USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 460 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 G O2' : rot 46:sc= -5.93! USER MOD Single : A 2 C O2' : rot -14:sc= 0.149 USER MOD Single : A 3 C O2' : rot 48:sc= -5.75! USER MOD Single : A 4 C O2' : rot 180:sc= -0.946 USER MOD Single : A 5 U O2' : rot -21:sc= -0.273 USER MOD Single : A 6 G O2' : rot -84:sc= -0.0484 USER MOD Single : A 7 A O2' : rot 180:sc= -5.51! USER MOD Single : A 8 A O2' : rot 54:sc= -3.12! USER MOD Single : A 9 A O2' : rot -16:sc= 0.127 USER MOD Single : A 10 A O2' : rot -19:sc= 0.144 USER MOD Single : A 11 A O2' : rot -83:sc= -0.508! USER MOD Single : A 12 G O2' : rot -22:sc= 0.151 USER MOD Single : A 13 G O2' : rot -108:sc= 0.339 USER MOD Single : A 14 G O2' : rot 180:sc= -2.07! USER MOD Single : A 15 C O2' : rot -31:sc= 0.168 USER MOD Single : A 15 C O3' : rot 180:sc= 0.123 USER MOD Single : B 4 GLN : amide:sc= -3.91 K(o=-3.9,f=-4.9!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 GLN : amide:sc= -5.62! C(o=-5.6!,f=-3.8!) USER MOD Single : B 17 GLN : amide:sc= -0.206 K(o=-0.21,f=-1.2) USER MOD Single : B 19 LYS NZ :NH3+ -137:sc= -0.353 (180deg=-0.726) USER MOD Single : B 22 ASN : amide:sc= -6.17! K(o=-6.2!,f=-5.6) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.258) USER MOD Single : B 34 ASN : amide:sc= 0.00678 K(o=0.0068,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP B 2 10.129 -12.517 -1.496 1.00 0.76 N ATOM 2 CA ASP B 2 9.628 -12.173 -0.132 1.00 0.88 C ATOM 3 C ASP B 2 8.131 -12.455 -0.032 1.00 0.68 C ATOM 4 O ASP B 2 7.569 -13.187 -0.823 1.00 0.66 O ATOM 5 CB ASP B 2 9.895 -10.674 0.041 1.00 1.25 C ATOM 6 CG ASP B 2 11.337 -10.349 -0.359 1.00 1.88 C ATOM 7 OD1 ASP B 2 12.231 -11.028 0.117 1.00 2.35 O ATOM 8 OD2 ASP B 2 11.521 -9.425 -1.135 1.00 2.37 O ATOM 0 HA ASP B 2 10.122 -12.764 0.639 1.00 0.88 H new ATOM 0 HB2 ASP B 2 9.201 -10.099 -0.572 1.00 1.25 H new ATOM 0 HB3 ASP B 2 9.722 -10.383 1.077 1.00 1.25 H new ATOM 15 N ALA B 3 7.487 -11.875 0.938 1.00 0.63 N ATOM 16 CA ALA B 3 6.021 -12.095 1.109 1.00 0.58 C ATOM 17 C ALA B 3 5.290 -10.758 1.154 1.00 0.63 C ATOM 18 O ALA B 3 4.233 -10.599 0.576 1.00 0.61 O ATOM 19 CB ALA B 3 5.884 -12.830 2.441 1.00 0.75 C ATOM 0 H ALA B 3 7.913 -11.254 1.626 1.00 0.63 H new ATOM 0 HA ALA B 3 5.589 -12.663 0.286 1.00 0.58 H new ATOM 0 HB1 ALA B 3 4.831 -13.029 2.640 1.00 0.75 H new ATOM 0 HB2 ALA B 3 6.429 -13.773 2.394 1.00 0.75 H new ATOM 0 HB3 ALA B 3 6.294 -12.213 3.241 1.00 0.75 H new ATOM 25 N GLN B 4 5.846 -9.794 1.830 1.00 0.75 N ATOM 26 CA GLN B 4 5.180 -8.465 1.901 1.00 0.89 C ATOM 27 C GLN B 4 5.223 -7.809 0.534 1.00 0.79 C ATOM 28 O GLN B 4 4.204 -7.427 -0.009 1.00 0.81 O ATOM 29 CB GLN B 4 5.983 -7.659 2.919 1.00 1.09 C ATOM 30 CG GLN B 4 5.216 -6.388 3.280 1.00 1.29 C ATOM 31 CD GLN B 4 5.937 -5.652 4.408 1.00 0.85 C ATOM 32 OE1 GLN B 4 6.486 -6.269 5.300 1.00 1.14 O ATOM 33 NE2 GLN B 4 5.959 -4.347 4.405 1.00 0.94 N ATOM 0 H GLN B 4 6.729 -9.868 2.335 1.00 0.75 H new ATOM 0 HA GLN B 4 4.133 -8.535 2.196 1.00 0.89 H new ATOM 0 HB2 GLN B 4 6.160 -8.256 3.813 1.00 1.09 H new ATOM 0 HB3 GLN B 4 6.959 -7.403 2.508 1.00 1.09 H new ATOM 0 HG2 GLN B 4 5.133 -5.742 2.406 1.00 1.29 H new ATOM 0 HG3 GLN B 4 4.201 -6.640 3.588 1.00 1.29 H new ATOM 0 HE21 GLN B 4 5.498 -3.831 3.656 1.00 0.94 H new ATOM 0 HE22 GLN B 4 6.437 -3.843 5.152 1.00 0.94 H new ATOM 42 N THR B 5 6.386 -7.701 -0.043 1.00 0.76 N ATOM 43 CA THR B 5 6.473 -7.100 -1.404 1.00 0.79 C ATOM 44 C THR B 5 5.458 -7.816 -2.292 1.00 0.59 C ATOM 45 O THR B 5 4.821 -7.224 -3.141 1.00 0.57 O ATOM 46 CB THR B 5 7.899 -7.360 -1.884 1.00 0.94 C ATOM 47 OG1 THR B 5 8.817 -6.714 -1.011 1.00 1.26 O ATOM 48 CG2 THR B 5 8.058 -6.807 -3.296 1.00 0.94 C ATOM 0 H THR B 5 7.273 -7.999 0.363 1.00 0.76 H new ATOM 0 HA THR B 5 6.257 -6.032 -1.422 1.00 0.79 H new ATOM 0 HB THR B 5 8.099 -8.432 -1.886 1.00 0.94 H new ATOM 0 HG1 THR B 5 9.733 -6.882 -1.317 1.00 1.26 H new ATOM 0 HG21 THR B 5 9.074 -6.989 -3.646 1.00 0.94 H new ATOM 0 HG22 THR B 5 7.351 -7.301 -3.962 1.00 0.94 H new ATOM 0 HG23 THR B 5 7.863 -5.735 -3.291 1.00 0.94 H new ATOM 56 N ARG B 6 5.277 -9.086 -2.050 1.00 0.48 N ATOM 57 CA ARG B 6 4.269 -9.858 -2.820 1.00 0.46 C ATOM 58 C ARG B 6 2.893 -9.410 -2.380 1.00 0.43 C ATOM 59 O ARG B 6 2.003 -9.185 -3.178 1.00 0.45 O ATOM 60 CB ARG B 6 4.457 -11.312 -2.402 1.00 0.56 C ATOM 61 CG ARG B 6 4.897 -12.151 -3.607 1.00 0.78 C ATOM 62 CD ARG B 6 6.331 -12.644 -3.397 1.00 1.03 C ATOM 63 NE ARG B 6 6.185 -14.006 -2.806 1.00 0.88 N ATOM 64 CZ ARG B 6 5.813 -15.021 -3.547 1.00 0.73 C ATOM 65 NH1 ARG B 6 5.561 -14.864 -4.822 1.00 1.43 N ATOM 66 NH2 ARG B 6 5.693 -16.203 -3.007 1.00 1.26 N ATOM 0 H ARG B 6 5.788 -9.622 -1.348 1.00 0.48 H new ATOM 0 HA ARG B 6 4.376 -9.721 -3.896 1.00 0.46 H new ATOM 0 HB2 ARG B 6 5.204 -11.378 -1.610 1.00 0.56 H new ATOM 0 HB3 ARG B 6 3.525 -11.705 -1.995 1.00 0.56 H new ATOM 0 HG2 ARG B 6 4.226 -13.000 -3.736 1.00 0.78 H new ATOM 0 HG3 ARG B 6 4.837 -11.556 -4.518 1.00 0.78 H new ATOM 0 HD2 ARG B 6 6.879 -12.678 -4.339 1.00 1.03 H new ATOM 0 HD3 ARG B 6 6.883 -11.981 -2.731 1.00 1.03 H new ATOM 0 HE ARG B 6 6.377 -14.149 -1.814 1.00 0.88 H new ATOM 0 HH11 ARG B 6 5.653 -13.943 -5.250 1.00 1.43 H new ATOM 0 HH12 ARG B 6 5.272 -15.663 -5.387 1.00 1.43 H new ATOM 0 HH21 ARG B 6 5.888 -16.332 -2.014 1.00 1.26 H new ATOM 0 HH22 ARG B 6 5.404 -16.997 -3.578 1.00 1.26 H new ATOM 80 N ARG B 7 2.715 -9.293 -1.092 1.00 0.61 N ATOM 81 CA ARG B 7 1.397 -8.873 -0.566 1.00 0.80 C ATOM 82 C ARG B 7 1.014 -7.521 -1.175 1.00 0.65 C ATOM 83 O ARG B 7 -0.139 -7.249 -1.439 1.00 0.56 O ATOM 84 CB ARG B 7 1.596 -8.775 0.949 1.00 1.16 C ATOM 85 CG ARG B 7 0.430 -8.014 1.600 1.00 1.10 C ATOM 86 CD ARG B 7 0.888 -7.424 2.939 1.00 0.92 C ATOM 87 NE ARG B 7 0.741 -5.942 2.784 1.00 0.41 N ATOM 88 CZ ARG B 7 1.707 -5.221 2.273 1.00 0.93 C ATOM 89 NH1 ARG B 7 2.827 -5.775 1.888 1.00 1.61 N ATOM 90 NH2 ARG B 7 1.550 -3.932 2.150 1.00 1.08 N ATOM 0 H ARG B 7 3.429 -9.471 -0.386 1.00 0.61 H new ATOM 0 HA ARG B 7 0.592 -9.565 -0.813 1.00 0.80 H new ATOM 0 HB2 ARG B 7 1.669 -9.775 1.377 1.00 1.16 H new ATOM 0 HB3 ARG B 7 2.535 -8.266 1.166 1.00 1.16 H new ATOM 0 HG2 ARG B 7 0.087 -7.219 0.939 1.00 1.10 H new ATOM 0 HG3 ARG B 7 -0.414 -8.685 1.756 1.00 1.10 H new ATOM 0 HD2 ARG B 7 0.279 -7.796 3.763 1.00 0.92 H new ATOM 0 HD3 ARG B 7 1.920 -7.697 3.157 1.00 0.92 H new ATOM 0 HE ARG B 7 -0.123 -5.488 3.080 1.00 0.41 H new ATOM 0 HH11 ARG B 7 2.957 -6.782 1.984 1.00 1.61 H new ATOM 0 HH12 ARG B 7 3.571 -5.200 1.492 1.00 1.61 H new ATOM 0 HH21 ARG B 7 0.680 -3.493 2.451 1.00 1.08 H new ATOM 0 HH22 ARG B 7 2.297 -3.363 1.753 1.00 1.08 H new ATOM 104 N ARG B 8 1.985 -6.681 -1.413 1.00 0.68 N ATOM 105 CA ARG B 8 1.695 -5.348 -2.022 1.00 0.67 C ATOM 106 C ARG B 8 0.974 -5.554 -3.340 1.00 0.48 C ATOM 107 O ARG B 8 0.037 -4.849 -3.661 1.00 0.50 O ATOM 108 CB ARG B 8 3.066 -4.706 -2.239 1.00 0.77 C ATOM 109 CG ARG B 8 2.951 -3.186 -2.131 1.00 0.73 C ATOM 110 CD ARG B 8 2.905 -2.782 -0.656 1.00 0.73 C ATOM 111 NE ARG B 8 4.155 -3.342 -0.065 1.00 0.85 N ATOM 112 CZ ARG B 8 5.322 -2.804 -0.323 1.00 1.05 C ATOM 113 NH1 ARG B 8 5.418 -1.761 -1.104 1.00 1.43 N ATOM 114 NH2 ARG B 8 6.401 -3.316 0.205 1.00 1.16 N ATOM 0 H ARG B 8 2.969 -6.860 -1.212 1.00 0.68 H new ATOM 0 HA ARG B 8 1.059 -4.719 -1.398 1.00 0.67 H new ATOM 0 HB2 ARG B 8 3.773 -5.079 -1.499 1.00 0.77 H new ATOM 0 HB3 ARG B 8 3.455 -4.981 -3.219 1.00 0.77 H new ATOM 0 HG2 ARG B 8 3.799 -2.710 -2.623 1.00 0.73 H new ATOM 0 HG3 ARG B 8 2.052 -2.841 -2.642 1.00 0.73 H new ATOM 0 HD2 ARG B 8 2.866 -1.698 -0.544 1.00 0.73 H new ATOM 0 HD3 ARG B 8 2.020 -3.185 -0.163 1.00 0.73 H new ATOM 0 HE ARG B 8 4.101 -4.155 0.549 1.00 0.85 H new ATOM 0 HH11 ARG B 8 4.579 -1.357 -1.520 1.00 1.43 H new ATOM 0 HH12 ARG B 8 6.332 -1.351 -1.297 1.00 1.43 H new ATOM 0 HH21 ARG B 8 6.333 -4.131 0.815 1.00 1.16 H new ATOM 0 HH22 ARG B 8 7.312 -2.901 0.007 1.00 1.16 H new ATOM 128 N GLU B 9 1.363 -6.545 -4.086 1.00 0.38 N ATOM 129 CA GLU B 9 0.641 -6.815 -5.355 1.00 0.34 C ATOM 130 C GLU B 9 -0.798 -7.147 -4.991 1.00 0.31 C ATOM 131 O GLU B 9 -1.730 -6.829 -5.702 1.00 0.34 O ATOM 132 CB GLU B 9 1.346 -8.012 -5.997 1.00 0.40 C ATOM 133 CG GLU B 9 2.784 -7.631 -6.363 1.00 0.59 C ATOM 134 CD GLU B 9 3.048 -7.971 -7.832 1.00 1.24 C ATOM 135 OE1 GLU B 9 2.852 -9.118 -8.198 1.00 1.73 O ATOM 136 OE2 GLU B 9 3.439 -7.078 -8.565 1.00 1.88 O ATOM 0 H GLU B 9 2.139 -7.173 -3.876 1.00 0.38 H new ATOM 0 HA GLU B 9 0.640 -5.974 -6.048 1.00 0.34 H new ATOM 0 HB2 GLU B 9 1.348 -8.857 -5.309 1.00 0.40 H new ATOM 0 HB3 GLU B 9 0.806 -8.329 -6.889 1.00 0.40 H new ATOM 0 HG2 GLU B 9 2.944 -6.566 -6.191 1.00 0.59 H new ATOM 0 HG3 GLU B 9 3.486 -8.166 -5.724 1.00 0.59 H new ATOM 143 N ARG B 10 -0.974 -7.738 -3.843 1.00 0.31 N ATOM 144 CA ARG B 10 -2.340 -8.048 -3.364 1.00 0.38 C ATOM 145 C ARG B 10 -2.976 -6.756 -2.863 1.00 0.35 C ATOM 146 O ARG B 10 -4.177 -6.668 -2.693 1.00 0.40 O ATOM 147 CB ARG B 10 -2.149 -9.040 -2.215 1.00 0.46 C ATOM 148 CG ARG B 10 -2.692 -10.410 -2.618 1.00 0.73 C ATOM 149 CD ARG B 10 -2.266 -11.449 -1.578 1.00 0.67 C ATOM 150 NE ARG B 10 -3.449 -12.342 -1.417 1.00 1.55 N ATOM 151 CZ ARG B 10 -4.500 -11.945 -0.739 1.00 2.12 C ATOM 152 NH1 ARG B 10 -4.533 -10.757 -0.188 1.00 3.14 N ATOM 153 NH2 ARG B 10 -5.524 -12.743 -0.611 1.00 2.20 N ATOM 0 H ARG B 10 -0.222 -8.020 -3.215 1.00 0.31 H new ATOM 0 HA ARG B 10 -2.985 -8.466 -4.137 1.00 0.38 H new ATOM 0 HB2 ARG B 10 -1.092 -9.118 -1.962 1.00 0.46 H new ATOM 0 HB3 ARG B 10 -2.665 -8.682 -1.324 1.00 0.46 H new ATOM 0 HG2 ARG B 10 -3.779 -10.376 -2.691 1.00 0.73 H new ATOM 0 HG3 ARG B 10 -2.315 -10.688 -3.602 1.00 0.73 H new ATOM 0 HD2 ARG B 10 -1.392 -12.008 -1.914 1.00 0.67 H new ATOM 0 HD3 ARG B 10 -1.998 -10.975 -0.634 1.00 0.67 H new ATOM 0 HE ARG B 10 -3.441 -13.271 -1.838 1.00 1.55 H new ATOM 0 HH11 ARG B 10 -3.736 -10.128 -0.283 1.00 3.14 H new ATOM 0 HH12 ARG B 10 -5.356 -10.461 0.336 1.00 3.14 H new ATOM 0 HH21 ARG B 10 -5.505 -13.670 -1.037 1.00 2.20 H new ATOM 0 HH22 ARG B 10 -6.344 -12.440 -0.085 1.00 2.20 H new ATOM 167 N ARG B 11 -2.175 -5.744 -2.638 1.00 0.29 N ATOM 168 CA ARG B 11 -2.736 -4.457 -2.165 1.00 0.29 C ATOM 169 C ARG B 11 -3.002 -3.538 -3.349 1.00 0.24 C ATOM 170 O ARG B 11 -3.438 -2.423 -3.174 1.00 0.25 O ATOM 171 CB ARG B 11 -1.671 -3.844 -1.260 1.00 0.32 C ATOM 172 CG ARG B 11 -1.480 -4.705 -0.008 1.00 0.41 C ATOM 173 CD ARG B 11 -2.816 -4.855 0.733 1.00 0.55 C ATOM 174 NE ARG B 11 -2.993 -6.328 0.903 1.00 1.59 N ATOM 175 CZ ARG B 11 -4.099 -6.817 1.408 1.00 2.18 C ATOM 176 NH1 ARG B 11 -5.072 -6.026 1.780 1.00 1.76 N ATOM 177 NH2 ARG B 11 -4.230 -8.109 1.544 1.00 3.24 N ATOM 0 H ARG B 11 -1.163 -5.760 -2.763 1.00 0.29 H new ATOM 0 HA ARG B 11 -3.679 -4.600 -1.638 1.00 0.29 H new ATOM 0 HB2 ARG B 11 -0.728 -3.761 -1.800 1.00 0.32 H new ATOM 0 HB3 ARG B 11 -1.964 -2.834 -0.974 1.00 0.32 H new ATOM 0 HG2 ARG B 11 -1.097 -5.687 -0.286 1.00 0.41 H new ATOM 0 HG3 ARG B 11 -0.740 -4.248 0.649 1.00 0.41 H new ATOM 0 HD2 ARG B 11 -2.794 -4.345 1.696 1.00 0.55 H new ATOM 0 HD3 ARG B 11 -3.637 -4.421 0.162 1.00 0.55 H new ATOM 0 HE ARG B 11 -2.244 -6.961 0.623 1.00 1.59 H new ATOM 0 HH11 ARG B 11 -4.975 -5.016 1.678 1.00 1.76 H new ATOM 0 HH12 ARG B 11 -5.928 -6.419 2.172 1.00 1.76 H new ATOM 0 HH21 ARG B 11 -3.474 -8.731 1.258 1.00 3.24 H new ATOM 0 HH22 ARG B 11 -5.088 -8.496 1.936 1.00 3.24 H new ATOM 191 N ALA B 12 -2.767 -3.990 -4.559 1.00 0.24 N ATOM 192 CA ALA B 12 -3.048 -3.103 -5.729 1.00 0.28 C ATOM 193 C ALA B 12 -4.494 -2.622 -5.629 1.00 0.31 C ATOM 194 O ALA B 12 -4.842 -1.556 -6.093 1.00 0.33 O ATOM 195 CB ALA B 12 -2.847 -3.979 -6.966 1.00 0.34 C ATOM 0 H ALA B 12 -2.400 -4.915 -4.783 1.00 0.24 H new ATOM 0 HA ALA B 12 -2.402 -2.226 -5.769 1.00 0.28 H new ATOM 0 HB1 ALA B 12 -3.037 -3.390 -7.863 1.00 0.34 H new ATOM 0 HB2 ALA B 12 -1.822 -4.350 -6.986 1.00 0.34 H new ATOM 0 HB3 ALA B 12 -3.538 -4.821 -6.931 1.00 0.34 H new ATOM 201 N GLU B 13 -5.328 -3.398 -4.988 1.00 0.34 N ATOM 202 CA GLU B 13 -6.741 -2.983 -4.809 1.00 0.41 C ATOM 203 C GLU B 13 -6.800 -1.940 -3.697 1.00 0.38 C ATOM 204 O GLU B 13 -7.593 -1.021 -3.738 1.00 0.42 O ATOM 205 CB GLU B 13 -7.495 -4.255 -4.412 1.00 0.48 C ATOM 206 CG GLU B 13 -7.711 -5.127 -5.651 1.00 0.52 C ATOM 207 CD GLU B 13 -8.125 -6.535 -5.219 1.00 0.77 C ATOM 208 OE1 GLU B 13 -9.241 -6.685 -4.746 1.00 1.18 O ATOM 209 OE2 GLU B 13 -7.320 -7.439 -5.368 1.00 1.15 O ATOM 0 H GLU B 13 -5.087 -4.302 -4.582 1.00 0.34 H new ATOM 0 HA GLU B 13 -7.176 -2.542 -5.706 1.00 0.41 H new ATOM 0 HB2 GLU B 13 -6.930 -4.806 -3.660 1.00 0.48 H new ATOM 0 HB3 GLU B 13 -8.455 -3.997 -3.964 1.00 0.48 H new ATOM 0 HG2 GLU B 13 -8.481 -4.689 -6.287 1.00 0.52 H new ATOM 0 HG3 GLU B 13 -6.796 -5.171 -6.242 1.00 0.52 H new ATOM 216 N LYS B 14 -5.931 -2.051 -2.721 1.00 0.33 N ATOM 217 CA LYS B 14 -5.905 -1.038 -1.635 1.00 0.33 C ATOM 218 C LYS B 14 -5.145 0.180 -2.154 1.00 0.28 C ATOM 219 O LYS B 14 -5.448 1.315 -1.842 1.00 0.30 O ATOM 220 CB LYS B 14 -5.146 -1.701 -0.483 1.00 0.31 C ATOM 221 CG LYS B 14 -5.899 -2.943 -0.010 1.00 0.38 C ATOM 222 CD LYS B 14 -7.071 -2.524 0.882 1.00 1.23 C ATOM 223 CE LYS B 14 -7.191 -3.496 2.058 1.00 1.37 C ATOM 224 NZ LYS B 14 -8.293 -2.953 2.903 1.00 1.83 N ATOM 0 H LYS B 14 -5.243 -2.799 -2.635 1.00 0.33 H new ATOM 0 HA LYS B 14 -6.895 -0.716 -1.312 1.00 0.33 H new ATOM 0 HB2 LYS B 14 -4.142 -1.975 -0.808 1.00 0.31 H new ATOM 0 HB3 LYS B 14 -5.033 -0.998 0.342 1.00 0.31 H new ATOM 0 HG2 LYS B 14 -6.265 -3.507 -0.868 1.00 0.38 H new ATOM 0 HG3 LYS B 14 -5.227 -3.601 0.541 1.00 0.38 H new ATOM 0 HD2 LYS B 14 -6.917 -1.509 1.249 1.00 1.23 H new ATOM 0 HD3 LYS B 14 -7.996 -2.518 0.306 1.00 1.23 H new ATOM 0 HE2 LYS B 14 -7.419 -4.505 1.714 1.00 1.37 H new ATOM 0 HE3 LYS B 14 -6.258 -3.554 2.618 1.00 1.37 H new ATOM 0 HZ1 LYS B 14 -8.432 -3.569 3.729 1.00 1.83 H new ATOM 0 HZ2 LYS B 14 -8.045 -1.995 3.223 1.00 1.83 H new ATOM 0 HZ3 LYS B 14 -9.171 -2.916 2.347 1.00 1.83 H new ATOM 238 N GLN B 15 -4.165 -0.078 -2.970 1.00 0.25 N ATOM 239 CA GLN B 15 -3.347 1.001 -3.573 1.00 0.24 C ATOM 240 C GLN B 15 -4.151 1.705 -4.655 1.00 0.28 C ATOM 241 O GLN B 15 -4.238 2.909 -4.689 1.00 0.28 O ATOM 242 CB GLN B 15 -2.154 0.261 -4.186 1.00 0.24 C ATOM 243 CG GLN B 15 -0.897 0.558 -3.375 1.00 0.25 C ATOM 244 CD GLN B 15 0.059 -0.628 -3.479 1.00 0.30 C ATOM 245 OE1 GLN B 15 1.177 -0.490 -3.936 1.00 0.35 O ATOM 246 NE2 GLN B 15 -0.340 -1.800 -3.070 1.00 0.33 N ATOM 0 H GLN B 15 -3.891 -1.020 -3.250 1.00 0.25 H new ATOM 0 HA GLN B 15 -3.040 1.762 -2.856 1.00 0.24 H new ATOM 0 HB2 GLN B 15 -2.346 -0.812 -4.199 1.00 0.24 H new ATOM 0 HB3 GLN B 15 -2.013 0.572 -5.221 1.00 0.24 H new ATOM 0 HG2 GLN B 15 -0.415 1.462 -3.746 1.00 0.25 H new ATOM 0 HG3 GLN B 15 -1.157 0.741 -2.332 1.00 0.25 H new ATOM 0 HE21 GLN B 15 -1.278 -1.914 -2.687 1.00 0.33 H new ATOM 0 HE22 GLN B 15 0.286 -2.603 -3.133 1.00 0.33 H new ATOM 255 N ALA B 16 -4.745 0.959 -5.537 1.00 0.35 N ATOM 256 CA ALA B 16 -5.552 1.595 -6.616 1.00 0.41 C ATOM 257 C ALA B 16 -6.778 2.269 -6.006 1.00 0.40 C ATOM 258 O ALA B 16 -7.288 3.237 -6.537 1.00 0.43 O ATOM 259 CB ALA B 16 -5.962 0.455 -7.549 1.00 0.48 C ATOM 0 H ALA B 16 -4.709 -0.060 -5.561 1.00 0.35 H new ATOM 0 HA ALA B 16 -4.996 2.362 -7.155 1.00 0.41 H new ATOM 0 HB1 ALA B 16 -6.560 0.853 -8.369 1.00 0.48 H new ATOM 0 HB2 ALA B 16 -5.070 -0.025 -7.951 1.00 0.48 H new ATOM 0 HB3 ALA B 16 -6.549 -0.277 -6.993 1.00 0.48 H new ATOM 265 N GLN B 17 -7.240 1.792 -4.879 1.00 0.40 N ATOM 266 CA GLN B 17 -8.411 2.451 -4.240 1.00 0.42 C ATOM 267 C GLN B 17 -7.906 3.681 -3.505 1.00 0.37 C ATOM 268 O GLN B 17 -8.549 4.713 -3.461 1.00 0.40 O ATOM 269 CB GLN B 17 -8.981 1.422 -3.265 1.00 0.45 C ATOM 270 CG GLN B 17 -9.905 0.461 -4.015 1.00 0.53 C ATOM 271 CD GLN B 17 -11.226 1.164 -4.332 1.00 0.66 C ATOM 272 OE1 GLN B 17 -11.749 1.896 -3.515 1.00 1.06 O ATOM 273 NE2 GLN B 17 -11.794 0.971 -5.491 1.00 1.33 N ATOM 0 H GLN B 17 -6.862 0.986 -4.381 1.00 0.40 H new ATOM 0 HA GLN B 17 -9.176 2.765 -4.950 1.00 0.42 H new ATOM 0 HB2 GLN B 17 -8.171 0.868 -2.791 1.00 0.45 H new ATOM 0 HB3 GLN B 17 -9.531 1.925 -2.470 1.00 0.45 H new ATOM 0 HG2 GLN B 17 -9.429 0.127 -4.937 1.00 0.53 H new ATOM 0 HG3 GLN B 17 -10.090 -0.428 -3.411 1.00 0.53 H new ATOM 0 HE21 GLN B 17 -11.356 0.357 -6.178 1.00 1.33 H new ATOM 0 HE22 GLN B 17 -12.676 1.434 -5.710 1.00 1.33 H new ATOM 282 N TRP B 18 -6.731 3.578 -2.958 1.00 0.32 N ATOM 283 CA TRP B 18 -6.125 4.731 -2.252 1.00 0.30 C ATOM 284 C TRP B 18 -5.590 5.710 -3.290 1.00 0.31 C ATOM 285 O TRP B 18 -5.812 6.903 -3.225 1.00 0.35 O ATOM 286 CB TRP B 18 -4.956 4.140 -1.465 1.00 0.25 C ATOM 287 CG TRP B 18 -4.166 5.260 -0.877 1.00 0.24 C ATOM 288 CD1 TRP B 18 -4.285 5.756 0.372 1.00 0.30 C ATOM 289 CD2 TRP B 18 -3.141 6.039 -1.526 1.00 0.24 C ATOM 290 NE1 TRP B 18 -3.392 6.809 0.513 1.00 0.31 N ATOM 291 CE2 TRP B 18 -2.660 7.010 -0.630 1.00 0.29 C ATOM 292 CE3 TRP B 18 -2.589 5.984 -2.799 1.00 0.28 C ATOM 293 CZ2 TRP B 18 -1.660 7.902 -0.997 1.00 0.34 C ATOM 294 CZ3 TRP B 18 -1.589 6.867 -3.174 1.00 0.36 C ATOM 295 CH2 TRP B 18 -1.122 7.824 -2.284 1.00 0.38 C ATOM 0 H TRP B 18 -6.159 2.733 -2.971 1.00 0.32 H new ATOM 0 HA TRP B 18 -6.833 5.254 -1.609 1.00 0.30 H new ATOM 0 HB2 TRP B 18 -5.324 3.482 -0.678 1.00 0.25 H new ATOM 0 HB3 TRP B 18 -4.327 3.535 -2.118 1.00 0.25 H new ATOM 0 HD1 TRP B 18 -4.961 5.395 1.133 1.00 0.30 H new ATOM 0 HE1 TRP B 18 -3.292 7.365 1.362 1.00 0.31 H new ATOM 0 HE3 TRP B 18 -2.942 5.246 -3.504 1.00 0.28 H new ATOM 0 HZ2 TRP B 18 -1.304 8.644 -0.298 1.00 0.34 H new ATOM 0 HZ3 TRP B 18 -1.169 6.810 -4.168 1.00 0.36 H new ATOM 0 HH2 TRP B 18 -0.343 8.508 -2.586 1.00 0.38 H new ATOM 306 N LYS B 19 -4.878 5.191 -4.245 1.00 0.30 N ATOM 307 CA LYS B 19 -4.298 6.045 -5.312 1.00 0.37 C ATOM 308 C LYS B 19 -5.428 6.756 -6.023 1.00 0.46 C ATOM 309 O LYS B 19 -5.304 7.892 -6.439 1.00 0.70 O ATOM 310 CB LYS B 19 -3.582 5.084 -6.265 1.00 0.40 C ATOM 311 CG LYS B 19 -2.255 4.619 -5.659 1.00 0.49 C ATOM 312 CD LYS B 19 -1.475 3.811 -6.699 1.00 0.96 C ATOM 313 CE LYS B 19 -0.013 3.682 -6.260 1.00 1.30 C ATOM 314 NZ LYS B 19 0.269 2.220 -6.279 1.00 1.92 N ATOM 0 H LYS B 19 -4.670 4.196 -4.333 1.00 0.30 H new ATOM 0 HA LYS B 19 -3.610 6.798 -4.928 1.00 0.37 H new ATOM 0 HB2 LYS B 19 -4.218 4.222 -6.468 1.00 0.40 H new ATOM 0 HB3 LYS B 19 -3.400 5.577 -7.220 1.00 0.40 H new ATOM 0 HG2 LYS B 19 -1.669 5.480 -5.337 1.00 0.49 H new ATOM 0 HG3 LYS B 19 -2.440 4.010 -4.774 1.00 0.49 H new ATOM 0 HD2 LYS B 19 -1.919 2.822 -6.814 1.00 0.96 H new ATOM 0 HD3 LYS B 19 -1.531 4.300 -7.671 1.00 0.96 H new ATOM 0 HE2 LYS B 19 0.651 4.221 -6.936 1.00 1.30 H new ATOM 0 HE3 LYS B 19 0.138 4.100 -5.265 1.00 1.30 H new ATOM 0 HZ1 LYS B 19 0.811 1.960 -5.430 1.00 1.92 H new ATOM 0 HZ2 LYS B 19 -0.628 1.694 -6.292 1.00 1.92 H new ATOM 0 HZ3 LYS B 19 0.821 1.984 -7.128 1.00 1.92 H new ATOM 328 N ALA B 20 -6.542 6.094 -6.152 1.00 0.44 N ATOM 329 CA ALA B 20 -7.692 6.735 -6.823 1.00 0.52 C ATOM 330 C ALA B 20 -8.096 7.993 -6.053 1.00 0.56 C ATOM 331 O ALA B 20 -8.581 8.952 -6.620 1.00 0.74 O ATOM 332 CB ALA B 20 -8.815 5.709 -6.780 1.00 0.55 C ATOM 0 H ALA B 20 -6.701 5.142 -5.822 1.00 0.44 H new ATOM 0 HA ALA B 20 -7.460 7.031 -7.846 1.00 0.52 H new ATOM 0 HB1 ALA B 20 -9.702 6.120 -7.262 1.00 0.55 H new ATOM 0 HB2 ALA B 20 -8.503 4.806 -7.304 1.00 0.55 H new ATOM 0 HB3 ALA B 20 -9.046 5.465 -5.743 1.00 0.55 H new ATOM 338 N ALA B 21 -7.893 7.989 -4.762 1.00 0.54 N ATOM 339 CA ALA B 21 -8.260 9.181 -3.949 1.00 0.66 C ATOM 340 C ALA B 21 -7.025 9.765 -3.277 1.00 0.73 C ATOM 341 O ALA B 21 -7.101 10.414 -2.253 1.00 0.99 O ATOM 342 CB ALA B 21 -9.259 8.673 -2.912 1.00 0.71 C ATOM 0 H ALA B 21 -7.490 7.213 -4.238 1.00 0.54 H new ATOM 0 HA ALA B 21 -8.688 9.977 -4.559 1.00 0.66 H new ATOM 0 HB1 ALA B 21 -9.574 9.500 -2.275 1.00 0.71 H new ATOM 0 HB2 ALA B 21 -10.128 8.253 -3.419 1.00 0.71 H new ATOM 0 HB3 ALA B 21 -8.789 7.903 -2.300 1.00 0.71 H new ATOM 348 N ASN B 22 -5.893 9.554 -3.872 1.00 0.73 N ATOM 349 CA ASN B 22 -4.627 10.107 -3.310 1.00 0.88 C ATOM 350 C ASN B 22 -3.586 10.304 -4.416 1.00 1.08 C ATOM 351 O ASN B 22 -2.460 9.863 -4.295 1.00 0.00 O ATOM 352 CB ASN B 22 -4.128 9.087 -2.294 1.00 0.93 C ATOM 353 CG ASN B 22 -5.097 9.020 -1.117 1.00 0.94 C ATOM 354 OD1 ASN B 22 -5.324 10.002 -0.439 1.00 1.13 O ATOM 355 ND2 ASN B 22 -5.677 7.890 -0.845 1.00 0.94 N ATOM 0 H ASN B 22 -5.783 9.017 -4.733 1.00 0.73 H new ATOM 0 HA ASN B 22 -4.796 11.080 -2.849 1.00 0.88 H new ATOM 0 HB2 ASN B 22 -4.040 8.106 -2.762 1.00 0.93 H new ATOM 0 HB3 ASN B 22 -3.134 9.364 -1.944 1.00 0.93 H new ATOM 0 HD21 ASN B 22 -6.325 7.825 -0.060 1.00 0.94 H new ATOM 0 HD22 ASN B 22 -5.484 7.067 -1.416 1.00 0.94 H new ATOM 362 N PRO B 23 -3.990 10.994 -5.449 1.00 0.00 N ATOM 363 CA PRO B 23 -3.074 11.289 -6.567 1.00 0.00 C ATOM 364 C PRO B 23 -2.051 12.299 -6.060 1.00 0.00 C ATOM 365 O PRO B 23 -0.906 12.316 -6.468 1.00 0.00 O ATOM 366 CB PRO B 23 -3.982 11.882 -7.640 1.00 0.00 C ATOM 367 CG PRO B 23 -5.156 12.420 -6.892 1.00 0.00 C ATOM 368 CD PRO B 23 -5.313 11.567 -5.659 1.00 0.00 C ATOM 0 HA PRO B 23 -2.525 10.432 -6.957 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -3.474 12.669 -8.197 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -4.287 11.125 -8.363 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -4.997 13.464 -6.622 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -6.056 12.382 -7.506 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -5.630 12.161 -4.802 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -6.064 10.791 -5.805 1.00 0.00 H new ATOM 376 N LEU B 24 -2.471 13.122 -5.133 1.00 0.00 N ATOM 377 CA LEU B 24 -1.549 14.127 -4.533 1.00 0.00 C ATOM 378 C LEU B 24 -0.321 13.410 -3.973 1.00 0.00 C ATOM 379 O LEU B 24 0.789 13.904 -4.021 1.00 0.00 O ATOM 380 CB LEU B 24 -2.377 14.800 -3.417 1.00 0.00 C ATOM 381 CG LEU B 24 -2.238 14.050 -2.073 1.00 0.00 C ATOM 382 CD1 LEU B 24 -2.746 14.947 -0.944 1.00 0.00 C ATOM 383 CD2 LEU B 24 -3.066 12.751 -2.090 1.00 0.00 C ATOM 0 H LEU B 24 -3.422 13.139 -4.765 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.183 14.864 -5.248 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -2.050 15.833 -3.293 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -3.426 14.831 -3.710 1.00 0.00 H new ATOM 0 HG LEU B 24 -1.189 13.800 -1.917 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -2.651 14.424 0.007 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.157 15.864 -0.915 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -3.793 15.194 -1.119 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -2.956 12.237 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.117 12.991 -2.253 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -2.712 12.105 -2.893 1.00 0.00 H new ATOM 395 N LEU B 25 -0.529 12.231 -3.466 1.00 0.00 N ATOM 396 CA LEU B 25 0.591 11.427 -2.919 1.00 0.00 C ATOM 397 C LEU B 25 0.910 10.337 -3.923 1.00 0.00 C ATOM 398 O LEU B 25 1.261 9.225 -3.583 1.00 0.00 O ATOM 399 CB LEU B 25 0.034 10.826 -1.630 1.00 0.00 C ATOM 400 CG LEU B 25 0.302 11.773 -0.460 1.00 0.00 C ATOM 401 CD1 LEU B 25 -0.851 11.685 0.543 1.00 0.00 C ATOM 402 CD2 LEU B 25 1.607 11.371 0.232 1.00 0.00 C ATOM 0 H LEU B 25 -1.444 11.784 -3.407 1.00 0.00 H new ATOM 0 HA LEU B 25 1.501 11.998 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -1.037 10.653 -1.732 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.497 9.858 -1.440 1.00 0.00 H new ATOM 0 HG LEU B 25 0.385 12.794 -0.832 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.660 12.360 1.377 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.782 11.969 0.053 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.933 10.664 0.914 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.799 12.046 1.066 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.522 10.350 0.603 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.430 11.431 -0.480 1.00 0.00 H new ATOM 414 N VAL B 26 0.747 10.659 -5.167 1.00 0.00 N ATOM 415 CA VAL B 26 0.979 9.662 -6.235 1.00 0.00 C ATOM 416 C VAL B 26 1.753 10.295 -7.399 1.00 0.00 C ATOM 417 O VAL B 26 1.298 11.222 -8.039 1.00 0.00 O ATOM 418 CB VAL B 26 -0.448 9.235 -6.624 1.00 0.00 C ATOM 419 CG1 VAL B 26 -0.679 9.375 -8.130 1.00 0.00 C ATOM 420 CG2 VAL B 26 -0.671 7.781 -6.203 1.00 0.00 C ATOM 0 H VAL B 26 0.459 11.582 -5.493 1.00 0.00 H new ATOM 0 HA VAL B 26 1.588 8.811 -5.931 1.00 0.00 H new ATOM 0 HB VAL B 26 -1.155 9.887 -6.112 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -1.696 9.066 -8.372 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -0.536 10.415 -8.425 1.00 0.00 H new ATOM 0 HG13 VAL B 26 0.030 8.745 -8.667 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -1.680 7.474 -6.476 1.00 0.00 H new ATOM 0 HG22 VAL B 26 0.052 7.141 -6.708 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -0.544 7.691 -5.124 1.00 0.00 H new ATOM 430 N GLY B 27 2.928 9.791 -7.663 1.00 0.00 N ATOM 431 CA GLY B 27 3.759 10.342 -8.776 1.00 0.00 C ATOM 432 C GLY B 27 4.049 11.827 -8.547 1.00 0.00 C ATOM 433 O GLY B 27 4.518 12.517 -9.430 1.00 0.00 O ATOM 0 H GLY B 27 3.352 9.016 -7.153 1.00 0.00 H new ATOM 0 HA2 GLY B 27 4.696 9.789 -8.846 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.240 10.209 -9.725 1.00 0.00 H new ATOM 437 N VAL B 28 3.786 12.316 -7.367 1.00 0.00 N ATOM 438 CA VAL B 28 4.049 13.760 -7.059 1.00 0.00 C ATOM 439 C VAL B 28 3.421 14.670 -8.127 1.00 0.00 C ATOM 440 O VAL B 28 2.935 14.214 -9.143 1.00 0.00 O ATOM 441 CB VAL B 28 5.577 13.896 -7.062 1.00 0.00 C ATOM 442 CG1 VAL B 28 5.969 15.290 -6.567 1.00 0.00 C ATOM 443 CG2 VAL B 28 6.190 12.844 -6.133 1.00 0.00 C ATOM 0 H VAL B 28 3.397 11.777 -6.593 1.00 0.00 H new ATOM 0 HA VAL B 28 3.613 14.058 -6.105 1.00 0.00 H new ATOM 0 HB VAL B 28 5.947 13.749 -8.077 1.00 0.00 H new ATOM 0 HG11 VAL B 28 7.055 15.385 -6.570 1.00 0.00 H new ATOM 0 HG12 VAL B 28 5.537 16.044 -7.225 1.00 0.00 H new ATOM 0 HG13 VAL B 28 5.595 15.435 -5.554 1.00 0.00 H new ATOM 0 HG21 VAL B 28 7.275 12.943 -6.137 1.00 0.00 H new ATOM 0 HG22 VAL B 28 5.816 12.991 -5.120 1.00 0.00 H new ATOM 0 HG23 VAL B 28 5.915 11.848 -6.480 1.00 0.00 H new ATOM 453 N SER B 29 3.425 15.959 -7.896 1.00 0.00 N ATOM 454 CA SER B 29 2.833 16.910 -8.887 1.00 0.00 C ATOM 455 C SER B 29 1.429 16.459 -9.295 1.00 0.00 C ATOM 456 O SER B 29 1.102 16.387 -10.464 1.00 0.00 O ATOM 457 CB SER B 29 3.778 16.880 -10.088 1.00 0.00 C ATOM 458 OG SER B 29 4.175 18.206 -10.406 1.00 0.00 O ATOM 0 H SER B 29 3.814 16.395 -7.060 1.00 0.00 H new ATOM 0 HA SER B 29 2.731 17.914 -8.475 1.00 0.00 H new ATOM 0 HB2 SER B 29 4.653 16.271 -9.862 1.00 0.00 H new ATOM 0 HB3 SER B 29 3.283 16.421 -10.944 1.00 0.00 H new ATOM 0 HG SER B 29 4.783 18.190 -11.175 1.00 0.00 H new ATOM 464 N ALA B 30 0.597 16.163 -8.338 1.00 0.00 N ATOM 465 CA ALA B 30 -0.789 15.725 -8.659 1.00 0.00 C ATOM 466 C ALA B 30 -1.779 16.417 -7.725 1.00 0.00 C ATOM 467 O ALA B 30 -2.700 15.811 -7.213 1.00 0.00 O ATOM 468 CB ALA B 30 -0.796 14.210 -8.441 1.00 0.00 C ATOM 0 H ALA B 30 0.818 16.206 -7.343 1.00 0.00 H new ATOM 0 HA ALA B 30 -1.081 15.980 -9.678 1.00 0.00 H new ATOM 0 HB1 ALA B 30 -1.788 13.816 -8.659 1.00 0.00 H new ATOM 0 HB2 ALA B 30 -0.067 13.744 -9.103 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -0.538 13.990 -7.405 1.00 0.00 H new ATOM 474 N LYS B 31 -1.585 17.687 -7.506 1.00 0.00 N ATOM 475 CA LYS B 31 -2.501 18.451 -6.604 1.00 0.00 C ATOM 476 C LYS B 31 -2.100 19.933 -6.572 1.00 0.00 C ATOM 477 O LYS B 31 -0.992 20.279 -6.929 1.00 0.00 O ATOM 478 CB LYS B 31 -2.324 17.824 -5.216 1.00 0.00 C ATOM 479 CG LYS B 31 -0.854 17.905 -4.791 1.00 0.00 C ATOM 480 CD LYS B 31 -0.766 18.308 -3.315 1.00 0.00 C ATOM 481 CE LYS B 31 0.255 17.421 -2.599 1.00 0.00 C ATOM 482 NZ LYS B 31 1.571 17.803 -3.182 1.00 0.00 N ATOM 0 H LYS B 31 -0.828 18.235 -7.914 1.00 0.00 H new ATOM 0 HA LYS B 31 -3.536 18.404 -6.942 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -2.951 18.343 -4.490 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -2.650 16.784 -5.233 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -0.367 16.942 -4.945 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -0.326 18.632 -5.409 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -0.475 19.355 -3.231 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -1.743 18.209 -2.842 1.00 0.00 H new ATOM 0 HE2 LYS B 31 0.237 17.588 -1.522 1.00 0.00 H new ATOM 0 HE3 LYS B 31 0.043 16.364 -2.761 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 2.337 17.436 -2.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 1.658 17.400 -4.137 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 1.639 18.839 -3.236 1.00 0.00 H new ATOM 496 N PRO B 32 -3.017 20.760 -6.136 1.00 0.00 N ATOM 497 CA PRO B 32 -2.746 22.216 -6.050 1.00 0.00 C ATOM 498 C PRO B 32 -1.797 22.508 -4.883 1.00 0.00 C ATOM 499 O PRO B 32 -1.453 21.628 -4.119 1.00 0.00 O ATOM 500 CB PRO B 32 -4.123 22.825 -5.799 1.00 0.00 C ATOM 501 CG PRO B 32 -4.921 21.730 -5.166 1.00 0.00 C ATOM 502 CD PRO B 32 -4.377 20.425 -5.689 1.00 0.00 C ATOM 0 HA PRO B 32 -2.267 22.619 -6.943 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -4.057 23.694 -5.145 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -4.582 23.161 -6.729 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -4.840 21.773 -4.080 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -5.978 21.833 -5.411 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -4.365 19.658 -4.914 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -4.983 20.040 -6.509 1.00 0.00 H new ATOM 510 N VAL B 33 -1.372 23.736 -4.739 1.00 0.00 N ATOM 511 CA VAL B 33 -0.443 24.076 -3.619 1.00 0.00 C ATOM 512 C VAL B 33 -1.208 24.145 -2.293 1.00 0.00 C ATOM 513 O VAL B 33 -0.622 24.112 -1.229 1.00 0.00 O ATOM 514 CB VAL B 33 0.136 25.451 -3.969 1.00 0.00 C ATOM 515 CG1 VAL B 33 0.789 25.399 -5.353 1.00 0.00 C ATOM 516 CG2 VAL B 33 -0.983 26.499 -3.972 1.00 0.00 C ATOM 0 H VAL B 33 -1.626 24.516 -5.345 1.00 0.00 H new ATOM 0 HA VAL B 33 0.338 23.325 -3.501 1.00 0.00 H new ATOM 0 HB VAL B 33 0.884 25.723 -3.225 1.00 0.00 H new ATOM 0 HG11 VAL B 33 1.200 26.378 -5.599 1.00 0.00 H new ATOM 0 HG12 VAL B 33 1.590 24.660 -5.350 1.00 0.00 H new ATOM 0 HG13 VAL B 33 0.043 25.122 -6.097 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -0.567 27.475 -4.221 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -1.735 26.226 -4.712 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -1.444 26.542 -2.985 1.00 0.00 H new ATOM 526 N ASN B 34 -2.513 24.255 -2.347 1.00 0.00 N ATOM 527 CA ASN B 34 -3.310 24.345 -1.085 1.00 0.00 C ATOM 528 C ASN B 34 -2.797 25.513 -0.239 1.00 0.00 C ATOM 529 O ASN B 34 -1.862 26.188 -0.618 1.00 0.00 O ATOM 530 CB ASN B 34 -3.086 23.012 -0.365 1.00 0.00 C ATOM 531 CG ASN B 34 -4.428 22.458 0.118 1.00 0.00 C ATOM 532 OD1 ASN B 34 -5.201 23.160 0.737 1.00 0.00 O ATOM 533 ND2 ASN B 34 -4.737 21.216 -0.141 1.00 0.00 N ATOM 0 H ASN B 34 -3.059 24.286 -3.208 1.00 0.00 H new ATOM 0 HA ASN B 34 -4.370 24.520 -1.272 1.00 0.00 H new ATOM 0 HB2 ASN B 34 -2.608 22.300 -1.037 1.00 0.00 H new ATOM 0 HB3 ASN B 34 -2.413 23.153 0.481 1.00 0.00 H new ATOM 0 HD21 ASN B 34 -5.628 20.835 0.177 1.00 0.00 H new ATOM 0 HD22 ASN B 34 -4.087 20.627 -0.661 1.00 0.00 H new ATOM 540 N ARG B 35 -3.401 25.759 0.897 1.00 0.00 N ATOM 541 CA ARG B 35 -2.946 26.887 1.771 1.00 0.00 C ATOM 542 C ARG B 35 -2.765 28.175 0.938 1.00 0.00 C ATOM 543 O ARG B 35 -3.103 28.199 -0.229 1.00 0.00 O ATOM 544 CB ARG B 35 -1.629 26.379 2.401 1.00 0.00 C ATOM 545 CG ARG B 35 -0.400 26.787 1.572 1.00 0.00 C ATOM 546 CD ARG B 35 0.860 26.655 2.433 1.00 0.00 C ATOM 547 NE ARG B 35 1.299 28.059 2.693 1.00 0.00 N ATOM 548 CZ ARG B 35 1.553 28.477 3.913 1.00 0.00 C ATOM 549 NH1 ARG B 35 1.430 27.680 4.944 1.00 0.00 N ATOM 550 NH2 ARG B 35 1.935 29.711 4.100 1.00 0.00 N ATOM 0 H ARG B 35 -4.192 25.226 1.259 1.00 0.00 H new ATOM 0 HA ARG B 35 -3.666 27.155 2.545 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -1.533 26.777 3.411 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -1.664 25.293 2.488 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -0.318 26.155 0.688 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -0.508 27.813 1.221 1.00 0.00 H new ATOM 0 HD2 ARG B 35 0.649 26.129 3.364 1.00 0.00 H new ATOM 0 HD3 ARG B 35 1.634 26.089 1.915 1.00 0.00 H new ATOM 0 HE ARG B 35 1.403 28.705 1.910 1.00 0.00 H new ATOM 0 HH11 ARG B 35 1.132 26.714 4.809 1.00 0.00 H new ATOM 0 HH12 ARG B 35 1.632 28.025 5.882 1.00 0.00 H new ATOM 0 HH21 ARG B 35 2.034 30.341 3.304 1.00 0.00 H new ATOM 0 HH22 ARG B 35 2.135 30.046 5.043 1.00 0.00 H new ATOM 564 N PRO B 36 -2.249 29.211 1.557 1.00 0.00 N ATOM 565 CA PRO B 36 -2.048 30.491 0.828 1.00 0.00 C ATOM 566 C PRO B 36 -0.895 30.357 -0.173 1.00 0.00 C ATOM 567 O PRO B 36 -0.010 31.197 -0.148 1.00 0.00 O ATOM 568 CB PRO B 36 -1.705 31.485 1.935 1.00 0.00 C ATOM 569 CG PRO B 36 -1.143 30.651 3.039 1.00 0.00 C ATOM 570 CD PRO B 36 -1.810 29.304 2.957 1.00 0.00 C ATOM 571 OXT PRO B 36 -0.917 29.415 -0.948 1.00 0.00 O ATOM 0 HA PRO B 36 -2.918 30.798 0.247 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -0.982 32.225 1.592 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -2.589 32.031 2.263 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -0.062 30.553 2.936 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -1.330 31.116 4.007 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.120 28.500 3.213 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.652 29.233 3.645 1.00 0.00 H new TER 579 PRO B 36 ATOM 580 P G A 1 13.184 -17.797 -0.151 1.00 1.31 P ATOM 581 OP1 G A 1 12.443 -16.550 -0.470 1.00 1.51 O ATOM 582 OP2 G A 1 12.695 -19.097 -0.678 1.00 1.52 O ATOM 583 O5' G A 1 13.299 -17.913 1.434 1.00 1.09 O ATOM 584 C5' G A 1 12.571 -17.018 2.296 1.00 1.03 C ATOM 585 C4' G A 1 11.391 -17.732 2.912 1.00 0.94 C ATOM 586 O4' G A 1 11.599 -17.816 4.343 1.00 1.02 O ATOM 587 C3' G A 1 10.069 -16.993 2.792 1.00 0.80 C ATOM 588 O3' G A 1 9.466 -17.226 1.513 1.00 0.75 O ATOM 589 C2' G A 1 9.261 -17.570 3.953 1.00 0.78 C ATOM 590 O2' G A 1 8.626 -18.800 3.666 1.00 0.77 O ATOM 591 C1' G A 1 10.346 -17.797 5.004 1.00 0.90 C ATOM 592 N9 G A 1 10.353 -16.719 5.983 1.00 0.90 N ATOM 593 C8 G A 1 11.218 -15.655 6.051 1.00 0.97 C ATOM 594 N7 G A 1 10.941 -14.835 7.028 1.00 0.99 N ATOM 595 C5 G A 1 9.829 -15.397 7.641 1.00 0.90 C ATOM 596 C6 G A 1 9.070 -14.953 8.748 1.00 0.88 C ATOM 597 O6 G A 1 9.237 -13.943 9.436 1.00 0.94 O ATOM 598 N1 G A 1 8.017 -15.819 9.034 1.00 0.82 N ATOM 599 C2 G A 1 7.736 -16.968 8.334 1.00 0.81 C ATOM 600 N2 G A 1 6.682 -17.682 8.755 1.00 0.83 N ATOM 601 N3 G A 1 8.436 -17.390 7.298 1.00 0.83 N ATOM 602 C4 G A 1 9.460 -16.562 7.009 1.00 0.86 C ATOM 0 H5' G A 1 12.226 -16.154 1.728 1.00 1.03 H new ATOM 0 H5'' G A 1 13.228 -16.642 3.080 1.00 1.03 H new ATOM 0 H4' G A 1 11.333 -18.683 2.383 1.00 0.94 H new ATOM 0 H3' G A 1 10.153 -15.908 2.849 1.00 0.80 H new ATOM 0 H2' G A 1 8.444 -16.907 4.237 1.00 0.78 H new ATOM 0 HO2' G A 1 9.260 -19.399 3.220 1.00 0.77 H new ATOM 0 H1' G A 1 10.154 -18.737 5.522 1.00 0.90 H new ATOM 0 H8 G A 1 12.042 -15.511 5.367 1.00 0.97 H new ATOM 0 H1 G A 1 7.411 -15.583 9.820 1.00 0.82 H new ATOM 0 H21 G A 1 6.425 -18.544 8.274 1.00 0.83 H new ATOM 0 H22 G A 1 6.137 -17.363 9.556 1.00 0.83 H new ATOM 614 P C A 2 8.724 -18.619 1.203 1.00 0.69 P ATOM 615 OP1 C A 2 9.460 -19.697 1.912 1.00 0.82 O ATOM 616 OP2 C A 2 8.526 -18.716 -0.267 1.00 0.84 O ATOM 617 O5' C A 2 7.291 -18.439 1.878 1.00 0.58 O ATOM 618 C5' C A 2 6.748 -17.125 2.103 1.00 0.57 C ATOM 619 C4' C A 2 5.524 -17.202 2.986 1.00 0.55 C ATOM 620 O4' C A 2 5.939 -17.071 4.370 1.00 0.54 O ATOM 621 C3' C A 2 4.537 -16.067 2.775 1.00 0.51 C ATOM 622 O3' C A 2 3.607 -16.401 1.748 1.00 0.59 O ATOM 623 C2' C A 2 3.846 -15.950 4.129 1.00 0.53 C ATOM 624 O2' C A 2 2.743 -16.828 4.255 1.00 0.67 O ATOM 625 C1' C A 2 4.955 -16.360 5.099 1.00 0.51 C ATOM 626 N1 C A 2 5.611 -15.214 5.743 1.00 0.45 N ATOM 627 C2 C A 2 5.042 -14.687 6.901 1.00 0.44 C ATOM 628 O2 C A 2 4.000 -15.198 7.339 1.00 0.49 O ATOM 629 N3 C A 2 5.638 -13.641 7.515 1.00 0.43 N ATOM 630 C4 C A 2 6.758 -13.122 7.009 1.00 0.45 C ATOM 631 N4 C A 2 7.314 -12.094 7.651 1.00 0.49 N ATOM 632 C5 C A 2 7.359 -13.638 5.825 1.00 0.47 C ATOM 633 C6 C A 2 6.758 -14.675 5.228 1.00 0.46 C ATOM 0 H5' C A 2 6.488 -16.665 1.150 1.00 0.57 H new ATOM 0 H5'' C A 2 7.501 -16.489 2.569 1.00 0.57 H new ATOM 0 H4' C A 2 5.048 -18.151 2.740 1.00 0.55 H new ATOM 0 H3' C A 2 5.006 -15.135 2.459 1.00 0.51 H new ATOM 0 H2' C A 2 3.435 -14.955 4.299 1.00 0.53 H new ATOM 0 HO2' C A 2 2.502 -17.179 3.372 1.00 0.67 H new ATOM 0 H1' C A 2 4.496 -16.962 5.883 1.00 0.51 H new ATOM 0 H41 C A 2 8.171 -11.672 7.293 1.00 0.49 H new ATOM 0 H42 C A 2 6.882 -11.730 8.500 1.00 0.49 H new ATOM 0 H5 C A 2 8.265 -13.209 5.424 1.00 0.47 H new ATOM 0 H6 C A 2 7.185 -15.092 4.328 1.00 0.46 H new ATOM 645 P C A 3 2.722 -15.245 1.067 1.00 0.67 P ATOM 646 OP1 C A 3 1.423 -15.849 0.679 1.00 1.00 O ATOM 647 OP2 C A 3 3.552 -14.567 0.039 1.00 1.20 O ATOM 648 O5' C A 3 2.455 -14.216 2.254 1.00 0.89 O ATOM 649 C5' C A 3 1.241 -13.443 2.305 1.00 0.68 C ATOM 650 C4' C A 3 0.690 -13.433 3.707 1.00 0.61 C ATOM 651 O4' C A 3 1.802 -13.578 4.624 1.00 0.67 O ATOM 652 C3' C A 3 0.042 -12.119 4.090 1.00 0.56 C ATOM 653 O3' C A 3 -1.341 -12.112 3.713 1.00 0.57 O ATOM 654 C2' C A 3 0.256 -12.047 5.599 1.00 0.57 C ATOM 655 O2' C A 3 -0.740 -12.696 6.363 1.00 0.64 O ATOM 656 C1' C A 3 1.587 -12.783 5.774 1.00 0.62 C ATOM 657 N1 C A 3 2.721 -11.856 5.889 1.00 0.61 N ATOM 658 C2 C A 3 2.803 -11.021 7.004 1.00 0.56 C ATOM 659 O2 C A 3 1.915 -11.088 7.868 1.00 0.55 O ATOM 660 N3 C A 3 3.843 -10.163 7.114 1.00 0.58 N ATOM 661 C4 C A 3 4.776 -10.124 6.160 1.00 0.65 C ATOM 662 N4 C A 3 5.786 -9.263 6.307 1.00 0.71 N ATOM 663 C5 C A 3 4.717 -10.966 5.012 1.00 0.71 C ATOM 664 C6 C A 3 3.681 -11.810 4.916 1.00 0.68 C ATOM 0 H5' C A 3 0.505 -13.863 1.620 1.00 0.68 H new ATOM 0 H5'' C A 3 1.437 -12.422 1.976 1.00 0.68 H new ATOM 0 H4' C A 3 -0.050 -14.232 3.754 1.00 0.61 H new ATOM 0 H3' C A 3 0.465 -11.250 3.586 1.00 0.56 H new ATOM 0 H2' C A 3 0.231 -11.015 5.948 1.00 0.57 H new ATOM 0 HO2' C A 3 -0.899 -13.592 6.000 1.00 0.64 H new ATOM 0 H1' C A 3 1.528 -13.374 6.688 1.00 0.62 H new ATOM 0 H41 C A 3 6.516 -9.207 5.597 1.00 0.71 H new ATOM 0 H42 C A 3 5.827 -8.661 7.129 1.00 0.71 H new ATOM 0 H5 C A 3 5.479 -10.925 4.248 1.00 0.71 H new ATOM 0 H6 C A 3 3.603 -12.463 4.059 1.00 0.68 H new ATOM 676 P C A 4 -2.437 -12.867 4.614 1.00 0.57 P ATOM 677 OP1 C A 4 -1.796 -14.042 5.262 1.00 0.73 O ATOM 678 OP2 C A 4 -3.637 -13.068 3.764 1.00 0.60 O ATOM 679 O5' C A 4 -2.808 -11.789 5.725 1.00 0.61 O ATOM 680 C5' C A 4 -2.994 -10.405 5.365 1.00 0.51 C ATOM 681 C4' C A 4 -2.906 -9.522 6.584 1.00 0.47 C ATOM 682 O4' C A 4 -1.613 -9.714 7.208 1.00 0.55 O ATOM 683 C3' C A 4 -2.940 -8.037 6.275 1.00 0.45 C ATOM 684 O3' C A 4 -4.275 -7.559 6.169 1.00 0.51 O ATOM 685 C2' C A 4 -2.231 -7.430 7.476 1.00 0.47 C ATOM 686 O2' C A 4 -3.094 -7.225 8.579 1.00 0.57 O ATOM 687 C1' C A 4 -1.194 -8.502 7.810 1.00 0.48 C ATOM 688 N1 C A 4 0.130 -8.162 7.274 1.00 0.43 N ATOM 689 C2 C A 4 0.884 -7.169 7.903 1.00 0.39 C ATOM 690 O2 C A 4 0.415 -6.601 8.901 1.00 0.43 O ATOM 691 N3 C A 4 2.101 -6.854 7.408 1.00 0.38 N ATOM 692 C4 C A 4 2.564 -7.488 6.330 1.00 0.45 C ATOM 693 N4 C A 4 3.763 -7.148 5.871 1.00 0.51 N ATOM 694 C5 C A 4 1.817 -8.500 5.674 1.00 0.51 C ATOM 695 C6 C A 4 0.616 -8.804 6.169 1.00 0.48 C ATOM 0 H5' C A 4 -3.964 -10.276 4.885 1.00 0.51 H new ATOM 0 H5'' C A 4 -2.237 -10.108 4.639 1.00 0.51 H new ATOM 0 H4' C A 4 -3.764 -9.797 7.198 1.00 0.47 H new ATOM 0 H3' C A 4 -2.473 -7.785 5.323 1.00 0.45 H new ATOM 0 H2' C A 4 -1.821 -6.443 7.261 1.00 0.47 H new ATOM 0 HO2' C A 4 -2.588 -6.835 9.322 1.00 0.57 H new ATOM 0 H1' C A 4 -1.116 -8.585 8.894 1.00 0.48 H new ATOM 0 H41 C A 4 4.145 -7.614 5.048 1.00 0.51 H new ATOM 0 H42 C A 4 4.302 -6.421 6.341 1.00 0.51 H new ATOM 0 H5 C A 4 2.207 -9.007 4.804 1.00 0.51 H new ATOM 0 H6 C A 4 0.020 -9.567 5.691 1.00 0.48 H new ATOM 707 P U A 5 -4.585 -6.273 5.253 1.00 0.57 P ATOM 708 OP1 U A 5 -6.056 -6.151 5.100 1.00 0.77 O ATOM 709 OP2 U A 5 -3.725 -6.370 4.047 1.00 0.62 O ATOM 710 O5' U A 5 -4.068 -5.049 6.131 1.00 0.49 O ATOM 711 C5' U A 5 -4.609 -4.813 7.441 1.00 0.45 C ATOM 712 C4' U A 5 -3.740 -3.843 8.206 1.00 0.41 C ATOM 713 O4' U A 5 -2.427 -4.425 8.401 1.00 0.47 O ATOM 714 C3' U A 5 -3.435 -2.536 7.496 1.00 0.35 C ATOM 715 O3' U A 5 -4.486 -1.591 7.682 1.00 0.36 O ATOM 716 C2' U A 5 -2.169 -2.064 8.198 1.00 0.41 C ATOM 717 O2' U A 5 -2.434 -1.304 9.363 1.00 0.50 O ATOM 718 C1' U A 5 -1.488 -3.379 8.571 1.00 0.43 C ATOM 719 N1 U A 5 -0.302 -3.634 7.744 1.00 0.43 N ATOM 720 C2 U A 5 0.767 -2.794 7.952 1.00 0.40 C ATOM 721 O2 U A 5 0.737 -1.886 8.767 1.00 0.39 O ATOM 722 N3 U A 5 1.865 -3.047 7.174 1.00 0.43 N ATOM 723 C4 U A 5 2.000 -4.028 6.225 1.00 0.50 C ATOM 724 O4 U A 5 3.060 -4.117 5.600 1.00 0.54 O ATOM 725 C5 U A 5 0.849 -4.863 6.061 1.00 0.55 C ATOM 726 C6 U A 5 -0.245 -4.644 6.810 1.00 0.51 C ATOM 0 H5' U A 5 -4.680 -5.754 7.986 1.00 0.45 H new ATOM 0 H5'' U A 5 -5.621 -4.416 7.357 1.00 0.45 H new ATOM 0 H4' U A 5 -4.313 -3.646 9.112 1.00 0.41 H new ATOM 0 H3' U A 5 -3.326 -2.650 6.417 1.00 0.35 H new ATOM 0 H2' U A 5 -1.573 -1.404 7.568 1.00 0.41 H new ATOM 0 HO2' U A 5 -3.345 -0.947 9.320 1.00 0.50 H new ATOM 0 H1' U A 5 -1.152 -3.322 9.606 1.00 0.43 H new ATOM 0 H3 U A 5 2.671 -2.439 7.316 1.00 0.43 H new ATOM 0 H5 U A 5 0.860 -5.666 5.338 1.00 0.55 H new ATOM 0 H6 U A 5 -1.107 -5.281 6.675 1.00 0.51 H new ATOM 737 P G A 6 -4.835 -0.547 6.510 1.00 0.43 P ATOM 738 OP1 G A 6 -6.313 -0.414 6.435 1.00 0.65 O ATOM 739 OP2 G A 6 -4.078 -0.970 5.305 1.00 0.54 O ATOM 740 O5' G A 6 -4.241 0.844 7.018 1.00 0.43 O ATOM 741 C5' G A 6 -2.868 0.963 7.450 1.00 0.47 C ATOM 742 C4' G A 6 -2.064 1.745 6.435 1.00 0.47 C ATOM 743 O4' G A 6 -0.688 1.291 6.474 1.00 0.53 O ATOM 744 C3' G A 6 -2.469 1.507 4.994 1.00 0.39 C ATOM 745 O3' G A 6 -3.552 2.358 4.636 1.00 0.41 O ATOM 746 C2' G A 6 -1.205 1.871 4.222 1.00 0.48 C ATOM 747 O2' G A 6 -1.126 3.250 3.916 1.00 0.59 O ATOM 748 C1' G A 6 -0.094 1.482 5.201 1.00 0.49 C ATOM 749 N9 G A 6 0.577 0.243 4.818 1.00 0.50 N ATOM 750 C8 G A 6 0.067 -1.027 4.916 1.00 0.60 C ATOM 751 N7 G A 6 0.898 -1.946 4.503 1.00 0.63 N ATOM 752 C5 G A 6 2.025 -1.240 4.104 1.00 0.54 C ATOM 753 C6 G A 6 3.247 -1.698 3.544 1.00 0.55 C ATOM 754 O6 G A 6 3.596 -2.860 3.305 1.00 0.61 O ATOM 755 N1 G A 6 4.109 -0.644 3.253 1.00 0.55 N ATOM 756 C2 G A 6 3.829 0.681 3.479 1.00 0.57 C ATOM 757 N2 G A 6 4.790 1.558 3.132 1.00 0.70 N ATOM 758 N3 G A 6 2.695 1.122 4.004 1.00 0.53 N ATOM 759 C4 G A 6 1.844 0.114 4.291 1.00 0.49 C ATOM 0 H5' G A 6 -2.434 -0.028 7.582 1.00 0.47 H new ATOM 0 H5'' G A 6 -2.826 1.461 8.419 1.00 0.47 H new ATOM 0 H4' G A 6 -2.223 2.790 6.703 1.00 0.47 H new ATOM 0 H3' G A 6 -2.811 0.491 4.797 1.00 0.39 H new ATOM 0 H2' G A 6 -1.156 1.370 3.255 1.00 0.48 H new ATOM 0 HO2' G A 6 -1.633 3.433 3.098 1.00 0.59 H new ATOM 0 H1' G A 6 0.652 2.276 5.205 1.00 0.49 H new ATOM 0 H8 G A 6 -0.920 -1.244 5.296 1.00 0.60 H new ATOM 0 H1 G A 6 5.014 -0.873 2.842 1.00 0.55 H new ATOM 0 H21 G A 6 4.644 2.557 3.274 1.00 0.70 H new ATOM 0 H22 G A 6 5.664 1.223 2.727 1.00 0.70 H new ATOM 771 P A A 7 -4.432 2.020 3.335 1.00 0.43 P ATOM 772 OP1 A A 7 -4.953 3.305 2.804 1.00 0.74 O ATOM 773 OP2 A A 7 -5.379 0.931 3.681 1.00 0.66 O ATOM 774 O5' A A 7 -3.368 1.448 2.297 1.00 0.33 O ATOM 775 C5' A A 7 -3.737 1.188 0.932 1.00 0.29 C ATOM 776 C4' A A 7 -2.753 1.842 -0.007 1.00 0.23 C ATOM 777 O4' A A 7 -2.868 3.276 0.115 1.00 0.23 O ATOM 778 C3' A A 7 -1.291 1.586 0.312 1.00 0.25 C ATOM 779 O3' A A 7 -0.867 0.346 -0.245 1.00 0.27 O ATOM 780 C2' A A 7 -0.592 2.762 -0.365 1.00 0.24 C ATOM 781 O2' A A 7 -0.296 2.526 -1.727 1.00 0.25 O ATOM 782 C1' A A 7 -1.638 3.870 -0.251 1.00 0.21 C ATOM 783 N9 A A 7 -1.290 4.877 0.752 1.00 0.24 N ATOM 784 C8 A A 7 -1.885 5.099 1.969 1.00 0.29 C ATOM 785 N7 A A 7 -1.342 6.077 2.651 1.00 0.33 N ATOM 786 C5 A A 7 -0.322 6.532 1.828 1.00 0.30 C ATOM 787 C6 A A 7 0.624 7.562 1.973 1.00 0.34 C ATOM 788 N6 A A 7 0.703 8.349 3.048 1.00 0.39 N ATOM 789 N1 A A 7 1.498 7.759 0.961 1.00 0.35 N ATOM 790 C2 A A 7 1.418 6.969 -0.117 1.00 0.32 C ATOM 791 N3 A A 7 0.576 5.970 -0.369 1.00 0.27 N ATOM 792 C4 A A 7 -0.278 5.801 0.655 1.00 0.25 C ATOM 0 H5' A A 7 -4.741 1.567 0.740 1.00 0.29 H new ATOM 0 H5'' A A 7 -3.763 0.113 0.753 1.00 0.29 H new ATOM 0 H4' A A 7 -2.999 1.425 -0.984 1.00 0.23 H new ATOM 0 H3' A A 7 -1.079 1.516 1.379 1.00 0.25 H new ATOM 0 H2' A A 7 0.372 2.981 0.095 1.00 0.24 H new ATOM 0 HO2' A A 7 0.149 3.313 -2.106 1.00 0.25 H new ATOM 0 H1' A A 7 -1.696 4.376 -1.215 1.00 0.21 H new ATOM 0 H8 A A 7 -2.723 4.521 2.331 1.00 0.29 H new ATOM 0 H61 A A 7 1.413 9.080 3.094 1.00 0.39 H new ATOM 0 H62 A A 7 0.054 8.219 3.824 1.00 0.39 H new ATOM 0 H2 A A 7 2.141 7.172 -0.894 1.00 0.32 H new ATOM 804 P A A 8 0.161 -0.582 0.569 1.00 0.37 P ATOM 805 OP1 A A 8 0.019 -1.965 0.050 1.00 0.47 O ATOM 806 OP2 A A 8 -0.021 -0.319 2.020 1.00 0.44 O ATOM 807 O5' A A 8 1.593 -0.036 0.138 1.00 0.38 O ATOM 808 C5' A A 8 1.822 0.464 -1.193 1.00 0.39 C ATOM 809 C4' A A 8 2.789 1.623 -1.157 1.00 0.43 C ATOM 810 O4' A A 8 2.148 2.747 -0.507 1.00 0.37 O ATOM 811 C3' A A 8 4.026 1.367 -0.314 1.00 0.53 C ATOM 812 O3' A A 8 5.054 0.729 -1.076 1.00 0.66 O ATOM 813 C2' A A 8 4.452 2.768 0.107 1.00 0.50 C ATOM 814 O2' A A 8 5.254 3.412 -0.861 1.00 0.58 O ATOM 815 C1' A A 8 3.108 3.490 0.223 1.00 0.38 C ATOM 816 N9 A A 8 2.646 3.585 1.605 1.00 0.36 N ATOM 817 C8 A A 8 1.651 2.855 2.201 1.00 0.42 C ATOM 818 N7 A A 8 1.446 3.172 3.456 1.00 0.47 N ATOM 819 C5 A A 8 2.373 4.173 3.705 1.00 0.41 C ATOM 820 C6 A A 8 2.688 4.907 4.862 1.00 0.44 C ATOM 821 N6 A A 8 2.051 4.761 6.026 1.00 0.54 N ATOM 822 N1 A A 8 3.693 5.806 4.783 1.00 0.40 N ATOM 823 C2 A A 8 4.332 5.951 3.615 1.00 0.36 C ATOM 824 N3 A A 8 4.126 5.323 2.459 1.00 0.35 N ATOM 825 C4 A A 8 3.121 4.437 2.573 1.00 0.35 C ATOM 0 H5' A A 8 0.879 0.782 -1.637 1.00 0.39 H new ATOM 0 H5'' A A 8 2.219 -0.331 -1.824 1.00 0.39 H new ATOM 0 H4' A A 8 3.074 1.792 -2.195 1.00 0.43 H new ATOM 0 H3' A A 8 3.835 0.701 0.528 1.00 0.53 H new ATOM 0 H2' A A 8 5.056 2.759 1.014 1.00 0.50 H new ATOM 0 HO2' A A 8 4.794 3.402 -1.726 1.00 0.58 H new ATOM 0 H1' A A 8 3.234 4.502 -0.163 1.00 0.38 H new ATOM 0 H8 A A 8 1.089 2.091 1.685 1.00 0.42 H new ATOM 0 H61 A A 8 2.325 5.323 6.832 1.00 0.54 H new ATOM 0 H62 A A 8 1.290 4.087 6.110 1.00 0.54 H new ATOM 0 H2 A A 8 5.128 6.681 3.610 1.00 0.36 H new ATOM 837 P A A 9 5.068 0.863 -2.679 1.00 1.47 P ATOM 838 OP1 A A 9 5.019 2.310 -3.008 1.00 2.33 O ATOM 839 OP2 A A 9 4.038 -0.051 -3.233 1.00 2.35 O ATOM 840 O5' A A 9 6.502 0.313 -3.097 1.00 1.08 O ATOM 841 C5' A A 9 7.636 0.486 -2.229 1.00 1.04 C ATOM 842 C4' A A 9 8.318 1.798 -2.518 1.00 1.09 C ATOM 843 O4' A A 9 7.720 2.385 -3.699 1.00 1.26 O ATOM 844 C3' A A 9 8.110 2.857 -1.454 1.00 0.99 C ATOM 845 O3' A A 9 9.044 2.701 -0.395 1.00 1.17 O ATOM 846 C2' A A 9 8.341 4.149 -2.224 1.00 1.26 C ATOM 847 O2' A A 9 9.712 4.479 -2.337 1.00 1.57 O ATOM 848 C1' A A 9 7.773 3.798 -3.603 1.00 1.29 C ATOM 849 N9 A A 9 6.415 4.305 -3.793 1.00 0.00 N ATOM 850 C8 A A 9 5.664 5.039 -2.909 1.00 0.00 C ATOM 851 N7 A A 9 4.474 5.353 -3.360 1.00 0.00 N ATOM 852 C5 A A 9 4.437 4.785 -4.625 1.00 0.00 C ATOM 853 C6 A A 9 3.435 4.735 -5.609 1.00 0.00 C ATOM 854 N6 A A 9 2.240 5.313 -5.480 1.00 0.00 N ATOM 855 N1 A A 9 3.708 4.058 -6.746 1.00 0.00 N ATOM 856 C2 A A 9 4.906 3.477 -6.874 1.00 0.00 C ATOM 857 N3 A A 9 5.927 3.455 -6.022 1.00 0.00 N ATOM 858 C4 A A 9 5.626 4.136 -4.904 1.00 0.00 C ATOM 0 H5' A A 9 8.338 -0.336 -2.369 1.00 1.04 H new ATOM 0 H5'' A A 9 7.314 0.457 -1.188 1.00 1.04 H new ATOM 0 H4' A A 9 9.377 1.552 -2.601 1.00 1.09 H new ATOM 0 H3' A A 9 7.131 2.815 -0.976 1.00 0.99 H new ATOM 0 H2' A A 9 7.885 5.012 -1.740 1.00 1.26 H new ATOM 0 HO2' A A 9 10.229 3.952 -1.692 1.00 1.57 H new ATOM 0 H1' A A 9 8.414 4.251 -4.359 1.00 1.29 H new ATOM 0 H8 A A 9 6.021 5.331 -1.932 1.00 0.00 H new ATOM 0 H61 A A 9 1.555 5.240 -6.232 1.00 0.00 H new ATOM 0 H62 A A 9 2.012 5.828 -4.630 1.00 0.00 H new ATOM 0 H2 A A 9 5.067 2.950 -7.803 1.00 0.00 H new ATOM 870 P A A 10 8.756 1.625 0.764 1.00 1.33 P ATOM 871 OP1 A A 10 9.216 0.295 0.289 1.00 2.11 O ATOM 872 OP2 A A 10 7.342 1.798 1.218 1.00 2.10 O ATOM 873 O5' A A 10 9.710 2.086 1.952 1.00 0.79 O ATOM 874 C5' A A 10 9.252 2.034 3.309 1.00 0.59 C ATOM 875 C4' A A 10 9.415 3.379 3.974 1.00 0.54 C ATOM 876 O4' A A 10 8.168 4.101 3.860 1.00 0.50 O ATOM 877 C3' A A 10 9.680 3.286 5.463 1.00 0.50 C ATOM 878 O3' A A 10 11.083 3.188 5.707 1.00 0.61 O ATOM 879 C2' A A 10 9.082 4.575 6.013 1.00 0.50 C ATOM 880 O2' A A 10 9.991 5.659 5.975 1.00 0.61 O ATOM 881 C1' A A 10 7.921 4.831 5.047 1.00 0.48 C ATOM 882 N9 A A 10 6.642 4.351 5.559 1.00 0.45 N ATOM 883 C8 A A 10 5.803 3.463 4.939 1.00 0.45 C ATOM 884 N7 A A 10 4.715 3.199 5.618 1.00 0.51 N ATOM 885 C5 A A 10 4.850 3.967 6.769 1.00 0.54 C ATOM 886 C6 A A 10 4.039 4.118 7.907 1.00 0.64 C ATOM 887 N6 A A 10 2.871 3.494 8.073 1.00 0.72 N ATOM 888 N1 A A 10 4.477 4.944 8.882 1.00 0.69 N ATOM 889 C2 A A 10 5.650 5.567 8.716 1.00 0.66 C ATOM 890 N3 A A 10 6.499 5.508 7.695 1.00 0.58 N ATOM 891 C4 A A 10 6.035 4.681 6.743 1.00 0.51 C ATOM 0 H5' A A 10 9.813 1.279 3.860 1.00 0.59 H new ATOM 0 H5'' A A 10 8.204 1.734 3.334 1.00 0.59 H new ATOM 0 H4' A A 10 10.260 3.860 3.482 1.00 0.54 H new ATOM 0 H3' A A 10 9.244 2.406 5.936 1.00 0.50 H new ATOM 0 H2' A A 10 8.797 4.485 7.061 1.00 0.50 H new ATOM 0 HO2' A A 10 10.905 5.317 5.886 1.00 0.61 H new ATOM 0 H1' A A 10 7.862 5.909 4.895 1.00 0.48 H new ATOM 0 H8 A A 10 6.019 3.021 3.978 1.00 0.45 H new ATOM 0 H61 A A 10 2.328 3.646 8.923 1.00 0.72 H new ATOM 0 H62 A A 10 2.521 2.866 7.350 1.00 0.72 H new ATOM 0 H2 A A 10 5.950 6.211 9.529 1.00 0.66 H new ATOM 903 P A A 11 11.612 2.736 7.155 1.00 0.62 P ATOM 904 OP1 A A 11 12.605 3.738 7.622 1.00 0.77 O ATOM 905 OP2 A A 11 12.001 1.306 7.059 1.00 0.65 O ATOM 906 O5' A A 11 10.324 2.838 8.086 1.00 0.58 O ATOM 907 C5' A A 11 10.299 3.721 9.221 1.00 0.56 C ATOM 908 C4' A A 11 8.950 3.658 9.896 1.00 0.49 C ATOM 909 O4' A A 11 7.946 3.436 8.874 1.00 0.46 O ATOM 910 C3' A A 11 8.783 2.496 10.861 1.00 0.47 C ATOM 911 O3' A A 11 9.233 2.883 12.164 1.00 0.51 O ATOM 912 C2' A A 11 7.280 2.233 10.820 1.00 0.43 C ATOM 913 O2' A A 11 6.554 3.052 11.716 1.00 0.47 O ATOM 914 C1' A A 11 6.915 2.612 9.384 1.00 0.42 C ATOM 915 N9 A A 11 6.796 1.461 8.489 1.00 0.41 N ATOM 916 C8 A A 11 7.736 0.991 7.606 1.00 0.46 C ATOM 917 N7 A A 11 7.335 -0.047 6.910 1.00 0.47 N ATOM 918 C5 A A 11 6.047 -0.280 7.371 1.00 0.42 C ATOM 919 C6 A A 11 5.076 -1.243 7.033 1.00 0.43 C ATOM 920 N6 A A 11 5.248 -2.197 6.107 1.00 0.49 N ATOM 921 N1 A A 11 3.898 -1.194 7.689 1.00 0.40 N ATOM 922 C2 A A 11 3.711 -0.246 8.614 1.00 0.37 C ATOM 923 N3 A A 11 4.541 0.712 9.016 1.00 0.37 N ATOM 924 C4 A A 11 5.705 0.640 8.348 1.00 0.39 C ATOM 0 H5' A A 11 10.508 4.742 8.902 1.00 0.56 H new ATOM 0 H5'' A A 11 11.081 3.441 9.927 1.00 0.56 H new ATOM 0 H4' A A 11 8.853 4.593 10.448 1.00 0.49 H new ATOM 0 H3' A A 11 9.360 1.607 10.605 1.00 0.47 H new ATOM 0 H2' A A 11 7.041 1.209 11.106 1.00 0.43 H new ATOM 0 HO2' A A 11 6.573 2.654 12.611 1.00 0.47 H new ATOM 0 H1' A A 11 5.945 3.107 9.420 1.00 0.42 H new ATOM 0 H8 A A 11 8.715 1.434 7.494 1.00 0.46 H new ATOM 0 H61 A A 11 4.499 -2.862 5.915 1.00 0.49 H new ATOM 0 H62 A A 11 6.128 -2.258 5.595 1.00 0.49 H new ATOM 0 H2 A A 11 2.749 -0.261 9.104 1.00 0.37 H new ATOM 936 P G A 12 8.678 2.132 13.477 1.00 0.56 P ATOM 937 OP1 G A 12 7.236 1.866 13.276 1.00 0.68 O ATOM 938 OP2 G A 12 9.110 2.922 14.658 1.00 0.65 O ATOM 939 O5' G A 12 9.478 0.750 13.521 1.00 0.50 O ATOM 940 C5' G A 12 8.974 -0.453 12.893 1.00 0.47 C ATOM 941 C4' G A 12 7.470 -0.526 13.003 1.00 0.42 C ATOM 942 O4' G A 12 6.930 -0.320 11.676 1.00 0.40 O ATOM 943 C3' G A 12 6.913 -1.871 13.426 1.00 0.39 C ATOM 944 O3' G A 12 6.840 -1.964 14.846 1.00 0.43 O ATOM 945 C2' G A 12 5.519 -1.870 12.805 1.00 0.35 C ATOM 946 O2' G A 12 4.559 -1.224 13.620 1.00 0.37 O ATOM 947 C1' G A 12 5.741 -1.066 11.520 1.00 0.35 C ATOM 948 N9 G A 12 5.914 -1.934 10.363 1.00 0.33 N ATOM 949 C8 G A 12 7.000 -1.985 9.524 1.00 0.36 C ATOM 950 N7 G A 12 6.874 -2.874 8.578 1.00 0.36 N ATOM 951 C5 G A 12 5.630 -3.445 8.806 1.00 0.33 C ATOM 952 C6 G A 12 4.947 -4.465 8.100 1.00 0.36 C ATOM 953 O6 G A 12 5.321 -5.093 7.103 1.00 0.40 O ATOM 954 N1 G A 12 3.703 -4.738 8.664 1.00 0.36 N ATOM 955 C2 G A 12 3.191 -4.108 9.772 1.00 0.34 C ATOM 956 N2 G A 12 1.976 -4.514 10.172 1.00 0.37 N ATOM 957 N3 G A 12 3.819 -3.154 10.440 1.00 0.31 N ATOM 958 C4 G A 12 5.024 -2.875 9.904 1.00 0.31 C ATOM 0 H5' G A 12 9.420 -1.329 13.364 1.00 0.47 H new ATOM 0 H5'' G A 12 9.268 -0.471 11.843 1.00 0.47 H new ATOM 0 H4' G A 12 7.199 0.213 13.757 1.00 0.42 H new ATOM 0 H3' G A 12 7.525 -2.715 13.108 1.00 0.39 H new ATOM 0 H2' G A 12 5.129 -2.877 12.657 1.00 0.35 H new ATOM 0 HO2' G A 12 4.874 -1.210 14.548 1.00 0.37 H new ATOM 0 H1' G A 12 4.869 -0.433 11.354 1.00 0.35 H new ATOM 0 H8 G A 12 7.869 -1.354 9.636 1.00 0.36 H new ATOM 0 H1 G A 12 3.131 -5.458 8.222 1.00 0.36 H new ATOM 0 H21 G A 12 1.539 -4.087 10.988 1.00 0.37 H new ATOM 0 H22 G A 12 1.490 -5.250 9.660 1.00 0.37 H new ATOM 970 P G A 13 7.552 -3.192 15.602 1.00 0.51 P ATOM 971 OP1 G A 13 7.908 -2.727 16.967 1.00 0.59 O ATOM 972 OP2 G A 13 8.610 -3.735 14.712 1.00 0.57 O ATOM 973 O5' G A 13 6.401 -4.284 15.735 1.00 0.57 O ATOM 974 C5' G A 13 5.133 -3.952 16.332 1.00 0.62 C ATOM 975 C4' G A 13 4.063 -4.890 15.837 1.00 0.60 C ATOM 976 O4' G A 13 3.840 -4.627 14.431 1.00 0.59 O ATOM 977 C3' G A 13 4.442 -6.356 15.879 1.00 0.59 C ATOM 978 O3' G A 13 4.149 -6.912 17.158 1.00 0.66 O ATOM 979 C2' G A 13 3.549 -6.960 14.803 1.00 0.57 C ATOM 980 O2' G A 13 2.270 -7.326 15.286 1.00 0.63 O ATOM 981 C1' G A 13 3.420 -5.817 13.794 1.00 0.54 C ATOM 982 N9 G A 13 4.250 -6.019 12.611 1.00 0.50 N ATOM 983 C8 G A 13 5.417 -5.371 12.288 1.00 0.54 C ATOM 984 N7 G A 13 5.928 -5.773 11.156 1.00 0.56 N ATOM 985 C5 G A 13 5.045 -6.745 10.707 1.00 0.50 C ATOM 986 C6 G A 13 5.073 -7.540 9.532 1.00 0.53 C ATOM 987 O6 G A 13 5.913 -7.542 8.625 1.00 0.60 O ATOM 988 N1 G A 13 3.980 -8.402 9.469 1.00 0.51 N ATOM 989 C2 G A 13 2.992 -8.485 10.419 1.00 0.48 C ATOM 990 N2 G A 13 2.020 -9.380 10.185 1.00 0.52 N ATOM 991 N3 G A 13 2.955 -7.751 11.516 1.00 0.47 N ATOM 992 C4 G A 13 4.005 -6.909 11.595 1.00 0.47 C ATOM 0 H5' G A 13 4.866 -2.924 16.088 1.00 0.62 H new ATOM 0 H5'' G A 13 5.207 -4.013 17.418 1.00 0.62 H new ATOM 0 H4' G A 13 3.207 -4.716 16.490 1.00 0.60 H new ATOM 0 H3' G A 13 5.503 -6.540 15.713 1.00 0.59 H new ATOM 0 H2' G A 13 3.967 -7.882 14.399 1.00 0.57 H new ATOM 0 HO2' G A 13 2.205 -8.303 15.332 1.00 0.63 H new ATOM 0 H1' G A 13 2.381 -5.769 13.467 1.00 0.54 H new ATOM 0 H8 G A 13 5.866 -4.608 12.907 1.00 0.54 H new ATOM 0 H1 G A 13 3.909 -9.016 8.658 1.00 0.51 H new ATOM 0 H21 G A 13 1.257 -9.490 10.853 1.00 0.52 H new ATOM 0 H22 G A 13 2.044 -9.950 9.339 1.00 0.52 H new ATOM 1004 P G A 14 4.303 -8.494 17.396 1.00 0.74 P ATOM 1005 OP1 G A 14 4.058 -8.753 18.838 1.00 0.80 O ATOM 1006 OP2 G A 14 5.580 -8.936 16.778 1.00 0.90 O ATOM 1007 O5' G A 14 3.100 -9.130 16.567 1.00 0.68 O ATOM 1008 C5' G A 14 2.018 -9.810 17.233 1.00 0.70 C ATOM 1009 C4' G A 14 1.422 -10.853 16.317 1.00 0.68 C ATOM 1010 O4' G A 14 1.437 -10.334 14.963 1.00 0.67 O ATOM 1011 C3' G A 14 2.214 -12.143 16.229 1.00 0.67 C ATOM 1012 O3' G A 14 1.824 -13.043 17.260 1.00 0.77 O ATOM 1013 C2' G A 14 1.838 -12.680 14.853 1.00 0.67 C ATOM 1014 O2' G A 14 0.636 -13.425 14.864 1.00 0.80 O ATOM 1015 C1' G A 14 1.639 -11.395 14.047 1.00 0.61 C ATOM 1016 N9 G A 14 2.809 -11.069 13.242 1.00 0.50 N ATOM 1017 C8 G A 14 3.724 -10.073 13.480 1.00 0.50 C ATOM 1018 N7 G A 14 4.677 -10.031 12.588 1.00 0.47 N ATOM 1019 C5 G A 14 4.369 -11.061 11.709 1.00 0.41 C ATOM 1020 C6 G A 14 5.043 -11.503 10.543 1.00 0.40 C ATOM 1021 O6 G A 14 6.079 -11.055 10.040 1.00 0.45 O ATOM 1022 N1 G A 14 4.391 -12.585 9.948 1.00 0.41 N ATOM 1023 C2 G A 14 3.237 -13.158 10.426 1.00 0.46 C ATOM 1024 N2 G A 14 2.754 -14.189 9.718 1.00 0.55 N ATOM 1025 N3 G A 14 2.601 -12.754 11.511 1.00 0.49 N ATOM 1026 C4 G A 14 3.219 -11.709 12.099 1.00 0.44 C ATOM 0 H5' G A 14 1.252 -9.092 17.527 1.00 0.70 H new ATOM 0 H5'' G A 14 2.381 -10.281 18.147 1.00 0.70 H new ATOM 0 H4' G A 14 0.434 -11.063 16.727 1.00 0.68 H new ATOM 0 H3' G A 14 3.288 -12.005 16.353 1.00 0.67 H new ATOM 0 H2' G A 14 2.591 -13.363 14.459 1.00 0.67 H new ATOM 0 HO2' G A 14 0.441 -13.744 13.958 1.00 0.80 H new ATOM 0 H1' G A 14 0.789 -11.538 13.379 1.00 0.61 H new ATOM 0 H8 G A 14 3.662 -9.395 14.318 1.00 0.50 H new ATOM 0 H1 G A 14 4.800 -12.977 9.100 1.00 0.41 H new ATOM 0 H21 G A 14 1.900 -14.659 10.019 1.00 0.55 H new ATOM 0 H22 G A 14 3.240 -14.503 8.878 1.00 0.55 H new ATOM 1038 P C A 15 2.901 -14.068 17.868 1.00 0.87 P ATOM 1039 OP1 C A 15 2.339 -14.654 19.111 1.00 1.02 O ATOM 1040 OP2 C A 15 4.208 -13.365 17.913 1.00 0.91 O ATOM 1041 O5' C A 15 2.991 -15.216 16.769 1.00 0.85 O ATOM 1042 C5' C A 15 1.800 -15.855 16.277 1.00 0.94 C ATOM 1043 C4' C A 15 2.124 -16.711 15.077 1.00 0.97 C ATOM 1044 O4' C A 15 2.425 -15.859 13.946 1.00 0.84 O ATOM 1045 C3' C A 15 3.384 -17.542 15.226 1.00 1.09 C ATOM 1046 O3' C A 15 3.108 -18.768 15.916 1.00 1.31 O ATOM 1047 C2' C A 15 3.782 -17.810 13.779 1.00 1.09 C ATOM 1048 O2' C A 15 3.151 -18.957 13.238 1.00 1.30 O ATOM 1049 C1' C A 15 3.290 -16.550 13.064 1.00 0.89 C ATOM 1050 N1 C A 15 4.397 -15.659 12.696 1.00 0.75 N ATOM 1051 C2 C A 15 5.199 -16.008 11.607 1.00 0.77 C ATOM 1052 O2 C A 15 4.945 -17.045 10.981 1.00 0.89 O ATOM 1053 N3 C A 15 6.228 -15.211 11.264 1.00 0.70 N ATOM 1054 C4 C A 15 6.473 -14.103 11.959 1.00 0.66 C ATOM 1055 N4 C A 15 7.502 -13.356 11.579 1.00 0.71 N ATOM 1056 C5 C A 15 5.672 -13.718 13.072 1.00 0.64 C ATOM 1057 C6 C A 15 4.652 -14.518 13.405 1.00 0.66 C ATOM 0 H5' C A 15 1.060 -15.102 16.006 1.00 0.94 H new ATOM 0 H5'' C A 15 1.358 -16.469 17.062 1.00 0.94 H new ATOM 0 H4' C A 15 1.252 -17.354 14.958 1.00 0.97 H new ATOM 0 H3' C A 15 4.164 -17.048 15.805 1.00 1.09 H new ATOM 0 H2' C A 15 4.849 -18.007 13.675 1.00 1.09 H new ATOM 0 HO2' C A 15 2.993 -19.610 13.951 1.00 1.30 H new ATOM 0 HO3' C A 15 3.934 -19.289 16.000 1.00 1.31 H new ATOM 0 H1' C A 15 2.782 -16.847 12.146 1.00 0.89 H new ATOM 0 H41 C A 15 7.724 -12.499 12.085 1.00 0.71 H new ATOM 0 H42 C A 15 8.071 -13.639 10.781 1.00 0.71 H new ATOM 0 H5 C A 15 5.880 -12.815 13.626 1.00 0.64 H new ATOM 0 H6 C A 15 4.023 -14.259 14.244 1.00 0.66 H new TER 1069 C A 15