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+ -178:sc= -0.213 (180deg=-0.22) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -1.05! C(o=-1!,f=-6.2!) USER MOD Single : A 6 HIS : no HD1:sc= -1.34 X(o=-1.3,f=-1.2) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 MET CE :methyl -141:sc= -0.261 (180deg=-1.31) USER MOD Single : A 16 TYR OH : rot 180:sc= -0.834 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -2.6! C(o=-2.6!,f=-8.3!) 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 -30:sc= -0.623 (180deg=-1.41) USER MOD Single : B 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 1.167 -36.761 20.145 1.00 1.19 N ATOM 2 CA SER A 1 1.236 -36.589 21.624 1.00 1.10 C ATOM 3 C SER A 1 2.525 -35.861 21.990 1.00 0.85 C ATOM 4 O SER A 1 2.786 -35.591 23.162 1.00 0.99 O ATOM 5 CB SER A 1 1.200 -37.962 22.295 1.00 1.24 C ATOM 6 OG SER A 1 -0.025 -38.108 23.002 1.00 1.40 O ATOM 0 H1 SER A 1 0.273 -37.227 19.891 1.00 1.19 H new ATOM 0 H2 SER A 1 1.215 -35.830 19.685 1.00 1.19 H new ATOM 0 H3 SER A 1 1.965 -37.346 19.826 1.00 1.19 H new ATOM 0 HA SER A 1 0.385 -36.001 21.968 1.00 1.10 H new ATOM 0 HB2 SER A 1 1.297 -38.748 21.546 1.00 1.24 H new ATOM 0 HB3 SER A 1 2.042 -38.068 22.979 1.00 1.24 H new ATOM 0 HG SER A 1 -0.052 -38.988 23.432 1.00 1.40 H new ATOM 14 N MET A 2 3.330 -35.546 20.979 1.00 0.51 N ATOM 15 CA MET A 2 4.591 -34.848 21.207 1.00 0.31 C ATOM 16 C MET A 2 5.122 -34.264 19.902 1.00 0.27 C ATOM 17 O MET A 2 5.537 -34.998 19.005 1.00 0.43 O ATOM 18 CB MET A 2 5.624 -35.810 21.796 1.00 0.53 C ATOM 19 CG MET A 2 6.358 -35.126 22.951 1.00 0.55 C ATOM 20 SD MET A 2 7.139 -33.606 22.354 1.00 0.64 S ATOM 21 CE MET A 2 8.846 -34.206 22.370 1.00 0.53 C ATOM 0 H MET A 2 3.134 -35.761 20.001 1.00 0.51 H new ATOM 0 HA MET A 2 4.412 -34.035 21.911 1.00 0.31 H new ATOM 0 HB2 MET A 2 5.132 -36.716 22.149 1.00 0.53 H new ATOM 0 HB3 MET A 2 6.335 -36.112 21.027 1.00 0.53 H new ATOM 0 HG2 MET A 2 5.659 -34.897 23.755 1.00 0.55 H new ATOM 0 HG3 MET A 2 7.111 -35.796 23.365 1.00 0.55 H new ATOM 0 HE1 MET A 2 9.513 -33.414 22.030 1.00 0.53 H new ATOM 0 HE2 MET A 2 9.119 -34.501 23.383 1.00 0.53 H new ATOM 0 HE3 MET A 2 8.936 -35.066 21.706 1.00 0.53 H new ATOM 31 N HIS A 3 5.107 -32.939 19.803 1.00 0.11 N ATOM 32 CA HIS A 3 5.590 -32.266 18.603 1.00 0.12 C ATOM 33 C HIS A 3 6.949 -31.620 18.861 1.00 0.17 C ATOM 34 O HIS A 3 7.248 -31.205 19.980 1.00 0.20 O ATOM 35 CB HIS A 3 4.589 -31.195 18.166 1.00 0.18 C ATOM 36 CG HIS A 3 3.290 -31.392 18.899 1.00 0.17 C ATOM 37 ND1 HIS A 3 3.228 -31.494 20.280 1.00 0.15 N ATOM 38 CD2 HIS A 3 1.995 -31.504 18.456 1.00 0.27 C ATOM 39 CE1 HIS A 3 1.936 -31.661 20.617 1.00 0.18 C ATOM 40 NE2 HIS A 3 1.142 -31.674 19.542 1.00 0.25 N ATOM 0 H HIS A 3 4.768 -32.313 20.534 1.00 0.11 H new ATOM 0 HA HIS A 3 5.697 -33.008 17.811 1.00 0.12 H new ATOM 0 HB2 HIS A 3 4.989 -30.202 18.373 1.00 0.18 H new ATOM 0 HB3 HIS A 3 4.424 -31.254 17.090 1.00 0.18 H new ATOM 0 HD2 HIS A 3 1.686 -31.466 17.422 1.00 0.27 H new ATOM 0 HE1 HIS A 3 1.584 -31.771 21.632 1.00 0.18 H new ATOM 0 HE2 HIS A 3 0.128 -31.785 19.522 1.00 0.25 H new ATOM 48 N PRO A 4 7.766 -31.527 17.846 1.00 0.23 N ATOM 49 CA PRO A 4 9.120 -30.918 17.953 1.00 0.31 C ATOM 50 C PRO A 4 9.127 -29.680 18.848 1.00 0.35 C ATOM 51 O PRO A 4 9.619 -29.722 19.976 1.00 0.38 O ATOM 52 CB PRO A 4 9.454 -30.554 16.508 1.00 0.36 C ATOM 53 CG PRO A 4 8.703 -31.534 15.666 1.00 0.33 C ATOM 54 CD PRO A 4 7.488 -31.994 16.480 1.00 0.28 C ATOM 0 HA PRO A 4 9.844 -31.593 18.409 1.00 0.31 H new ATOM 0 HB2 PRO A 4 9.154 -29.531 16.282 1.00 0.36 H new ATOM 0 HB3 PRO A 4 10.526 -30.620 16.325 1.00 0.36 H new ATOM 0 HG2 PRO A 4 8.387 -31.074 14.730 1.00 0.33 H new ATOM 0 HG3 PRO A 4 9.336 -32.383 15.406 1.00 0.33 H new ATOM 0 HD2 PRO A 4 6.564 -31.564 16.093 1.00 0.28 H new ATOM 0 HD3 PRO A 4 7.374 -33.077 16.446 1.00 0.28 H new ATOM 62 N GLY A 5 8.578 -28.582 18.339 1.00 0.39 N ATOM 63 CA GLY A 5 8.525 -27.341 19.103 1.00 0.45 C ATOM 64 C GLY A 5 9.828 -26.557 18.973 1.00 0.40 C ATOM 65 O GLY A 5 9.812 -25.344 18.758 1.00 0.45 O ATOM 0 H GLY A 5 8.166 -28.526 17.407 1.00 0.39 H new ATOM 0 HA2 GLY A 5 7.693 -26.730 18.752 1.00 0.45 H new ATOM 0 HA3 GLY A 5 8.335 -27.565 20.153 1.00 0.45 H new ATOM 69 N HIS A 6 10.952 -27.252 19.110 1.00 0.35 N ATOM 70 CA HIS A 6 12.256 -26.603 19.012 1.00 0.31 C ATOM 71 C HIS A 6 12.792 -26.671 17.585 1.00 0.24 C ATOM 72 O HIS A 6 13.960 -26.370 17.338 1.00 0.27 O ATOM 73 CB HIS A 6 13.247 -27.275 19.964 1.00 0.36 C ATOM 74 CG HIS A 6 13.046 -28.765 19.928 1.00 0.49 C ATOM 75 ND1 HIS A 6 13.619 -29.566 18.952 1.00 0.63 N ATOM 76 CD2 HIS A 6 12.340 -29.615 20.743 1.00 0.70 C ATOM 77 CE1 HIS A 6 13.251 -30.836 19.202 1.00 0.75 C ATOM 78 NE2 HIS A 6 12.471 -30.923 20.282 1.00 0.79 N ATOM 0 H HIS A 6 10.988 -28.256 19.288 1.00 0.35 H new ATOM 0 HA HIS A 6 12.137 -25.556 19.289 1.00 0.31 H new ATOM 0 HB2 HIS A 6 14.269 -27.028 19.676 1.00 0.36 H new ATOM 0 HB3 HIS A 6 13.103 -26.902 20.978 1.00 0.36 H new ATOM 0 HD2 HIS A 6 11.770 -29.315 21.610 1.00 0.70 H new ATOM 0 HE1 HIS A 6 13.550 -31.682 18.602 1.00 0.75 H new ATOM 0 HE2 HIS A 6 12.060 -31.766 20.683 1.00 0.79 H new ATOM 86 N LEU A 7 11.934 -27.064 16.649 1.00 0.20 N ATOM 87 CA LEU A 7 12.341 -27.162 15.251 1.00 0.14 C ATOM 88 C LEU A 7 12.052 -25.855 14.519 1.00 0.17 C ATOM 89 O LEU A 7 11.289 -25.018 15.001 1.00 0.37 O ATOM 90 CB LEU A 7 11.594 -28.307 14.566 1.00 0.14 C ATOM 91 CG LEU A 7 12.525 -29.512 14.422 1.00 0.14 C ATOM 92 CD1 LEU A 7 13.126 -29.859 15.787 1.00 0.20 C ATOM 93 CD2 LEU A 7 11.733 -30.712 13.893 1.00 0.18 C ATOM 0 H LEU A 7 10.963 -27.317 16.830 1.00 0.20 H new ATOM 0 HA LEU A 7 13.413 -27.358 15.217 1.00 0.14 H new ATOM 0 HB2 LEU A 7 10.715 -28.581 15.149 1.00 0.14 H new ATOM 0 HB3 LEU A 7 11.240 -27.989 13.585 1.00 0.14 H new ATOM 0 HG LEU A 7 13.325 -29.270 13.723 1.00 0.14 H new ATOM 0 HD11 LEU A 7 13.790 -30.718 15.685 1.00 0.20 H new ATOM 0 HD12 LEU A 7 13.691 -29.006 16.163 1.00 0.20 H new ATOM 0 HD13 LEU A 7 12.325 -30.100 16.486 1.00 0.20 H new ATOM 0 HD21 LEU A 7 12.397 -31.570 13.791 1.00 0.18 H new ATOM 0 HD22 LEU A 7 10.931 -30.955 14.590 1.00 0.18 H new ATOM 0 HD23 LEU A 7 11.306 -30.466 12.921 1.00 0.18 H new ATOM 105 N LYS A 8 12.666 -25.686 13.352 1.00 0.15 N ATOM 106 CA LYS A 8 12.466 -24.477 12.563 1.00 0.14 C ATOM 107 C LYS A 8 12.672 -24.765 11.079 1.00 0.17 C ATOM 108 O LYS A 8 13.748 -25.194 10.664 1.00 0.22 O ATOM 109 CB LYS A 8 13.444 -23.391 13.016 1.00 0.17 C ATOM 110 CG LYS A 8 13.039 -22.047 12.404 1.00 0.15 C ATOM 111 CD LYS A 8 13.433 -22.014 10.925 1.00 0.20 C ATOM 112 CE LYS A 8 13.681 -20.566 10.496 1.00 0.38 C ATOM 113 NZ LYS A 8 14.239 -20.546 9.114 1.00 0.44 N ATOM 0 H LYS A 8 13.302 -26.366 12.935 1.00 0.15 H new ATOM 0 HA LYS A 8 11.444 -24.131 12.715 1.00 0.14 H new ATOM 0 HB2 LYS A 8 13.447 -23.321 14.104 1.00 0.17 H new ATOM 0 HB3 LYS A 8 14.458 -23.650 12.711 1.00 0.17 H new ATOM 0 HG2 LYS A 8 11.964 -21.899 12.507 1.00 0.15 H new ATOM 0 HG3 LYS A 8 13.526 -21.231 12.938 1.00 0.15 H new ATOM 0 HD2 LYS A 8 14.330 -22.611 10.763 1.00 0.20 H new ATOM 0 HD3 LYS A 8 12.643 -22.455 10.317 1.00 0.20 H new ATOM 0 HE2 LYS A 8 12.750 -20.000 10.532 1.00 0.38 H new ATOM 0 HE3 LYS A 8 14.374 -20.084 11.186 1.00 0.38 H new ATOM 0 HZ1 LYS A 8 14.408 -19.562 8.822 1.00 0.44 H new ATOM 0 HZ2 LYS A 8 15.136 -21.072 9.094 1.00 0.44 H new ATOM 0 HZ3 LYS A 8 13.563 -20.990 8.460 1.00 0.44 H new ATOM 127 N GLY A 9 11.633 -24.525 10.285 1.00 0.21 N ATOM 128 CA GLY A 9 11.712 -24.761 8.848 1.00 0.26 C ATOM 129 C GLY A 9 10.722 -25.838 8.418 1.00 0.24 C ATOM 130 O GLY A 9 9.891 -26.283 9.209 1.00 0.40 O ATOM 0 H GLY A 9 10.733 -24.170 10.609 1.00 0.21 H new ATOM 0 HA2 GLY A 9 11.504 -23.835 8.311 1.00 0.26 H new ATOM 0 HA3 GLY A 9 12.724 -25.064 8.580 1.00 0.26 H new ATOM 134 N ARG A 10 10.817 -26.252 7.159 1.00 0.20 N ATOM 135 CA ARG A 10 9.924 -27.279 6.632 1.00 0.20 C ATOM 136 C ARG A 10 10.039 -28.559 7.453 1.00 0.24 C ATOM 137 O ARG A 10 9.220 -29.468 7.321 1.00 0.39 O ATOM 138 CB ARG A 10 10.271 -27.574 5.172 1.00 0.24 C ATOM 139 CG ARG A 10 10.707 -26.283 4.478 1.00 0.28 C ATOM 140 CD ARG A 10 10.397 -26.376 2.983 1.00 0.34 C ATOM 141 NE ARG A 10 11.447 -25.724 2.209 1.00 0.41 N ATOM 142 CZ ARG A 10 11.364 -25.625 0.886 1.00 0.41 C ATOM 143 NH1 ARG A 10 10.331 -26.116 0.258 1.00 0.41 N ATOM 144 NH2 ARG A 10 12.316 -25.036 0.215 1.00 0.52 N ATOM 0 H ARG A 10 11.498 -25.896 6.488 1.00 0.20 H new ATOM 0 HA ARG A 10 8.900 -26.911 6.694 1.00 0.20 H new ATOM 0 HB2 ARG A 10 11.069 -28.314 5.120 1.00 0.24 H new ATOM 0 HB3 ARG A 10 9.407 -28.000 4.661 1.00 0.24 H new ATOM 0 HG2 ARG A 10 10.188 -25.430 4.915 1.00 0.28 H new ATOM 0 HG3 ARG A 10 11.774 -26.119 4.629 1.00 0.28 H new ATOM 0 HD2 ARG A 10 10.312 -27.421 2.686 1.00 0.34 H new ATOM 0 HD3 ARG A 10 9.436 -25.906 2.774 1.00 0.34 H new ATOM 0 HE ARG A 10 12.259 -25.337 2.691 1.00 0.41 H new ATOM 0 HH11 ARG A 10 9.587 -26.576 0.782 1.00 0.41 H new ATOM 0 HH12 ARG A 10 10.268 -26.040 -0.757 1.00 0.41 H new ATOM 0 HH21 ARG A 10 13.123 -24.652 0.706 1.00 0.52 H new ATOM 0 HH22 ARG A 10 12.253 -24.960 -0.800 1.00 0.52 H new ATOM 158 N GLU A 11 11.061 -28.622 8.299 1.00 0.18 N ATOM 159 CA GLU A 11 11.275 -29.798 9.136 1.00 0.22 C ATOM 160 C GLU A 11 10.001 -30.155 9.895 1.00 0.21 C ATOM 161 O GLU A 11 9.462 -31.251 9.741 1.00 0.26 O ATOM 162 CB GLU A 11 12.406 -29.532 10.132 1.00 0.25 C ATOM 163 CG GLU A 11 13.690 -29.198 9.370 1.00 0.75 C ATOM 164 CD GLU A 11 14.886 -29.254 10.314 1.00 0.66 C ATOM 165 OE1 GLU A 11 14.667 -29.366 11.508 1.00 1.34 O ATOM 166 OE2 GLU A 11 16.003 -29.184 9.827 1.00 0.89 O ATOM 0 H GLU A 11 11.749 -27.880 8.424 1.00 0.18 H new ATOM 0 HA GLU A 11 11.547 -30.634 8.492 1.00 0.22 H new ATOM 0 HB2 GLU A 11 12.137 -28.707 10.792 1.00 0.25 H new ATOM 0 HB3 GLU A 11 12.562 -30.407 10.763 1.00 0.25 H new ATOM 0 HG2 GLU A 11 13.830 -29.903 8.550 1.00 0.75 H new ATOM 0 HG3 GLU A 11 13.612 -28.205 8.927 1.00 0.75 H new ATOM 173 N ILE A 12 9.524 -29.223 10.714 1.00 0.18 N ATOM 174 CA ILE A 12 8.312 -29.452 11.493 1.00 0.18 C ATOM 175 C ILE A 12 7.109 -29.637 10.573 1.00 0.20 C ATOM 176 O ILE A 12 6.156 -30.337 10.916 1.00 0.27 O ATOM 177 CB ILE A 12 8.061 -28.267 12.428 1.00 0.21 C ATOM 178 CG1 ILE A 12 6.893 -28.595 13.361 1.00 0.20 C ATOM 179 CG2 ILE A 12 7.717 -27.027 11.600 1.00 0.25 C ATOM 180 CD1 ILE A 12 6.831 -27.563 14.487 1.00 0.20 C ATOM 0 H ILE A 12 9.954 -28.309 10.855 1.00 0.18 H new ATOM 0 HA ILE A 12 8.448 -30.359 12.082 1.00 0.18 H new ATOM 0 HB ILE A 12 8.957 -28.073 13.018 1.00 0.21 H new ATOM 0 HG12 ILE A 12 5.957 -28.595 12.802 1.00 0.20 H new ATOM 0 HG13 ILE A 12 7.016 -29.595 13.777 1.00 0.20 H new ATOM 0 HG21 ILE A 12 7.538 -26.183 12.266 1.00 0.25 H new ATOM 0 HG22 ILE A 12 8.547 -26.793 10.933 1.00 0.25 H new ATOM 0 HG23 ILE A 12 6.821 -27.220 11.011 1.00 0.25 H new ATOM 0 HD11 ILE A 12 5.999 -27.798 15.150 1.00 0.20 H new ATOM 0 HD12 ILE A 12 7.763 -27.585 15.052 1.00 0.20 H new ATOM 0 HD13 ILE A 12 6.687 -26.569 14.062 1.00 0.20 H new ATOM 192 N GLY A 13 7.160 -29.003 9.407 1.00 0.21 N ATOM 193 CA GLY A 13 6.067 -29.104 8.447 1.00 0.23 C ATOM 194 C GLY A 13 6.127 -30.423 7.686 1.00 0.23 C ATOM 195 O GLY A 13 5.115 -30.901 7.173 1.00 0.36 O ATOM 0 H GLY A 13 7.939 -28.418 9.105 1.00 0.21 H new ATOM 0 HA2 GLY A 13 5.113 -29.024 8.968 1.00 0.23 H new ATOM 0 HA3 GLY A 13 6.118 -28.272 7.744 1.00 0.23 H new ATOM 199 N MET A 14 7.318 -31.008 7.615 1.00 0.16 N ATOM 200 CA MET A 14 7.496 -32.273 6.911 1.00 0.18 C ATOM 201 C MET A 14 7.794 -33.400 7.895 1.00 0.20 C ATOM 202 O MET A 14 7.721 -34.578 7.546 1.00 0.39 O ATOM 203 CB MET A 14 8.642 -32.155 5.905 1.00 0.21 C ATOM 204 CG MET A 14 8.316 -31.063 4.885 1.00 0.27 C ATOM 205 SD MET A 14 6.799 -31.498 3.998 1.00 0.37 S ATOM 206 CE MET A 14 5.952 -29.913 4.205 1.00 0.31 C ATOM 0 H MET A 14 8.168 -30.630 8.033 1.00 0.16 H new ATOM 0 HA MET A 14 6.571 -32.504 6.383 1.00 0.18 H new ATOM 0 HB2 MET A 14 9.571 -31.918 6.423 1.00 0.21 H new ATOM 0 HB3 MET A 14 8.794 -33.108 5.398 1.00 0.21 H new ATOM 0 HG2 MET A 14 8.193 -30.105 5.389 1.00 0.27 H new ATOM 0 HG3 MET A 14 9.141 -30.949 4.182 1.00 0.27 H new ATOM 0 HE1 MET A 14 4.893 -30.088 4.393 1.00 0.31 H new ATOM 0 HE2 MET A 14 6.386 -29.376 5.048 1.00 0.31 H new ATOM 0 HE3 MET A 14 6.066 -29.318 3.299 1.00 0.31 H new ATOM 216 N TRP A 15 8.131 -33.031 9.127 1.00 0.18 N ATOM 217 CA TRP A 15 8.439 -34.023 10.152 1.00 0.17 C ATOM 218 C TRP A 15 7.375 -35.116 10.174 1.00 0.19 C ATOM 219 O TRP A 15 7.693 -36.305 10.157 1.00 0.33 O ATOM 220 CB TRP A 15 8.510 -33.351 11.525 1.00 0.18 C ATOM 221 CG TRP A 15 8.893 -34.364 12.555 1.00 0.19 C ATOM 222 CD1 TRP A 15 8.051 -34.898 13.469 1.00 0.27 C ATOM 223 CD2 TRP A 15 10.195 -34.973 12.792 1.00 0.20 C ATOM 224 NE1 TRP A 15 8.753 -35.796 14.253 1.00 0.28 N ATOM 225 CE2 TRP A 15 10.079 -35.877 13.874 1.00 0.22 C ATOM 226 CE3 TRP A 15 11.453 -34.830 12.179 1.00 0.29 C ATOM 227 CZ2 TRP A 15 11.172 -36.614 14.332 1.00 0.24 C ATOM 228 CZ3 TRP A 15 12.555 -35.570 12.637 1.00 0.36 C ATOM 229 CH2 TRP A 15 12.415 -36.460 13.712 1.00 0.32 C ATOM 0 H TRP A 15 8.197 -32.062 9.438 1.00 0.18 H new ATOM 0 HA TRP A 15 9.404 -34.473 9.918 1.00 0.17 H new ATOM 0 HB2 TRP A 15 9.238 -32.540 11.508 1.00 0.18 H new ATOM 0 HB3 TRP A 15 7.546 -32.908 11.776 1.00 0.18 H new ATOM 0 HD1 TRP A 15 7.002 -34.662 13.570 1.00 0.27 H new ATOM 0 HE1 TRP A 15 8.342 -36.332 15.017 1.00 0.28 H new ATOM 0 HE3 TRP A 15 11.572 -34.147 11.351 1.00 0.29 H new ATOM 0 HZ2 TRP A 15 11.058 -37.298 15.160 1.00 0.24 H new ATOM 0 HZ3 TRP A 15 13.516 -35.453 12.159 1.00 0.36 H new ATOM 0 HH2 TRP A 15 13.267 -37.026 14.060 1.00 0.32 H new ATOM 240 N TYR A 16 6.112 -34.704 10.214 1.00 0.21 N ATOM 241 CA TYR A 16 5.008 -35.657 10.240 1.00 0.25 C ATOM 242 C TYR A 16 3.668 -34.928 10.185 1.00 0.26 C ATOM 243 O TYR A 16 2.613 -35.538 10.361 1.00 0.28 O ATOM 244 CB TYR A 16 5.084 -36.513 11.508 1.00 0.27 C ATOM 245 CG TYR A 16 4.469 -35.771 12.673 1.00 0.27 C ATOM 246 CD1 TYR A 16 4.511 -34.371 12.723 1.00 0.23 C ATOM 247 CD2 TYR A 16 3.857 -36.488 13.709 1.00 0.31 C ATOM 248 CE1 TYR A 16 3.944 -33.692 13.809 1.00 0.24 C ATOM 249 CE2 TYR A 16 3.289 -35.808 14.793 1.00 0.32 C ATOM 250 CZ TYR A 16 3.333 -34.410 14.843 1.00 0.28 C ATOM 251 OH TYR A 16 2.775 -33.740 15.913 1.00 0.30 O ATOM 0 H TYR A 16 5.829 -33.724 10.229 1.00 0.21 H new ATOM 0 HA TYR A 16 5.089 -36.303 9.366 1.00 0.25 H new ATOM 0 HB2 TYR A 16 4.561 -37.457 11.351 1.00 0.27 H new ATOM 0 HB3 TYR A 16 6.123 -36.757 11.730 1.00 0.27 H new ATOM 0 HD1 TYR A 16 4.980 -33.816 11.924 1.00 0.23 H new ATOM 0 HD2 TYR A 16 3.823 -37.567 13.672 1.00 0.31 H new ATOM 0 HE1 TYR A 16 3.978 -32.613 13.848 1.00 0.24 H new ATOM 0 HE2 TYR A 16 2.817 -36.362 15.591 1.00 0.32 H new ATOM 0 HH TYR A 16 2.392 -34.388 16.541 1.00 0.30 H new ATOM 261 N ALA A 17 3.722 -33.624 9.933 1.00 0.31 N ATOM 262 CA ALA A 17 2.511 -32.810 9.847 1.00 0.35 C ATOM 263 C ALA A 17 1.365 -33.456 10.620 1.00 0.25 C ATOM 264 O ALA A 17 0.727 -34.392 10.137 1.00 0.21 O ATOM 265 CB ALA A 17 2.104 -32.634 8.383 1.00 0.41 C ATOM 0 H ALA A 17 4.589 -33.108 9.785 1.00 0.31 H new ATOM 0 HA ALA A 17 2.723 -31.836 10.288 1.00 0.35 H new ATOM 0 HB1 ALA A 17 1.201 -32.026 8.327 1.00 0.41 H new ATOM 0 HB2 ALA A 17 2.908 -32.139 7.839 1.00 0.41 H new ATOM 0 HB3 ALA A 17 1.912 -33.611 7.939 1.00 0.41 H new ATOM 271 N LYS A 18 1.106 -32.947 11.820 1.00 0.27 N ATOM 272 CA LYS A 18 0.031 -33.481 12.648 1.00 0.22 C ATOM 273 C LYS A 18 -1.327 -33.037 12.113 1.00 0.19 C ATOM 274 O LYS A 18 -2.341 -33.697 12.342 1.00 0.20 O ATOM 275 CB LYS A 18 0.196 -33.000 14.091 1.00 0.34 C ATOM 276 CG LYS A 18 -1.007 -33.453 14.922 1.00 0.30 C ATOM 277 CD LYS A 18 -0.556 -33.746 16.355 1.00 0.53 C ATOM 278 CE LYS A 18 -1.731 -33.539 17.312 1.00 0.48 C ATOM 279 NZ LYS A 18 -1.699 -34.587 18.372 1.00 0.72 N ATOM 0 H LYS A 18 1.621 -32.172 12.238 1.00 0.27 H new ATOM 0 HA LYS A 18 0.081 -34.569 12.620 1.00 0.22 H new ATOM 0 HB2 LYS A 18 1.116 -33.401 14.516 1.00 0.34 H new ATOM 0 HB3 LYS A 18 0.280 -31.914 14.116 1.00 0.34 H new ATOM 0 HG2 LYS A 18 -1.775 -32.679 14.922 1.00 0.30 H new ATOM 0 HG3 LYS A 18 -1.453 -34.344 14.480 1.00 0.30 H new ATOM 0 HD2 LYS A 18 -0.188 -34.769 16.430 1.00 0.53 H new ATOM 0 HD3 LYS A 18 0.270 -33.090 16.629 1.00 0.53 H new ATOM 0 HE2 LYS A 18 -1.676 -32.548 17.763 1.00 0.48 H new ATOM 0 HE3 LYS A 18 -2.673 -33.588 16.765 1.00 0.48 H new ATOM 0 HZ1 LYS A 18 -2.498 -34.447 19.023 1.00 0.72 H new ATOM 0 HZ2 LYS A 18 -1.771 -35.527 17.933 1.00 0.72 H new ATOM 0 HZ3 LYS A 18 -0.806 -34.519 18.900 1.00 0.72 H new ATOM 293 N LYS A 19 -1.339 -31.914 11.401 1.00 0.24 N ATOM 294 CA LYS A 19 -2.580 -31.393 10.838 1.00 0.29 C ATOM 295 C LYS A 19 -3.622 -31.192 11.934 1.00 0.27 C ATOM 296 O LYS A 19 -3.769 -30.094 12.470 1.00 0.31 O ATOM 297 CB LYS A 19 -3.125 -32.360 9.784 1.00 0.31 C ATOM 298 CG LYS A 19 -2.101 -32.523 8.659 1.00 0.41 C ATOM 299 CD LYS A 19 -2.493 -33.713 7.782 1.00 0.43 C ATOM 300 CE LYS A 19 -2.103 -33.431 6.329 1.00 0.56 C ATOM 301 NZ LYS A 19 -2.289 -34.668 5.517 1.00 0.68 N ATOM 0 H LYS A 19 -0.512 -31.352 11.202 1.00 0.24 H new ATOM 0 HA LYS A 19 -2.368 -30.431 10.371 1.00 0.29 H new ATOM 0 HB2 LYS A 19 -3.338 -33.327 10.239 1.00 0.31 H new ATOM 0 HB3 LYS A 19 -4.065 -31.983 9.382 1.00 0.31 H new ATOM 0 HG2 LYS A 19 -2.056 -31.614 8.059 1.00 0.41 H new ATOM 0 HG3 LYS A 19 -1.107 -32.678 9.077 1.00 0.41 H new ATOM 0 HD2 LYS A 19 -1.995 -34.617 8.134 1.00 0.43 H new ATOM 0 HD3 LYS A 19 -3.566 -33.892 7.853 1.00 0.43 H new ATOM 0 HE2 LYS A 19 -2.715 -32.623 5.927 1.00 0.56 H new ATOM 0 HE3 LYS A 19 -1.065 -33.101 6.277 1.00 0.56 H new ATOM 0 HZ1 LYS A 19 -2.024 -34.478 4.529 1.00 0.68 H new ATOM 0 HZ2 LYS A 19 -1.687 -35.426 5.897 1.00 0.68 H new ATOM 0 HZ3 LYS A 19 -3.285 -34.963 5.558 1.00 0.68 H new ATOM 315 N GLN A 20 -4.341 -32.260 12.263 1.00 0.23 N ATOM 316 CA GLN A 20 -5.366 -32.188 13.298 1.00 0.22 C ATOM 317 C GLN A 20 -4.946 -32.993 14.524 1.00 0.54 C ATOM 318 O GLN A 20 -5.443 -32.700 15.599 1.00 0.99 O ATOM 319 CB GLN A 20 -6.694 -32.728 12.759 1.00 0.33 C ATOM 320 CG GLN A 20 -6.837 -32.356 11.282 1.00 0.74 C ATOM 321 CD GLN A 20 -6.726 -30.845 11.110 1.00 0.88 C ATOM 322 OE1 GLN A 20 -5.699 -30.346 10.650 1.00 0.69 O ATOM 323 NE2 GLN A 20 -7.727 -30.081 11.452 1.00 1.62 N ATOM 324 OXT GLN A 20 -4.134 -33.891 14.369 1.00 0.87 O ATOM 0 H GLN A 20 -4.235 -33.178 11.832 1.00 0.23 H new ATOM 0 HA GLN A 20 -5.491 -31.145 13.588 1.00 0.22 H new ATOM 0 HB2 GLN A 20 -6.733 -33.811 12.877 1.00 0.33 H new ATOM 0 HB3 GLN A 20 -7.525 -32.315 13.331 1.00 0.33 H new ATOM 0 HG2 GLN A 20 -6.064 -32.854 10.697 1.00 0.74 H new ATOM 0 HG3 GLN A 20 -7.798 -32.704 10.903 1.00 0.74 H new ATOM 0 HE21 GLN A 20 -8.578 -30.495 11.833 1.00 1.62 H new ATOM 0 HE22 GLN A 20 -7.659 -29.070 11.338 1.00 1.62 H new TER 333 GLN A 20 ATOM 334 O5' DT B 1 15.254 -10.881 -6.240 1.00 0.67 O ATOM 335 C5' DT B 1 15.558 -12.260 -6.016 1.00 0.62 C ATOM 336 C4' DT B 1 14.764 -12.821 -4.838 1.00 0.35 C ATOM 337 O4' DT B 1 13.366 -12.706 -5.101 1.00 0.24 O ATOM 338 C3' DT B 1 15.048 -14.300 -4.547 1.00 0.40 C ATOM 339 O3' DT B 1 15.536 -14.433 -3.207 1.00 0.42 O ATOM 340 C2' DT B 1 13.692 -14.995 -4.674 1.00 0.49 C ATOM 341 C1' DT B 1 12.721 -13.836 -4.528 1.00 0.31 C ATOM 342 N1 DT B 1 11.437 -14.027 -5.229 1.00 0.40 N ATOM 343 C2 DT B 1 10.294 -14.100 -4.456 1.00 0.57 C ATOM 344 O2 DT B 1 10.326 -14.013 -3.231 1.00 0.68 O ATOM 345 N3 DT B 1 9.107 -14.276 -5.145 1.00 0.77 N ATOM 346 C4 DT B 1 8.969 -14.384 -6.518 1.00 0.90 C ATOM 347 O4 DT B 1 7.860 -14.539 -7.026 1.00 1.15 O ATOM 348 C5 DT B 1 10.218 -14.296 -7.242 1.00 0.82 C ATOM 349 C7 DT B 1 10.211 -14.398 -8.764 1.00 1.13 C ATOM 350 C6 DT B 1 11.387 -14.125 -6.593 1.00 0.57 C ATOM 0 H5' DT B 1 16.625 -12.372 -5.824 1.00 0.62 H new ATOM 0 H5'' DT B 1 15.333 -12.834 -6.915 1.00 0.62 H new ATOM 0 H4' DT B 1 15.075 -12.237 -3.972 1.00 0.35 H new ATOM 0 H3' DT B 1 15.792 -14.724 -5.221 1.00 0.40 H new ATOM 0 H2' DT B 1 13.582 -15.500 -5.634 1.00 0.49 H new ATOM 0 H2'' DT B 1 13.546 -15.748 -3.899 1.00 0.49 H new ATOM 0 HO5' DT B 1 15.778 -10.550 -6.999 1.00 0.67 H new ATOM 0 H1' DT B 1 12.479 -13.730 -3.470 1.00 0.31 H new ATOM 0 H3 DT B 1 8.254 -14.331 -4.589 1.00 0.77 H new ATOM 0 H71 DT B 1 11.038 -13.817 -9.171 1.00 1.13 H new ATOM 0 H72 DT B 1 10.320 -15.442 -9.059 1.00 1.13 H new ATOM 0 H73 DT B 1 9.269 -14.008 -9.150 1.00 1.13 H new ATOM 0 H6 DT B 1 12.303 -14.064 -7.161 1.00 0.57 H new ATOM 364 P DT B 2 16.963 -13.811 -2.797 1.00 0.48 P ATOM 365 OP1 DT B 2 16.975 -12.383 -3.187 1.00 0.67 O ATOM 366 OP2 DT B 2 18.023 -14.718 -3.291 1.00 0.60 O ATOM 367 O5' DT B 2 16.940 -13.894 -1.189 1.00 0.46 O ATOM 368 C5' DT B 2 17.023 -15.155 -0.521 1.00 0.35 C ATOM 369 C4' DT B 2 15.639 -15.714 -0.197 1.00 0.26 C ATOM 370 O4' DT B 2 14.919 -15.951 -1.404 1.00 0.24 O ATOM 371 C3' DT B 2 15.669 -17.039 0.575 1.00 0.26 C ATOM 372 O3' DT B 2 15.023 -16.864 1.840 1.00 0.35 O ATOM 373 C2' DT B 2 14.863 -18.014 -0.285 1.00 0.30 C ATOM 374 C1' DT B 2 14.080 -17.076 -1.186 1.00 0.26 C ATOM 375 N1 DT B 2 13.731 -17.646 -2.500 1.00 0.31 N ATOM 376 C2 DT B 2 12.391 -17.697 -2.837 1.00 0.38 C ATOM 377 O2 DT B 2 11.512 -17.291 -2.081 1.00 0.42 O ATOM 378 N3 DT B 2 12.097 -18.235 -4.076 1.00 0.50 N ATOM 379 C4 DT B 2 13.015 -18.718 -4.993 1.00 0.54 C ATOM 380 O4 DT B 2 12.642 -19.177 -6.071 1.00 0.67 O ATOM 381 C5 DT B 2 14.389 -18.624 -4.555 1.00 0.48 C ATOM 382 C7 DT B 2 15.505 -19.119 -5.469 1.00 0.59 C ATOM 383 C6 DT B 2 14.701 -18.103 -3.350 1.00 0.38 C ATOM 0 H5' DT B 2 17.595 -15.042 0.400 1.00 0.35 H new ATOM 0 H5'' DT B 2 17.564 -15.864 -1.147 1.00 0.35 H new ATOM 0 H4' DT B 2 15.163 -14.962 0.432 1.00 0.26 H new ATOM 0 H3' DT B 2 16.683 -17.393 0.760 1.00 0.26 H new ATOM 0 H2' DT B 2 15.508 -18.682 -0.855 1.00 0.30 H new ATOM 0 H2'' DT B 2 14.207 -18.642 0.318 1.00 0.30 H new ATOM 0 H1' DT B 2 13.134 -16.845 -0.695 1.00 0.26 H new ATOM 0 H3 DT B 2 11.113 -18.280 -4.339 1.00 0.50 H new ATOM 0 H71 DT B 2 16.410 -18.540 -5.285 1.00 0.59 H new ATOM 0 H72 DT B 2 15.701 -20.172 -5.266 1.00 0.59 H new ATOM 0 H73 DT B 2 15.203 -19.000 -6.509 1.00 0.59 H new ATOM 0 H6 DT B 2 15.737 -18.046 -3.050 1.00 0.38 H new ATOM 396 P DG B 3 15.008 -18.055 2.923 1.00 0.47 P ATOM 397 OP1 DG B 3 14.703 -17.473 4.248 1.00 0.70 O ATOM 398 OP2 DG B 3 16.234 -18.862 2.738 1.00 0.66 O ATOM 399 O5' DG B 3 13.747 -18.942 2.461 1.00 0.36 O ATOM 400 C5' DG B 3 13.259 -19.993 3.300 1.00 0.36 C ATOM 401 C4' DG B 3 12.077 -20.724 2.669 1.00 0.37 C ATOM 402 O4' DG B 3 11.644 -21.762 3.548 1.00 0.34 O ATOM 403 C3' DG B 3 10.867 -19.826 2.389 1.00 0.39 C ATOM 404 O3' DG B 3 10.535 -19.878 0.994 1.00 0.49 O ATOM 405 C2' DG B 3 9.728 -20.419 3.215 1.00 0.32 C ATOM 406 C1' DG B 3 10.223 -21.825 3.515 1.00 0.28 C ATOM 407 N9 DG B 3 9.773 -22.350 4.817 1.00 0.27 N ATOM 408 C8 DG B 3 10.222 -22.026 6.070 1.00 0.32 C ATOM 409 N7 DG B 3 9.609 -22.654 7.032 1.00 0.32 N ATOM 410 C5 DG B 3 8.686 -23.457 6.372 1.00 0.26 C ATOM 411 C6 DG B 3 7.732 -24.368 6.902 1.00 0.24 C ATOM 412 O6 DG B 3 7.514 -24.644 8.080 1.00 0.30 O ATOM 413 N1 DG B 3 6.996 -24.975 5.894 1.00 0.21 N ATOM 414 C2 DG B 3 7.154 -24.738 4.545 1.00 0.19 C ATOM 415 N2 DG B 3 6.351 -25.421 3.728 1.00 0.21 N ATOM 416 N3 DG B 3 8.050 -23.881 4.045 1.00 0.19 N ATOM 417 C4 DG B 3 8.778 -23.279 5.014 1.00 0.23 C ATOM 0 H5' DG B 3 12.958 -19.579 4.262 1.00 0.36 H new ATOM 0 H5'' DG B 3 14.062 -20.703 3.496 1.00 0.36 H new ATOM 0 H4' DG B 3 12.437 -21.105 1.713 1.00 0.37 H new ATOM 0 H3' DG B 3 11.061 -18.784 2.645 1.00 0.39 H new ATOM 0 H2' DG B 3 9.552 -19.849 4.127 1.00 0.32 H new ATOM 0 H2'' DG B 3 8.790 -20.431 2.660 1.00 0.32 H new ATOM 0 H1' DG B 3 9.825 -22.488 2.747 1.00 0.28 H new ATOM 0 H8 DG B 3 11.014 -21.313 6.244 1.00 0.32 H new ATOM 0 H1 DG B 3 6.283 -25.649 6.173 1.00 0.21 H new ATOM 0 H21 DG B 3 6.419 -25.290 2.719 1.00 0.21 H new ATOM 0 H22 DG B 3 5.669 -26.075 4.112 1.00 0.21 H new ATOM 429 P DG B 4 10.402 -21.282 0.211 1.00 0.52 P ATOM 430 OP1 DG B 4 11.390 -22.226 0.776 1.00 0.61 O ATOM 431 OP2 DG B 4 10.406 -21.001 -1.242 1.00 0.79 O ATOM 432 O5' DG B 4 8.930 -21.793 0.616 1.00 0.38 O ATOM 433 C5' DG B 4 8.404 -22.990 0.031 1.00 0.36 C ATOM 434 C4' DG B 4 6.948 -23.228 0.423 1.00 0.30 C ATOM 435 O4' DG B 4 6.842 -23.388 1.834 1.00 0.28 O ATOM 436 C3' DG B 4 5.996 -22.090 0.034 1.00 0.30 C ATOM 437 O3' DG B 4 5.070 -22.564 -0.949 1.00 0.39 O ATOM 438 C2' DG B 4 5.248 -21.745 1.326 1.00 0.29 C ATOM 439 C1' DG B 4 5.544 -22.950 2.203 1.00 0.23 C ATOM 440 N9 DG B 4 5.548 -22.669 3.650 1.00 0.19 N ATOM 441 C8 DG B 4 6.407 -21.881 4.370 1.00 0.20 C ATOM 442 N7 DG B 4 6.143 -21.841 5.646 1.00 0.22 N ATOM 443 C5 DG B 4 5.030 -22.662 5.784 1.00 0.20 C ATOM 444 C6 DG B 4 4.290 -23.005 6.950 1.00 0.21 C ATOM 445 O6 DG B 4 4.482 -22.642 8.108 1.00 0.27 O ATOM 446 N1 DG B 4 3.238 -23.861 6.649 1.00 0.18 N ATOM 447 C2 DG B 4 2.935 -24.330 5.385 1.00 0.19 C ATOM 448 N2 DG B 4 1.886 -25.144 5.290 1.00 0.22 N ATOM 449 N3 DG B 4 3.630 -24.007 4.292 1.00 0.21 N ATOM 450 C4 DG B 4 4.658 -23.174 4.567 1.00 0.18 C ATOM 0 H5' DG B 4 9.007 -23.842 0.345 1.00 0.36 H new ATOM 0 H5'' DG B 4 8.481 -22.927 -1.054 1.00 0.36 H new ATOM 0 H4' DG B 4 6.653 -24.123 -0.125 1.00 0.30 H new ATOM 0 H3' DG B 4 6.519 -21.229 -0.382 1.00 0.30 H new ATOM 0 H2' DG B 4 5.611 -20.819 1.771 1.00 0.29 H new ATOM 0 H2'' DG B 4 4.179 -21.619 1.156 1.00 0.29 H new ATOM 0 H1' DG B 4 4.756 -23.686 2.046 1.00 0.23 H new ATOM 0 H8 DG B 4 7.228 -21.342 3.921 1.00 0.20 H new ATOM 0 H1 DG B 4 2.644 -24.167 7.420 1.00 0.18 H new ATOM 0 H21 DG B 4 1.614 -25.522 4.382 1.00 0.22 H new ATOM 0 H22 DG B 4 1.354 -25.390 6.125 1.00 0.22 H new ATOM 462 P DG B 5 3.808 -21.666 -1.389 1.00 0.49 P ATOM 463 OP1 DG B 5 3.400 -22.075 -2.752 1.00 0.70 O ATOM 464 OP2 DG B 5 4.129 -20.248 -1.112 1.00 0.58 O ATOM 465 O5' DG B 5 2.663 -22.134 -0.359 1.00 0.37 O ATOM 466 C5' DG B 5 2.126 -23.459 -0.420 1.00 0.39 C ATOM 467 C4' DG B 5 0.905 -23.611 0.483 1.00 0.33 C ATOM 468 O4' DG B 5 1.264 -23.289 1.825 1.00 0.34 O ATOM 469 C3' DG B 5 -0.265 -22.699 0.100 1.00 0.32 C ATOM 470 O3' DG B 5 -1.397 -23.497 -0.275 1.00 0.49 O ATOM 471 C2' DG B 5 -0.584 -21.901 1.367 1.00 0.33 C ATOM 472 C1' DG B 5 0.136 -22.690 2.448 1.00 0.30 C ATOM 473 N9 DG B 5 0.627 -21.874 3.572 1.00 0.26 N ATOM 474 C8 DG B 5 1.592 -20.902 3.566 1.00 0.28 C ATOM 475 N7 DG B 5 1.817 -20.374 4.736 1.00 0.29 N ATOM 476 C5 DG B 5 0.939 -21.042 5.580 1.00 0.26 C ATOM 477 C6 DG B 5 0.733 -20.893 6.978 1.00 0.27 C ATOM 478 O6 DG B 5 1.302 -20.128 7.754 1.00 0.30 O ATOM 479 N1 DG B 5 -0.248 -21.760 7.442 1.00 0.28 N ATOM 480 C2 DG B 5 -0.943 -22.660 6.660 1.00 0.31 C ATOM 481 N2 DG B 5 -1.851 -23.409 7.285 1.00 0.38 N ATOM 482 N3 DG B 5 -0.747 -22.801 5.346 1.00 0.31 N ATOM 483 C4 DG B 5 0.206 -21.963 4.876 1.00 0.26 C ATOM 0 H5' DG B 5 2.891 -24.176 -0.123 1.00 0.39 H new ATOM 0 H5'' DG B 5 1.851 -23.694 -1.448 1.00 0.39 H new ATOM 0 H4' DG B 5 0.581 -24.646 0.371 1.00 0.33 H new ATOM 0 H3' DG B 5 -0.024 -22.049 -0.741 1.00 0.32 H new ATOM 0 H2' DG B 5 -0.219 -20.876 1.303 1.00 0.33 H new ATOM 0 H2'' DG B 5 -1.657 -21.846 1.552 1.00 0.33 H new ATOM 0 H1' DG B 5 -0.576 -23.400 2.869 1.00 0.30 H new ATOM 0 H8 DG B 5 2.119 -20.600 2.673 1.00 0.28 H new ATOM 0 H1 DG B 5 -0.472 -21.729 8.437 1.00 0.28 H new ATOM 0 H21 DG B 5 -2.397 -24.093 6.760 1.00 0.38 H new ATOM 0 H22 DG B 5 -2.000 -23.299 8.288 1.00 0.38 H new ATOM 495 P DT B 6 -1.942 -24.682 0.673 1.00 0.64 P ATOM 496 OP1 DT B 6 -3.392 -24.471 0.891 1.00 0.85 O ATOM 497 OP2 DT B 6 -1.035 -24.811 1.832 1.00 0.66 O ATOM 498 O5' DT B 6 -1.758 -25.987 -0.250 1.00 0.62 O ATOM 499 C5' DT B 6 -2.461 -26.109 -1.489 1.00 0.62 C ATOM 500 C4' DT B 6 -2.297 -27.502 -2.091 1.00 0.58 C ATOM 501 O4' DT B 6 -2.951 -27.552 -3.364 1.00 0.59 O ATOM 502 C3' DT B 6 -0.845 -27.903 -2.324 1.00 0.44 C ATOM 503 O3' DT B 6 -0.701 -29.315 -2.138 1.00 0.58 O ATOM 504 C2' DT B 6 -0.619 -27.548 -3.781 1.00 0.29 C ATOM 505 C1' DT B 6 -1.984 -27.872 -4.370 1.00 0.34 C ATOM 506 N1 DT B 6 -2.328 -27.101 -5.583 1.00 0.44 N ATOM 507 C2 DT B 6 -3.666 -27.026 -5.924 1.00 0.63 C ATOM 508 O2 DT B 6 -4.542 -27.569 -5.255 1.00 0.69 O ATOM 509 N3 DT B 6 -3.962 -26.301 -7.064 1.00 0.85 N ATOM 510 C4 DT B 6 -3.049 -25.655 -7.880 1.00 0.93 C ATOM 511 O4 DT B 6 -3.425 -25.038 -8.873 1.00 1.18 O ATOM 512 C5 DT B 6 -1.677 -25.789 -7.446 1.00 0.76 C ATOM 513 C7 DT B 6 -0.567 -25.125 -8.255 1.00 0.93 C ATOM 514 C6 DT B 6 -1.362 -26.491 -6.337 1.00 0.50 C ATOM 0 H5' DT B 6 -2.093 -25.362 -2.192 1.00 0.62 H new ATOM 0 H5'' DT B 6 -3.519 -25.903 -1.330 1.00 0.62 H new ATOM 0 H4' DT B 6 -2.732 -28.190 -1.366 1.00 0.58 H new ATOM 0 H3' DT B 6 -0.144 -27.415 -1.647 1.00 0.44 H new ATOM 0 H2' DT B 6 -0.350 -26.500 -3.914 1.00 0.29 H new ATOM 0 H2'' DT B 6 0.177 -28.141 -4.232 1.00 0.29 H new ATOM 0 H1' DT B 6 -1.972 -28.921 -4.665 1.00 0.34 H new ATOM 0 H3 DT B 6 -4.945 -26.236 -7.328 1.00 0.85 H new ATOM 0 H71 DT B 6 0.254 -24.854 -7.592 1.00 0.93 H new ATOM 0 H72 DT B 6 -0.206 -25.818 -9.015 1.00 0.93 H new ATOM 0 H73 DT B 6 -0.955 -24.228 -8.737 1.00 0.93 H new ATOM 0 H6 DT B 6 -0.327 -26.573 -6.039 1.00 0.50 H new ATOM 527 P DG B 7 0.598 -29.918 -1.401 1.00 0.58 P ATOM 528 OP1 DG B 7 1.740 -29.013 -1.658 1.00 0.58 O ATOM 529 OP2 DG B 7 0.701 -31.353 -1.746 1.00 0.78 O ATOM 530 O5' DG B 7 0.204 -29.802 0.156 1.00 0.53 O ATOM 531 C5' DG B 7 1.217 -29.635 1.152 1.00 0.45 C ATOM 532 C4' DG B 7 0.656 -29.815 2.561 1.00 0.37 C ATOM 533 O4' DG B 7 1.701 -29.616 3.519 1.00 0.36 O ATOM 534 C3' DG B 7 -0.473 -28.840 2.908 1.00 0.33 C ATOM 535 O3' DG B 7 -1.540 -29.551 3.549 1.00 0.35 O ATOM 536 C2' DG B 7 0.164 -27.867 3.890 1.00 0.25 C ATOM 537 C1' DG B 7 1.220 -28.745 4.539 1.00 0.26 C ATOM 538 N9 DG B 7 2.373 -28.003 5.081 1.00 0.22 N ATOM 539 C8 DG B 7 3.419 -27.428 4.409 1.00 0.21 C ATOM 540 N7 DG B 7 4.287 -26.839 5.185 1.00 0.21 N ATOM 541 C5 DG B 7 3.780 -27.038 6.466 1.00 0.19 C ATOM 542 C6 DG B 7 4.293 -26.622 7.724 1.00 0.19 C ATOM 543 O6 DG B 7 5.317 -25.983 7.957 1.00 0.22 O ATOM 544 N1 DG B 7 3.474 -27.029 8.769 1.00 0.19 N ATOM 545 C2 DG B 7 2.306 -27.748 8.622 1.00 0.22 C ATOM 546 N2 DG B 7 1.652 -28.049 9.742 1.00 0.26 N ATOM 547 N3 DG B 7 1.822 -28.139 7.440 1.00 0.23 N ATOM 548 C4 DG B 7 2.608 -27.751 6.411 1.00 0.21 C ATOM 0 H5' DG B 7 1.659 -28.643 1.060 1.00 0.45 H new ATOM 0 H5'' DG B 7 2.016 -30.357 0.983 1.00 0.45 H new ATOM 0 H4' DG B 7 0.249 -30.826 2.591 1.00 0.37 H new ATOM 0 H3' DG B 7 -0.889 -28.341 2.033 1.00 0.33 H new ATOM 0 H2' DG B 7 0.600 -27.003 3.388 1.00 0.25 H new ATOM 0 H2'' DG B 7 -0.555 -27.485 4.615 1.00 0.25 H new ATOM 0 H1' DG B 7 0.758 -29.257 5.383 1.00 0.26 H new ATOM 0 H8 DG B 7 3.516 -27.459 3.334 1.00 0.21 H new ATOM 0 H1 DG B 7 3.757 -26.777 9.716 1.00 0.19 H new ATOM 0 H21 DG B 7 0.782 -28.579 9.698 1.00 0.26 H new ATOM 0 H22 DG B 7 2.021 -27.749 10.644 1.00 0.26 H new ATOM 560 P DG B 8 -2.979 -28.854 3.754 1.00 0.34 P ATOM 561 OP1 DG B 8 -4.025 -29.851 3.440 1.00 0.39 O ATOM 562 OP2 DG B 8 -2.966 -27.555 3.046 1.00 0.37 O ATOM 563 O5' DG B 8 -3.018 -28.561 5.338 1.00 0.35 O ATOM 564 C5' DG B 8 -3.565 -29.528 6.243 1.00 0.29 C ATOM 565 C4' DG B 8 -3.641 -28.986 7.669 1.00 0.23 C ATOM 566 O4' DG B 8 -2.346 -28.542 8.083 1.00 0.23 O ATOM 567 C3' DG B 8 -4.602 -27.802 7.834 1.00 0.25 C ATOM 568 O3' DG B 8 -5.510 -28.073 8.906 1.00 0.25 O ATOM 569 C2' DG B 8 -3.707 -26.624 8.203 1.00 0.30 C ATOM 570 C1' DG B 8 -2.502 -27.325 8.804 1.00 0.22 C ATOM 571 N9 DG B 8 -1.243 -26.566 8.685 1.00 0.24 N ATOM 572 C8 DG B 8 -0.451 -26.393 7.582 1.00 0.25 C ATOM 573 N7 DG B 8 0.601 -25.656 7.797 1.00 0.28 N ATOM 574 C5 DG B 8 0.504 -25.315 9.140 1.00 0.28 C ATOM 575 C6 DG B 8 1.370 -24.523 9.940 1.00 0.31 C ATOM 576 O6 DG B 8 2.409 -23.956 9.606 1.00 0.33 O ATOM 577 N1 DG B 8 0.908 -24.427 11.246 1.00 0.32 N ATOM 578 C2 DG B 8 -0.244 -25.020 11.724 1.00 0.30 C ATOM 579 N2 DG B 8 -0.526 -24.817 13.010 1.00 0.33 N ATOM 580 N3 DG B 8 -1.058 -25.765 10.970 1.00 0.27 N ATOM 581 C4 DG B 8 -0.622 -25.869 9.694 1.00 0.26 C ATOM 0 H5' DG B 8 -2.951 -30.429 6.228 1.00 0.29 H new ATOM 0 H5'' DG B 8 -4.562 -29.816 5.909 1.00 0.29 H new ATOM 0 H4' DG B 8 -4.013 -29.810 8.277 1.00 0.23 H new ATOM 0 H3' DG B 8 -5.190 -27.610 6.936 1.00 0.25 H new ATOM 0 H2' DG B 8 -3.439 -26.025 7.332 1.00 0.30 H new ATOM 0 H2'' DG B 8 -4.187 -25.953 8.916 1.00 0.30 H new ATOM 0 H1' DG B 8 -2.686 -27.456 9.870 1.00 0.22 H new ATOM 0 H8 DG B 8 -0.678 -26.828 6.620 1.00 0.25 H new ATOM 0 H1 DG B 8 1.462 -23.877 11.902 1.00 0.32 H new ATOM 0 H21 DG B 8 -1.364 -25.230 13.420 1.00 0.33 H new ATOM 0 H22 DG B 8 0.096 -24.249 13.585 1.00 0.33 H new ATOM 593 P DG B 9 -6.565 -26.954 9.387 1.00 0.31 P ATOM 594 OP1 DG B 9 -7.735 -27.642 9.977 1.00 0.36 O ATOM 595 OP2 DG B 9 -6.755 -25.992 8.279 1.00 0.41 O ATOM 596 O5' DG B 9 -5.771 -26.204 10.573 1.00 0.26 O ATOM 597 C5' DG B 9 -5.524 -26.871 11.815 1.00 0.18 C ATOM 598 C4' DG B 9 -5.045 -25.900 12.891 1.00 0.19 C ATOM 599 O4' DG B 9 -3.833 -25.267 12.464 1.00 0.17 O ATOM 600 C3' DG B 9 -6.047 -24.785 13.213 1.00 0.28 C ATOM 601 O3' DG B 9 -6.181 -24.663 14.634 1.00 0.34 O ATOM 602 C2' DG B 9 -5.400 -23.526 12.650 1.00 0.28 C ATOM 603 C1' DG B 9 -3.930 -23.877 12.766 1.00 0.21 C ATOM 604 N9 DG B 9 -3.050 -23.145 11.833 1.00 0.20 N ATOM 605 C8 DG B 9 -3.047 -23.156 10.461 1.00 0.23 C ATOM 606 N7 DG B 9 -2.126 -22.401 9.929 1.00 0.24 N ATOM 607 C5 DG B 9 -1.470 -21.850 11.024 1.00 0.21 C ATOM 608 C6 DG B 9 -0.374 -20.945 11.068 1.00 0.24 C ATOM 609 O6 DG B 9 0.242 -20.448 10.128 1.00 0.29 O ATOM 610 N1 DG B 9 -0.019 -20.638 12.376 1.00 0.25 N ATOM 611 C2 DG B 9 -0.640 -21.138 13.502 1.00 0.24 C ATOM 612 N2 DG B 9 -0.160 -20.726 14.675 1.00 0.27 N ATOM 613 N3 DG B 9 -1.670 -21.988 13.461 1.00 0.20 N ATOM 614 C4 DG B 9 -2.030 -22.298 12.194 1.00 0.19 C ATOM 0 H5' DG B 9 -4.775 -27.649 11.668 1.00 0.18 H new ATOM 0 H5'' DG B 9 -6.436 -27.365 12.150 1.00 0.18 H new ATOM 0 H4' DG B 9 -4.908 -26.503 13.788 1.00 0.19 H new ATOM 0 H3' DG B 9 -7.038 -24.971 12.798 1.00 0.28 H new ATOM 0 H2' DG B 9 -5.698 -23.335 11.619 1.00 0.28 H new ATOM 0 H2'' DG B 9 -5.658 -22.637 13.226 1.00 0.28 H new ATOM 0 H1' DG B 9 -3.597 -23.607 13.768 1.00 0.21 H new ATOM 0 H8 DG B 9 -3.744 -23.737 9.875 1.00 0.23 H new ATOM 0 H1 DG B 9 0.760 -19.994 12.514 1.00 0.25 H new ATOM 0 H21 DG B 9 -0.578 -21.061 15.543 1.00 0.27 H new ATOM 0 H22 DG B 9 0.625 -20.076 14.705 1.00 0.27 H new ATOM 626 P DT B 10 -6.876 -25.831 15.498 1.00 0.35 P ATOM 627 OP1 DT B 10 -6.098 -27.076 15.302 1.00 0.43 O ATOM 628 OP2 DT B 10 -8.328 -25.816 15.215 1.00 0.39 O ATOM 629 O5' DT B 10 -6.653 -25.330 17.012 1.00 0.31 O ATOM 630 C5' DT B 10 -5.451 -25.657 17.717 1.00 0.33 C ATOM 631 C4' DT B 10 -5.636 -26.891 18.597 1.00 0.38 C ATOM 632 O4' DT B 10 -6.628 -26.624 19.595 1.00 0.33 O ATOM 633 C3' DT B 10 -6.088 -28.136 17.830 1.00 0.43 C ATOM 634 O3' DT B 10 -5.324 -29.269 18.258 1.00 0.48 O ATOM 635 C2' DT B 10 -7.544 -28.316 18.235 1.00 0.46 C ATOM 636 C1' DT B 10 -7.542 -27.717 19.630 1.00 0.39 C ATOM 637 N1 DT B 10 -8.851 -27.200 20.070 1.00 0.36 N ATOM 638 C2 DT B 10 -9.425 -27.783 21.183 1.00 0.50 C ATOM 639 O2 DT B 10 -8.882 -28.702 21.793 1.00 0.73 O ATOM 640 N3 DT B 10 -10.650 -27.273 21.572 1.00 0.48 N ATOM 641 C4 DT B 10 -11.338 -26.244 20.952 1.00 0.41 C ATOM 642 O4 DT B 10 -12.426 -25.868 21.384 1.00 0.47 O ATOM 643 C5 DT B 10 -10.661 -25.697 19.797 1.00 0.45 C ATOM 644 C7 DT B 10 -11.308 -24.556 19.019 1.00 0.70 C ATOM 645 C6 DT B 10 -9.467 -26.179 19.398 1.00 0.39 C ATOM 0 H5' DT B 10 -5.148 -24.811 18.334 1.00 0.33 H new ATOM 0 H5'' DT B 10 -4.646 -25.835 17.003 1.00 0.33 H new ATOM 0 H4' DT B 10 -4.656 -27.096 19.027 1.00 0.38 H new ATOM 0 H3' DT B 10 -5.959 -28.039 16.752 1.00 0.43 H new ATOM 0 H2' DT B 10 -8.225 -27.792 17.564 1.00 0.46 H new ATOM 0 H2'' DT B 10 -7.843 -29.364 18.238 1.00 0.46 H new ATOM 0 H1' DT B 10 -7.272 -28.505 20.333 1.00 0.39 H new ATOM 0 H3 DT B 10 -11.087 -27.694 22.392 1.00 0.48 H new ATOM 0 H71 DT B 10 -10.532 -23.932 18.575 1.00 0.70 H new ATOM 0 H72 DT B 10 -11.940 -24.965 18.231 1.00 0.70 H new ATOM 0 H73 DT B 10 -11.915 -23.953 19.694 1.00 0.70 H new ATOM 0 H6 DT B 10 -8.987 -25.751 18.531 1.00 0.39 H new ATOM 658 P DG B 11 -3.727 -29.302 18.058 1.00 0.35 P ATOM 659 OP1 DG B 11 -3.279 -30.711 18.145 1.00 0.43 O ATOM 660 OP2 DG B 11 -3.125 -28.281 18.944 1.00 0.47 O ATOM 661 O5' DG B 11 -3.558 -28.815 16.534 1.00 0.25 O ATOM 662 C5' DG B 11 -2.350 -29.070 15.815 1.00 0.23 C ATOM 663 C4' DG B 11 -1.133 -28.480 16.524 1.00 0.18 C ATOM 664 O4' DG B 11 0.025 -28.691 15.718 1.00 0.20 O ATOM 665 C3' DG B 11 -1.241 -26.974 16.789 1.00 0.19 C ATOM 666 O3' DG B 11 -1.104 -26.724 18.193 1.00 0.28 O ATOM 667 C2' DG B 11 -0.063 -26.353 16.039 1.00 0.14 C ATOM 668 C1' DG B 11 0.858 -27.543 15.817 1.00 0.17 C ATOM 669 N9 DG B 11 1.652 -27.460 14.578 1.00 0.18 N ATOM 670 C8 DG B 11 1.472 -28.137 13.401 1.00 0.17 C ATOM 671 N7 DG B 11 2.334 -27.827 12.476 1.00 0.18 N ATOM 672 C5 DG B 11 3.148 -26.875 13.081 1.00 0.21 C ATOM 673 C6 DG B 11 4.266 -26.169 12.559 1.00 0.24 C ATOM 674 O6 DG B 11 4.758 -26.247 11.435 1.00 0.24 O ATOM 675 N1 DG B 11 4.803 -25.301 13.500 1.00 0.27 N ATOM 676 C2 DG B 11 4.325 -25.133 14.784 1.00 0.28 C ATOM 677 N2 DG B 11 4.973 -24.253 15.549 1.00 0.34 N ATOM 678 N3 DG B 11 3.274 -25.794 15.274 1.00 0.24 N ATOM 679 C4 DG B 11 2.738 -26.646 14.370 1.00 0.21 C ATOM 0 H5' DG B 11 -2.427 -28.648 14.813 1.00 0.23 H new ATOM 0 H5'' DG B 11 -2.217 -30.145 15.698 1.00 0.23 H new ATOM 0 H4' DG B 11 -1.070 -28.985 17.488 1.00 0.18 H new ATOM 0 H3' DG B 11 -2.198 -26.564 16.466 1.00 0.19 H new ATOM 0 H2' DG B 11 -0.375 -25.902 15.097 1.00 0.14 H new ATOM 0 H2'' DG B 11 0.421 -25.570 16.623 1.00 0.14 H new ATOM 0 H1' DG B 11 1.565 -27.577 16.645 1.00 0.17 H new ATOM 0 H8 DG B 11 0.686 -28.863 13.254 1.00 0.17 H new ATOM 0 H1 DG B 11 5.612 -24.745 13.222 1.00 0.27 H new ATOM 0 H21 DG B 11 4.666 -24.086 16.507 1.00 0.34 H new ATOM 0 H22 DG B 11 5.776 -23.747 15.176 1.00 0.34 H new ATOM 691 P DG B 12 -1.662 -25.355 18.835 1.00 0.34 P ATOM 692 OP1 DG B 12 -1.849 -25.567 20.287 1.00 0.43 O ATOM 693 OP2 DG B 12 -2.796 -24.886 18.008 1.00 0.39 O ATOM 694 O5' DG B 12 -0.433 -24.333 18.630 1.00 0.27 O ATOM 695 C5' DG B 12 0.580 -24.202 19.632 1.00 0.23 C ATOM 696 C4' DG B 12 1.543 -23.061 19.311 1.00 0.17 C ATOM 697 O4' DG B 12 2.121 -23.270 18.020 1.00 0.20 O ATOM 698 C3' DG B 12 0.880 -21.678 19.295 1.00 0.14 C ATOM 699 O3' DG B 12 1.621 -20.788 20.137 1.00 0.20 O ATOM 700 C2' DG B 12 0.977 -21.220 17.843 1.00 0.17 C ATOM 701 C1' DG B 12 2.168 -22.018 17.343 1.00 0.16 C ATOM 702 N9 DG B 12 2.149 -22.289 15.892 1.00 0.17 N ATOM 703 C8 DG B 12 1.196 -22.946 15.153 1.00 0.19 C ATOM 704 N7 DG B 12 1.479 -23.033 13.884 1.00 0.21 N ATOM 705 C5 DG B 12 2.705 -22.388 13.768 1.00 0.20 C ATOM 706 C6 DG B 12 3.510 -22.168 12.617 1.00 0.22 C ATOM 707 O6 DG B 12 3.289 -22.511 11.457 1.00 0.25 O ATOM 708 N1 DG B 12 4.672 -21.476 12.933 1.00 0.23 N ATOM 709 C2 DG B 12 5.017 -21.049 14.200 1.00 0.22 C ATOM 710 N2 DG B 12 6.174 -20.397 14.308 1.00 0.26 N ATOM 711 N3 DG B 12 4.261 -21.256 15.282 1.00 0.19 N ATOM 712 C4 DG B 12 3.124 -21.929 14.992 1.00 0.18 C ATOM 0 H5' DG B 12 1.136 -25.136 19.713 1.00 0.23 H new ATOM 0 H5'' DG B 12 0.114 -24.024 20.601 1.00 0.23 H new ATOM 0 H4' DG B 12 2.288 -23.070 20.107 1.00 0.17 H new ATOM 0 H3' DG B 12 -0.149 -21.698 19.654 1.00 0.14 H new ATOM 0 H2' DG B 12 0.070 -21.445 17.282 1.00 0.17 H new ATOM 0 H2'' DG B 12 1.143 -20.146 17.764 1.00 0.17 H new ATOM 0 H1' DG B 12 3.069 -21.435 17.536 1.00 0.16 H new ATOM 0 H8 DG B 12 0.294 -23.354 15.584 1.00 0.19 H new ATOM 0 H1 DG B 12 5.319 -21.268 12.172 1.00 0.23 H new ATOM 0 H21 DG B 12 6.484 -20.056 15.218 1.00 0.26 H new ATOM 0 H22 DG B 12 6.749 -20.239 13.481 1.00 0.26 H new ATOM 724 P DG B 13 1.168 -19.251 20.301 1.00 0.23 P ATOM 725 OP1 DG B 13 1.443 -18.832 21.694 1.00 0.27 O ATOM 726 OP2 DG B 13 -0.195 -19.108 19.744 1.00 0.26 O ATOM 727 O5' DG B 13 2.193 -18.475 19.331 1.00 0.26 O ATOM 728 C5' DG B 13 3.567 -18.323 19.699 1.00 0.22 C ATOM 729 C4' DG B 13 4.318 -17.431 18.714 1.00 0.21 C ATOM 730 O4' DG B 13 4.264 -18.010 17.406 1.00 0.24 O ATOM 731 C3' DG B 13 3.749 -16.012 18.607 1.00 0.20 C ATOM 732 O3' DG B 13 4.814 -15.060 18.697 1.00 0.23 O ATOM 733 C2' DG B 13 3.126 -15.957 17.217 1.00 0.23 C ATOM 734 C1' DG B 13 3.965 -16.978 16.469 1.00 0.20 C ATOM 735 N9 DG B 13 3.284 -17.596 15.318 1.00 0.21 N ATOM 736 C8 DG B 13 2.101 -18.288 15.290 1.00 0.29 C ATOM 737 N7 DG B 13 1.768 -18.721 14.108 1.00 0.31 N ATOM 738 C5 DG B 13 2.803 -18.287 13.288 1.00 0.22 C ATOM 739 C6 DG B 13 2.990 -18.462 11.890 1.00 0.22 C ATOM 740 O6 DG B 13 2.262 -19.050 11.091 1.00 0.28 O ATOM 741 N1 DG B 13 4.166 -17.866 11.455 1.00 0.21 N ATOM 742 C2 DG B 13 5.055 -17.186 12.264 1.00 0.24 C ATOM 743 N2 DG B 13 6.132 -16.680 11.667 1.00 0.34 N ATOM 744 N3 DG B 13 4.880 -17.021 13.579 1.00 0.21 N ATOM 745 C4 DG B 13 3.737 -17.597 14.019 1.00 0.19 C ATOM 0 H5' DG B 13 4.044 -19.302 19.740 1.00 0.22 H new ATOM 0 H5'' DG B 13 3.631 -17.895 20.700 1.00 0.22 H new ATOM 0 H4' DG B 13 5.336 -17.360 19.096 1.00 0.21 H new ATOM 0 H3' DG B 13 3.033 -15.784 19.397 1.00 0.20 H new ATOM 0 H2' DG B 13 2.069 -16.225 17.230 1.00 0.23 H new ATOM 0 H2'' DG B 13 3.198 -14.964 16.774 1.00 0.23 H new ATOM 0 H1' DG B 13 4.840 -16.466 16.068 1.00 0.20 H new ATOM 0 H8 DG B 13 1.499 -18.459 16.170 1.00 0.29 H new ATOM 0 H1 DG B 13 4.390 -17.936 10.462 1.00 0.21 H new ATOM 0 H21 DG B 13 6.824 -16.167 12.213 1.00 0.34 H new ATOM 0 H22 DG B 13 6.265 -16.805 10.663 1.00 0.34 H new ATOM 757 P DT B 14 5.384 -14.599 20.131 1.00 0.32 P ATOM 758 OP1 DT B 14 4.261 -14.602 21.097 1.00 0.52 O ATOM 759 OP2 DT B 14 6.185 -13.370 19.938 1.00 0.57 O ATOM 760 O5' DT B 14 6.387 -15.797 20.522 1.00 0.19 O ATOM 761 C5' DT B 14 7.032 -15.809 21.798 1.00 0.22 C ATOM 762 C4' DT B 14 8.067 -16.927 21.901 1.00 0.17 C ATOM 763 O4' DT B 14 8.658 -16.910 23.202 1.00 0.18 O ATOM 764 C3' DT B 14 7.490 -18.330 21.680 1.00 0.14 C ATOM 765 O3' DT B 14 8.227 -18.990 20.643 1.00 0.21 O ATOM 766 C2' DT B 14 7.703 -19.054 23.008 1.00 0.13 C ATOM 767 C1' DT B 14 8.837 -18.256 23.627 1.00 0.15 C ATOM 768 N1 DT B 14 8.849 -18.263 25.103 1.00 0.16 N ATOM 769 C2 DT B 14 9.927 -18.861 25.728 1.00 0.24 C ATOM 770 O2 DT B 14 10.846 -19.376 25.095 1.00 0.34 O ATOM 771 N3 DT B 14 9.911 -18.846 27.110 1.00 0.24 N ATOM 772 C4 DT B 14 8.925 -18.293 27.909 1.00 0.22 C ATOM 773 O4 DT B 14 9.012 -18.336 29.134 1.00 0.25 O ATOM 774 C5 DT B 14 7.839 -17.692 27.168 1.00 0.24 C ATOM 775 C7 DT B 14 6.685 -17.042 27.923 1.00 0.36 C ATOM 776 C6 DT B 14 7.831 -17.694 25.819 1.00 0.21 C ATOM 0 H5' DT B 14 6.285 -15.933 22.582 1.00 0.22 H new ATOM 0 H5'' DT B 14 7.517 -14.848 21.969 1.00 0.22 H new ATOM 0 H4' DT B 14 8.792 -16.733 21.110 1.00 0.17 H new ATOM 0 H3' DT B 14 6.441 -18.310 21.385 1.00 0.14 H new ATOM 0 H2' DT B 14 6.807 -19.038 23.629 1.00 0.13 H new ATOM 0 H2'' DT B 14 7.972 -20.100 22.863 1.00 0.13 H new ATOM 0 H1' DT B 14 9.776 -18.708 23.308 1.00 0.15 H new ATOM 0 H3 DT B 14 10.700 -19.284 27.586 1.00 0.24 H new ATOM 0 H71 DT B 14 6.273 -16.228 27.327 1.00 0.36 H new ATOM 0 H72 DT B 14 5.909 -17.784 28.110 1.00 0.36 H new ATOM 0 H73 DT B 14 7.047 -16.649 28.873 1.00 0.36 H new ATOM 0 H6 DT B 14 7.005 -17.238 25.294 1.00 0.21 H new ATOM 789 P DG B 15 9.742 -19.479 20.893 1.00 0.24 P ATOM 790 OP1 DG B 15 9.697 -20.834 21.487 1.00 0.30 O ATOM 791 OP2 DG B 15 10.471 -18.393 21.586 1.00 0.33 O ATOM 792 O5' DG B 15 10.326 -19.604 19.398 1.00 0.27 O ATOM 793 C5' DG B 15 9.884 -20.651 18.530 1.00 0.26 C ATOM 794 C4' DG B 15 10.530 -20.547 17.151 1.00 0.25 C ATOM 795 O4' DG B 15 10.076 -21.622 16.333 1.00 0.26 O ATOM 796 C3' DG B 15 10.207 -19.244 16.414 1.00 0.24 C ATOM 797 O3' DG B 15 11.424 -18.544 16.133 1.00 0.27 O ATOM 798 C2' DG B 15 9.545 -19.678 15.105 1.00 0.22 C ATOM 799 C1' DG B 15 9.939 -21.144 15.002 1.00 0.21 C ATOM 800 N9 DG B 15 8.939 -21.994 14.331 1.00 0.22 N ATOM 801 C8 DG B 15 7.907 -22.699 14.892 1.00 0.24 C ATOM 802 N7 DG B 15 7.194 -23.369 14.032 1.00 0.25 N ATOM 803 C5 DG B 15 7.794 -23.090 12.810 1.00 0.22 C ATOM 804 C6 DG B 15 7.451 -23.542 11.507 1.00 0.23 C ATOM 805 O6 DG B 15 6.533 -24.292 11.178 1.00 0.25 O ATOM 806 N1 DG B 15 8.311 -23.026 10.548 1.00 0.21 N ATOM 807 C2 DG B 15 9.370 -22.179 10.807 1.00 0.21 C ATOM 808 N2 DG B 15 10.085 -21.787 9.753 1.00 0.22 N ATOM 809 N3 DG B 15 9.693 -21.754 12.032 1.00 0.20 N ATOM 810 C4 DG B 15 8.864 -22.247 12.981 1.00 0.20 C ATOM 0 H5' DG B 15 8.800 -20.607 18.429 1.00 0.26 H new ATOM 0 H5'' DG B 15 10.124 -21.618 18.973 1.00 0.26 H new ATOM 0 H4' DG B 15 11.606 -20.579 17.322 1.00 0.25 H new ATOM 0 H3' DG B 15 9.565 -18.584 16.997 1.00 0.24 H new ATOM 0 H2' DG B 15 8.463 -19.551 15.137 1.00 0.22 H new ATOM 0 H2'' DG B 15 9.909 -19.100 14.256 1.00 0.22 H new ATOM 0 H1' DG B 15 10.850 -21.199 14.407 1.00 0.21 H new ATOM 0 H8 DG B 15 7.703 -22.699 15.953 1.00 0.24 H new ATOM 0 H1 DG B 15 8.148 -23.293 9.577 1.00 0.21 H new ATOM 0 H21 DG B 15 10.880 -21.161 9.880 1.00 0.22 H new ATOM 0 H22 DG B 15 9.837 -22.113 8.819 1.00 0.22 H new ATOM 822 P DG B 16 11.402 -16.963 15.821 1.00 0.35 P ATOM 823 OP1 DG B 16 12.732 -16.406 16.154 1.00 0.45 O ATOM 824 OP2 DG B 16 10.187 -16.388 16.439 1.00 0.43 O ATOM 825 O5' DG B 16 11.223 -16.919 14.223 1.00 0.28 O ATOM 826 C5' DG B 16 12.364 -16.993 13.362 1.00 0.25 C ATOM 827 C4' DG B 16 11.958 -16.951 11.893 1.00 0.21 C ATOM 828 O4' DG B 16 11.104 -18.060 11.602 1.00 0.21 O ATOM 829 C3' DG B 16 11.203 -15.678 11.495 1.00 0.21 C ATOM 830 O3' DG B 16 11.876 -15.050 10.400 1.00 0.21 O ATOM 831 C2' DG B 16 9.826 -16.163 11.046 1.00 0.20 C ATOM 832 C1' DG B 16 10.099 -17.616 10.698 1.00 0.17 C ATOM 833 N9 DG B 16 8.932 -18.505 10.851 1.00 0.16 N ATOM 834 C8 DG B 16 8.185 -18.756 11.972 1.00 0.17 C ATOM 835 N7 DG B 16 7.213 -19.601 11.781 1.00 0.18 N ATOM 836 C5 DG B 16 7.319 -19.936 10.435 1.00 0.17 C ATOM 837 C6 DG B 16 6.526 -20.819 9.652 1.00 0.20 C ATOM 838 O6 DG B 16 5.559 -21.490 10.005 1.00 0.21 O ATOM 839 N1 DG B 16 6.971 -20.870 8.337 1.00 0.24 N ATOM 840 C2 DG B 16 8.045 -20.160 7.837 1.00 0.26 C ATOM 841 N2 DG B 16 8.324 -20.337 6.546 1.00 0.32 N ATOM 842 N3 DG B 16 8.789 -19.330 8.574 1.00 0.22 N ATOM 843 C4 DG B 16 8.369 -19.269 9.857 1.00 0.18 C ATOM 0 H5' DG B 16 12.914 -17.913 13.563 1.00 0.25 H new ATOM 0 H5'' DG B 16 13.039 -16.165 13.578 1.00 0.25 H new ATOM 0 H4' DG B 16 12.889 -16.982 11.327 1.00 0.21 H new ATOM 0 H3' DG B 16 11.140 -14.956 12.309 1.00 0.21 H new ATOM 0 H2' DG B 16 9.082 -16.066 11.837 1.00 0.20 H new ATOM 0 H2'' DG B 16 9.455 -15.601 10.189 1.00 0.20 H new ATOM 0 H1' DG B 16 10.386 -17.661 9.647 1.00 0.17 H new ATOM 0 H8 DG B 16 8.385 -18.295 12.928 1.00 0.17 H new ATOM 0 H1 DG B 16 6.466 -21.478 7.692 1.00 0.24 H new ATOM 0 H21 DG B 16 9.106 -19.839 6.120 1.00 0.32 H new ATOM 0 H22 DG B 16 7.756 -20.970 5.984 1.00 0.32 H new ATOM 855 P DG B 17 11.246 -13.748 9.691 1.00 0.26 P ATOM 856 OP1 DG B 17 12.355 -12.936 9.142 1.00 0.33 O ATOM 857 OP2 DG B 17 10.278 -13.135 10.628 1.00 0.29 O ATOM 858 O5' DG B 17 10.424 -14.379 8.460 1.00 0.25 O ATOM 859 C5' DG B 17 11.115 -14.979 7.361 1.00 0.21 C ATOM 860 C4' DG B 17 10.156 -15.370 6.240 1.00 0.20 C ATOM 861 O4' DG B 17 9.201 -16.314 6.732 1.00 0.18 O ATOM 862 C3' DG B 17 9.369 -14.190 5.657 1.00 0.26 C ATOM 863 O3' DG B 17 9.528 -14.170 4.234 1.00 0.25 O ATOM 864 C2' DG B 17 7.915 -14.485 6.010 1.00 0.30 C ATOM 865 C1' DG B 17 7.936 -15.994 6.165 1.00 0.22 C ATOM 866 N9 DG B 17 6.890 -16.527 7.060 1.00 0.23 N ATOM 867 C8 DG B 17 6.675 -16.262 8.389 1.00 0.23 C ATOM 868 N7 DG B 17 5.660 -16.901 8.897 1.00 0.24 N ATOM 869 C5 DG B 17 5.164 -17.644 7.832 1.00 0.24 C ATOM 870 C6 DG B 17 4.060 -18.538 7.783 1.00 0.26 C ATOM 871 O6 DG B 17 3.293 -18.852 8.691 1.00 0.28 O ATOM 872 N1 DG B 17 3.901 -19.081 6.514 1.00 0.27 N ATOM 873 C2 DG B 17 4.705 -18.799 5.427 1.00 0.27 C ATOM 874 N2 DG B 17 4.399 -19.417 4.287 1.00 0.30 N ATOM 875 N3 DG B 17 5.743 -17.960 5.474 1.00 0.25 N ATOM 876 C4 DG B 17 5.911 -17.422 6.703 1.00 0.23 C ATOM 0 H5' DG B 17 11.651 -15.863 7.707 1.00 0.21 H new ATOM 0 H5'' DG B 17 11.861 -14.284 6.976 1.00 0.21 H new ATOM 0 H4' DG B 17 10.782 -15.784 5.449 1.00 0.20 H new ATOM 0 H3' DG B 17 9.703 -13.227 6.045 1.00 0.26 H new ATOM 0 H2' DG B 17 7.607 -13.984 6.927 1.00 0.30 H new ATOM 0 H2'' DG B 17 7.230 -14.164 5.225 1.00 0.30 H new ATOM 0 H1' DG B 17 7.755 -16.437 5.186 1.00 0.22 H new ATOM 0 H8 DG B 17 7.291 -15.585 8.962 1.00 0.23 H new ATOM 0 H1 DG B 17 3.133 -19.737 6.375 1.00 0.27 H new ATOM 0 H21 DG B 17 4.957 -19.249 3.450 1.00 0.30 H new ATOM 0 H22 DG B 17 3.607 -20.059 4.251 1.00 0.30 H new ATOM 888 P DT B 18 8.802 -13.041 3.344 1.00 0.28 P ATOM 889 OP1 DT B 18 9.755 -12.587 2.307 1.00 0.36 O ATOM 890 OP2 DT B 18 8.183 -12.057 4.259 1.00 0.45 O ATOM 891 O5' DT B 18 7.624 -13.865 2.618 1.00 0.28 O ATOM 892 C5' DT B 18 7.929 -14.811 1.592 1.00 0.39 C ATOM 893 C4' DT B 18 6.697 -15.157 0.758 1.00 0.44 C ATOM 894 O4' DT B 18 5.709 -15.777 1.594 1.00 0.53 O ATOM 895 C3' DT B 18 6.034 -13.945 0.103 1.00 0.34 C ATOM 896 O3' DT B 18 5.565 -14.258 -1.213 1.00 0.48 O ATOM 897 C2' DT B 18 4.879 -13.644 1.042 1.00 0.40 C ATOM 898 C1' DT B 18 4.489 -15.046 1.467 1.00 0.53 C ATOM 899 N1 DT B 18 3.778 -15.120 2.759 1.00 0.67 N ATOM 900 C2 DT B 18 2.542 -15.740 2.770 1.00 0.89 C ATOM 901 O2 DT B 18 2.040 -16.215 1.754 1.00 0.95 O ATOM 902 N3 DT B 18 1.903 -15.795 3.995 1.00 1.07 N ATOM 903 C4 DT B 18 2.386 -15.291 5.190 1.00 1.05 C ATOM 904 O4 DT B 18 1.730 -15.395 6.224 1.00 1.23 O ATOM 905 C5 DT B 18 3.682 -14.662 5.080 1.00 0.82 C ATOM 906 C7 DT B 18 4.333 -14.063 6.322 1.00 0.83 C ATOM 907 C6 DT B 18 4.326 -14.595 3.898 1.00 0.64 C ATOM 0 H5' DT B 18 8.331 -15.719 2.042 1.00 0.39 H new ATOM 0 H5'' DT B 18 8.706 -14.406 0.943 1.00 0.39 H new ATOM 0 H4' DT B 18 7.053 -15.819 -0.031 1.00 0.44 H new ATOM 0 H3' DT B 18 6.712 -13.102 -0.029 1.00 0.34 H new ATOM 0 H2' DT B 18 5.183 -13.025 1.886 1.00 0.40 H new ATOM 0 H2'' DT B 18 4.064 -13.122 0.541 1.00 0.40 H new ATOM 0 HO3' DT B 18 5.144 -13.466 -1.607 1.00 0.48 H new ATOM 0 H1' DT B 18 3.801 -15.442 0.720 1.00 0.53 H new ATOM 0 H3 DT B 18 0.990 -16.250 4.020 1.00 1.07 H new ATOM 0 H71 DT B 18 3.559 -13.717 7.008 1.00 0.83 H new ATOM 0 H72 DT B 18 4.942 -14.821 6.815 1.00 0.83 H new ATOM 0 H73 DT B 18 4.964 -13.222 6.033 1.00 0.83 H new ATOM 0 H6 DT B 18 5.294 -14.118 3.849 1.00 0.64 H new TER 921 DT B 18