 O2 DC B 14 0.546 -5.818 -4.349 1.00 0.00 O ATOM 426 N3 DC B 14 -0.820 -6.286 -2.651 1.00 0.00 N ATOM 427 C4 DC B 14 -2.041 -6.603 -2.218 1.00 0.00 C ATOM 428 N4 DC B 14 -2.205 -6.816 -0.920 1.00 0.00 N ATOM 429 C5 DC B 14 -3.165 -6.620 -3.100 1.00 0.00 C ATOM 430 C6 DC B 14 -2.934 -6.307 -4.395 1.00 0.00 C ATOM 0 H5' DC B 14 -3.120 -2.675 -8.484 1.00 0.00 H new ATOM 0 H5'' DC B 14 -2.538 -3.465 -9.936 1.00 0.00 H new ATOM 0 H4' DC B 14 -1.042 -3.831 -8.258 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.394 -6.272 -9.332 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.760 -7.090 -7.111 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.058 -7.484 -7.250 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.379 -5.320 -6.207 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.126 -7.060 -0.556 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.410 -6.736 -0.286 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.155 -6.872 -2.748 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.757 -6.321 -5.094 1.00 0.00 H new ATOM 442 P DG B 15 0.070 -7.077 -10.210 1.00 0.00 P ATOM 443 OP1 DG B 15 1.066 -6.474 -11.120 1.00 0.00 O ATOM 444 OP2 DG B 15 -1.131 -7.729 -10.774 1.00 0.00 O ATOM 445 O5' DG B 15 0.838 -8.154 -9.286 1.00 0.00 O ATOM 446 C5' DG B 15 1.709 -7.748 -8.248 1.00 0.00 C ATOM 447 C4' DG B 15 2.792 -8.796 -7.924 1.00 0.00 C ATOM 448 O4' DG B 15 2.987 -8.747 -6.520 1.00 0.00 O ATOM 449 C3' DG B 15 2.456 -10.261 -8.258 1.00 0.00 C ATOM 450 O3' DG B 15 3.632 -11.049 -8.207 1.00 0.00 O ATOM 451 C2' DG B 15 1.505 -10.460 -7.101 1.00 0.00 C ATOM 452 C1' DG B 15 2.324 -9.859 -5.955 1.00 0.00 C ATOM 453 N9 DG B 15 1.480 -9.518 -4.796 1.00 0.00 N ATOM 454 C8 DG B 15 0.124 -9.410 -4.773 1.00 0.00 C ATOM 455 N7 DG B 15 -0.394 -9.240 -3.592 1.00 0.00 N ATOM 456 C5 DG B 15 0.720 -9.228 -2.754 1.00 0.00 C ATOM 457 C6 DG B 15 0.809 -9.128 -1.334 1.00 0.00 C ATOM 458 O6 DG B 15 -0.105 -9.004 -0.524 1.00 0.00 O ATOM 459 N1 DG B 15 2.116 -9.186 -0.874 1.00 0.00 N ATOM 460 C2 DG B 15 3.211 -9.376 -1.682 1.00 0.00 C ATOM 461 N2 DG B 15 4.410 -9.467 -1.121 1.00 0.00 N ATOM 462 N3 DG B 15 3.136 -9.530 -3.006 1.00 0.00 N ATOM 463 C4 DG B 15 1.870 -9.417 -3.482 1.00 0.00 C ATOM 0 H5' DG B 15 1.125 -7.547 -7.350 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.191 -6.812 -8.531 1.00 0.00 H new ATOM 0 H4' DG B 15 3.652 -8.536 -8.542 1.00 0.00 H new ATOM 0 H3' DG B 15 2.053 -10.515 -9.238 1.00 0.00 H new ATOM 0 H2' DG B 15 0.558 -9.941 -7.250 1.00 0.00 H new ATOM 0 H2'' DG B 15 1.270 -11.511 -6.935 1.00 0.00 H new ATOM 0 H1' DG B 15 3.045 -10.567 -5.546 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.477 -9.462 -5.669 1.00 0.00 H new ATOM 0 H1 DG B 15 2.275 -9.081 0.128 1.00 0.00 H new ATOM 0 H21 DG B 15 5.236 -9.608 -1.703 1.00 0.00 H new ATOM 0 H22 DG B 15 4.506 -9.396 -0.108 1.00 0.00 H new ATOM 475 P DC B 16 3.614 -12.654 -8.387 1.00 0.00 P ATOM 476 OP1 DC B 16 4.646 -13.014 -9.383 1.00 0.00 O ATOM 477 OP2 DC B 16 2.214 -13.085 -8.591 1.00 0.00 O ATOM 478 O5' DC B 16 4.093 -13.165 -6.936 1.00 0.00 O ATOM 479 C5' DC B 16 5.425 -12.952 -6.513 1.00 0.00 C ATOM 480 C4' DC B 16 5.598 -13.261 -5.027 1.00 0.00 C ATOM 481 O4' DC B 16 4.791 -12.382 -4.278 1.00 0.00 O ATOM 482 C3' DC B 16 5.167 -14.662 -4.602 1.00 0.00 C ATOM 483 O3' DC B 16 6.170 -15.623 -4.846 1.00 0.00 O ATOM 484 C2' DC B 16 4.934 -14.444 -3.112 1.00 0.00 C ATOM 485 C1' DC B 16 4.556 -12.959 -3.006 1.00 0.00 C ATOM 486 N1 DC B 16 3.127 -12.783 -2.637 1.00 0.00 N ATOM 487 C2 DC B 16 2.809 -12.632 -1.290 1.00 0.00 C ATOM 488 O2 DC B 16 3.675 -12.677 -0.421 1.00 0.00 O ATOM 489 N3 DC B 16 1.513 -12.429 -0.930 1.00 0.00 N ATOM 490 C4 DC B 16 0.551 -12.408 -1.858 1.00 0.00 C ATOM 491 N4 DC B 16 -0.685 -12.133 -1.467 1.00 0.00 N ATOM 492 C5 DC B 16 0.842 -12.578 -3.250 1.00 0.00 C ATOM 493 C6 DC B 16 2.140 -12.755 -3.590 1.00 0.00 C ATOM 0 H5' DC B 16 5.708 -11.917 -6.706 1.00 0.00 H new ATOM 0 H5'' DC B 16 6.098 -13.580 -7.097 1.00 0.00 H new ATOM 0 H4' DC B 16 6.668 -13.160 -4.847 1.00 0.00 H new ATOM 0 H3' DC B 16 4.304 -15.052 -5.142 1.00 0.00 H new ATOM 0 H2' DC B 16 4.138 -15.086 -2.735 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.828 -14.670 -2.531 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.855 -16.505 -4.558 1.00 0.00 H new ATOM 0 H1' DC B 16 5.151 -12.481 -2.228 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.442 -12.109 -2.150 1.00 0.00 H new ATOM 0 H42 DC B 16 -0.879 -11.945 -0.483 1.00 0.00 H new ATOM 0 H5 DC B 16 0.060 -12.566 -3.995 1.00 0.00 H new ATOM 0 H6 DC B 16 2.404 -12.876 -4.630 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.422 0.200 -1.487 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.672 0.111 -1.415 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.433 -0.071 -0.114 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.615 0.044 1.136 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.380 0.281 1.975 1.00 0.00 C HETATM 512 C6 PSO B 1 1.009 0.419 1.773 1.00 0.00 C HETATM 513 C7 PSO B 1 1.513 0.445 0.522 1.00 0.00 C HETATM 514 C8 PSO B 1 0.666 0.201 -0.563 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.738 0.233 -0.413 1.00 0.00 C HETATM 516 C10 PSO B 1 -1.250 0.206 0.879 1.00 0.00 C HETATM 517 C4' PSO B 1 2.113 0.042 2.711 1.00 0.00 C HETATM 518 C5' PSO B 1 3.293 0.283 1.780 1.00 0.00 C HETATM 519 O6' PSO B 1 2.773 0.454 0.451 1.00 0.00 O HETATM 520 O11 PSO B 1 -3.309 0.172 -2.460 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.921 -1.023 2.201 1.00 0.00 C HETATM 522 C13 PSO B 1 2.105 0.781 4.059 1.00 0.00 C HETATM 523 O14 PSO B 1 1.739 2.142 4.004 1.00 0.00 O HETATM 524 C15 PSO B 1 4.093 1.440 2.356 1.00 0.00 C HETATM 525 C16 PSO B 1 1.295 -0.110 -1.892 1.00 0.00 C HETATM 0 H163 PSO B 1 1.920 0.727 -2.203 1.00 0.00 H new HETATM 0 H162 PSO B 1 1.908 -1.007 -1.804 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.514 -0.275 -2.634 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.462 2.327 2.411 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.441 1.180 3.356 1.00 0.00 H new HETATM 0 H151 PSO B 1 4.951 1.644 1.715 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.420 0.266 4.732 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.099 0.708 4.499 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.967 -0.949 2.500 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.730 -2.014 1.789 1.00 0.00 H new HETATM 0 H121 PSO B 1 -2.283 -0.863 3.070 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.779 0.232 2.988 1.00 0.00 H new HETATM 0 H14 PSO B 1 1.762 2.524 4.906 1.00 0.00 H new