USER MOD reduce.3.24.130724 H: found=0, std=0, add=375, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 373 hydrogens (0 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 SER N :NH3+ 176:sc= -0.113 (180deg=-0.168) USER MOD Single : A 1 SER OG : rot -37:sc= 0.939 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.0352 X(o=-0.035,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -4.6! C(o=-4.6!,f=-11!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 MET CE :methyl 151:sc= -0.188 (180deg=-0.837) USER MOD Single : A 16 TYR OH : rot 30:sc= -0.656 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -153:sc= -0.0156 (180deg=-0.78) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0.02) USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot 180:sc= 0 USER MOD Single : B 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 18 DT C7 :methyl 150:sc= -0.203 (180deg=-0.203) USER MOD Single : B 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 18.496 -36.504 18.579 1.00 0.66 N ATOM 2 CA SER A 1 18.444 -36.686 20.057 1.00 0.50 C ATOM 3 C SER A 1 17.333 -35.815 20.635 1.00 0.47 C ATOM 4 O SER A 1 17.236 -35.642 21.850 1.00 0.65 O ATOM 5 CB SER A 1 19.790 -36.288 20.664 1.00 0.85 C ATOM 6 OG SER A 1 19.760 -36.520 22.066 1.00 1.15 O ATOM 0 H1 SER A 1 19.295 -37.044 18.191 1.00 0.66 H new ATOM 0 H2 SER A 1 17.609 -36.845 18.156 1.00 0.66 H new ATOM 0 H3 SER A 1 18.619 -35.495 18.358 1.00 0.66 H new ATOM 0 HA SER A 1 18.239 -37.730 20.294 1.00 0.50 H new ATOM 0 HB2 SER A 1 20.593 -36.865 20.205 1.00 0.85 H new ATOM 0 HB3 SER A 1 19.997 -35.237 20.462 1.00 0.85 H new ATOM 0 HG SER A 1 18.871 -36.300 22.415 1.00 1.15 H new ATOM 14 N MET A 2 16.497 -35.270 19.757 1.00 0.38 N ATOM 15 CA MET A 2 15.396 -34.418 20.192 1.00 0.35 C ATOM 16 C MET A 2 14.127 -34.740 19.409 1.00 0.30 C ATOM 17 O MET A 2 14.152 -35.527 18.462 1.00 0.43 O ATOM 18 CB MET A 2 15.763 -32.947 19.993 1.00 0.32 C ATOM 19 CG MET A 2 16.824 -32.540 21.017 1.00 0.26 C ATOM 20 SD MET A 2 17.194 -30.777 20.835 1.00 0.64 S ATOM 21 CE MET A 2 16.185 -30.188 22.217 1.00 0.89 C ATOM 0 H MET A 2 16.560 -35.402 18.747 1.00 0.38 H new ATOM 0 HA MET A 2 15.213 -34.605 21.250 1.00 0.35 H new ATOM 0 HB2 MET A 2 16.139 -32.789 18.982 1.00 0.32 H new ATOM 0 HB3 MET A 2 14.877 -32.322 20.105 1.00 0.32 H new ATOM 0 HG2 MET A 2 16.468 -32.745 22.027 1.00 0.26 H new ATOM 0 HG3 MET A 2 17.729 -33.129 20.872 1.00 0.26 H new ATOM 0 HE1 MET A 2 16.267 -29.104 22.291 1.00 0.89 H new ATOM 0 HE2 MET A 2 15.144 -30.463 22.050 1.00 0.89 H new ATOM 0 HE3 MET A 2 16.536 -30.642 23.143 1.00 0.89 H new ATOM 31 N HIS A 3 13.018 -34.127 19.811 1.00 0.30 N ATOM 32 CA HIS A 3 11.744 -34.354 19.140 1.00 0.26 C ATOM 33 C HIS A 3 11.128 -33.030 18.698 1.00 0.25 C ATOM 34 O HIS A 3 11.555 -31.959 19.130 1.00 0.25 O ATOM 35 CB HIS A 3 10.781 -35.080 20.082 1.00 0.37 C ATOM 36 CG HIS A 3 11.520 -35.509 21.321 1.00 0.44 C ATOM 37 ND1 HIS A 3 12.113 -36.757 21.432 1.00 0.85 N ATOM 38 CD2 HIS A 3 11.772 -34.867 22.508 1.00 0.41 C ATOM 39 CE1 HIS A 3 12.686 -36.827 22.648 1.00 0.88 C ATOM 40 NE2 HIS A 3 12.507 -35.701 23.345 1.00 0.56 N ATOM 0 H HIS A 3 12.976 -33.473 20.593 1.00 0.30 H new ATOM 0 HA HIS A 3 11.922 -34.970 18.258 1.00 0.26 H new ATOM 0 HB2 HIS A 3 9.952 -34.424 20.349 1.00 0.37 H new ATOM 0 HB3 HIS A 3 10.352 -35.949 19.582 1.00 0.37 H new ATOM 0 HD2 HIS A 3 11.449 -33.866 22.755 1.00 0.41 H new ATOM 0 HE1 HIS A 3 13.225 -37.688 23.015 1.00 0.88 H new ATOM 0 HE2 HIS A 3 12.838 -35.497 24.288 1.00 0.56 H new ATOM 48 N PRO A 4 10.141 -33.089 17.845 1.00 0.25 N ATOM 49 CA PRO A 4 9.447 -31.876 17.328 1.00 0.25 C ATOM 50 C PRO A 4 9.148 -30.867 18.434 1.00 0.21 C ATOM 51 O PRO A 4 9.425 -31.119 19.607 1.00 0.26 O ATOM 52 CB PRO A 4 8.156 -32.432 16.729 1.00 0.30 C ATOM 53 CG PRO A 4 8.475 -33.838 16.337 1.00 0.32 C ATOM 54 CD PRO A 4 9.575 -34.325 17.284 1.00 0.29 C ATOM 0 HA PRO A 4 10.056 -31.329 16.609 1.00 0.25 H new ATOM 0 HB2 PRO A 4 7.342 -32.401 17.453 1.00 0.30 H new ATOM 0 HB3 PRO A 4 7.839 -31.846 15.867 1.00 0.30 H new ATOM 0 HG2 PRO A 4 7.591 -34.471 16.415 1.00 0.32 H new ATOM 0 HG3 PRO A 4 8.810 -33.884 15.301 1.00 0.32 H new ATOM 0 HD2 PRO A 4 9.171 -34.969 18.066 1.00 0.29 H new ATOM 0 HD3 PRO A 4 10.331 -34.904 16.753 1.00 0.29 H new ATOM 62 N GLY A 5 8.584 -29.726 18.051 1.00 0.22 N ATOM 63 CA GLY A 5 8.255 -28.687 19.020 1.00 0.23 C ATOM 64 C GLY A 5 9.358 -27.636 19.083 1.00 0.22 C ATOM 65 O GLY A 5 9.085 -26.437 19.132 1.00 0.26 O ATOM 0 H GLY A 5 8.347 -29.499 17.085 1.00 0.22 H new ATOM 0 HA2 GLY A 5 7.311 -28.214 18.747 1.00 0.23 H new ATOM 0 HA3 GLY A 5 8.115 -29.133 20.005 1.00 0.23 H new ATOM 69 N HIS A 6 10.605 -28.096 19.081 1.00 0.25 N ATOM 70 CA HIS A 6 11.744 -27.187 19.136 1.00 0.24 C ATOM 71 C HIS A 6 12.303 -26.943 17.738 1.00 0.24 C ATOM 72 O HIS A 6 13.219 -26.142 17.557 1.00 0.43 O ATOM 73 CB HIS A 6 12.838 -27.774 20.030 1.00 0.24 C ATOM 74 CG HIS A 6 12.224 -28.736 21.009 1.00 0.20 C ATOM 75 ND1 HIS A 6 11.531 -29.865 20.602 1.00 0.19 N ATOM 76 CD2 HIS A 6 12.191 -28.753 22.382 1.00 0.28 C ATOM 77 CE1 HIS A 6 11.114 -30.508 21.707 1.00 0.23 C ATOM 78 NE2 HIS A 6 11.489 -29.872 22.821 1.00 0.30 N ATOM 0 H HIS A 6 10.851 -29.085 19.042 1.00 0.25 H new ATOM 0 HA HIS A 6 11.407 -26.237 19.551 1.00 0.24 H new ATOM 0 HB2 HIS A 6 13.584 -28.285 19.422 1.00 0.24 H new ATOM 0 HB3 HIS A 6 13.354 -26.976 20.563 1.00 0.24 H new ATOM 0 HD2 HIS A 6 12.642 -28.010 23.024 1.00 0.28 H new ATOM 0 HE1 HIS A 6 10.546 -31.426 21.696 1.00 0.23 H new ATOM 0 HE2 HIS A 6 11.301 -30.147 23.785 1.00 0.30 H new ATOM 86 N LEU A 7 11.743 -27.640 16.754 1.00 0.21 N ATOM 87 CA LEU A 7 12.193 -27.492 15.374 1.00 0.20 C ATOM 88 C LEU A 7 11.514 -26.297 14.714 1.00 0.23 C ATOM 89 O LEU A 7 10.552 -25.744 15.247 1.00 0.46 O ATOM 90 CB LEU A 7 11.875 -28.763 14.584 1.00 0.25 C ATOM 91 CG LEU A 7 12.932 -29.828 14.880 1.00 0.22 C ATOM 92 CD1 LEU A 7 13.042 -30.032 16.392 1.00 0.23 C ATOM 93 CD2 LEU A 7 12.526 -31.146 14.216 1.00 0.24 C ATOM 0 H LEU A 7 10.983 -28.308 16.884 1.00 0.21 H new ATOM 0 HA LEU A 7 13.270 -27.326 15.378 1.00 0.20 H new ATOM 0 HB2 LEU A 7 10.886 -29.133 14.853 1.00 0.25 H new ATOM 0 HB3 LEU A 7 11.854 -28.544 13.516 1.00 0.25 H new ATOM 0 HG LEU A 7 13.895 -29.503 14.487 1.00 0.22 H new ATOM 0 HD11 LEU A 7 13.795 -30.791 16.603 1.00 0.23 H new ATOM 0 HD12 LEU A 7 13.330 -29.094 16.866 1.00 0.23 H new ATOM 0 HD13 LEU A 7 12.079 -30.357 16.786 1.00 0.23 H new ATOM 0 HD21 LEU A 7 13.278 -31.906 14.426 1.00 0.24 H new ATOM 0 HD22 LEU A 7 11.563 -31.470 14.610 1.00 0.24 H new ATOM 0 HD23 LEU A 7 12.447 -31.001 13.139 1.00 0.24 H new ATOM 105 N LYS A 8 12.020 -25.904 13.549 1.00 0.23 N ATOM 106 CA LYS A 8 11.453 -24.773 12.822 1.00 0.25 C ATOM 107 C LYS A 8 11.695 -24.922 11.325 1.00 0.29 C ATOM 108 O LYS A 8 12.803 -25.239 10.894 1.00 0.56 O ATOM 109 CB LYS A 8 12.081 -23.467 13.315 1.00 0.24 C ATOM 110 CG LYS A 8 13.554 -23.423 12.906 1.00 0.29 C ATOM 111 CD LYS A 8 13.706 -22.597 11.627 1.00 0.30 C ATOM 112 CE LYS A 8 13.717 -21.107 11.976 1.00 0.40 C ATOM 113 NZ LYS A 8 15.066 -20.540 11.690 1.00 1.08 N ATOM 0 H LYS A 8 12.816 -26.348 13.091 1.00 0.23 H new ATOM 0 HA LYS A 8 10.379 -24.751 13.004 1.00 0.25 H new ATOM 0 HB2 LYS A 8 11.550 -22.614 12.893 1.00 0.24 H new ATOM 0 HB3 LYS A 8 11.991 -23.394 14.399 1.00 0.24 H new ATOM 0 HG2 LYS A 8 14.151 -22.986 13.706 1.00 0.29 H new ATOM 0 HG3 LYS A 8 13.928 -24.434 12.745 1.00 0.29 H new ATOM 0 HD2 LYS A 8 14.629 -22.868 11.115 1.00 0.30 H new ATOM 0 HD3 LYS A 8 12.886 -22.814 10.942 1.00 0.30 H new ATOM 0 HE2 LYS A 8 12.959 -20.581 11.396 1.00 0.40 H new ATOM 0 HE3 LYS A 8 13.467 -20.967 13.028 1.00 0.40 H new ATOM 0 HZ1 LYS A 8 15.074 -19.527 11.927 1.00 1.08 H new ATOM 0 HZ2 LYS A 8 15.779 -21.035 12.262 1.00 1.08 H new ATOM 0 HZ3 LYS A 8 15.287 -20.661 10.681 1.00 1.08 H new ATOM 127 N GLY A 9 10.650 -24.691 10.536 1.00 0.15 N ATOM 128 CA GLY A 9 10.761 -24.802 9.086 1.00 0.18 C ATOM 129 C GLY A 9 10.279 -26.166 8.608 1.00 0.18 C ATOM 130 O GLY A 9 9.740 -26.954 9.386 1.00 0.36 O ATOM 0 H GLY A 9 9.724 -24.428 10.873 1.00 0.15 H new ATOM 0 HA2 GLY A 9 10.173 -24.017 8.611 1.00 0.18 H new ATOM 0 HA3 GLY A 9 11.797 -24.651 8.784 1.00 0.18 H new ATOM 134 N ARG A 10 10.477 -26.439 7.323 1.00 0.21 N ATOM 135 CA ARG A 10 10.058 -27.712 6.748 1.00 0.19 C ATOM 136 C ARG A 10 10.487 -28.871 7.642 1.00 0.24 C ATOM 137 O ARG A 10 10.038 -30.004 7.464 1.00 0.52 O ATOM 138 CB ARG A 10 10.672 -27.883 5.357 1.00 0.18 C ATOM 139 CG ARG A 10 10.070 -26.849 4.403 1.00 0.28 C ATOM 140 CD ARG A 10 10.352 -27.261 2.957 1.00 0.44 C ATOM 141 NE ARG A 10 11.778 -27.504 2.770 1.00 0.63 N ATOM 142 CZ ARG A 10 12.362 -27.295 1.594 1.00 0.84 C ATOM 143 NH1 ARG A 10 11.658 -26.864 0.583 1.00 0.87 N ATOM 144 NH2 ARG A 10 13.640 -27.523 1.451 1.00 1.11 N ATOM 0 H ARG A 10 10.922 -25.801 6.663 1.00 0.21 H new ATOM 0 HA ARG A 10 8.971 -27.713 6.668 1.00 0.19 H new ATOM 0 HB2 ARG A 10 11.754 -27.760 5.408 1.00 0.18 H new ATOM 0 HB3 ARG A 10 10.483 -28.890 4.985 1.00 0.18 H new ATOM 0 HG2 ARG A 10 8.995 -26.771 4.567 1.00 0.28 H new ATOM 0 HG3 ARG A 10 10.495 -25.865 4.601 1.00 0.28 H new ATOM 0 HD2 ARG A 10 9.787 -28.160 2.711 1.00 0.44 H new ATOM 0 HD3 ARG A 10 10.017 -26.478 2.276 1.00 0.44 H new ATOM 0 HE ARG A 10 12.337 -27.840 3.555 1.00 0.63 H new ATOM 0 HH11 ARG A 10 10.660 -26.687 0.695 1.00 0.87 H new ATOM 0 HH12 ARG A 10 12.106 -26.704 -0.319 1.00 0.87 H new ATOM 0 HH21 ARG A 10 14.189 -27.861 2.241 1.00 1.11 H new ATOM 0 HH22 ARG A 10 14.089 -27.363 0.549 1.00 1.11 H new ATOM 158 N GLU A 11 11.357 -28.581 8.604 1.00 0.13 N ATOM 159 CA GLU A 11 11.838 -29.610 9.519 1.00 0.12 C ATOM 160 C GLU A 11 10.671 -30.256 10.260 1.00 0.12 C ATOM 161 O GLU A 11 10.554 -31.480 10.304 1.00 0.19 O ATOM 162 CB GLU A 11 12.808 -28.997 10.531 1.00 0.18 C ATOM 163 CG GLU A 11 14.092 -28.570 9.816 1.00 0.36 C ATOM 164 CD GLU A 11 14.671 -27.327 10.482 1.00 0.44 C ATOM 165 OE1 GLU A 11 15.076 -27.427 11.628 1.00 1.03 O ATOM 166 OE2 GLU A 11 14.701 -26.292 9.835 1.00 0.81 O ATOM 0 H GLU A 11 11.741 -27.651 8.770 1.00 0.13 H new ATOM 0 HA GLU A 11 12.353 -30.374 8.937 1.00 0.12 H new ATOM 0 HB2 GLU A 11 12.347 -28.137 11.017 1.00 0.18 H new ATOM 0 HB3 GLU A 11 13.038 -29.720 11.313 1.00 0.18 H new ATOM 0 HG2 GLU A 11 14.820 -29.380 9.844 1.00 0.36 H new ATOM 0 HG3 GLU A 11 13.883 -28.366 8.766 1.00 0.36 H new ATOM 173 N ILE A 12 9.810 -29.425 10.838 1.00 0.11 N ATOM 174 CA ILE A 12 8.655 -29.928 11.573 1.00 0.13 C ATOM 175 C ILE A 12 7.453 -30.070 10.646 1.00 0.12 C ATOM 176 O ILE A 12 6.562 -30.884 10.889 1.00 0.19 O ATOM 177 CB ILE A 12 8.307 -28.975 12.718 1.00 0.15 C ATOM 178 CG1 ILE A 12 7.078 -29.501 13.463 1.00 0.23 C ATOM 179 CG2 ILE A 12 8.005 -27.586 12.154 1.00 0.14 C ATOM 180 CD1 ILE A 12 6.764 -28.584 14.645 1.00 0.29 C ATOM 0 H ILE A 12 9.889 -28.408 10.812 1.00 0.11 H new ATOM 0 HA ILE A 12 8.906 -30.908 11.980 1.00 0.13 H new ATOM 0 HB ILE A 12 9.150 -28.911 13.406 1.00 0.15 H new ATOM 0 HG12 ILE A 12 6.223 -29.547 12.788 1.00 0.23 H new ATOM 0 HG13 ILE A 12 7.261 -30.516 13.816 1.00 0.23 H new ATOM 0 HG21 ILE A 12 7.757 -26.908 12.971 1.00 0.14 H new ATOM 0 HG22 ILE A 12 8.880 -27.211 11.623 1.00 0.14 H new ATOM 0 HG23 ILE A 12 7.162 -27.648 11.466 1.00 0.14 H new ATOM 0 HD11 ILE A 12 5.889 -28.960 15.175 1.00 0.29 H new ATOM 0 HD12 ILE A 12 7.616 -28.561 15.324 1.00 0.29 H new ATOM 0 HD13 ILE A 12 6.563 -27.577 14.281 1.00 0.29 H new ATOM 192 N GLY A 13 7.437 -29.275 9.582 1.00 0.13 N ATOM 193 CA GLY A 13 6.339 -29.320 8.623 1.00 0.11 C ATOM 194 C GLY A 13 6.282 -30.672 7.921 1.00 0.13 C ATOM 195 O GLY A 13 5.281 -31.013 7.290 1.00 0.15 O ATOM 0 H GLY A 13 8.166 -28.596 9.362 1.00 0.13 H new ATOM 0 HA2 GLY A 13 5.396 -29.132 9.136 1.00 0.11 H new ATOM 0 HA3 GLY A 13 6.464 -28.528 7.885 1.00 0.11 H new ATOM 199 N MET A 14 7.362 -31.440 8.033 1.00 0.16 N ATOM 200 CA MET A 14 7.422 -32.753 7.401 1.00 0.18 C ATOM 201 C MET A 14 7.590 -33.849 8.449 1.00 0.17 C ATOM 202 O MET A 14 6.988 -34.918 8.345 1.00 0.20 O ATOM 203 CB MET A 14 8.590 -32.804 6.415 1.00 0.23 C ATOM 204 CG MET A 14 8.221 -32.033 5.147 1.00 0.21 C ATOM 205 SD MET A 14 8.397 -30.257 5.449 1.00 0.36 S ATOM 206 CE MET A 14 6.820 -29.746 4.724 1.00 0.34 C ATOM 0 H MET A 14 8.201 -31.178 8.551 1.00 0.16 H new ATOM 0 HA MET A 14 6.487 -32.920 6.867 1.00 0.18 H new ATOM 0 HB2 MET A 14 9.482 -32.373 6.869 1.00 0.23 H new ATOM 0 HB3 MET A 14 8.827 -33.839 6.168 1.00 0.23 H new ATOM 0 HG2 MET A 14 8.865 -32.338 4.322 1.00 0.21 H new ATOM 0 HG3 MET A 14 7.197 -32.263 4.853 1.00 0.21 H new ATOM 0 HE1 MET A 14 6.469 -28.840 5.218 1.00 0.34 H new ATOM 0 HE2 MET A 14 6.955 -29.550 3.660 1.00 0.34 H new ATOM 0 HE3 MET A 14 6.085 -30.540 4.856 1.00 0.34 H new ATOM 216 N TRP A 15 8.415 -33.579 9.456 1.00 0.17 N ATOM 217 CA TRP A 15 8.656 -34.552 10.516 1.00 0.18 C ATOM 218 C TRP A 15 7.443 -35.459 10.700 1.00 0.20 C ATOM 219 O TRP A 15 7.545 -36.680 10.580 1.00 0.23 O ATOM 220 CB TRP A 15 8.961 -33.831 11.829 1.00 0.20 C ATOM 221 CG TRP A 15 9.609 -34.784 12.782 1.00 0.29 C ATOM 222 CD1 TRP A 15 8.948 -35.636 13.598 1.00 0.36 C ATOM 223 CD2 TRP A 15 11.028 -34.998 13.029 1.00 0.40 C ATOM 224 NE1 TRP A 15 9.872 -36.359 14.332 1.00 0.47 N ATOM 225 CE2 TRP A 15 11.168 -36.002 14.017 1.00 0.50 C ATOM 226 CE3 TRP A 15 12.198 -34.424 12.499 1.00 0.48 C ATOM 227 CZ2 TRP A 15 12.421 -36.422 14.462 1.00 0.63 C ATOM 228 CZ3 TRP A 15 13.462 -34.844 12.945 1.00 0.63 C ATOM 229 CH2 TRP A 15 13.573 -35.841 13.925 1.00 0.68 C ATOM 0 H TRP A 15 8.924 -32.701 9.560 1.00 0.17 H new ATOM 0 HA TRP A 15 9.512 -35.164 10.231 1.00 0.18 H new ATOM 0 HB2 TRP A 15 9.618 -32.981 11.645 1.00 0.20 H new ATOM 0 HB3 TRP A 15 8.042 -33.436 12.262 1.00 0.20 H new ATOM 0 HD1 TRP A 15 7.875 -35.736 13.666 1.00 0.36 H new ATOM 0 HE1 TRP A 15 9.626 -37.069 15.022 1.00 0.47 H new ATOM 0 HE3 TRP A 15 12.124 -33.655 11.744 1.00 0.48 H new ATOM 0 HZ2 TRP A 15 12.501 -37.191 15.216 1.00 0.63 H new ATOM 0 HZ3 TRP A 15 14.353 -34.397 12.531 1.00 0.63 H new ATOM 0 HH2 TRP A 15 14.548 -36.159 14.264 1.00 0.68 H new ATOM 240 N TYR A 16 6.297 -34.853 10.992 1.00 0.24 N ATOM 241 CA TYR A 16 5.071 -35.617 11.192 1.00 0.26 C ATOM 242 C TYR A 16 3.876 -34.680 11.350 1.00 0.28 C ATOM 243 O TYR A 16 3.080 -34.823 12.279 1.00 0.34 O ATOM 244 CB TYR A 16 5.205 -36.504 12.432 1.00 0.28 C ATOM 245 CG TYR A 16 4.885 -35.703 13.673 1.00 0.31 C ATOM 246 CD1 TYR A 16 5.400 -34.409 13.824 1.00 0.31 C ATOM 247 CD2 TYR A 16 4.074 -36.255 14.672 1.00 0.41 C ATOM 248 CE1 TYR A 16 5.102 -33.668 14.975 1.00 0.33 C ATOM 249 CE2 TYR A 16 3.777 -35.514 15.821 1.00 0.45 C ATOM 250 CZ TYR A 16 4.291 -34.221 15.974 1.00 0.38 C ATOM 251 OH TYR A 16 3.997 -33.490 17.107 1.00 0.44 O ATOM 0 H TYR A 16 6.191 -33.844 11.095 1.00 0.24 H new ATOM 0 HA TYR A 16 4.907 -36.246 10.317 1.00 0.26 H new ATOM 0 HB2 TYR A 16 4.530 -37.357 12.355 1.00 0.28 H new ATOM 0 HB3 TYR A 16 6.217 -36.903 12.497 1.00 0.28 H new ATOM 0 HD1 TYR A 16 6.026 -33.983 13.054 1.00 0.31 H new ATOM 0 HD2 TYR A 16 3.678 -37.253 14.556 1.00 0.41 H new ATOM 0 HE1 TYR A 16 5.498 -32.670 15.092 1.00 0.33 H new ATOM 0 HE2 TYR A 16 3.151 -35.940 16.591 1.00 0.45 H new ATOM 0 HH TYR A 16 3.991 -32.535 16.888 1.00 0.44 H new ATOM 261 N ALA A 17 3.760 -33.721 10.435 1.00 0.27 N ATOM 262 CA ALA A 17 2.662 -32.760 10.474 1.00 0.30 C ATOM 263 C ALA A 17 1.457 -33.343 11.206 1.00 0.18 C ATOM 264 O ALA A 17 0.907 -34.366 10.799 1.00 0.20 O ATOM 265 CB ALA A 17 2.257 -32.373 9.051 1.00 0.40 C ATOM 0 H ALA A 17 4.410 -33.589 9.660 1.00 0.27 H new ATOM 0 HA ALA A 17 3.002 -31.874 11.011 1.00 0.30 H new ATOM 0 HB1 ALA A 17 1.437 -31.656 9.088 1.00 0.40 H new ATOM 0 HB2 ALA A 17 3.109 -31.924 8.540 1.00 0.40 H new ATOM 0 HB3 ALA A 17 1.936 -33.263 8.509 1.00 0.40 H new ATOM 271 N LYS A 18 1.054 -32.684 12.287 1.00 0.19 N ATOM 272 CA LYS A 18 -0.086 -33.145 13.072 1.00 0.19 C ATOM 273 C LYS A 18 -1.388 -32.926 12.308 1.00 0.18 C ATOM 274 O LYS A 18 -2.454 -33.365 12.741 1.00 0.42 O ATOM 275 CB LYS A 18 -0.143 -32.390 14.402 1.00 0.34 C ATOM 276 CG LYS A 18 0.326 -33.307 15.533 1.00 0.35 C ATOM 277 CD LYS A 18 0.105 -32.612 16.879 1.00 0.42 C ATOM 278 CE LYS A 18 0.853 -33.372 17.975 1.00 0.51 C ATOM 279 NZ LYS A 18 -0.025 -34.445 18.524 1.00 0.80 N ATOM 0 H LYS A 18 1.496 -31.835 12.638 1.00 0.19 H new ATOM 0 HA LYS A 18 0.036 -34.211 13.262 1.00 0.19 H new ATOM 0 HB2 LYS A 18 0.487 -31.502 14.355 1.00 0.34 H new ATOM 0 HB3 LYS A 18 -1.160 -32.049 14.595 1.00 0.34 H new ATOM 0 HG2 LYS A 18 -0.223 -34.248 15.503 1.00 0.35 H new ATOM 0 HG3 LYS A 18 1.381 -33.549 15.406 1.00 0.35 H new ATOM 0 HD2 LYS A 18 0.458 -31.582 16.831 1.00 0.42 H new ATOM 0 HD3 LYS A 18 -0.960 -32.574 17.110 1.00 0.42 H new ATOM 0 HE2 LYS A 18 1.768 -33.807 17.572 1.00 0.51 H new ATOM 0 HE3 LYS A 18 1.149 -32.687 18.770 1.00 0.51 H new ATOM 0 HZ1 LYS A 18 0.483 -34.962 19.269 1.00 0.80 H new ATOM 0 HZ2 LYS A 18 -0.886 -34.019 18.923 1.00 0.80 H new ATOM 0 HZ3 LYS A 18 -0.286 -35.103 17.762 1.00 0.80 H new ATOM 293 N LYS A 19 -1.295 -32.246 11.170 1.00 0.29 N ATOM 294 CA LYS A 19 -2.475 -31.975 10.356 1.00 0.36 C ATOM 295 C LYS A 19 -3.512 -31.197 11.161 1.00 0.39 C ATOM 296 O LYS A 19 -3.203 -30.161 11.748 1.00 0.68 O ATOM 297 CB LYS A 19 -3.082 -33.291 9.867 1.00 0.36 C ATOM 298 CG LYS A 19 -3.922 -33.030 8.614 1.00 0.48 C ATOM 299 CD LYS A 19 -3.123 -33.427 7.372 1.00 0.42 C ATOM 300 CE LYS A 19 -3.571 -32.576 6.182 1.00 0.35 C ATOM 301 NZ LYS A 19 -5.060 -32.485 6.168 1.00 0.62 N ATOM 0 H LYS A 19 -0.423 -31.875 10.793 1.00 0.29 H new ATOM 0 HA LYS A 19 -2.175 -31.374 9.498 1.00 0.36 H new ATOM 0 HB2 LYS A 19 -2.292 -34.008 9.645 1.00 0.36 H new ATOM 0 HB3 LYS A 19 -3.702 -33.731 10.648 1.00 0.36 H new ATOM 0 HG2 LYS A 19 -4.850 -33.600 8.660 1.00 0.48 H new ATOM 0 HG3 LYS A 19 -4.197 -31.977 8.561 1.00 0.48 H new ATOM 0 HD2 LYS A 19 -2.057 -33.286 7.552 1.00 0.42 H new ATOM 0 HD3 LYS A 19 -3.273 -34.484 7.153 1.00 0.42 H new ATOM 0 HE2 LYS A 19 -3.136 -31.579 6.250 1.00 0.35 H new ATOM 0 HE3 LYS A 19 -3.214 -33.017 5.251 1.00 0.35 H new ATOM 0 HZ1 LYS A 19 -5.389 -32.333 5.193 1.00 0.62 H new ATOM 0 HZ2 LYS A 19 -5.465 -33.369 6.536 1.00 0.62 H new ATOM 0 HZ3 LYS A 19 -5.365 -31.690 6.765 1.00 0.62 H new ATOM 315 N GLN A 20 -4.741 -31.701 11.182 1.00 0.54 N ATOM 316 CA GLN A 20 -5.813 -31.043 11.920 1.00 0.74 C ATOM 317 C GLN A 20 -5.899 -31.590 13.342 1.00 1.25 C ATOM 318 O GLN A 20 -5.178 -32.528 13.639 1.00 1.32 O ATOM 319 CB GLN A 20 -7.149 -31.258 11.205 1.00 0.34 C ATOM 320 CG GLN A 20 -6.890 -31.647 9.747 1.00 0.39 C ATOM 321 CD GLN A 20 -8.187 -31.573 8.948 1.00 0.50 C ATOM 322 OE1 GLN A 20 -8.728 -30.487 8.738 1.00 0.87 O ATOM 323 NE2 GLN A 20 -8.723 -32.670 8.486 1.00 0.59 N ATOM 324 OXT GLN A 20 -6.684 -31.062 14.112 1.00 1.77 O ATOM 0 H GLN A 20 -5.019 -32.556 10.701 1.00 0.54 H new ATOM 0 HA GLN A 20 -5.595 -29.976 11.966 1.00 0.74 H new ATOM 0 HB2 GLN A 20 -7.720 -32.040 11.705 1.00 0.34 H new ATOM 0 HB3 GLN A 20 -7.748 -30.348 11.249 1.00 0.34 H new ATOM 0 HG2 GLN A 20 -6.146 -30.980 9.311 1.00 0.39 H new ATOM 0 HG3 GLN A 20 -6.481 -32.656 9.699 1.00 0.39 H new ATOM 0 HE21 GLN A 20 -8.274 -33.569 8.660 1.00 0.59 H new ATOM 0 HE22 GLN A 20 -9.590 -32.628 7.951 1.00 0.59 H new TER 333 GLN A 20 ATOM 334 O5' DT B 1 22.526 -15.879 4.333 1.00 0.63 O ATOM 335 C5' DT B 1 22.673 -16.560 3.085 1.00 0.51 C ATOM 336 C4' DT B 1 23.185 -17.985 3.287 1.00 0.39 C ATOM 337 O4' DT B 1 24.460 -17.951 3.935 1.00 0.45 O ATOM 338 C3' DT B 1 22.263 -18.860 4.145 1.00 0.33 C ATOM 339 O3' DT B 1 22.035 -20.106 3.477 1.00 0.27 O ATOM 340 C2' DT B 1 23.051 -19.100 5.426 1.00 0.42 C ATOM 341 C1' DT B 1 24.478 -18.966 4.933 1.00 0.43 C ATOM 342 N1 DT B 1 25.446 -18.562 5.971 1.00 0.53 N ATOM 343 C2 DT B 1 26.536 -19.386 6.181 1.00 0.53 C ATOM 344 O2 DT B 1 26.708 -20.419 5.537 1.00 0.45 O ATOM 345 N3 DT B 1 27.426 -18.979 7.157 1.00 0.65 N ATOM 346 C4 DT B 1 27.319 -17.836 7.932 1.00 0.78 C ATOM 347 O4 DT B 1 28.171 -17.569 8.775 1.00 0.87 O ATOM 348 C5 DT B 1 26.148 -17.038 7.643 1.00 0.78 C ATOM 349 C7 DT B 1 25.908 -15.750 8.422 1.00 0.94 C ATOM 350 C6 DT B 1 25.267 -17.414 6.694 1.00 0.66 C ATOM 0 H5' DT B 1 23.365 -16.010 2.447 1.00 0.51 H new ATOM 0 H5'' DT B 1 21.714 -16.586 2.567 1.00 0.51 H new ATOM 0 H4' DT B 1 23.236 -18.422 2.290 1.00 0.39 H new ATOM 0 H3' DT B 1 21.294 -18.398 4.332 1.00 0.33 H new ATOM 0 H2' DT B 1 22.813 -18.367 6.197 1.00 0.42 H new ATOM 0 H2'' DT B 1 22.854 -20.085 5.850 1.00 0.42 H new ATOM 0 HO5' DT B 1 22.199 -14.969 4.173 1.00 0.63 H new ATOM 0 H1' DT B 1 24.802 -19.944 4.576 1.00 0.43 H new ATOM 0 H3 DT B 1 28.237 -19.576 7.322 1.00 0.65 H new ATOM 0 H71 DT B 1 25.368 -15.041 7.795 1.00 0.94 H new ATOM 0 H72 DT B 1 25.319 -15.968 9.313 1.00 0.94 H new ATOM 0 H73 DT B 1 26.865 -15.319 8.716 1.00 0.94 H new ATOM 0 H6 DT B 1 24.402 -16.796 6.501 1.00 0.66 H new ATOM 364 P DT B 2 21.070 -20.176 2.191 1.00 0.23 P ATOM 365 OP1 DT B 2 21.239 -21.502 1.556 1.00 0.30 O ATOM 366 OP2 DT B 2 21.271 -18.945 1.393 1.00 0.24 O ATOM 367 O5' DT B 2 19.604 -20.115 2.852 1.00 0.34 O ATOM 368 C5' DT B 2 18.928 -21.317 3.231 1.00 0.30 C ATOM 369 C4' DT B 2 18.056 -21.104 4.465 1.00 0.31 C ATOM 370 O4' DT B 2 18.882 -20.833 5.598 1.00 0.35 O ATOM 371 C3' DT B 2 17.070 -19.937 4.334 1.00 0.30 C ATOM 372 O3' DT B 2 15.747 -20.394 4.632 1.00 0.31 O ATOM 373 C2' DT B 2 17.519 -18.936 5.395 1.00 0.31 C ATOM 374 C1' DT B 2 18.235 -19.839 6.383 1.00 0.33 C ATOM 375 N1 DT B 2 19.263 -19.166 7.201 1.00 0.37 N ATOM 376 C2 DT B 2 20.213 -19.966 7.807 1.00 0.48 C ATOM 377 O2 DT B 2 20.217 -21.189 7.676 1.00 0.57 O ATOM 378 N3 DT B 2 21.161 -19.311 8.570 1.00 0.55 N ATOM 379 C4 DT B 2 21.241 -17.944 8.775 1.00 0.50 C ATOM 380 O4 DT B 2 22.131 -17.467 9.476 1.00 0.57 O ATOM 381 C5 DT B 2 20.208 -17.189 8.104 1.00 0.42 C ATOM 382 C7 DT B 2 20.177 -15.671 8.245 1.00 0.48 C ATOM 383 C6 DT B 2 19.271 -17.804 7.354 1.00 0.36 C ATOM 0 H5' DT B 2 19.660 -22.099 3.432 1.00 0.30 H new ATOM 0 H5'' DT B 2 18.310 -21.664 2.403 1.00 0.30 H new ATOM 0 H4' DT B 2 17.482 -22.023 4.579 1.00 0.31 H new ATOM 0 H3' DT B 2 17.057 -19.507 3.332 1.00 0.30 H new ATOM 0 H2' DT B 2 18.180 -18.172 4.984 1.00 0.31 H new ATOM 0 H2'' DT B 2 16.676 -18.417 5.851 1.00 0.31 H new ATOM 0 H1' DT B 2 17.497 -20.221 7.088 1.00 0.33 H new ATOM 0 H3 DT B 2 21.868 -19.889 9.025 1.00 0.55 H new ATOM 0 H71 DT B 2 19.750 -15.231 7.344 1.00 0.48 H new ATOM 0 H72 DT B 2 19.567 -15.398 9.106 1.00 0.48 H new ATOM 0 H73 DT B 2 21.191 -15.298 8.386 1.00 0.48 H new ATOM 0 H6 DT B 2 18.512 -17.212 6.864 1.00 0.36 H new ATOM 396 P DG B 3 14.488 -19.405 4.469 1.00 0.32 P ATOM 397 OP1 DG B 3 14.786 -18.454 3.374 1.00 0.37 O ATOM 398 OP2 DG B 3 14.121 -18.897 5.809 1.00 0.29 O ATOM 399 O5' DG B 3 13.324 -20.399 3.969 1.00 0.35 O ATOM 400 C5' DG B 3 13.482 -21.152 2.764 1.00 0.41 C ATOM 401 C4' DG B 3 12.152 -21.718 2.277 1.00 0.38 C ATOM 402 O4' DG B 3 11.572 -22.524 3.303 1.00 0.32 O ATOM 403 C3' DG B 3 11.124 -20.644 1.904 1.00 0.36 C ATOM 404 O3' DG B 3 10.680 -20.859 0.561 1.00 0.42 O ATOM 405 C2' DG B 3 9.963 -20.858 2.872 1.00 0.29 C ATOM 406 C1' DG B 3 10.166 -22.299 3.305 1.00 0.27 C ATOM 407 N9 DG B 3 9.667 -22.598 4.659 1.00 0.21 N ATOM 408 C8 DG B 3 10.082 -22.074 5.856 1.00 0.24 C ATOM 409 N7 DG B 3 9.439 -22.542 6.888 1.00 0.21 N ATOM 410 C5 DG B 3 8.531 -23.443 6.338 1.00 0.19 C ATOM 411 C6 DG B 3 7.560 -24.262 6.977 1.00 0.25 C ATOM 412 O6 DG B 3 7.306 -24.350 8.176 1.00 0.32 O ATOM 413 N1 DG B 3 6.851 -25.023 6.056 1.00 0.30 N ATOM 414 C2 DG B 3 7.052 -25.002 4.692 1.00 0.28 C ATOM 415 N2 DG B 3 6.273 -25.806 3.968 1.00 0.38 N ATOM 416 N3 DG B 3 7.964 -24.234 4.090 1.00 0.22 N ATOM 417 C4 DG B 3 8.666 -23.484 4.973 1.00 0.18 C ATOM 0 H5' DG B 3 14.185 -21.968 2.934 1.00 0.41 H new ATOM 0 H5'' DG B 3 13.912 -20.516 1.991 1.00 0.41 H new ATOM 0 H4' DG B 3 12.384 -22.291 1.379 1.00 0.38 H new ATOM 0 H3' DG B 3 11.531 -19.635 1.966 1.00 0.36 H new ATOM 0 H2' DG B 3 10.005 -20.170 3.716 1.00 0.29 H new ATOM 0 H2'' DG B 3 8.997 -20.711 2.388 1.00 0.29 H new ATOM 0 H1' DG B 3 9.608 -22.937 2.620 1.00 0.27 H new ATOM 0 H8 DG B 3 10.870 -21.340 5.936 1.00 0.24 H new ATOM 0 H1 DG B 3 6.127 -25.644 6.416 1.00 0.30 H new ATOM 0 H21 DG B 3 6.374 -25.835 2.953 1.00 0.38 H new ATOM 0 H22 DG B 3 5.577 -26.392 4.429 1.00 0.38 H new ATOM 429 P DG B 4 9.551 -19.914 -0.088 1.00 0.44 P ATOM 430 OP1 DG B 4 9.731 -19.914 -1.557 1.00 0.51 O ATOM 431 OP2 DG B 4 9.539 -18.632 0.653 1.00 0.43 O ATOM 432 O5' DG B 4 8.191 -20.705 0.254 1.00 0.44 O ATOM 433 C5' DG B 4 7.880 -21.928 -0.417 1.00 0.46 C ATOM 434 C4' DG B 4 6.499 -22.448 -0.026 1.00 0.42 C ATOM 435 O4' DG B 4 6.463 -22.709 1.378 1.00 0.40 O ATOM 436 C3' DG B 4 5.356 -21.473 -0.332 1.00 0.41 C ATOM 437 O3' DG B 4 4.419 -22.103 -1.212 1.00 0.45 O ATOM 438 C2' DG B 4 4.696 -21.206 1.020 1.00 0.38 C ATOM 439 C1' DG B 4 5.154 -22.402 1.835 1.00 0.36 C ATOM 440 N9 DG B 4 5.224 -22.160 3.288 1.00 0.35 N ATOM 441 C8 DG B 4 6.080 -21.349 3.985 1.00 0.43 C ATOM 442 N7 DG B 4 5.884 -21.357 5.275 1.00 0.39 N ATOM 443 C5 DG B 4 4.821 -22.236 5.446 1.00 0.29 C ATOM 444 C6 DG B 4 4.162 -22.647 6.638 1.00 0.23 C ATOM 445 O6 DG B 4 4.399 -22.306 7.795 1.00 0.24 O ATOM 446 N1 DG B 4 3.137 -23.548 6.367 1.00 0.21 N ATOM 447 C2 DG B 4 2.790 -23.994 5.106 1.00 0.24 C ATOM 448 N2 DG B 4 1.778 -24.857 5.033 1.00 0.31 N ATOM 449 N3 DG B 4 3.411 -23.608 3.989 1.00 0.25 N ATOM 450 C4 DG B 4 4.411 -22.732 4.235 1.00 0.27 C ATOM 0 H5' DG B 4 8.633 -22.678 -0.176 1.00 0.46 H new ATOM 0 H5'' DG B 4 7.919 -21.772 -1.495 1.00 0.46 H new ATOM 0 H4' DG B 4 6.347 -23.347 -0.623 1.00 0.42 H new ATOM 0 H3' DG B 4 5.703 -20.557 -0.810 1.00 0.41 H new ATOM 0 H2' DG B 4 5.027 -20.264 1.457 1.00 0.38 H new ATOM 0 H2'' DG B 4 3.610 -21.157 0.942 1.00 0.38 H new ATOM 0 H1' DG B 4 4.427 -23.203 1.697 1.00 0.36 H new ATOM 0 H8 DG B 4 6.848 -20.756 3.510 1.00 0.43 H new ATOM 0 H1 DG B 4 2.602 -23.906 7.158 1.00 0.21 H new ATOM 0 H21 DG B 4 1.480 -25.218 4.127 1.00 0.31 H new ATOM 0 H22 DG B 4 1.301 -25.156 5.883 1.00 0.31 H new ATOM 462 P DG B 5 3.030 -21.378 -1.587 1.00 0.46 P ATOM 463 OP1 DG B 5 2.619 -21.832 -2.935 1.00 0.56 O ATOM 464 OP2 DG B 5 3.174 -19.932 -1.308 1.00 0.45 O ATOM 465 O5' DG B 5 2.005 -21.999 -0.512 1.00 0.39 O ATOM 466 C5' DG B 5 1.646 -23.383 -0.567 1.00 0.43 C ATOM 467 C4' DG B 5 0.499 -23.705 0.387 1.00 0.38 C ATOM 468 O4' DG B 5 0.880 -23.373 1.727 1.00 0.35 O ATOM 469 C3' DG B 5 -0.796 -22.944 0.082 1.00 0.35 C ATOM 470 O3' DG B 5 -1.897 -23.857 0.092 1.00 0.34 O ATOM 471 C2' DG B 5 -0.935 -21.960 1.237 1.00 0.35 C ATOM 472 C1' DG B 5 -0.212 -22.700 2.346 1.00 0.35 C ATOM 473 N9 DG B 5 0.333 -21.829 3.405 1.00 0.34 N ATOM 474 C8 DG B 5 1.268 -20.834 3.301 1.00 0.34 C ATOM 475 N7 DG B 5 1.551 -20.253 4.432 1.00 0.33 N ATOM 476 C5 DG B 5 0.745 -20.909 5.357 1.00 0.33 C ATOM 477 C6 DG B 5 0.618 -20.710 6.759 1.00 0.34 C ATOM 478 O6 DG B 5 1.208 -19.900 7.470 1.00 0.36 O ATOM 479 N1 DG B 5 -0.306 -21.584 7.315 1.00 0.36 N ATOM 480 C2 DG B 5 -1.022 -22.531 6.614 1.00 0.37 C ATOM 481 N2 DG B 5 -1.867 -23.279 7.322 1.00 0.41 N ATOM 482 N3 DG B 5 -0.903 -22.720 5.296 1.00 0.36 N ATOM 483 C4 DG B 5 -0.006 -21.876 4.736 1.00 0.34 C ATOM 0 H5' DG B 5 2.512 -23.994 -0.314 1.00 0.43 H new ATOM 0 H5'' DG B 5 1.357 -23.644 -1.585 1.00 0.43 H new ATOM 0 H4' DG B 5 0.303 -24.770 0.260 1.00 0.38 H new ATOM 0 H3' DG B 5 -0.780 -22.451 -0.890 1.00 0.35 H new ATOM 0 H2' DG B 5 -0.473 -20.998 1.015 1.00 0.35 H new ATOM 0 H2'' DG B 5 -1.978 -21.763 1.486 1.00 0.35 H new ATOM 0 H1' DG B 5 -0.930 -23.359 2.834 1.00 0.35 H new ATOM 0 H8 DG B 5 1.730 -20.556 2.365 1.00 0.34 H new ATOM 0 H1 DG B 5 -0.468 -21.521 8.320 1.00 0.36 H new ATOM 0 H21 DG B 5 -2.424 -23.996 6.858 1.00 0.41 H new ATOM 0 H22 DG B 5 -1.957 -23.134 8.328 1.00 0.41 H new ATOM 495 P DT B 6 -2.187 -24.808 -1.175 1.00 0.32 P ATOM 496 OP1 DT B 6 -2.118 -23.979 -2.399 1.00 0.42 O ATOM 497 OP2 DT B 6 -3.404 -25.599 -0.889 1.00 0.37 O ATOM 498 O5' DT B 6 -0.921 -25.806 -1.170 1.00 0.30 O ATOM 499 C5' DT B 6 -0.852 -26.900 -0.249 1.00 0.33 C ATOM 500 C4' DT B 6 -1.592 -28.129 -0.774 1.00 0.27 C ATOM 501 O4' DT B 6 -2.988 -27.841 -0.890 1.00 0.25 O ATOM 502 C3' DT B 6 -1.113 -28.603 -2.153 1.00 0.23 C ATOM 503 O3' DT B 6 -0.734 -29.982 -2.080 1.00 0.24 O ATOM 504 C2' DT B 6 -2.334 -28.456 -3.058 1.00 0.21 C ATOM 505 C1' DT B 6 -3.471 -28.500 -2.053 1.00 0.20 C ATOM 506 N1 DT B 6 -4.702 -27.815 -2.492 1.00 0.18 N ATOM 507 C2 DT B 6 -5.873 -28.550 -2.490 1.00 0.18 C ATOM 508 O2 DT B 6 -5.905 -29.727 -2.141 1.00 0.19 O ATOM 509 N3 DT B 6 -7.010 -27.881 -2.907 1.00 0.20 N ATOM 510 C4 DT B 6 -7.075 -26.560 -3.316 1.00 0.27 C ATOM 511 O4 DT B 6 -8.143 -26.066 -3.668 1.00 0.33 O ATOM 512 C5 DT B 6 -5.805 -25.872 -3.283 1.00 0.28 C ATOM 513 C7 DT B 6 -5.733 -24.409 -3.711 1.00 0.37 C ATOM 514 C6 DT B 6 -4.682 -26.501 -2.882 1.00 0.23 C ATOM 0 H5' DT B 6 -1.280 -26.598 0.707 1.00 0.33 H new ATOM 0 H5'' DT B 6 0.192 -27.155 -0.065 1.00 0.33 H new ATOM 0 H4' DT B 6 -1.388 -28.920 -0.052 1.00 0.27 H new ATOM 0 H3' DT B 6 -0.254 -28.037 -2.515 1.00 0.23 H new ATOM 0 H2' DT B 6 -2.318 -27.521 -3.617 1.00 0.21 H new ATOM 0 H2'' DT B 6 -2.402 -29.263 -3.788 1.00 0.21 H new ATOM 0 H1' DT B 6 -3.748 -29.543 -1.899 1.00 0.20 H new ATOM 0 H3 DT B 6 -7.882 -28.411 -2.914 1.00 0.20 H new ATOM 0 H71 DT B 6 -4.933 -23.909 -3.165 1.00 0.37 H new ATOM 0 H72 DT B 6 -5.532 -24.352 -4.781 1.00 0.37 H new ATOM 0 H73 DT B 6 -6.682 -23.919 -3.493 1.00 0.37 H new ATOM 0 H6 DT B 6 -3.748 -25.959 -2.868 1.00 0.23 H new ATOM 527 P DG B 7 0.641 -30.417 -1.363 1.00 0.23 P ATOM 528 OP1 DG B 7 1.674 -29.409 -1.687 1.00 0.34 O ATOM 529 OP2 DG B 7 0.886 -31.846 -1.663 1.00 0.32 O ATOM 530 O5' DG B 7 0.283 -30.287 0.202 1.00 0.24 O ATOM 531 C5' DG B 7 1.316 -30.060 1.163 1.00 0.21 C ATOM 532 C4' DG B 7 0.832 -30.331 2.585 1.00 0.22 C ATOM 533 O4' DG B 7 1.893 -30.071 3.504 1.00 0.25 O ATOM 534 C3' DG B 7 -0.363 -29.472 3.008 1.00 0.19 C ATOM 535 O3' DG B 7 -1.423 -30.324 3.458 1.00 0.20 O ATOM 536 C2' DG B 7 0.151 -28.622 4.169 1.00 0.22 C ATOM 537 C1' DG B 7 1.353 -29.421 4.649 1.00 0.20 C ATOM 538 N9 DG B 7 2.427 -28.598 5.236 1.00 0.17 N ATOM 539 C8 DG B 7 3.446 -27.943 4.597 1.00 0.21 C ATOM 540 N7 DG B 7 4.245 -27.296 5.397 1.00 0.23 N ATOM 541 C5 DG B 7 3.719 -27.538 6.661 1.00 0.19 C ATOM 542 C6 DG B 7 4.167 -27.090 7.934 1.00 0.21 C ATOM 543 O6 DG B 7 5.136 -26.377 8.193 1.00 0.28 O ATOM 544 N1 DG B 7 3.353 -27.562 8.955 1.00 0.22 N ATOM 545 C2 DG B 7 2.244 -28.363 8.777 1.00 0.23 C ATOM 546 N2 DG B 7 1.586 -28.715 9.881 1.00 0.30 N ATOM 547 N3 DG B 7 1.822 -28.785 7.581 1.00 0.20 N ATOM 548 C4 DG B 7 2.605 -28.335 6.573 1.00 0.16 C ATOM 0 H5' DG B 7 1.664 -29.030 1.087 1.00 0.21 H new ATOM 0 H5'' DG B 7 2.168 -30.702 0.940 1.00 0.21 H new ATOM 0 H4' DG B 7 0.515 -31.374 2.598 1.00 0.22 H new ATOM 0 H3' DG B 7 -0.748 -28.859 2.193 1.00 0.19 H new ATOM 0 H2' DG B 7 0.432 -27.620 3.846 1.00 0.22 H new ATOM 0 H2'' DG B 7 -0.599 -28.506 4.951 1.00 0.22 H new ATOM 0 H1' DG B 7 1.010 -30.099 5.430 1.00 0.20 H new ATOM 0 H8 DG B 7 3.576 -27.961 3.525 1.00 0.21 H new ATOM 0 H1 DG B 7 3.593 -27.296 9.910 1.00 0.22 H new ATOM 0 H21 DG B 7 0.758 -29.306 9.814 1.00 0.30 H new ATOM 0 H22 DG B 7 1.911 -28.393 10.793 1.00 0.30 H new ATOM 560 P DG B 8 -2.883 -29.721 3.770 1.00 0.23 P ATOM 561 OP1 DG B 8 -3.884 -30.785 3.535 1.00 0.36 O ATOM 562 OP2 DG B 8 -3.007 -28.425 3.069 1.00 0.28 O ATOM 563 O5' DG B 8 -2.814 -29.435 5.352 1.00 0.19 O ATOM 564 C5' DG B 8 -3.799 -28.614 5.985 1.00 0.22 C ATOM 565 C4' DG B 8 -3.468 -28.379 7.457 1.00 0.19 C ATOM 566 O4' DG B 8 -2.103 -27.999 7.587 1.00 0.19 O ATOM 567 C3' DG B 8 -4.303 -27.276 8.114 1.00 0.25 C ATOM 568 O3' DG B 8 -5.146 -27.851 9.118 1.00 0.27 O ATOM 569 C2' DG B 8 -3.280 -26.342 8.771 1.00 0.27 C ATOM 570 C1' DG B 8 -2.000 -27.165 8.731 1.00 0.22 C ATOM 571 N9 DG B 8 -0.767 -26.367 8.594 1.00 0.23 N ATOM 572 C8 DG B 8 0.030 -26.205 7.491 1.00 0.33 C ATOM 573 N7 DG B 8 1.052 -25.423 7.687 1.00 0.34 N ATOM 574 C5 DG B 8 0.929 -25.036 9.014 1.00 0.26 C ATOM 575 C6 DG B 8 1.757 -24.182 9.788 1.00 0.27 C ATOM 576 O6 DG B 8 2.775 -23.586 9.434 1.00 0.32 O ATOM 577 N1 DG B 8 1.281 -24.053 11.087 1.00 0.25 N ATOM 578 C2 DG B 8 0.148 -24.671 11.578 1.00 0.23 C ATOM 579 N2 DG B 8 -0.156 -24.431 12.854 1.00 0.29 N ATOM 580 N3 DG B 8 -0.632 -25.474 10.848 1.00 0.20 N ATOM 581 C4 DG B 8 -0.182 -25.609 9.580 1.00 0.21 C ATOM 0 H5' DG B 8 -4.777 -29.088 5.902 1.00 0.22 H new ATOM 0 H5'' DG B 8 -3.863 -27.657 5.468 1.00 0.22 H new ATOM 0 H4' DG B 8 -3.691 -29.321 7.958 1.00 0.19 H new ATOM 0 H3' DG B 8 -4.939 -26.753 7.399 1.00 0.25 H new ATOM 0 H2' DG B 8 -3.176 -25.406 8.223 1.00 0.27 H new ATOM 0 H2'' DG B 8 -3.564 -26.084 9.791 1.00 0.27 H new ATOM 0 H1' DG B 8 -1.916 -27.700 9.677 1.00 0.22 H new ATOM 0 H8 DG B 8 -0.172 -26.683 6.544 1.00 0.33 H new ATOM 0 H1 DG B 8 1.808 -23.457 11.726 1.00 0.25 H new ATOM 0 H21 DG B 8 -0.982 -24.860 13.271 1.00 0.29 H new ATOM 0 H22 DG B 8 0.437 -23.818 13.413 1.00 0.29 H new ATOM 593 P DG B 9 -6.376 -27.009 9.729 1.00 0.34 P ATOM 594 OP1 DG B 9 -7.315 -27.957 10.369 1.00 0.41 O ATOM 595 OP2 DG B 9 -6.864 -26.081 8.684 1.00 0.37 O ATOM 596 O5' DG B 9 -5.672 -26.139 10.886 1.00 0.33 O ATOM 597 C5' DG B 9 -5.344 -26.735 12.144 1.00 0.36 C ATOM 598 C4' DG B 9 -4.870 -25.692 13.152 1.00 0.33 C ATOM 599 O4' DG B 9 -3.684 -25.059 12.666 1.00 0.36 O ATOM 600 C3' DG B 9 -5.895 -24.587 13.428 1.00 0.28 C ATOM 601 O3' DG B 9 -6.042 -24.417 14.842 1.00 0.35 O ATOM 602 C2' DG B 9 -5.272 -23.333 12.823 1.00 0.26 C ATOM 603 C1' DG B 9 -3.794 -23.661 12.915 1.00 0.30 C ATOM 604 N9 DG B 9 -2.949 -22.956 11.932 1.00 0.28 N ATOM 605 C8 DG B 9 -3.013 -22.984 10.561 1.00 0.30 C ATOM 606 N7 DG B 9 -2.108 -22.250 9.975 1.00 0.30 N ATOM 607 C5 DG B 9 -1.392 -21.695 11.030 1.00 0.27 C ATOM 608 C6 DG B 9 -0.280 -20.807 11.010 1.00 0.29 C ATOM 609 O6 DG B 9 0.296 -20.332 10.035 1.00 0.30 O ATOM 610 N1 DG B 9 0.142 -20.491 12.295 1.00 0.34 N ATOM 611 C2 DG B 9 -0.432 -20.969 13.456 1.00 0.38 C ATOM 612 N2 DG B 9 0.110 -20.554 14.600 1.00 0.47 N ATOM 613 N3 DG B 9 -1.475 -21.802 13.475 1.00 0.35 N ATOM 614 C4 DG B 9 -1.900 -22.122 12.231 1.00 0.29 C ATOM 0 H5' DG B 9 -4.565 -27.484 12.001 1.00 0.36 H new ATOM 0 H5'' DG B 9 -6.217 -27.255 12.540 1.00 0.36 H new ATOM 0 H4' DG B 9 -4.700 -26.236 14.081 1.00 0.33 H new ATOM 0 H3' DG B 9 -6.878 -24.809 13.013 1.00 0.28 H new ATOM 0 H2' DG B 9 -5.593 -23.170 11.794 1.00 0.26 H new ATOM 0 H2'' DG B 9 -5.529 -22.435 13.384 1.00 0.26 H new ATOM 0 H1' DG B 9 -3.440 -23.348 13.897 1.00 0.30 H new ATOM 0 H8 DG B 9 -3.746 -23.561 10.017 1.00 0.30 H new ATOM 0 H1 DG B 9 0.936 -19.858 12.388 1.00 0.34 H new ATOM 0 H21 DG B 9 -0.271 -20.873 15.490 1.00 0.47 H new ATOM 0 H22 DG B 9 0.906 -19.917 14.585 1.00 0.47 H new ATOM 626 P DT B 10 -7.489 -24.549 15.537 1.00 0.31 P ATOM 627 OP1 DT B 10 -8.365 -25.333 14.637 1.00 0.32 O ATOM 628 OP2 DT B 10 -7.910 -23.205 15.990 1.00 0.44 O ATOM 629 O5' DT B 10 -7.174 -25.444 16.837 1.00 0.30 O ATOM 630 C5' DT B 10 -6.703 -26.787 16.696 1.00 0.26 C ATOM 631 C4' DT B 10 -6.497 -27.459 18.050 1.00 0.26 C ATOM 632 O4' DT B 10 -7.745 -27.536 18.743 1.00 0.25 O ATOM 633 C3' DT B 10 -5.941 -28.885 17.954 1.00 0.31 C ATOM 634 O3' DT B 10 -4.782 -28.999 18.785 1.00 0.34 O ATOM 635 C2' DT B 10 -7.056 -29.771 18.499 1.00 0.31 C ATOM 636 C1' DT B 10 -7.814 -28.803 19.389 1.00 0.26 C ATOM 637 N1 DT B 10 -9.238 -29.138 19.578 1.00 0.28 N ATOM 638 C2 DT B 10 -9.676 -29.351 20.871 1.00 0.29 C ATOM 639 O2 DT B 10 -8.922 -29.272 21.838 1.00 0.31 O ATOM 640 N3 DT B 10 -11.017 -29.660 21.014 1.00 0.33 N ATOM 641 C4 DT B 10 -11.942 -29.771 19.989 1.00 0.36 C ATOM 642 O4 DT B 10 -13.113 -30.051 20.231 1.00 0.41 O ATOM 643 C5 DT B 10 -11.392 -29.530 18.674 1.00 0.39 C ATOM 644 C7 DT B 10 -12.302 -29.618 17.453 1.00 0.51 C ATOM 645 C6 DT B 10 -10.089 -29.228 18.509 1.00 0.36 C ATOM 0 H5' DT B 10 -5.763 -26.787 16.143 1.00 0.26 H new ATOM 0 H5'' DT B 10 -7.418 -27.363 16.109 1.00 0.26 H new ATOM 0 H4' DT B 10 -5.767 -26.844 18.576 1.00 0.26 H new ATOM 0 H3' DT B 10 -5.653 -29.158 16.939 1.00 0.31 H new ATOM 0 H2' DT B 10 -7.684 -30.173 17.704 1.00 0.31 H new ATOM 0 H2'' DT B 10 -6.666 -30.621 19.058 1.00 0.31 H new ATOM 0 H1' DT B 10 -7.360 -28.830 20.380 1.00 0.26 H new ATOM 0 H3 DT B 10 -11.356 -29.821 21.962 1.00 0.33 H new ATOM 0 H71 DT B 10 -11.940 -28.940 16.680 1.00 0.51 H new ATOM 0 H72 DT B 10 -12.300 -30.639 17.070 1.00 0.51 H new ATOM 0 H73 DT B 10 -13.317 -29.338 17.735 1.00 0.51 H new ATOM 0 H6 DT B 10 -9.708 -29.053 17.514 1.00 0.36 H new ATOM 658 P DG B 11 -3.477 -29.781 18.259 1.00 0.37 P ATOM 659 OP1 DG B 11 -3.869 -31.169 17.926 1.00 0.51 O ATOM 660 OP2 DG B 11 -2.371 -29.534 19.211 1.00 0.44 O ATOM 661 O5' DG B 11 -3.144 -29.008 16.887 1.00 0.38 O ATOM 662 C5' DG B 11 -1.949 -29.293 16.156 1.00 0.41 C ATOM 663 C4' DG B 11 -0.717 -28.707 16.841 1.00 0.30 C ATOM 664 O4' DG B 11 0.423 -28.889 15.996 1.00 0.31 O ATOM 665 C3' DG B 11 -0.832 -27.209 17.141 1.00 0.28 C ATOM 666 O3' DG B 11 -0.479 -26.964 18.507 1.00 0.33 O ATOM 667 C2' DG B 11 0.187 -26.552 16.220 1.00 0.22 C ATOM 668 C1' DG B 11 1.176 -27.680 15.986 1.00 0.21 C ATOM 669 N9 DG B 11 1.883 -27.598 14.696 1.00 0.18 N ATOM 670 C8 DG B 11 1.590 -28.230 13.515 1.00 0.23 C ATOM 671 N7 DG B 11 2.405 -27.935 12.542 1.00 0.22 N ATOM 672 C5 DG B 11 3.305 -27.044 13.116 1.00 0.17 C ATOM 673 C6 DG B 11 4.421 -26.379 12.541 1.00 0.16 C ATOM 674 O6 DG B 11 4.837 -26.449 11.385 1.00 0.21 O ATOM 675 N1 DG B 11 5.063 -25.566 13.466 1.00 0.18 N ATOM 676 C2 DG B 11 4.679 -25.411 14.782 1.00 0.23 C ATOM 677 N2 DG B 11 5.420 -24.586 15.521 1.00 0.31 N ATOM 678 N3 DG B 11 3.630 -26.035 15.325 1.00 0.21 N ATOM 679 C4 DG B 11 2.992 -26.832 14.435 1.00 0.16 C ATOM 0 H5' DG B 11 -2.033 -28.887 15.148 1.00 0.41 H new ATOM 0 H5'' DG B 11 -1.832 -30.372 16.056 1.00 0.41 H new ATOM 0 H4' DG B 11 -0.621 -29.233 17.791 1.00 0.30 H new ATOM 0 H3' DG B 11 -1.841 -26.827 16.985 1.00 0.28 H new ATOM 0 H2' DG B 11 -0.266 -26.207 15.290 1.00 0.22 H new ATOM 0 H2'' DG B 11 0.658 -25.686 16.685 1.00 0.22 H new ATOM 0 H1' DG B 11 1.938 -27.625 16.763 1.00 0.21 H new ATOM 0 H8 DG B 11 0.759 -28.911 13.402 1.00 0.23 H new ATOM 0 H1 DG B 11 5.880 -25.044 13.149 1.00 0.18 H new ATOM 0 H21 DG B 11 5.186 -24.430 16.502 1.00 0.31 H new ATOM 0 H22 DG B 11 6.221 -24.110 15.106 1.00 0.31 H new ATOM 691 P DG B 12 -0.946 -25.605 19.238 1.00 0.45 P ATOM 692 OP1 DG B 12 -0.875 -25.818 20.701 1.00 0.58 O ATOM 693 OP2 DG B 12 -2.215 -25.162 18.620 1.00 0.54 O ATOM 694 O5' DG B 12 0.207 -24.558 18.825 1.00 0.40 O ATOM 695 C5' DG B 12 1.276 -24.262 19.729 1.00 0.37 C ATOM 696 C4' DG B 12 2.085 -23.051 19.267 1.00 0.27 C ATOM 697 O4' DG B 12 2.601 -23.286 17.960 1.00 0.27 O ATOM 698 C3' DG B 12 1.276 -21.752 19.203 1.00 0.25 C ATOM 699 O3' DG B 12 1.802 -20.821 20.155 1.00 0.27 O ATOM 700 C2' DG B 12 1.489 -21.218 17.784 1.00 0.20 C ATOM 701 C1' DG B 12 2.679 -22.031 17.297 1.00 0.18 C ATOM 702 N9 DG B 12 2.681 -22.288 15.843 1.00 0.19 N ATOM 703 C8 DG B 12 1.840 -23.090 15.111 1.00 0.22 C ATOM 704 N7 DG B 12 2.107 -23.111 13.837 1.00 0.22 N ATOM 705 C5 DG B 12 3.201 -22.264 13.707 1.00 0.21 C ATOM 706 C6 DG B 12 3.930 -21.895 12.546 1.00 0.25 C ATOM 707 O6 DG B 12 3.743 -22.253 11.384 1.00 0.26 O ATOM 708 N1 DG B 12 4.963 -21.018 12.850 1.00 0.31 N ATOM 709 C2 DG B 12 5.259 -20.553 14.114 1.00 0.32 C ATOM 710 N2 DG B 12 6.291 -19.715 14.210 1.00 0.41 N ATOM 711 N3 DG B 12 4.573 -20.900 15.209 1.00 0.27 N ATOM 712 C4 DG B 12 3.562 -21.755 14.931 1.00 0.21 C ATOM 0 H5' DG B 12 1.932 -25.128 19.813 1.00 0.37 H new ATOM 0 H5'' DG B 12 0.871 -24.072 20.723 1.00 0.37 H new ATOM 0 H4' DG B 12 2.872 -22.927 20.011 1.00 0.27 H new ATOM 0 H3' DG B 12 0.221 -21.906 19.428 1.00 0.25 H new ATOM 0 H2' DG B 12 0.610 -21.371 17.157 1.00 0.20 H new ATOM 0 H2'' DG B 12 1.700 -20.149 17.781 1.00 0.20 H new ATOM 0 H1' DG B 12 3.585 -21.465 17.512 1.00 0.18 H new ATOM 0 H8 DG B 12 1.030 -23.652 15.552 1.00 0.22 H new ATOM 0 H1 DG B 12 5.547 -20.693 12.080 1.00 0.31 H new ATOM 0 H21 DG B 12 6.558 -19.337 15.119 1.00 0.41 H new ATOM 0 H22 DG B 12 6.813 -19.451 13.374 1.00 0.41 H new ATOM 724 P DG B 13 1.264 -19.305 20.202 1.00 0.24 P ATOM 725 OP1 DG B 13 1.439 -18.791 21.579 1.00 0.27 O ATOM 726 OP2 DG B 13 -0.070 -19.266 19.563 1.00 0.28 O ATOM 727 O5' DG B 13 2.303 -18.535 19.243 1.00 0.23 O ATOM 728 C5' DG B 13 3.691 -18.471 19.583 1.00 0.17 C ATOM 729 C4' DG B 13 4.458 -17.550 18.640 1.00 0.15 C ATOM 730 O4' DG B 13 4.312 -18.012 17.296 1.00 0.21 O ATOM 731 C3' DG B 13 3.986 -16.094 18.679 1.00 0.20 C ATOM 732 O3' DG B 13 5.114 -15.239 18.885 1.00 0.27 O ATOM 733 C2' DG B 13 3.387 -15.842 17.298 1.00 0.25 C ATOM 734 C1' DG B 13 4.091 -16.886 16.450 1.00 0.23 C ATOM 735 N9 DG B 13 3.310 -17.352 15.290 1.00 0.28 N ATOM 736 C8 DG B 13 2.093 -17.981 15.277 1.00 0.32 C ATOM 737 N7 DG B 13 1.672 -18.292 14.084 1.00 0.35 N ATOM 738 C5 DG B 13 2.680 -17.838 13.243 1.00 0.31 C ATOM 739 C6 DG B 13 2.776 -17.900 11.827 1.00 0.33 C ATOM 740 O6 DG B 13 1.977 -18.386 11.029 1.00 0.37 O ATOM 741 N1 DG B 13 3.955 -17.324 11.372 1.00 0.31 N ATOM 742 C2 DG B 13 4.923 -16.759 12.179 1.00 0.29 C ATOM 743 N2 DG B 13 5.988 -16.253 11.559 1.00 0.32 N ATOM 744 N3 DG B 13 4.833 -16.701 13.511 1.00 0.28 N ATOM 745 C4 DG B 13 3.688 -17.259 13.971 1.00 0.28 C ATOM 0 H5' DG B 13 4.122 -19.472 19.546 1.00 0.17 H new ATOM 0 H5'' DG B 13 3.799 -18.115 20.608 1.00 0.17 H new ATOM 0 H4' DG B 13 5.494 -17.577 18.977 1.00 0.15 H new ATOM 0 H3' DG B 13 3.270 -15.903 19.478 1.00 0.20 H new ATOM 0 H2' DG B 13 2.305 -15.975 17.293 1.00 0.25 H new ATOM 0 H2'' DG B 13 3.586 -14.830 16.946 1.00 0.25 H new ATOM 0 H1' DG B 13 5.000 -16.433 16.054 1.00 0.23 H new ATOM 0 H8 DG B 13 1.533 -18.199 16.174 1.00 0.32 H new ATOM 0 H1 DG B 13 4.118 -17.318 10.365 1.00 0.31 H new ATOM 0 H21 DG B 13 6.737 -15.822 12.101 1.00 0.32 H new ATOM 0 H22 DG B 13 6.055 -16.296 10.542 1.00 0.32 H new ATOM 757 P DT B 14 6.005 -15.383 20.220 1.00 0.29 P ATOM 758 OP1 DT B 14 6.657 -16.712 20.198 1.00 0.37 O ATOM 759 OP2 DT B 14 5.171 -14.989 21.377 1.00 0.49 O ATOM 760 O5' DT B 14 7.142 -14.262 20.013 1.00 0.37 O ATOM 761 C5' DT B 14 7.979 -13.869 21.105 1.00 0.47 C ATOM 762 C4' DT B 14 9.284 -14.664 21.137 1.00 0.52 C ATOM 763 O4' DT B 14 10.099 -14.200 22.219 1.00 0.66 O ATOM 764 C3' DT B 14 9.096 -16.174 21.328 1.00 0.41 C ATOM 765 O3' DT B 14 9.936 -16.875 20.407 1.00 0.47 O ATOM 766 C2' DT B 14 9.566 -16.431 22.754 1.00 0.46 C ATOM 767 C1' DT B 14 10.595 -15.331 22.932 1.00 0.63 C ATOM 768 N1 DT B 14 10.813 -14.925 24.333 1.00 0.76 N ATOM 769 C2 DT B 14 12.093 -15.045 24.839 1.00 0.94 C ATOM 770 O2 DT B 14 13.026 -15.474 24.165 1.00 0.99 O ATOM 771 N3 DT B 14 12.263 -14.654 26.155 1.00 1.08 N ATOM 772 C4 DT B 14 11.277 -14.161 26.993 1.00 1.07 C ATOM 773 O4 DT B 14 11.541 -13.843 28.151 1.00 1.22 O ATOM 774 C5 DT B 14 9.973 -14.070 26.376 1.00 0.88 C ATOM 775 C7 DT B 14 8.795 -13.541 27.186 1.00 0.89 C ATOM 776 C6 DT B 14 9.782 -14.446 25.096 1.00 0.72 C ATOM 0 H5' DT B 14 7.443 -14.013 22.043 1.00 0.47 H new ATOM 0 H5'' DT B 14 8.204 -12.805 21.026 1.00 0.47 H new ATOM 0 H4' DT B 14 9.746 -14.505 20.163 1.00 0.52 H new ATOM 0 H3' DT B 14 8.070 -16.502 21.159 1.00 0.41 H new ATOM 0 H2' DT B 14 8.752 -16.353 23.475 1.00 0.46 H new ATOM 0 H2'' DT B 14 10.001 -17.424 22.871 1.00 0.46 H new ATOM 0 H1' DT B 14 11.552 -15.705 22.569 1.00 0.63 H new ATOM 0 H3 DT B 14 13.202 -14.737 26.544 1.00 1.08 H new ATOM 0 H71 DT B 14 8.088 -13.047 26.520 1.00 0.89 H new ATOM 0 H72 DT B 14 8.300 -14.370 27.692 1.00 0.89 H new ATOM 0 H73 DT B 14 9.154 -12.827 27.927 1.00 0.89 H new ATOM 0 H6 DT B 14 8.796 -14.368 24.663 1.00 0.72 H new ATOM 789 P DG B 15 10.142 -18.468 20.527 1.00 0.44 P ATOM 790 OP1 DG B 15 8.809 -19.109 20.571 1.00 0.63 O ATOM 791 OP2 DG B 15 11.122 -18.729 21.606 1.00 0.58 O ATOM 792 O5' DG B 15 10.833 -18.837 19.121 1.00 0.51 O ATOM 793 C5' DG B 15 10.350 -19.931 18.335 1.00 0.38 C ATOM 794 C4' DG B 15 10.848 -19.847 16.895 1.00 0.36 C ATOM 795 O4' DG B 15 10.405 -20.992 16.171 1.00 0.31 O ATOM 796 C3' DG B 15 10.351 -18.610 16.143 1.00 0.37 C ATOM 797 O3' DG B 15 11.474 -17.827 15.720 1.00 0.48 O ATOM 798 C2' DG B 15 9.609 -19.157 14.921 1.00 0.31 C ATOM 799 C1' DG B 15 10.116 -20.589 14.839 1.00 0.27 C ATOM 800 N9 DG B 15 9.137 -21.547 14.293 1.00 0.20 N ATOM 801 C8 DG B 15 8.181 -22.264 14.964 1.00 0.25 C ATOM 802 N7 DG B 15 7.466 -23.039 14.199 1.00 0.31 N ATOM 803 C5 DG B 15 7.983 -22.822 12.925 1.00 0.25 C ATOM 804 C6 DG B 15 7.602 -23.392 11.680 1.00 0.29 C ATOM 805 O6 DG B 15 6.718 -24.215 11.457 1.00 0.40 O ATOM 806 N1 DG B 15 8.378 -22.903 10.638 1.00 0.24 N ATOM 807 C2 DG B 15 9.394 -21.979 10.773 1.00 0.20 C ATOM 808 N2 DG B 15 10.028 -21.629 9.654 1.00 0.23 N ATOM 809 N3 DG B 15 9.754 -21.442 11.944 1.00 0.20 N ATOM 810 C4 DG B 15 9.007 -21.909 12.973 1.00 0.19 C ATOM 0 H5' DG B 15 9.260 -19.934 18.345 1.00 0.38 H new ATOM 0 H5'' DG B 15 10.675 -20.872 18.780 1.00 0.38 H new ATOM 0 H4' DG B 15 11.935 -19.790 16.958 1.00 0.36 H new ATOM 0 H3' DG B 15 9.713 -17.977 16.759 1.00 0.37 H new ATOM 0 H2' DG B 15 8.528 -19.117 15.052 1.00 0.31 H new ATOM 0 H2'' DG B 15 9.842 -18.592 14.019 1.00 0.31 H new ATOM 0 H1' DG B 15 10.975 -20.598 14.168 1.00 0.27 H new ATOM 0 H8 DG B 15 8.034 -22.193 16.032 1.00 0.25 H new ATOM 0 H1 DG B 15 8.182 -23.254 9.700 1.00 0.24 H new ATOM 0 H21 DG B 15 10.788 -20.950 9.690 1.00 0.23 H new ATOM 0 H22 DG B 15 9.753 -22.040 8.762 1.00 0.23 H new ATOM 822 P DG B 16 11.290 -16.268 15.363 1.00 0.58 P ATOM 823 OP1 DG B 16 12.570 -15.576 15.636 1.00 0.76 O ATOM 824 OP2 DG B 16 10.044 -15.791 16.003 1.00 0.69 O ATOM 825 O5' DG B 16 11.061 -16.293 13.771 1.00 0.40 O ATOM 826 C5' DG B 16 12.177 -16.313 12.877 1.00 0.41 C ATOM 827 C4' DG B 16 11.729 -16.239 11.421 1.00 0.30 C ATOM 828 O4' DG B 16 10.925 -17.381 11.111 1.00 0.27 O ATOM 829 C3' DG B 16 10.899 -14.994 11.093 1.00 0.31 C ATOM 830 O3' DG B 16 11.456 -14.340 9.949 1.00 0.29 O ATOM 831 C2' DG B 16 9.512 -15.531 10.759 1.00 0.31 C ATOM 832 C1' DG B 16 9.824 -16.951 10.319 1.00 0.24 C ATOM 833 N9 DG B 16 8.720 -17.907 10.523 1.00 0.20 N ATOM 834 C8 DG B 16 8.050 -18.207 11.680 1.00 0.23 C ATOM 835 N7 DG B 16 7.118 -19.107 11.535 1.00 0.21 N ATOM 836 C5 DG B 16 7.173 -19.430 10.183 1.00 0.16 C ATOM 837 C6 DG B 16 6.394 -20.356 9.436 1.00 0.16 C ATOM 838 O6 DG B 16 5.488 -21.084 9.835 1.00 0.18 O ATOM 839 N1 DG B 16 6.772 -20.377 8.099 1.00 0.19 N ATOM 840 C2 DG B 16 7.775 -19.602 7.549 1.00 0.21 C ATOM 841 N2 DG B 16 7.997 -19.758 6.243 1.00 0.28 N ATOM 842 N3 DG B 16 8.506 -18.732 8.250 1.00 0.19 N ATOM 843 C4 DG B 16 8.152 -18.699 9.556 1.00 0.17 C ATOM 0 H5' DG B 16 12.755 -17.224 13.035 1.00 0.41 H new ATOM 0 H5'' DG B 16 12.837 -15.474 13.099 1.00 0.41 H new ATOM 0 H4' DG B 16 12.644 -16.201 10.829 1.00 0.30 H new ATOM 0 H3' DG B 16 10.877 -14.274 11.911 1.00 0.31 H new ATOM 0 H2' DG B 16 8.846 -15.508 11.622 1.00 0.31 H new ATOM 0 H2'' DG B 16 9.030 -14.955 9.969 1.00 0.31 H new ATOM 0 H1' DG B 16 10.020 -16.934 9.247 1.00 0.24 H new ATOM 0 H8 DG B 16 8.274 -17.740 12.628 1.00 0.23 H new ATOM 0 H1 DG B 16 6.272 -21.012 7.477 1.00 0.19 H new ATOM 0 H21 DG B 16 8.725 -19.213 5.781 1.00 0.28 H new ATOM 0 H22 DG B 16 7.439 -20.422 5.707 1.00 0.28 H new ATOM 855 P DG B 17 10.781 -13.000 9.361 1.00 0.29 P ATOM 856 OP1 DG B 17 11.858 -12.125 8.846 1.00 0.29 O ATOM 857 OP2 DG B 17 9.829 -12.483 10.370 1.00 0.34 O ATOM 858 O5' DG B 17 9.937 -13.553 8.107 1.00 0.34 O ATOM 859 C5' DG B 17 10.606 -14.017 6.933 1.00 0.37 C ATOM 860 C4' DG B 17 9.618 -14.424 5.844 1.00 0.37 C ATOM 861 O4' DG B 17 8.773 -15.473 6.329 1.00 0.35 O ATOM 862 C3' DG B 17 8.705 -13.284 5.377 1.00 0.36 C ATOM 863 O3' DG B 17 8.736 -13.209 3.947 1.00 0.41 O ATOM 864 C2' DG B 17 7.313 -13.694 5.846 1.00 0.30 C ATOM 865 C1' DG B 17 7.443 -15.205 5.900 1.00 0.31 C ATOM 866 N9 DG B 17 6.519 -15.859 6.847 1.00 0.27 N ATOM 867 C8 DG B 17 6.405 -15.677 8.202 1.00 0.32 C ATOM 868 N7 DG B 17 5.486 -16.414 8.758 1.00 0.30 N ATOM 869 C5 DG B 17 4.950 -17.138 7.700 1.00 0.25 C ATOM 870 C6 DG B 17 3.909 -18.106 7.696 1.00 0.25 C ATOM 871 O6 DG B 17 3.249 -18.519 8.646 1.00 0.27 O ATOM 872 N1 DG B 17 3.675 -18.595 6.417 1.00 0.24 N ATOM 873 C2 DG B 17 4.356 -18.203 5.283 1.00 0.22 C ATOM 874 N2 DG B 17 3.988 -18.786 4.142 1.00 0.27 N ATOM 875 N3 DG B 17 5.334 -17.293 5.286 1.00 0.21 N ATOM 876 C4 DG B 17 5.576 -16.805 6.525 1.00 0.23 C ATOM 0 H5' DG B 17 11.239 -14.868 7.187 1.00 0.37 H new ATOM 0 H5'' DG B 17 11.262 -13.233 6.554 1.00 0.37 H new ATOM 0 H4' DG B 17 10.227 -14.738 4.997 1.00 0.37 H new ATOM 0 H3' DG B 17 9.005 -12.312 5.768 1.00 0.36 H new ATOM 0 H2' DG B 17 7.066 -13.269 6.819 1.00 0.30 H new ATOM 0 H2'' DG B 17 6.536 -13.374 5.152 1.00 0.30 H new ATOM 0 H1' DG B 17 7.201 -15.601 4.914 1.00 0.31 H new ATOM 0 H8 DG B 17 7.021 -14.985 8.757 1.00 0.32 H new ATOM 0 H1 DG B 17 2.944 -19.298 6.308 1.00 0.24 H new ATOM 0 H21 DG B 17 4.454 -18.538 3.269 1.00 0.27 H new ATOM 0 H22 DG B 17 3.240 -19.480 4.142 1.00 0.27 H new ATOM 888 P DT B 18 7.834 -12.132 3.160 1.00 0.41 P ATOM 889 OP1 DT B 18 8.584 -11.684 1.966 1.00 0.50 O ATOM 890 OP2 DT B 18 7.339 -11.138 4.138 1.00 0.46 O ATOM 891 O5' DT B 18 6.583 -13.018 2.665 1.00 0.34 O ATOM 892 C5' DT B 18 6.757 -14.008 1.649 1.00 0.33 C ATOM 893 C4' DT B 18 5.423 -14.605 1.206 1.00 0.39 C ATOM 894 O4' DT B 18 4.800 -15.268 2.315 1.00 0.45 O ATOM 895 C3' DT B 18 4.424 -13.571 0.677 1.00 0.47 C ATOM 896 O3' DT B 18 3.790 -14.030 -0.522 1.00 0.62 O ATOM 897 C2' DT B 18 3.420 -13.440 1.813 1.00 0.48 C ATOM 898 C1' DT B 18 3.440 -14.850 2.372 1.00 0.48 C ATOM 899 N1 DT B 18 2.980 -14.969 3.770 1.00 0.46 N ATOM 900 C2 DT B 18 1.974 -15.880 4.031 1.00 0.62 C ATOM 901 O2 DT B 18 1.469 -16.567 3.146 1.00 0.78 O ATOM 902 N3 DT B 18 1.567 -15.976 5.349 1.00 0.62 N ATOM 903 C4 DT B 18 2.073 -15.249 6.413 1.00 0.49 C ATOM 904 O4 DT B 18 1.636 -15.416 7.549 1.00 0.51 O ATOM 905 C5 DT B 18 3.120 -14.322 6.046 1.00 0.41 C ATOM 906 C7 DT B 18 3.767 -13.458 7.122 1.00 0.50 C ATOM 907 C6 DT B 18 3.534 -14.211 4.768 1.00 0.41 C ATOM 0 H5' DT B 18 7.405 -14.802 2.022 1.00 0.33 H new ATOM 0 H5'' DT B 18 7.260 -13.563 0.790 1.00 0.33 H new ATOM 0 H4' DT B 18 5.664 -15.289 0.392 1.00 0.39 H new ATOM 0 H3' DT B 18 4.893 -12.624 0.412 1.00 0.47 H new ATOM 0 H2' DT B 18 3.725 -12.698 2.551 1.00 0.48 H new ATOM 0 H2'' DT B 18 2.431 -13.149 1.459 1.00 0.48 H new ATOM 0 HO3' DT B 18 3.156 -13.352 -0.837 1.00 0.62 H new ATOM 0 H1' DT B 18 2.751 -15.457 1.784 1.00 0.48 H new ATOM 0 H3 DT B 18 0.825 -16.644 5.557 1.00 0.62 H new ATOM 0 H71 DT B 18 4.800 -13.247 6.846 1.00 0.50 H new ATOM 0 H72 DT B 18 3.217 -12.521 7.216 1.00 0.50 H new ATOM 0 H73 DT B 18 3.747 -13.987 8.075 1.00 0.50 H new ATOM 0 H6 DT B 18 4.319 -13.510 4.526 1.00 0.41 H new TER 921 DT B 18