USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=18 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 -25:sc= 0.174 USER MOD Single : A 2 C O2' : rot -4:sc= 0.135 USER MOD Single : A 3 C O2' : rot 53:sc= -6.52! USER MOD Single : A 4 C O2' : rot 52:sc= -5.57! USER MOD Single : A 5 U O2' : rot -15:sc= -0.358 USER MOD Single : A 6 G O2' : rot -101:sc= 0.482 USER MOD Single : A 7 A O2' : rot 180:sc= -5.01! USER MOD Single : A 8 A O2' : rot 50:sc= -2.53! USER MOD Single : A 9 A O2' : rot -17:sc= 0.125 USER MOD Single : A 10 A O2' : rot 180:sc= 0 USER MOD Single : A 11 A O2' : rot -87:sc= -0.863! USER MOD Single : A 12 G O2' : rot -23:sc= 0.151 USER MOD Single : A 13 G O2' : rot 59:sc= -6.5! USER MOD Single : A 14 G O2' : rot 180:sc= -2.65! USER MOD Single : A 15 C O2' : rot -15:sc= 0.16 USER MOD Single : A 15 C O3' : rot 180:sc= 0.15 USER MOD Single : B 4 GLN : amide:sc= -1.75 K(o=-1.7,f=-2.5!) 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= -3.83! C(o=-3.8!,f=-2.1!) USER MOD Single : B 17 GLN : amide:sc= -0.361 X(o=-0.36,f=-0.032) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -6.21! C(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+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 ASN : amide:sc= 1.1 K(o=1.1,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP B 2 9.731 -10.975 -1.314 1.00 0.76 N ATOM 2 CA ASP B 2 9.210 -11.528 -0.029 1.00 0.88 C ATOM 3 C ASP B 2 7.701 -11.751 -0.122 1.00 0.68 C ATOM 4 O ASP B 2 7.136 -11.820 -1.195 1.00 0.66 O ATOM 5 CB ASP B 2 9.522 -10.469 1.034 1.00 1.25 C ATOM 6 CG ASP B 2 10.990 -10.042 0.931 1.00 1.88 C ATOM 7 OD1 ASP B 2 11.283 -9.197 0.103 1.00 2.37 O ATOM 8 OD2 ASP B 2 11.793 -10.567 1.683 1.00 2.35 O ATOM 0 HA ASP B 2 9.666 -12.489 0.210 1.00 0.88 H new ATOM 0 HB2 ASP B 2 8.873 -9.604 0.899 1.00 1.25 H new ATOM 0 HB3 ASP B 2 9.319 -10.868 2.028 1.00 1.25 H new ATOM 15 N ALA B 3 7.053 -11.864 1.001 1.00 0.63 N ATOM 16 CA ALA B 3 5.577 -12.084 1.000 1.00 0.58 C ATOM 17 C ALA B 3 4.845 -10.744 1.000 1.00 0.63 C ATOM 18 O ALA B 3 3.811 -10.593 0.378 1.00 0.61 O ATOM 19 CB ALA B 3 5.289 -12.857 2.286 1.00 0.75 C ATOM 0 H ALA B 3 7.482 -11.814 1.925 1.00 0.63 H new ATOM 0 HA ALA B 3 5.240 -12.628 0.117 1.00 0.58 H new ATOM 0 HB1 ALA B 3 4.220 -13.058 2.358 1.00 0.75 H new ATOM 0 HB2 ALA B 3 5.835 -13.800 2.274 1.00 0.75 H new ATOM 0 HB3 ALA B 3 5.606 -12.265 3.145 1.00 0.75 H new ATOM 25 N GLN B 4 5.373 -9.770 1.685 1.00 0.75 N ATOM 26 CA GLN B 4 4.704 -8.440 1.711 1.00 0.89 C ATOM 27 C GLN B 4 4.831 -7.789 0.347 1.00 0.79 C ATOM 28 O GLN B 4 3.848 -7.434 -0.273 1.00 0.81 O ATOM 29 CB GLN B 4 5.447 -7.627 2.768 1.00 1.09 C ATOM 30 CG GLN B 4 4.703 -6.314 3.017 1.00 1.29 C ATOM 31 CD GLN B 4 5.592 -5.369 3.827 1.00 0.85 C ATOM 32 OE1 GLN B 4 6.191 -5.770 4.805 1.00 1.14 O ATOM 33 NE2 GLN B 4 5.705 -4.123 3.457 1.00 0.94 N ATOM 0 H GLN B 4 6.235 -9.836 2.226 1.00 0.75 H new ATOM 0 HA GLN B 4 3.642 -8.511 1.945 1.00 0.89 H new ATOM 0 HB2 GLN B 4 5.521 -8.197 3.694 1.00 1.09 H new ATOM 0 HB3 GLN B 4 6.465 -7.423 2.436 1.00 1.09 H new ATOM 0 HG2 GLN B 4 4.432 -5.851 2.068 1.00 1.29 H new ATOM 0 HG3 GLN B 4 3.774 -6.506 3.554 1.00 1.29 H new ATOM 0 HE21 GLN B 4 5.202 -3.787 2.636 1.00 0.94 H new ATOM 0 HE22 GLN B 4 6.297 -3.485 3.989 1.00 0.94 H new ATOM 42 N THR B 5 6.034 -7.657 -0.141 1.00 0.76 N ATOM 43 CA THR B 5 6.214 -7.060 -1.494 1.00 0.79 C ATOM 44 C THR B 5 5.259 -7.773 -2.448 1.00 0.59 C ATOM 45 O THR B 5 4.696 -7.185 -3.350 1.00 0.57 O ATOM 46 CB THR B 5 7.670 -7.330 -1.872 1.00 0.94 C ATOM 47 OG1 THR B 5 8.527 -6.679 -0.945 1.00 1.26 O ATOM 48 CG2 THR B 5 7.927 -6.792 -3.276 1.00 0.94 C ATOM 0 H THR B 5 6.893 -7.934 0.334 1.00 0.76 H new ATOM 0 HA THR B 5 6.003 -5.991 -1.531 1.00 0.79 H new ATOM 0 HB THR B 5 7.866 -8.402 -1.850 1.00 0.94 H new ATOM 0 HG1 THR B 5 9.461 -6.853 -1.185 1.00 1.26 H new ATOM 0 HG21 THR B 5 8.964 -6.981 -3.554 1.00 0.94 H new ATOM 0 HG22 THR B 5 7.265 -7.291 -3.984 1.00 0.94 H new ATOM 0 HG23 THR B 5 7.736 -5.719 -3.295 1.00 0.94 H new ATOM 56 N ARG B 6 5.037 -9.038 -2.203 1.00 0.48 N ATOM 57 CA ARG B 6 4.078 -9.806 -3.034 1.00 0.46 C ATOM 58 C ARG B 6 2.680 -9.352 -2.676 1.00 0.43 C ATOM 59 O ARG B 6 1.852 -9.088 -3.525 1.00 0.45 O ATOM 60 CB ARG B 6 4.236 -11.260 -2.607 1.00 0.56 C ATOM 61 CG ARG B 6 4.734 -12.100 -3.785 1.00 0.78 C ATOM 62 CD ARG B 6 4.098 -13.490 -3.724 1.00 1.03 C ATOM 63 NE ARG B 6 4.851 -14.209 -2.656 1.00 0.88 N ATOM 64 CZ ARG B 6 6.074 -14.633 -2.870 1.00 0.73 C ATOM 65 NH1 ARG B 6 6.659 -14.436 -4.024 1.00 1.26 N ATOM 66 NH2 ARG B 6 6.711 -15.259 -1.922 1.00 1.43 N ATOM 0 H ARG B 6 5.484 -9.571 -1.457 1.00 0.48 H new ATOM 0 HA ARG B 6 4.250 -9.671 -4.102 1.00 0.46 H new ATOM 0 HB2 ARG B 6 4.939 -11.330 -1.777 1.00 0.56 H new ATOM 0 HB3 ARG B 6 3.282 -11.649 -2.250 1.00 0.56 H new ATOM 0 HG2 ARG B 6 4.480 -11.613 -4.726 1.00 0.78 H new ATOM 0 HG3 ARG B 6 5.820 -12.183 -3.753 1.00 0.78 H new ATOM 0 HD2 ARG B 6 3.036 -13.429 -3.486 1.00 1.03 H new ATOM 0 HD3 ARG B 6 4.181 -14.005 -4.681 1.00 1.03 H new ATOM 0 HE ARG B 6 4.411 -14.373 -1.751 1.00 0.88 H new ATOM 0 HH11 ARG B 6 6.164 -13.948 -4.770 1.00 1.26 H new ATOM 0 HH12 ARG B 6 7.610 -14.771 -4.177 1.00 1.26 H new ATOM 0 HH21 ARG B 6 6.259 -15.416 -1.021 1.00 1.43 H new ATOM 0 HH22 ARG B 6 7.662 -15.592 -2.080 1.00 1.43 H new ATOM 80 N ARG B 7 2.418 -9.269 -1.401 1.00 0.61 N ATOM 81 CA ARG B 7 1.075 -8.842 -0.954 1.00 0.80 C ATOM 82 C ARG B 7 0.770 -7.459 -1.530 1.00 0.65 C ATOM 83 O ARG B 7 -0.359 -7.133 -1.831 1.00 0.56 O ATOM 84 CB ARG B 7 1.165 -8.797 0.573 1.00 1.16 C ATOM 85 CG ARG B 7 -0.070 -8.104 1.159 1.00 1.10 C ATOM 86 CD ARG B 7 0.261 -7.590 2.562 1.00 0.92 C ATOM 87 NE ARG B 7 -0.685 -6.464 2.806 1.00 0.41 N ATOM 88 CZ ARG B 7 -1.961 -6.694 3.004 1.00 0.93 C ATOM 89 NH1 ARG B 7 -2.434 -7.915 2.983 1.00 1.08 N ATOM 90 NH2 ARG B 7 -2.770 -5.695 3.223 1.00 1.61 N ATOM 0 H ARG B 7 3.080 -9.480 -0.654 1.00 0.61 H new ATOM 0 HA ARG B 7 0.280 -9.510 -1.284 1.00 0.80 H new ATOM 0 HB2 ARG B 7 1.245 -9.809 0.969 1.00 1.16 H new ATOM 0 HB3 ARG B 7 2.067 -8.265 0.875 1.00 1.16 H new ATOM 0 HG2 ARG B 7 -0.376 -7.277 0.518 1.00 1.10 H new ATOM 0 HG3 ARG B 7 -0.907 -8.801 1.202 1.00 1.10 H new ATOM 0 HD2 ARG B 7 0.137 -8.376 3.307 1.00 0.92 H new ATOM 0 HD3 ARG B 7 1.296 -7.253 2.623 1.00 0.92 H new ATOM 0 HE ARG B 7 -0.337 -5.505 2.819 1.00 0.41 H new ATOM 0 HH11 ARG B 7 -1.808 -8.702 2.811 1.00 1.08 H new ATOM 0 HH12 ARG B 7 -3.429 -8.079 3.139 1.00 1.08 H new ATOM 0 HH21 ARG B 7 -2.409 -4.741 3.240 1.00 1.61 H new ATOM 0 HH22 ARG B 7 -3.763 -5.868 3.378 1.00 1.61 H new ATOM 104 N ARG B 8 1.782 -6.651 -1.694 1.00 0.68 N ATOM 105 CA ARG B 8 1.569 -5.289 -2.262 1.00 0.67 C ATOM 106 C ARG B 8 0.888 -5.413 -3.609 1.00 0.48 C ATOM 107 O ARG B 8 -0.006 -4.656 -3.935 1.00 0.50 O ATOM 108 CB ARG B 8 2.970 -4.696 -2.407 1.00 0.77 C ATOM 109 CG ARG B 8 2.940 -3.208 -2.061 1.00 0.73 C ATOM 110 CD ARG B 8 2.792 -3.035 -0.545 1.00 0.73 C ATOM 111 NE ARG B 8 3.914 -3.824 0.053 1.00 0.85 N ATOM 112 CZ ARG B 8 5.148 -3.393 -0.017 1.00 1.05 C ATOM 113 NH1 ARG B 8 5.428 -2.265 -0.611 1.00 1.16 N ATOM 114 NH2 ARG B 8 6.110 -4.100 0.512 1.00 1.43 N ATOM 0 H ARG B 8 2.749 -6.876 -1.459 1.00 0.68 H new ATOM 0 HA ARG B 8 0.937 -4.659 -1.636 1.00 0.67 H new ATOM 0 HB2 ARG B 8 3.666 -5.218 -1.750 1.00 0.77 H new ATOM 0 HB3 ARG B 8 3.330 -4.835 -3.426 1.00 0.77 H new ATOM 0 HG2 ARG B 8 3.855 -2.726 -2.404 1.00 0.73 H new ATOM 0 HG3 ARG B 8 2.111 -2.721 -2.575 1.00 0.73 H new ATOM 0 HD2 ARG B 8 2.855 -1.985 -0.261 1.00 0.73 H new ATOM 0 HD3 ARG B 8 1.825 -3.402 -0.200 1.00 0.73 H new ATOM 0 HE ARG B 8 3.715 -4.708 0.521 1.00 0.85 H new ATOM 0 HH11 ARG B 8 4.681 -1.709 -1.027 1.00 1.16 H new ATOM 0 HH12 ARG B 8 6.394 -1.940 -0.659 1.00 1.16 H new ATOM 0 HH21 ARG B 8 5.898 -4.983 0.977 1.00 1.43 H new ATOM 0 HH22 ARG B 8 7.074 -3.769 0.461 1.00 1.43 H new ATOM 128 N GLU B 9 1.262 -6.392 -4.380 1.00 0.38 N ATOM 129 CA GLU B 9 0.577 -6.581 -5.682 1.00 0.34 C ATOM 130 C GLU B 9 -0.881 -6.890 -5.380 1.00 0.31 C ATOM 131 O GLU B 9 -1.781 -6.512 -6.105 1.00 0.34 O ATOM 132 CB GLU B 9 1.275 -7.763 -6.356 1.00 0.40 C ATOM 133 CG GLU B 9 2.752 -7.426 -6.581 1.00 0.59 C ATOM 134 CD GLU B 9 3.156 -7.814 -8.006 1.00 1.24 C ATOM 135 OE1 GLU B 9 2.777 -8.891 -8.436 1.00 1.88 O ATOM 136 OE2 GLU B 9 3.837 -7.027 -8.643 1.00 1.73 O ATOM 0 H GLU B 9 2.002 -7.061 -4.168 1.00 0.38 H new ATOM 0 HA GLU B 9 0.619 -5.709 -6.335 1.00 0.34 H new ATOM 0 HB2 GLU B 9 1.185 -8.654 -5.735 1.00 0.40 H new ATOM 0 HB3 GLU B 9 0.794 -7.988 -7.308 1.00 0.40 H new ATOM 0 HG2 GLU B 9 2.921 -6.361 -6.422 1.00 0.59 H new ATOM 0 HG3 GLU B 9 3.371 -7.958 -5.859 1.00 0.59 H new ATOM 143 N ARG B 10 -1.111 -7.530 -4.269 1.00 0.31 N ATOM 144 CA ARG B 10 -2.498 -7.820 -3.849 1.00 0.38 C ATOM 145 C ARG B 10 -3.106 -6.536 -3.294 1.00 0.35 C ATOM 146 O ARG B 10 -4.307 -6.411 -3.161 1.00 0.40 O ATOM 147 CB ARG B 10 -2.375 -8.883 -2.755 1.00 0.46 C ATOM 148 CG ARG B 10 -2.867 -10.234 -3.282 1.00 0.73 C ATOM 149 CD ARG B 10 -1.675 -11.183 -3.442 1.00 0.67 C ATOM 150 NE ARG B 10 -1.976 -11.982 -4.666 1.00 1.55 N ATOM 151 CZ ARG B 10 -2.814 -12.991 -4.622 1.00 2.12 C ATOM 152 NH1 ARG B 10 -3.409 -13.321 -3.503 1.00 3.14 N ATOM 153 NH2 ARG B 10 -3.058 -13.673 -5.707 1.00 2.20 N ATOM 0 H ARG B 10 -0.388 -7.865 -3.632 1.00 0.31 H new ATOM 0 HA ARG B 10 -3.133 -8.172 -4.662 1.00 0.38 H new ATOM 0 HB2 ARG B 10 -1.338 -8.965 -2.431 1.00 0.46 H new ATOM 0 HB3 ARG B 10 -2.959 -8.589 -1.883 1.00 0.46 H new ATOM 0 HG2 ARG B 10 -3.596 -10.661 -2.594 1.00 0.73 H new ATOM 0 HG3 ARG B 10 -3.371 -10.102 -4.239 1.00 0.73 H new ATOM 0 HD2 ARG B 10 -0.742 -10.630 -3.552 1.00 0.67 H new ATOM 0 HD3 ARG B 10 -1.563 -11.826 -2.569 1.00 0.67 H new ATOM 0 HE ARG B 10 -1.525 -11.741 -5.548 1.00 1.55 H new ATOM 0 HH11 ARG B 10 -3.223 -12.791 -2.651 1.00 3.14 H new ATOM 0 HH12 ARG B 10 -4.058 -14.108 -3.483 1.00 3.14 H new ATOM 0 HH21 ARG B 10 -2.599 -13.421 -6.582 1.00 2.20 H new ATOM 0 HH22 ARG B 10 -3.708 -14.458 -5.680 1.00 2.20 H new ATOM 167 N ARG B 11 -2.276 -5.567 -2.986 1.00 0.29 N ATOM 168 CA ARG B 11 -2.805 -4.286 -2.461 1.00 0.29 C ATOM 169 C ARG B 11 -3.014 -3.302 -3.605 1.00 0.24 C ATOM 170 O ARG B 11 -3.413 -2.181 -3.383 1.00 0.25 O ATOM 171 CB ARG B 11 -1.743 -3.758 -1.500 1.00 0.32 C ATOM 172 CG ARG B 11 -1.611 -4.692 -0.287 1.00 0.41 C ATOM 173 CD ARG B 11 -2.972 -4.853 0.402 1.00 0.55 C ATOM 174 NE ARG B 11 -3.169 -6.330 0.501 1.00 1.59 N ATOM 175 CZ ARG B 11 -4.300 -6.829 0.939 1.00 2.18 C ATOM 176 NH1 ARG B 11 -5.281 -6.043 1.302 1.00 3.24 N ATOM 177 NH2 ARG B 11 -4.448 -8.123 1.014 1.00 1.76 N ATOM 0 H ARG B 11 -1.261 -5.615 -3.078 1.00 0.29 H new ATOM 0 HA ARG B 11 -3.765 -4.420 -1.962 1.00 0.29 H new ATOM 0 HB2 ARG B 11 -0.785 -3.680 -2.013 1.00 0.32 H new ATOM 0 HB3 ARG B 11 -2.010 -2.755 -1.168 1.00 0.32 H new ATOM 0 HG2 ARG B 11 -1.238 -5.665 -0.606 1.00 0.41 H new ATOM 0 HG3 ARG B 11 -0.884 -4.287 0.417 1.00 0.41 H new ATOM 0 HD2 ARG B 11 -2.976 -4.385 1.387 1.00 0.55 H new ATOM 0 HD3 ARG B 11 -3.768 -4.384 -0.177 1.00 0.55 H new ATOM 0 HE ARG B 11 -2.415 -6.958 0.225 1.00 1.59 H new ATOM 0 HH11 ARG B 11 -5.171 -5.031 1.246 1.00 3.24 H new ATOM 0 HH12 ARG B 11 -6.156 -6.443 1.641 1.00 3.24 H new ATOM 0 HH21 ARG B 11 -3.686 -8.741 0.733 1.00 1.76 H new ATOM 0 HH22 ARG B 11 -5.325 -8.517 1.354 1.00 1.76 H new ATOM 191 N ALA B 12 -2.772 -3.704 -4.829 1.00 0.24 N ATOM 192 CA ALA B 12 -2.999 -2.758 -5.963 1.00 0.28 C ATOM 193 C ALA B 12 -4.431 -2.229 -5.866 1.00 0.31 C ATOM 194 O ALA B 12 -4.733 -1.131 -6.286 1.00 0.33 O ATOM 195 CB ALA B 12 -2.807 -3.586 -7.234 1.00 0.34 C ATOM 0 H ALA B 12 -2.433 -4.630 -5.088 1.00 0.24 H new ATOM 0 HA ALA B 12 -2.321 -1.905 -5.954 1.00 0.28 H new ATOM 0 HB1 ALA B 12 -2.959 -2.952 -8.108 1.00 0.34 H new ATOM 0 HB2 ALA B 12 -1.796 -3.994 -7.253 1.00 0.34 H new ATOM 0 HB3 ALA B 12 -3.528 -4.403 -7.248 1.00 0.34 H new ATOM 201 N GLU B 13 -5.304 -3.004 -5.275 1.00 0.34 N ATOM 202 CA GLU B 13 -6.706 -2.549 -5.101 1.00 0.41 C ATOM 203 C GLU B 13 -6.742 -1.543 -3.954 1.00 0.38 C ATOM 204 O GLU B 13 -7.501 -0.593 -3.972 1.00 0.42 O ATOM 205 CB GLU B 13 -7.504 -3.806 -4.753 1.00 0.48 C ATOM 206 CG GLU B 13 -7.552 -4.737 -5.969 1.00 0.52 C ATOM 207 CD GLU B 13 -7.265 -6.173 -5.529 1.00 0.77 C ATOM 208 OE1 GLU B 13 -6.375 -6.355 -4.714 1.00 1.18 O ATOM 209 OE2 GLU B 13 -7.940 -7.067 -6.013 1.00 1.15 O ATOM 0 H GLU B 13 -5.101 -3.933 -4.906 1.00 0.34 H new ATOM 0 HA GLU B 13 -7.117 -2.066 -5.988 1.00 0.41 H new ATOM 0 HB2 GLU B 13 -7.044 -4.318 -3.908 1.00 0.48 H new ATOM 0 HB3 GLU B 13 -8.515 -3.535 -4.450 1.00 0.48 H new ATOM 0 HG2 GLU B 13 -8.531 -4.681 -6.444 1.00 0.52 H new ATOM 0 HG3 GLU B 13 -6.819 -4.420 -6.711 1.00 0.52 H new ATOM 216 N LYS B 14 -5.892 -1.723 -2.975 1.00 0.33 N ATOM 217 CA LYS B 14 -5.842 -0.752 -1.852 1.00 0.33 C ATOM 218 C LYS B 14 -5.041 0.456 -2.326 1.00 0.28 C ATOM 219 O LYS B 14 -5.316 1.590 -1.988 1.00 0.30 O ATOM 220 CB LYS B 14 -5.115 -1.488 -0.722 1.00 0.31 C ATOM 221 CG LYS B 14 -5.898 -2.742 -0.333 1.00 0.38 C ATOM 222 CD LYS B 14 -7.192 -2.338 0.376 1.00 1.23 C ATOM 223 CE LYS B 14 -7.688 -3.500 1.239 1.00 1.37 C ATOM 224 NZ LYS B 14 -9.033 -3.076 1.718 1.00 1.83 N ATOM 0 H LYS B 14 -5.234 -2.500 -2.909 1.00 0.33 H new ATOM 0 HA LYS B 14 -6.820 -0.406 -1.519 1.00 0.33 H new ATOM 0 HB2 LYS B 14 -4.109 -1.761 -1.041 1.00 0.31 H new ATOM 0 HB3 LYS B 14 -5.008 -0.832 0.142 1.00 0.31 H new ATOM 0 HG2 LYS B 14 -6.126 -3.331 -1.221 1.00 0.38 H new ATOM 0 HG3 LYS B 14 -5.295 -3.372 0.320 1.00 0.38 H new ATOM 0 HD2 LYS B 14 -7.019 -1.459 0.996 1.00 1.23 H new ATOM 0 HD3 LYS B 14 -7.951 -2.067 -0.358 1.00 1.23 H new ATOM 0 HE2 LYS B 14 -7.747 -4.423 0.662 1.00 1.37 H new ATOM 0 HE3 LYS B 14 -7.013 -3.688 2.074 1.00 1.37 H new ATOM 0 HZ1 LYS B 14 -9.439 -3.822 2.318 1.00 1.83 H new ATOM 0 HZ2 LYS B 14 -8.944 -2.199 2.269 1.00 1.83 H new ATOM 0 HZ3 LYS B 14 -9.656 -2.911 0.902 1.00 1.83 H new ATOM 238 N GLN B 15 -4.056 0.192 -3.134 1.00 0.25 N ATOM 239 CA GLN B 15 -3.202 1.263 -3.698 1.00 0.24 C ATOM 240 C GLN B 15 -3.985 2.051 -4.740 1.00 0.28 C ATOM 241 O GLN B 15 -4.028 3.258 -4.713 1.00 0.28 O ATOM 242 CB GLN B 15 -2.047 0.503 -4.358 1.00 0.24 C ATOM 243 CG GLN B 15 -0.772 0.690 -3.541 1.00 0.25 C ATOM 244 CD GLN B 15 0.135 -0.522 -3.741 1.00 0.30 C ATOM 245 OE1 GLN B 15 1.184 -0.420 -4.345 1.00 0.35 O ATOM 246 NE2 GLN B 15 -0.232 -1.674 -3.253 1.00 0.33 N ATOM 0 H GLN B 15 -3.803 -0.750 -3.434 1.00 0.25 H new ATOM 0 HA GLN B 15 -2.859 1.978 -2.950 1.00 0.24 H new ATOM 0 HB2 GLN B 15 -2.291 -0.557 -4.431 1.00 0.24 H new ATOM 0 HB3 GLN B 15 -1.895 0.865 -5.375 1.00 0.24 H new ATOM 0 HG2 GLN B 15 -0.257 1.599 -3.851 1.00 0.25 H new ATOM 0 HG3 GLN B 15 -1.016 0.806 -2.485 1.00 0.25 H new ATOM 0 HE21 GLN B 15 -1.114 -1.756 -2.746 1.00 0.33 H new ATOM 0 HE22 GLN B 15 0.362 -2.493 -3.378 1.00 0.33 H new ATOM 255 N ALA B 16 -4.606 1.374 -5.659 1.00 0.35 N ATOM 256 CA ALA B 16 -5.389 2.093 -6.705 1.00 0.41 C ATOM 257 C ALA B 16 -6.569 2.814 -6.060 1.00 0.40 C ATOM 258 O ALA B 16 -7.021 3.833 -6.548 1.00 0.43 O ATOM 259 CB ALA B 16 -5.873 1.009 -7.670 1.00 0.48 C ATOM 0 H ALA B 16 -4.608 0.357 -5.735 1.00 0.35 H new ATOM 0 HA ALA B 16 -4.796 2.847 -7.223 1.00 0.41 H new ATOM 0 HB1 ALA B 16 -6.458 1.467 -8.468 1.00 0.48 H new ATOM 0 HB2 ALA B 16 -5.014 0.494 -8.100 1.00 0.48 H new ATOM 0 HB3 ALA B 16 -6.493 0.292 -7.131 1.00 0.48 H new ATOM 265 N GLN B 17 -7.056 2.318 -4.954 1.00 0.40 N ATOM 266 CA GLN B 17 -8.185 3.014 -4.281 1.00 0.42 C ATOM 267 C GLN B 17 -7.613 4.195 -3.512 1.00 0.37 C ATOM 268 O GLN B 17 -8.202 5.255 -3.434 1.00 0.40 O ATOM 269 CB GLN B 17 -8.792 1.980 -3.333 1.00 0.45 C ATOM 270 CG GLN B 17 -9.834 1.143 -4.083 1.00 0.53 C ATOM 271 CD GLN B 17 -11.241 1.556 -3.643 1.00 0.66 C ATOM 272 OE1 GLN B 17 -12.118 0.724 -3.516 1.00 1.06 O ATOM 273 NE2 GLN B 17 -11.495 2.813 -3.403 1.00 1.33 N ATOM 0 H GLN B 17 -6.724 1.471 -4.493 1.00 0.40 H new ATOM 0 HA GLN B 17 -8.941 3.391 -4.970 1.00 0.42 H new ATOM 0 HB2 GLN B 17 -8.010 1.334 -2.935 1.00 0.45 H new ATOM 0 HB3 GLN B 17 -9.256 2.480 -2.483 1.00 0.45 H new ATOM 0 HG2 GLN B 17 -9.723 1.284 -5.158 1.00 0.53 H new ATOM 0 HG3 GLN B 17 -9.676 0.083 -3.883 1.00 0.53 H new ATOM 0 HE21 GLN B 17 -10.759 3.511 -3.509 1.00 1.33 H new ATOM 0 HE22 GLN B 17 -12.429 3.097 -3.109 1.00 1.33 H new ATOM 282 N TRP B 18 -6.444 4.013 -2.975 1.00 0.32 N ATOM 283 CA TRP B 18 -5.777 5.111 -2.237 1.00 0.30 C ATOM 284 C TRP B 18 -5.191 6.092 -3.246 1.00 0.31 C ATOM 285 O TRP B 18 -5.346 7.293 -3.141 1.00 0.35 O ATOM 286 CB TRP B 18 -4.641 4.435 -1.477 1.00 0.25 C ATOM 287 CG TRP B 18 -3.783 5.491 -0.867 1.00 0.24 C ATOM 288 CD1 TRP B 18 -3.873 5.969 0.391 1.00 0.30 C ATOM 289 CD2 TRP B 18 -2.709 6.214 -1.499 1.00 0.24 C ATOM 290 NE1 TRP B 18 -2.910 6.954 0.557 1.00 0.31 N ATOM 291 CE2 TRP B 18 -2.165 7.130 -0.581 1.00 0.29 C ATOM 292 CE3 TRP B 18 -2.160 6.152 -2.773 1.00 0.28 C ATOM 293 CZ2 TRP B 18 -1.105 7.960 -0.925 1.00 0.34 C ATOM 294 CZ3 TRP B 18 -1.102 6.975 -3.125 1.00 0.36 C ATOM 295 CH2 TRP B 18 -0.572 7.877 -2.212 1.00 0.38 C ATOM 0 H TRP B 18 -5.918 3.140 -3.017 1.00 0.32 H new ATOM 0 HA TRP B 18 -6.455 5.651 -1.576 1.00 0.30 H new ATOM 0 HB2 TRP B 18 -5.041 3.779 -0.704 1.00 0.25 H new ATOM 0 HB3 TRP B 18 -4.053 3.812 -2.151 1.00 0.25 H new ATOM 0 HD1 TRP B 18 -4.576 5.641 1.142 1.00 0.30 H new ATOM 0 HE1 TRP B 18 -2.773 7.482 1.419 1.00 0.31 H new ATOM 0 HE3 TRP B 18 -2.561 5.457 -3.496 1.00 0.28 H new ATOM 0 HZ2 TRP B 18 -0.700 8.658 -0.208 1.00 0.34 H new ATOM 0 HZ3 TRP B 18 -0.685 6.914 -4.120 1.00 0.36 H new ATOM 0 HH2 TRP B 18 0.252 8.514 -2.498 1.00 0.38 H new ATOM 306 N LYS B 19 -4.514 5.567 -4.221 1.00 0.30 N ATOM 307 CA LYS B 19 -3.889 6.420 -5.261 1.00 0.37 C ATOM 308 C LYS B 19 -4.980 7.218 -5.942 1.00 0.46 C ATOM 309 O LYS B 19 -4.794 8.359 -6.320 1.00 0.70 O ATOM 310 CB LYS B 19 -3.234 5.453 -6.251 1.00 0.40 C ATOM 311 CG LYS B 19 -1.926 4.904 -5.674 1.00 0.49 C ATOM 312 CD LYS B 19 -1.098 4.275 -6.796 1.00 0.96 C ATOM 313 CE LYS B 19 -1.794 3.008 -7.299 1.00 1.30 C ATOM 314 NZ LYS B 19 -0.702 2.170 -7.866 1.00 1.92 N ATOM 0 H LYS B 19 -4.365 4.565 -4.344 1.00 0.30 H new ATOM 0 HA LYS B 19 -3.156 7.117 -4.855 1.00 0.37 H new ATOM 0 HB2 LYS B 19 -3.915 4.631 -6.471 1.00 0.40 H new ATOM 0 HB3 LYS B 19 -3.037 5.965 -7.193 1.00 0.40 H new ATOM 0 HG2 LYS B 19 -1.362 5.705 -5.197 1.00 0.49 H new ATOM 0 HG3 LYS B 19 -2.139 4.162 -4.905 1.00 0.49 H new ATOM 0 HD2 LYS B 19 -0.977 4.985 -7.614 1.00 0.96 H new ATOM 0 HD3 LYS B 19 -0.099 4.034 -6.433 1.00 0.96 H new ATOM 0 HE2 LYS B 19 -2.308 2.491 -6.488 1.00 1.30 H new ATOM 0 HE3 LYS B 19 -2.544 3.243 -8.054 1.00 1.30 H new ATOM 0 HZ1 LYS B 19 -1.100 1.282 -8.232 1.00 1.92 H new ATOM 0 HZ2 LYS B 19 -0.235 2.685 -8.640 1.00 1.92 H new ATOM 0 HZ3 LYS B 19 -0.006 1.957 -7.123 1.00 1.92 H new ATOM 328 N ALA B 20 -6.130 6.624 -6.089 1.00 0.44 N ATOM 329 CA ALA B 20 -7.244 7.352 -6.732 1.00 0.52 C ATOM 330 C ALA B 20 -7.581 8.595 -5.910 1.00 0.56 C ATOM 331 O ALA B 20 -8.039 9.594 -6.432 1.00 0.74 O ATOM 332 CB ALA B 20 -8.418 6.384 -6.737 1.00 0.55 C ATOM 0 H ALA B 20 -6.341 5.671 -5.792 1.00 0.44 H new ATOM 0 HA ALA B 20 -6.996 7.680 -7.741 1.00 0.52 H new ATOM 0 HB1 ALA B 20 -9.281 6.861 -7.201 1.00 0.55 H new ATOM 0 HB2 ALA B 20 -8.150 5.490 -7.301 1.00 0.55 H new ATOM 0 HB3 ALA B 20 -8.665 6.106 -5.712 1.00 0.55 H new ATOM 338 N ALA B 21 -7.354 8.538 -4.623 1.00 0.54 N ATOM 339 CA ALA B 21 -7.656 9.715 -3.760 1.00 0.66 C ATOM 340 C ALA B 21 -6.386 10.212 -3.081 1.00 0.73 C ATOM 341 O ALA B 21 -6.421 10.831 -2.036 1.00 0.99 O ATOM 342 CB ALA B 21 -8.668 9.212 -2.734 1.00 0.71 C ATOM 0 H ALA B 21 -6.973 7.728 -4.134 1.00 0.54 H new ATOM 0 HA ALA B 21 -8.051 10.555 -4.331 1.00 0.66 H new ATOM 0 HB1 ALA B 21 -8.939 10.026 -2.061 1.00 0.71 H new ATOM 0 HB2 ALA B 21 -9.560 8.854 -3.248 1.00 0.71 H new ATOM 0 HB3 ALA B 21 -8.229 8.397 -2.159 1.00 0.71 H new ATOM 348 N ASN B 22 -5.272 9.962 -3.694 1.00 0.73 N ATOM 349 CA ASN B 22 -3.970 10.430 -3.132 1.00 0.88 C ATOM 350 C ASN B 22 -2.929 10.574 -4.246 1.00 1.08 C ATOM 351 O ASN B 22 -1.835 10.058 -4.143 1.00 0.00 O ATOM 352 CB ASN B 22 -3.526 9.361 -2.139 1.00 0.93 C ATOM 353 CG ASN B 22 -4.500 9.307 -0.966 1.00 0.94 C ATOM 354 OD1 ASN B 22 -4.677 10.279 -0.257 1.00 1.13 O ATOM 355 ND2 ASN B 22 -5.143 8.204 -0.735 1.00 0.94 N ATOM 0 H ASN B 22 -5.200 9.447 -4.572 1.00 0.73 H new ATOM 0 HA ASN B 22 -4.075 11.404 -2.653 1.00 0.88 H new ATOM 0 HB2 ASN B 22 -3.482 8.390 -2.632 1.00 0.93 H new ATOM 0 HB3 ASN B 22 -2.521 9.581 -1.779 1.00 0.93 H new ATOM 0 HD21 ASN B 22 -5.800 8.150 0.044 1.00 0.94 H new ATOM 0 HD22 ASN B 22 -4.992 7.391 -1.332 1.00 0.94 H new ATOM 362 N PRO B 23 -3.299 11.299 -5.268 1.00 0.00 N ATOM 363 CA PRO B 23 -2.383 11.543 -6.397 1.00 0.00 C ATOM 364 C PRO B 23 -1.295 12.488 -5.909 1.00 0.00 C ATOM 365 O PRO B 23 -0.168 12.451 -6.354 1.00 0.00 O ATOM 366 CB PRO B 23 -3.270 12.195 -7.454 1.00 0.00 C ATOM 367 CG PRO B 23 -4.393 12.805 -6.684 1.00 0.00 C ATOM 368 CD PRO B 23 -4.582 11.960 -5.451 1.00 0.00 C ATOM 0 HA PRO B 23 -1.892 10.654 -6.794 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -2.723 12.949 -8.020 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -3.635 11.461 -8.172 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -4.163 13.836 -6.415 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -5.305 12.827 -7.281 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -4.842 12.571 -4.586 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -5.387 11.237 -5.584 1.00 0.00 H new ATOM 376 N LEU B 24 -1.633 13.319 -4.960 1.00 0.00 N ATOM 377 CA LEU B 24 -0.624 14.257 -4.390 1.00 0.00 C ATOM 378 C LEU B 24 0.572 13.445 -3.897 1.00 0.00 C ATOM 379 O LEU B 24 1.713 13.849 -4.005 1.00 0.00 O ATOM 380 CB LEU B 24 -1.354 14.967 -3.229 1.00 0.00 C ATOM 381 CG LEU B 24 -1.196 14.194 -1.900 1.00 0.00 C ATOM 382 CD1 LEU B 24 -1.597 15.105 -0.739 1.00 0.00 C ATOM 383 CD2 LEU B 24 -2.097 12.942 -1.888 1.00 0.00 C ATOM 0 H LEU B 24 -2.566 13.389 -4.554 1.00 0.00 H new ATOM 0 HA LEU B 24 -0.244 14.984 -5.108 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -0.959 15.976 -3.113 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -2.413 15.065 -3.470 1.00 0.00 H new ATOM 0 HG LEU B 24 -0.156 13.883 -1.798 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -1.488 14.565 0.202 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -0.955 15.986 -0.729 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -2.635 15.415 -0.861 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -1.971 12.412 -0.944 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -3.139 13.242 -1.999 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -1.819 12.286 -2.713 1.00 0.00 H new ATOM 395 N LEU B 25 0.299 12.277 -3.393 1.00 0.00 N ATOM 396 CA LEU B 25 1.378 11.378 -2.925 1.00 0.00 C ATOM 397 C LEU B 25 1.586 10.334 -4.008 1.00 0.00 C ATOM 398 O LEU B 25 1.859 9.177 -3.756 1.00 0.00 O ATOM 399 CB LEU B 25 0.831 10.746 -1.646 1.00 0.00 C ATOM 400 CG LEU B 25 1.165 11.641 -0.452 1.00 0.00 C ATOM 401 CD1 LEU B 25 0.274 11.268 0.733 1.00 0.00 C ATOM 402 CD2 LEU B 25 2.634 11.447 -0.064 1.00 0.00 C ATOM 0 H LEU B 25 -0.644 11.904 -3.285 1.00 0.00 H new ATOM 0 HA LEU B 25 2.330 11.873 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.248 10.615 -1.725 1.00 0.00 H new ATOM 0 HB3 LEU B 25 1.263 9.755 -1.504 1.00 0.00 H new ATOM 0 HG LEU B 25 0.993 12.683 -0.722 1.00 0.00 H new ATOM 0 HD11 LEU B 25 0.513 11.907 1.583 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -0.772 11.405 0.459 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.445 10.226 1.003 1.00 0.00 H new ATOM 0 HD21 LEU B 25 2.873 12.085 0.787 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.805 10.404 0.205 1.00 0.00 H new ATOM 0 HD23 LEU B 25 3.271 11.714 -0.907 1.00 0.00 H new ATOM 414 N VAL B 26 1.413 10.760 -5.220 1.00 0.00 N ATOM 415 CA VAL B 26 1.539 9.850 -6.379 1.00 0.00 C ATOM 416 C VAL B 26 1.931 10.668 -7.611 1.00 0.00 C ATOM 417 O VAL B 26 1.225 11.571 -8.013 1.00 0.00 O ATOM 418 CB VAL B 26 0.130 9.252 -6.512 1.00 0.00 C ATOM 419 CG1 VAL B 26 -0.361 9.339 -7.958 1.00 0.00 C ATOM 420 CG2 VAL B 26 0.173 7.793 -6.069 1.00 0.00 C ATOM 0 H VAL B 26 1.184 11.724 -5.461 1.00 0.00 H new ATOM 0 HA VAL B 26 2.298 9.076 -6.269 1.00 0.00 H new ATOM 0 HB VAL B 26 -0.560 9.816 -5.884 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -1.360 8.910 -8.029 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -0.391 10.383 -8.270 1.00 0.00 H new ATOM 0 HG13 VAL B 26 0.318 8.786 -8.607 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -0.822 7.356 -6.158 1.00 0.00 H new ATOM 0 HG22 VAL B 26 0.870 7.241 -6.700 1.00 0.00 H new ATOM 0 HG23 VAL B 26 0.502 7.737 -5.031 1.00 0.00 H new ATOM 430 N GLY B 27 3.051 10.378 -8.204 1.00 0.00 N ATOM 431 CA GLY B 27 3.481 11.173 -9.392 1.00 0.00 C ATOM 432 C GLY B 27 3.906 12.562 -8.906 1.00 0.00 C ATOM 433 O GLY B 27 5.049 12.954 -9.041 1.00 0.00 O ATOM 0 H GLY B 27 3.686 9.631 -7.923 1.00 0.00 H new ATOM 0 HA2 GLY B 27 4.308 10.679 -9.902 1.00 0.00 H new ATOM 0 HA3 GLY B 27 2.666 11.254 -10.111 1.00 0.00 H new ATOM 437 N VAL B 28 2.994 13.296 -8.313 1.00 0.00 N ATOM 438 CA VAL B 28 3.331 14.652 -7.777 1.00 0.00 C ATOM 439 C VAL B 28 4.595 14.556 -6.919 1.00 0.00 C ATOM 440 O VAL B 28 5.062 13.476 -6.615 1.00 0.00 O ATOM 441 CB VAL B 28 2.116 15.037 -6.918 1.00 0.00 C ATOM 442 CG1 VAL B 28 2.499 16.129 -5.912 1.00 0.00 C ATOM 443 CG2 VAL B 28 1.000 15.556 -7.825 1.00 0.00 C ATOM 0 H VAL B 28 2.024 13.011 -8.177 1.00 0.00 H new ATOM 0 HA VAL B 28 3.526 15.388 -8.557 1.00 0.00 H new ATOM 0 HB VAL B 28 1.775 14.157 -6.373 1.00 0.00 H new ATOM 0 HG11 VAL B 28 1.628 16.391 -5.311 1.00 0.00 H new ATOM 0 HG12 VAL B 28 3.292 15.762 -5.261 1.00 0.00 H new ATOM 0 HG13 VAL B 28 2.849 17.011 -6.448 1.00 0.00 H new ATOM 0 HG21 VAL B 28 0.136 15.830 -7.219 1.00 0.00 H new ATOM 0 HG22 VAL B 28 1.352 16.431 -8.371 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.714 14.777 -8.532 1.00 0.00 H new ATOM 453 N SER B 29 5.145 15.665 -6.508 1.00 0.00 N ATOM 454 CA SER B 29 6.362 15.607 -5.656 1.00 0.00 C ATOM 455 C SER B 29 5.986 15.167 -4.237 1.00 0.00 C ATOM 456 O SER B 29 6.376 15.784 -3.266 1.00 0.00 O ATOM 457 CB SER B 29 6.925 17.027 -5.653 1.00 0.00 C ATOM 458 OG SER B 29 6.960 17.519 -6.986 1.00 0.00 O ATOM 0 H SER B 29 4.806 16.602 -6.724 1.00 0.00 H new ATOM 0 HA SER B 29 7.093 14.890 -6.029 1.00 0.00 H new ATOM 0 HB2 SER B 29 6.308 17.674 -5.030 1.00 0.00 H new ATOM 0 HB3 SER B 29 7.927 17.033 -5.224 1.00 0.00 H new ATOM 0 HG SER B 29 7.319 18.431 -6.989 1.00 0.00 H new ATOM 464 N ALA B 30 5.231 14.097 -4.123 1.00 0.00 N ATOM 465 CA ALA B 30 4.801 13.577 -2.783 1.00 0.00 C ATOM 466 C ALA B 30 4.699 14.708 -1.752 1.00 0.00 C ATOM 467 O ALA B 30 5.443 14.754 -0.792 1.00 0.00 O ATOM 468 CB ALA B 30 5.880 12.570 -2.389 1.00 0.00 C ATOM 0 H ALA B 30 4.889 13.554 -4.916 1.00 0.00 H new ATOM 0 HA ALA B 30 3.811 13.123 -2.822 1.00 0.00 H new ATOM 0 HB1 ALA B 30 5.640 12.141 -1.416 1.00 0.00 H new ATOM 0 HB2 ALA B 30 5.926 11.776 -3.134 1.00 0.00 H new ATOM 0 HB3 ALA B 30 6.845 13.073 -2.335 1.00 0.00 H new ATOM 474 N LYS B 31 3.784 15.618 -1.950 1.00 0.00 N ATOM 475 CA LYS B 31 3.631 16.747 -0.990 1.00 0.00 C ATOM 476 C LYS B 31 2.147 16.994 -0.704 1.00 0.00 C ATOM 477 O LYS B 31 1.294 16.546 -1.445 1.00 0.00 O ATOM 478 CB LYS B 31 4.260 17.953 -1.695 1.00 0.00 C ATOM 479 CG LYS B 31 3.521 18.242 -3.008 1.00 0.00 C ATOM 480 CD LYS B 31 3.659 19.728 -3.350 1.00 0.00 C ATOM 481 CE LYS B 31 5.128 20.053 -3.632 1.00 0.00 C ATOM 482 NZ LYS B 31 5.116 21.427 -4.208 1.00 0.00 N ATOM 0 H LYS B 31 3.135 15.628 -2.737 1.00 0.00 H new ATOM 0 HA LYS B 31 4.108 16.548 -0.030 1.00 0.00 H new ATOM 0 HB2 LYS B 31 4.217 18.827 -1.045 1.00 0.00 H new ATOM 0 HB3 LYS B 31 5.313 17.757 -1.897 1.00 0.00 H new ATOM 0 HG2 LYS B 31 3.933 17.632 -3.812 1.00 0.00 H new ATOM 0 HG3 LYS B 31 2.468 17.975 -2.913 1.00 0.00 H new ATOM 0 HD2 LYS B 31 3.049 19.970 -4.220 1.00 0.00 H new ATOM 0 HD3 LYS B 31 3.293 20.338 -2.524 1.00 0.00 H new ATOM 0 HE2 LYS B 31 5.723 20.013 -2.720 1.00 0.00 H new ATOM 0 HE3 LYS B 31 5.564 19.337 -4.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 6.089 21.720 -4.427 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 4.548 21.433 -5.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 4.702 22.088 -3.520 1.00 0.00 H new ATOM 496 N PRO B 32 1.883 17.700 0.364 1.00 0.00 N ATOM 497 CA PRO B 32 0.481 18.001 0.738 1.00 0.00 C ATOM 498 C PRO B 32 -0.119 19.024 -0.231 1.00 0.00 C ATOM 499 O PRO B 32 0.577 19.613 -1.035 1.00 0.00 O ATOM 500 CB PRO B 32 0.601 18.581 2.145 1.00 0.00 C ATOM 501 CG PRO B 32 1.992 19.125 2.221 1.00 0.00 C ATOM 502 CD PRO B 32 2.845 18.279 1.313 1.00 0.00 C ATOM 0 HA PRO B 32 -0.172 17.129 0.700 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -0.139 19.364 2.314 1.00 0.00 H new ATOM 0 HB3 PRO B 32 0.434 17.816 2.903 1.00 0.00 H new ATOM 0 HG2 PRO B 32 2.015 20.169 1.910 1.00 0.00 H new ATOM 0 HG3 PRO B 32 2.365 19.089 3.245 1.00 0.00 H new ATOM 0 HD2 PRO B 32 3.600 18.877 0.802 1.00 0.00 H new ATOM 0 HD3 PRO B 32 3.374 17.505 1.869 1.00 0.00 H new ATOM 510 N VAL B 33 -1.407 19.235 -0.165 1.00 0.00 N ATOM 511 CA VAL B 33 -2.053 20.218 -1.087 1.00 0.00 C ATOM 512 C VAL B 33 -3.163 20.990 -0.356 1.00 0.00 C ATOM 513 O VAL B 33 -2.909 21.997 0.275 1.00 0.00 O ATOM 514 CB VAL B 33 -2.620 19.385 -2.249 1.00 0.00 C ATOM 515 CG1 VAL B 33 -1.527 19.163 -3.295 1.00 0.00 C ATOM 516 CG2 VAL B 33 -3.112 18.025 -1.739 1.00 0.00 C ATOM 0 H VAL B 33 -2.040 18.770 0.486 1.00 0.00 H new ATOM 0 HA VAL B 33 -1.347 20.965 -1.448 1.00 0.00 H new ATOM 0 HB VAL B 33 -3.457 19.924 -2.693 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -1.927 18.573 -4.119 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -1.183 20.126 -3.672 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -0.691 18.632 -2.840 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -3.511 17.446 -2.572 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -2.281 17.484 -1.286 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -3.894 18.177 -0.995 1.00 0.00 H new ATOM 526 N ASN B 34 -4.389 20.534 -0.433 1.00 0.00 N ATOM 527 CA ASN B 34 -5.499 21.253 0.260 1.00 0.00 C ATOM 528 C ASN B 34 -6.767 20.394 0.258 1.00 0.00 C ATOM 529 O ASN B 34 -6.856 19.403 -0.442 1.00 0.00 O ATOM 530 CB ASN B 34 -5.714 22.531 -0.556 1.00 0.00 C ATOM 531 CG ASN B 34 -5.627 23.750 0.366 1.00 0.00 C ATOM 532 OD1 ASN B 34 -6.587 24.476 0.525 1.00 0.00 O ATOM 533 ND2 ASN B 34 -4.505 24.006 0.982 1.00 0.00 N ATOM 0 H ASN B 34 -4.667 19.697 -0.945 1.00 0.00 H new ATOM 0 HA ASN B 34 -5.264 21.470 1.302 1.00 0.00 H new ATOM 0 HB2 ASN B 34 -4.963 22.603 -1.342 1.00 0.00 H new ATOM 0 HB3 ASN B 34 -6.687 22.502 -1.046 1.00 0.00 H new ATOM 0 HD21 ASN B 34 -4.434 24.816 1.597 1.00 0.00 H new ATOM 0 HD22 ASN B 34 -3.699 23.396 0.848 1.00 0.00 H new ATOM 540 N ARG B 35 -7.750 20.767 1.036 1.00 0.00 N ATOM 541 CA ARG B 35 -9.020 19.977 1.084 1.00 0.00 C ATOM 542 C ARG B 35 -8.719 18.496 1.356 1.00 0.00 C ATOM 543 O ARG B 35 -9.094 17.636 0.584 1.00 0.00 O ATOM 544 CB ARG B 35 -9.655 20.153 -0.298 1.00 0.00 C ATOM 545 CG ARG B 35 -9.887 21.643 -0.574 1.00 0.00 C ATOM 546 CD ARG B 35 -9.216 22.033 -1.894 1.00 0.00 C ATOM 547 NE ARG B 35 -10.337 22.196 -2.865 1.00 0.00 N ATOM 548 CZ ARG B 35 -11.151 23.219 -2.782 1.00 0.00 C ATOM 549 NH1 ARG B 35 -10.998 24.122 -1.845 1.00 0.00 N ATOM 550 NH2 ARG B 35 -12.125 23.341 -3.642 1.00 0.00 N ATOM 0 H ARG B 35 -7.729 21.587 1.642 1.00 0.00 H new ATOM 0 HA ARG B 35 -9.683 20.315 1.881 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -9.006 19.728 -1.064 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -10.601 19.613 -0.346 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -10.956 21.852 -0.622 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -9.482 22.241 0.242 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -8.647 22.957 -1.789 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -8.517 21.264 -2.224 1.00 0.00 H new ATOM 0 HE ARG B 35 -10.471 21.503 -3.602 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -10.239 24.033 -1.170 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -11.638 24.914 -1.791 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -12.249 22.642 -4.374 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -12.762 24.136 -3.582 1.00 0.00 H new ATOM 564 N PRO B 36 -8.048 18.246 2.453 1.00 0.00 N ATOM 565 CA PRO B 36 -7.696 16.855 2.826 1.00 0.00 C ATOM 566 C PRO B 36 -8.939 16.100 3.305 1.00 0.00 C ATOM 567 O PRO B 36 -8.784 14.986 3.780 1.00 0.00 O ATOM 568 CB PRO B 36 -6.694 17.031 3.964 1.00 0.00 C ATOM 569 CG PRO B 36 -7.004 18.372 4.549 1.00 0.00 C ATOM 570 CD PRO B 36 -7.560 19.223 3.437 1.00 0.00 C ATOM 571 OXT PRO B 36 -10.022 16.648 3.189 1.00 0.00 O ATOM 0 HA PRO B 36 -7.291 16.278 1.995 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -6.800 16.242 4.708 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -5.669 16.988 3.597 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -7.725 18.280 5.361 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -6.106 18.826 4.969 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -8.364 19.868 3.792 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -6.795 19.872 3.010 1.00 0.00 H new TER 579 PRO B 36 ATOM 580 P G A 1 12.225 -14.182 -0.695 1.00 1.31 P ATOM 581 OP1 G A 1 12.747 -15.570 -0.765 1.00 1.51 O ATOM 582 OP2 G A 1 13.151 -13.038 -0.896 1.00 1.52 O ATOM 583 O5' G A 1 11.498 -13.997 0.711 1.00 1.09 O ATOM 584 C5' G A 1 12.208 -14.220 1.944 1.00 1.03 C ATOM 585 C4' G A 1 11.544 -15.325 2.734 1.00 0.94 C ATOM 586 O4' G A 1 11.904 -15.170 4.128 1.00 1.02 O ATOM 587 C3' G A 1 10.025 -15.282 2.726 1.00 0.80 C ATOM 588 O3' G A 1 9.517 -16.009 1.612 1.00 0.75 O ATOM 589 C2' G A 1 9.655 -15.961 4.040 1.00 0.78 C ATOM 590 O2' G A 1 9.575 -17.370 3.928 1.00 0.77 O ATOM 591 C1' G A 1 10.821 -15.571 4.947 1.00 0.90 C ATOM 592 N9 G A 1 10.467 -14.457 5.813 1.00 0.90 N ATOM 593 C8 G A 1 10.766 -13.130 5.624 1.00 0.97 C ATOM 594 N7 G A 1 10.288 -12.361 6.564 1.00 0.99 N ATOM 595 C5 G A 1 9.636 -13.235 7.423 1.00 0.90 C ATOM 596 C6 G A 1 8.912 -12.981 8.610 1.00 0.88 C ATOM 597 O6 G A 1 8.706 -11.900 9.160 1.00 0.94 O ATOM 598 N1 G A 1 8.399 -14.153 9.163 1.00 0.82 N ATOM 599 C2 G A 1 8.566 -15.408 8.630 1.00 0.81 C ATOM 600 N2 G A 1 8.000 -16.421 9.305 1.00 0.83 N ATOM 601 N3 G A 1 9.239 -15.656 7.520 1.00 0.83 N ATOM 602 C4 G A 1 9.743 -14.531 6.974 1.00 0.86 C ATOM 0 H5' G A 1 12.227 -13.303 2.533 1.00 1.03 H new ATOM 0 H5'' G A 1 13.244 -14.485 1.733 1.00 1.03 H new ATOM 0 H4' G A 1 11.878 -16.252 2.268 1.00 0.94 H new ATOM 0 H3' G A 1 9.616 -14.275 2.639 1.00 0.80 H new ATOM 0 H2' G A 1 8.672 -15.656 4.400 1.00 0.78 H new ATOM 0 HO2' G A 1 9.380 -17.614 2.999 1.00 0.77 H new ATOM 0 H1' G A 1 11.082 -16.427 5.569 1.00 0.90 H new ATOM 0 H8 G A 1 11.337 -12.761 4.785 1.00 0.97 H new ATOM 0 H1 G A 1 7.861 -14.073 10.026 1.00 0.82 H new ATOM 0 H21 G A 1 8.089 -17.377 8.960 1.00 0.83 H new ATOM 0 H22 G A 1 7.481 -16.235 10.163 1.00 0.83 H new ATOM 614 P C A 2 7.989 -15.809 1.159 1.00 0.69 P ATOM 615 OP1 C A 2 7.772 -16.649 -0.047 1.00 0.82 O ATOM 616 OP2 C A 2 7.705 -14.353 1.100 1.00 0.84 O ATOM 617 O5' C A 2 7.146 -16.438 2.355 1.00 0.58 O ATOM 618 C5' C A 2 6.343 -17.614 2.153 1.00 0.57 C ATOM 619 C4' C A 2 5.084 -17.535 2.987 1.00 0.55 C ATOM 620 O4' C A 2 5.455 -17.218 4.350 1.00 0.54 O ATOM 621 C3' C A 2 4.135 -16.415 2.599 1.00 0.51 C ATOM 622 O3' C A 2 3.257 -16.843 1.559 1.00 0.59 O ATOM 623 C2' C A 2 3.368 -16.160 3.892 1.00 0.53 C ATOM 624 O2' C A 2 2.244 -17.009 4.037 1.00 0.67 O ATOM 625 C1' C A 2 4.411 -16.486 4.965 1.00 0.51 C ATOM 626 N1 C A 2 4.993 -15.284 5.577 1.00 0.45 N ATOM 627 C2 C A 2 4.490 -14.858 6.805 1.00 0.44 C ATOM 628 O2 C A 2 3.577 -15.511 7.335 1.00 0.49 O ATOM 629 N3 C A 2 5.006 -13.751 7.385 1.00 0.43 N ATOM 630 C4 C A 2 5.988 -13.080 6.781 1.00 0.45 C ATOM 631 N4 C A 2 6.468 -11.994 7.390 1.00 0.49 N ATOM 632 C5 C A 2 6.522 -13.494 5.526 1.00 0.47 C ATOM 633 C6 C A 2 6.001 -14.593 4.964 1.00 0.46 C ATOM 0 H5' C A 2 6.912 -18.503 2.424 1.00 0.57 H new ATOM 0 H5'' C A 2 6.084 -17.710 1.099 1.00 0.57 H new ATOM 0 H4' C A 2 4.591 -18.497 2.844 1.00 0.55 H new ATOM 0 H3' C A 2 4.638 -15.527 2.217 1.00 0.51 H new ATOM 0 H2' C A 2 2.965 -15.148 3.938 1.00 0.53 H new ATOM 0 HO2' C A 2 2.145 -17.561 3.233 1.00 0.67 H new ATOM 0 H1' C A 2 3.914 -17.050 5.754 1.00 0.51 H new ATOM 0 H41 C A 2 7.219 -11.457 6.957 1.00 0.49 H new ATOM 0 H42 C A 2 6.084 -11.701 8.288 1.00 0.49 H new ATOM 0 H5 C A 2 7.317 -12.942 5.046 1.00 0.47 H new ATOM 0 H6 C A 2 6.382 -14.938 4.014 1.00 0.46 H new ATOM 645 P C A 3 2.106 -15.855 1.026 1.00 0.67 P ATOM 646 OP1 C A 3 0.812 -16.574 1.147 1.00 1.00 O ATOM 647 OP2 C A 3 2.526 -15.319 -0.293 1.00 1.20 O ATOM 648 O5' C A 3 2.104 -14.656 2.075 1.00 0.89 O ATOM 649 C5' C A 3 1.038 -13.686 2.093 1.00 0.68 C ATOM 650 C4' C A 3 0.449 -13.585 3.478 1.00 0.61 C ATOM 651 O4' C A 3 1.538 -13.660 4.430 1.00 0.67 O ATOM 652 C3' C A 3 -0.224 -12.256 3.773 1.00 0.56 C ATOM 653 O3' C A 3 -1.596 -12.269 3.353 1.00 0.57 O ATOM 654 C2' C A 3 -0.060 -12.111 5.284 1.00 0.57 C ATOM 655 O2' C A 3 -1.069 -12.747 6.042 1.00 0.64 O ATOM 656 C1' C A 3 1.272 -12.819 5.536 1.00 0.62 C ATOM 657 N1 C A 3 2.389 -11.871 5.657 1.00 0.61 N ATOM 658 C2 C A 3 2.503 -11.111 6.820 1.00 0.56 C ATOM 659 O2 C A 3 1.660 -11.258 7.715 1.00 0.55 O ATOM 660 N3 C A 3 3.527 -10.234 6.940 1.00 0.58 N ATOM 661 C4 C A 3 4.413 -10.106 5.951 1.00 0.65 C ATOM 662 N4 C A 3 5.408 -9.231 6.111 1.00 0.71 N ATOM 663 C5 C A 3 4.319 -10.870 4.752 1.00 0.71 C ATOM 664 C6 C A 3 3.300 -11.733 4.647 1.00 0.68 C ATOM 0 H5' C A 3 0.264 -13.972 1.381 1.00 0.68 H new ATOM 0 H5'' C A 3 1.416 -12.713 1.779 1.00 0.68 H new ATOM 0 H4' C A 3 -0.289 -14.384 3.548 1.00 0.61 H new ATOM 0 H3' C A 3 0.209 -11.412 3.236 1.00 0.56 H new ATOM 0 H2' C A 3 -0.111 -11.064 5.584 1.00 0.57 H new ATOM 0 HO2' C A 3 -1.150 -13.682 5.759 1.00 0.64 H new ATOM 0 H1' C A 3 1.189 -13.374 6.470 1.00 0.62 H new ATOM 0 H41 C A 3 6.103 -9.108 5.374 1.00 0.71 H new ATOM 0 H42 C A 3 5.474 -8.685 6.970 1.00 0.71 H new ATOM 0 H5 C A 3 5.042 -10.758 3.958 1.00 0.71 H new ATOM 0 H6 C A 3 3.197 -12.328 3.752 1.00 0.68 H new ATOM 676 P C A 4 -2.723 -12.971 4.261 1.00 0.57 P ATOM 677 OP1 C A 4 -2.138 -14.182 4.892 1.00 0.73 O ATOM 678 OP2 C A 4 -3.940 -13.101 3.421 1.00 0.60 O ATOM 679 O5' C A 4 -3.032 -11.890 5.392 1.00 0.61 O ATOM 680 C5' C A 4 -3.196 -10.497 5.057 1.00 0.51 C ATOM 681 C4' C A 4 -3.152 -9.647 6.303 1.00 0.47 C ATOM 682 O4' C A 4 -1.864 -9.832 6.940 1.00 0.55 O ATOM 683 C3' C A 4 -3.232 -8.152 6.045 1.00 0.45 C ATOM 684 O3' C A 4 -4.598 -7.735 5.932 1.00 0.51 O ATOM 685 C2' C A 4 -2.508 -7.556 7.249 1.00 0.47 C ATOM 686 O2' C A 4 -3.329 -7.370 8.386 1.00 0.57 O ATOM 687 C1' C A 4 -1.456 -8.623 7.553 1.00 0.48 C ATOM 688 N1 C A 4 -0.129 -8.275 7.023 1.00 0.43 N ATOM 689 C2 C A 4 0.655 -7.345 7.708 1.00 0.39 C ATOM 690 O2 C A 4 0.207 -6.826 8.742 1.00 0.43 O ATOM 691 N3 C A 4 1.876 -7.031 7.225 1.00 0.38 N ATOM 692 C4 C A 4 2.316 -7.608 6.105 1.00 0.45 C ATOM 693 N4 C A 4 3.520 -7.272 5.660 1.00 0.51 N ATOM 694 C5 C A 4 1.538 -8.554 5.390 1.00 0.51 C ATOM 695 C6 C A 4 0.333 -8.857 5.875 1.00 0.48 C ATOM 0 H5' C A 4 -4.145 -10.350 4.542 1.00 0.51 H new ATOM 0 H5'' C A 4 -2.409 -10.187 4.370 1.00 0.51 H new ATOM 0 H4' C A 4 -4.012 -9.959 6.895 1.00 0.47 H new ATOM 0 H3' C A 4 -2.778 -7.830 5.108 1.00 0.45 H new ATOM 0 H2' C A 4 -2.126 -6.560 7.027 1.00 0.47 H new ATOM 0 HO2' C A 4 -3.797 -8.206 8.592 1.00 0.57 H new ATOM 0 H1' C A 4 -1.375 -8.711 8.636 1.00 0.48 H new ATOM 0 H41 C A 4 3.885 -7.695 4.807 1.00 0.51 H new ATOM 0 H42 C A 4 4.081 -6.590 6.171 1.00 0.51 H new ATOM 0 H5 C A 4 1.908 -9.013 4.485 1.00 0.51 H new ATOM 0 H6 C A 4 -0.286 -9.572 5.354 1.00 0.48 H new ATOM 707 P U A 5 -5.521 -7.602 7.242 1.00 0.57 P ATOM 708 OP1 U A 5 -5.061 -8.585 8.255 1.00 0.77 O ATOM 709 OP2 U A 5 -6.935 -7.630 6.786 1.00 0.62 O ATOM 710 O5' U A 5 -5.208 -6.130 7.760 1.00 0.49 O ATOM 711 C5' U A 5 -4.456 -5.210 6.943 1.00 0.45 C ATOM 712 C4' U A 5 -3.745 -4.201 7.812 1.00 0.41 C ATOM 713 O4' U A 5 -2.429 -4.720 8.109 1.00 0.47 O ATOM 714 C3' U A 5 -3.453 -2.865 7.149 1.00 0.35 C ATOM 715 O3' U A 5 -4.559 -1.973 7.267 1.00 0.36 O ATOM 716 C2' U A 5 -2.266 -2.350 7.952 1.00 0.41 C ATOM 717 O2' U A 5 -2.656 -1.644 9.116 1.00 0.50 O ATOM 718 C1' U A 5 -1.548 -3.642 8.342 1.00 0.43 C ATOM 719 N1 U A 5 -0.330 -3.854 7.552 1.00 0.43 N ATOM 720 C2 U A 5 0.740 -3.042 7.836 1.00 0.40 C ATOM 721 O2 U A 5 0.695 -2.176 8.697 1.00 0.39 O ATOM 722 N3 U A 5 1.858 -3.273 7.079 1.00 0.43 N ATOM 723 C4 U A 5 2.008 -4.209 6.083 1.00 0.50 C ATOM 724 O4 U A 5 3.083 -4.287 5.484 1.00 0.54 O ATOM 725 C5 U A 5 0.851 -5.014 5.845 1.00 0.55 C ATOM 726 C6 U A 5 -0.257 -4.816 6.571 1.00 0.51 C ATOM 0 H5' U A 5 -5.124 -4.698 6.251 1.00 0.45 H new ATOM 0 H5'' U A 5 -3.731 -5.757 6.340 1.00 0.45 H new ATOM 0 H4' U A 5 -4.410 -4.045 8.661 1.00 0.41 H new ATOM 0 H3' U A 5 -3.260 -2.952 6.080 1.00 0.35 H new ATOM 0 H2' U A 5 -1.662 -1.643 7.384 1.00 0.41 H new ATOM 0 HO2' U A 5 -3.606 -1.412 9.055 1.00 0.50 H new ATOM 0 H1' U A 5 -1.260 -3.573 9.391 1.00 0.43 H new ATOM 0 H3 U A 5 2.669 -2.686 7.276 1.00 0.43 H new ATOM 0 H5 U A 5 0.870 -5.779 5.083 1.00 0.55 H new ATOM 0 H6 U A 5 -1.123 -5.433 6.380 1.00 0.51 H new ATOM 737 P G A 6 -4.871 -0.933 6.081 1.00 0.43 P ATOM 738 OP1 G A 6 -6.344 -0.858 5.907 1.00 0.65 O ATOM 739 OP2 G A 6 -4.017 -1.313 4.928 1.00 0.54 O ATOM 740 O5' G A 6 -4.368 0.476 6.637 1.00 0.43 O ATOM 741 C5' G A 6 -3.056 0.629 7.223 1.00 0.47 C ATOM 742 C4' G A 6 -2.159 1.428 6.303 1.00 0.47 C ATOM 743 O4' G A 6 -0.833 0.841 6.309 1.00 0.53 O ATOM 744 C3' G A 6 -2.558 1.374 4.841 1.00 0.39 C ATOM 745 O3' G A 6 -3.545 2.363 4.563 1.00 0.41 O ATOM 746 C2' G A 6 -1.250 1.686 4.122 1.00 0.48 C ATOM 747 O2' G A 6 -1.031 3.073 3.950 1.00 0.59 O ATOM 748 C1' G A 6 -0.201 1.096 5.067 1.00 0.49 C ATOM 749 N9 G A 6 0.350 -0.160 4.565 1.00 0.50 N ATOM 750 C8 G A 6 -0.295 -1.369 4.501 1.00 0.60 C ATOM 751 N7 G A 6 0.446 -2.319 3.998 1.00 0.63 N ATOM 752 C5 G A 6 1.653 -1.700 3.708 1.00 0.54 C ATOM 753 C6 G A 6 2.831 -2.219 3.107 1.00 0.55 C ATOM 754 O6 G A 6 3.058 -3.375 2.732 1.00 0.61 O ATOM 755 N1 G A 6 3.810 -1.238 2.957 1.00 0.55 N ATOM 756 C2 G A 6 3.669 0.074 3.339 1.00 0.57 C ATOM 757 N2 G A 6 4.727 0.874 3.115 1.00 0.70 N ATOM 758 N3 G A 6 2.574 0.570 3.899 1.00 0.53 N ATOM 759 C4 G A 6 1.614 -0.367 4.053 1.00 0.49 C ATOM 0 H5' G A 6 -2.617 -0.351 7.409 1.00 0.47 H new ATOM 0 H5'' G A 6 -3.137 1.130 8.188 1.00 0.47 H new ATOM 0 H4' G A 6 -2.221 2.451 6.675 1.00 0.47 H new ATOM 0 H3' G A 6 -2.994 0.422 4.538 1.00 0.39 H new ATOM 0 H2' G A 6 -1.232 1.278 3.111 1.00 0.48 H new ATOM 0 HO2' G A 6 -1.254 3.328 3.030 1.00 0.59 H new ATOM 0 H1' G A 6 0.619 1.808 5.159 1.00 0.49 H new ATOM 0 H8 G A 6 -1.312 -1.520 4.833 1.00 0.60 H new ATOM 0 H1 G A 6 4.695 -1.514 2.533 1.00 0.55 H new ATOM 0 H21 G A 6 4.686 1.859 3.376 1.00 0.70 H new ATOM 0 H22 G A 6 5.570 0.495 2.684 1.00 0.70 H new ATOM 771 P A A 7 -4.323 2.336 3.158 1.00 0.43 P ATOM 772 OP1 A A 7 -4.463 3.741 2.700 1.00 0.74 O ATOM 773 OP2 A A 7 -5.533 1.490 3.311 1.00 0.66 O ATOM 774 O5' A A 7 -3.311 1.594 2.178 1.00 0.33 O ATOM 775 C5' A A 7 -3.654 1.361 0.802 1.00 0.29 C ATOM 776 C4' A A 7 -2.614 1.969 -0.105 1.00 0.23 C ATOM 777 O4' A A 7 -2.632 3.405 0.055 1.00 0.23 O ATOM 778 C3' A A 7 -1.179 1.605 0.225 1.00 0.25 C ATOM 779 O3' A A 7 -0.837 0.352 -0.358 1.00 0.27 O ATOM 780 C2' A A 7 -0.391 2.747 -0.411 1.00 0.24 C ATOM 781 O2' A A 7 -0.091 2.524 -1.775 1.00 0.25 O ATOM 782 C1' A A 7 -1.359 3.922 -0.279 1.00 0.21 C ATOM 783 N9 A A 7 -0.955 4.872 0.758 1.00 0.24 N ATOM 784 C8 A A 7 -1.542 5.093 1.977 1.00 0.29 C ATOM 785 N7 A A 7 -0.942 6.012 2.694 1.00 0.33 N ATOM 786 C5 A A 7 0.111 6.426 1.890 1.00 0.30 C ATOM 787 C6 A A 7 1.114 7.393 2.069 1.00 0.34 C ATOM 788 N6 A A 7 1.237 8.139 3.170 1.00 0.39 N ATOM 789 N1 A A 7 2.001 7.571 1.066 1.00 0.35 N ATOM 790 C2 A A 7 1.878 6.823 -0.038 1.00 0.32 C ATOM 791 N3 A A 7 0.980 5.884 -0.324 1.00 0.27 N ATOM 792 C4 A A 7 0.114 5.732 0.694 1.00 0.25 C ATOM 0 H5' A A 7 -4.632 1.791 0.586 1.00 0.29 H new ATOM 0 H5'' A A 7 -3.729 0.290 0.615 1.00 0.29 H new ATOM 0 H4' A A 7 -2.874 1.596 -1.095 1.00 0.23 H new ATOM 0 H3' A A 7 -0.985 1.495 1.292 1.00 0.25 H new ATOM 0 H2' A A 7 0.579 2.889 0.066 1.00 0.24 H new ATOM 0 HO2' A A 7 0.412 3.287 -2.128 1.00 0.25 H new ATOM 0 H1' A A 7 -1.369 4.458 -1.228 1.00 0.21 H new ATOM 0 H8 A A 7 -2.418 4.559 2.315 1.00 0.29 H new ATOM 0 H61 A A 7 1.988 8.826 3.240 1.00 0.39 H new ATOM 0 H62 A A 7 0.580 8.022 3.941 1.00 0.39 H new ATOM 0 H2 A A 7 2.614 7.009 -0.807 1.00 0.32 H new ATOM 804 P A A 8 0.071 -0.686 0.467 1.00 0.37 P ATOM 805 OP1 A A 8 -0.207 -2.054 -0.037 1.00 0.44 O ATOM 806 OP2 A A 8 -0.107 -0.385 1.910 1.00 0.47 O ATOM 807 O5' A A 8 1.559 -0.292 0.057 1.00 0.38 O ATOM 808 C5' A A 8 1.851 0.207 -1.261 1.00 0.39 C ATOM 809 C4' A A 8 2.899 1.290 -1.186 1.00 0.43 C ATOM 810 O4' A A 8 2.325 2.450 -0.534 1.00 0.37 O ATOM 811 C3' A A 8 4.098 0.935 -0.322 1.00 0.53 C ATOM 812 O3' A A 8 5.098 0.241 -1.072 1.00 0.66 O ATOM 813 C2' A A 8 4.609 2.296 0.133 1.00 0.50 C ATOM 814 O2' A A 8 5.480 2.897 -0.803 1.00 0.58 O ATOM 815 C1' A A 8 3.318 3.110 0.231 1.00 0.38 C ATOM 816 N9 A A 8 2.832 3.218 1.604 1.00 0.36 N ATOM 817 C8 A A 8 1.799 2.529 2.182 1.00 0.42 C ATOM 818 N7 A A 8 1.589 2.847 3.437 1.00 0.47 N ATOM 819 C5 A A 8 2.554 3.807 3.703 1.00 0.41 C ATOM 820 C6 A A 8 2.893 4.508 4.874 1.00 0.44 C ATOM 821 N6 A A 8 2.237 4.383 6.029 1.00 0.54 N ATOM 822 N1 A A 8 3.945 5.355 4.816 1.00 0.40 N ATOM 823 C2 A A 8 4.603 5.480 3.657 1.00 0.36 C ATOM 824 N3 A A 8 4.379 4.879 2.491 1.00 0.35 N ATOM 825 C4 A A 8 3.328 4.045 2.582 1.00 0.35 C ATOM 0 H5' A A 8 0.943 0.600 -1.719 1.00 0.39 H new ATOM 0 H5'' A A 8 2.202 -0.606 -1.896 1.00 0.39 H new ATOM 0 H4' A A 8 3.220 1.450 -2.215 1.00 0.43 H new ATOM 0 H3' A A 8 3.843 0.269 0.502 1.00 0.53 H new ATOM 0 H2' A A 8 5.187 2.230 1.055 1.00 0.50 H new ATOM 0 HO2' A A 8 5.070 2.875 -1.693 1.00 0.58 H new ATOM 0 H1' A A 8 3.524 4.116 -0.135 1.00 0.38 H new ATOM 0 H8 A A 8 1.212 1.792 1.654 1.00 0.42 H new ATOM 0 H61 A A 8 2.533 4.920 6.844 1.00 0.54 H new ATOM 0 H62 A A 8 1.440 3.750 6.097 1.00 0.54 H new ATOM 0 H2 A A 8 5.436 6.168 3.670 1.00 0.36 H new ATOM 837 P A A 9 5.097 0.314 -2.679 1.00 1.47 P ATOM 838 OP1 A A 9 5.176 1.746 -3.060 1.00 2.33 O ATOM 839 OP2 A A 9 3.979 -0.520 -3.185 1.00 2.35 O ATOM 840 O5' A A 9 6.468 -0.381 -3.094 1.00 1.08 O ATOM 841 C5' A A 9 7.613 -0.317 -2.227 1.00 1.04 C ATOM 842 C4' A A 9 8.393 0.945 -2.490 1.00 1.09 C ATOM 843 O4' A A 9 7.876 1.570 -3.690 1.00 1.26 O ATOM 844 C3' A A 9 8.222 2.014 -1.428 1.00 0.99 C ATOM 845 O3' A A 9 9.118 1.801 -0.345 1.00 1.17 O ATOM 846 C2' A A 9 8.554 3.290 -2.189 1.00 1.26 C ATOM 847 O2' A A 9 9.946 3.539 -2.255 1.00 1.57 O ATOM 848 C1' A A 9 8.012 2.977 -3.587 1.00 1.29 C ATOM 849 N9 A A 9 6.694 3.567 -3.822 1.00 0.00 N ATOM 850 C8 A A 9 5.960 4.343 -2.962 1.00 0.00 C ATOM 851 N7 A A 9 4.808 4.731 -3.451 1.00 0.00 N ATOM 852 C5 A A 9 4.779 4.169 -4.719 1.00 0.00 C ATOM 853 C6 A A 9 3.794 4.152 -5.722 1.00 0.00 C ATOM 854 N6 A A 9 2.631 4.800 -5.629 1.00 0.00 N ATOM 855 N1 A A 9 4.049 3.436 -6.838 1.00 0.00 N ATOM 856 C2 A A 9 5.215 2.785 -6.930 1.00 0.00 C ATOM 857 N3 A A 9 6.218 2.726 -6.058 1.00 0.00 N ATOM 858 C4 A A 9 5.935 3.448 -4.961 1.00 0.00 C ATOM 0 H5' A A 9 8.250 -1.187 -2.388 1.00 1.04 H new ATOM 0 H5'' A A 9 7.292 -0.345 -1.186 1.00 1.04 H new ATOM 0 H4' A A 9 9.435 0.630 -2.539 1.00 1.09 H new ATOM 0 H3' A A 9 7.230 2.031 -0.976 1.00 0.99 H new ATOM 0 H2' A A 9 8.132 4.178 -1.718 1.00 1.26 H new ATOM 0 HO2' A A 9 10.406 3.005 -1.574 1.00 1.57 H new ATOM 0 H1' A A 9 8.705 3.392 -4.319 1.00 1.29 H new ATOM 0 H8 A A 9 6.300 4.610 -1.972 1.00 0.00 H new ATOM 0 H61 A A 9 1.956 4.749 -6.392 1.00 0.00 H new ATOM 0 H62 A A 9 2.417 5.347 -4.795 1.00 0.00 H new ATOM 0 H2 A A 9 5.363 2.228 -7.843 1.00 0.00 H new ATOM 870 P A A 10 8.731 0.756 0.814 1.00 1.33 P ATOM 871 OP1 A A 10 9.065 -0.610 0.339 1.00 2.11 O ATOM 872 OP2 A A 10 7.338 1.059 1.267 1.00 2.10 O ATOM 873 O5' A A 10 9.726 1.125 2.000 1.00 0.79 O ATOM 874 C5' A A 10 9.266 1.140 3.358 1.00 0.59 C ATOM 875 C4' A A 10 9.512 2.490 3.985 1.00 0.54 C ATOM 876 O4' A A 10 8.311 3.284 3.842 1.00 0.50 O ATOM 877 C3' A A 10 9.763 2.431 5.479 1.00 0.50 C ATOM 878 O3' A A 10 11.153 2.250 5.742 1.00 0.61 O ATOM 879 C2' A A 10 9.248 3.774 5.981 1.00 0.50 C ATOM 880 O2' A A 10 10.227 4.794 5.910 1.00 0.61 O ATOM 881 C1' A A 10 8.109 4.071 5.002 1.00 0.48 C ATOM 882 N9 A A 10 6.805 3.691 5.531 1.00 0.45 N ATOM 883 C8 A A 10 5.919 2.814 4.962 1.00 0.45 C ATOM 884 N7 A A 10 4.820 2.648 5.656 1.00 0.51 N ATOM 885 C5 A A 10 4.997 3.474 6.760 1.00 0.54 C ATOM 886 C6 A A 10 4.207 3.718 7.897 1.00 0.64 C ATOM 887 N6 A A 10 3.010 3.162 8.103 1.00 0.72 N ATOM 888 N1 A A 10 4.696 4.563 8.830 1.00 0.69 N ATOM 889 C2 A A 10 5.897 5.117 8.626 1.00 0.66 C ATOM 890 N3 A A 10 6.731 4.967 7.602 1.00 0.58 N ATOM 891 C4 A A 10 6.216 4.123 6.693 1.00 0.51 C ATOM 0 H5' A A 10 9.780 0.368 3.931 1.00 0.59 H new ATOM 0 H5'' A A 10 8.202 0.906 3.390 1.00 0.59 H new ATOM 0 H4' A A 10 10.390 2.899 3.485 1.00 0.54 H new ATOM 0 H3' A A 10 9.268 1.596 5.975 1.00 0.50 H new ATOM 0 H2' A A 10 8.954 3.740 7.030 1.00 0.50 H new ATOM 0 HO2' A A 10 9.848 5.635 6.242 1.00 0.61 H new ATOM 0 H1' A A 10 8.118 5.143 4.807 1.00 0.48 H new ATOM 0 H8 A A 10 6.109 2.306 4.028 1.00 0.45 H new ATOM 0 H61 A A 10 2.485 3.380 8.950 1.00 0.72 H new ATOM 0 H62 A A 10 2.621 2.519 7.413 1.00 0.72 H new ATOM 0 H2 A A 10 6.238 5.782 9.406 1.00 0.66 H new ATOM 903 P A A 11 11.683 2.234 7.260 1.00 0.62 P ATOM 904 OP1 A A 11 12.566 3.416 7.435 1.00 0.65 O ATOM 905 OP2 A A 11 12.207 0.877 7.556 1.00 0.77 O ATOM 906 O5' A A 11 10.370 2.464 8.132 1.00 0.58 O ATOM 907 C5' A A 11 10.422 3.200 9.369 1.00 0.56 C ATOM 908 C4' A A 11 9.076 3.157 10.054 1.00 0.49 C ATOM 909 O4' A A 11 8.059 3.002 9.035 1.00 0.46 O ATOM 910 C3' A A 11 8.879 1.972 10.984 1.00 0.47 C ATOM 911 O3' A A 11 9.347 2.300 12.296 1.00 0.51 O ATOM 912 C2' A A 11 7.369 1.754 10.944 1.00 0.43 C ATOM 913 O2' A A 11 6.673 2.566 11.870 1.00 0.47 O ATOM 914 C1' A A 11 7.008 2.191 9.524 1.00 0.42 C ATOM 915 N9 A A 11 6.859 1.074 8.593 1.00 0.41 N ATOM 916 C8 A A 11 7.792 0.604 7.701 1.00 0.46 C ATOM 917 N7 A A 11 7.365 -0.396 6.968 1.00 0.47 N ATOM 918 C5 A A 11 6.067 -0.603 7.409 1.00 0.42 C ATOM 919 C6 A A 11 5.074 -1.527 7.035 1.00 0.43 C ATOM 920 N6 A A 11 5.227 -2.452 6.079 1.00 0.49 N ATOM 921 N1 A A 11 3.894 -1.470 7.686 1.00 0.40 N ATOM 922 C2 A A 11 3.725 -0.549 8.640 1.00 0.37 C ATOM 923 N3 A A 11 4.577 0.373 9.079 1.00 0.37 N ATOM 924 C4 A A 11 5.743 0.293 8.414 1.00 0.39 C ATOM 0 H5' A A 11 10.707 4.234 9.175 1.00 0.56 H new ATOM 0 H5'' A A 11 11.185 2.776 10.022 1.00 0.56 H new ATOM 0 H4' A A 11 9.013 4.076 10.637 1.00 0.49 H new ATOM 0 H3' A A 11 9.430 1.076 10.696 1.00 0.47 H new ATOM 0 H2' A A 11 7.102 0.728 11.198 1.00 0.43 H new ATOM 0 HO2' A A 11 6.627 2.109 12.736 1.00 0.47 H new ATOM 0 H1' A A 11 6.052 2.711 9.583 1.00 0.42 H new ATOM 0 H8 A A 11 8.785 1.019 7.612 1.00 0.46 H new ATOM 0 H61 A A 11 4.462 -3.091 5.860 1.00 0.49 H new ATOM 0 H62 A A 11 6.108 -2.518 5.570 1.00 0.49 H new ATOM 0 H2 A A 11 2.759 -0.554 9.123 1.00 0.37 H new ATOM 936 P G A 12 8.743 1.553 13.590 1.00 0.56 P ATOM 937 OP1 G A 12 7.289 1.355 13.398 1.00 0.65 O ATOM 938 OP2 G A 12 9.220 2.307 14.777 1.00 0.68 O ATOM 939 O5' G A 12 9.476 0.135 13.621 1.00 0.50 O ATOM 940 C5' G A 12 8.935 -1.027 12.945 1.00 0.47 C ATOM 941 C4' G A 12 7.430 -1.057 13.056 1.00 0.42 C ATOM 942 O4' G A 12 6.893 -0.798 11.738 1.00 0.40 O ATOM 943 C3' G A 12 6.832 -2.396 13.445 1.00 0.39 C ATOM 944 O3' G A 12 6.754 -2.523 14.863 1.00 0.43 O ATOM 945 C2' G A 12 5.440 -2.339 12.822 1.00 0.35 C ATOM 946 O2' G A 12 4.497 -1.691 13.655 1.00 0.37 O ATOM 947 C1' G A 12 5.684 -1.506 11.561 1.00 0.35 C ATOM 948 N9 G A 12 5.829 -2.340 10.374 1.00 0.33 N ATOM 949 C8 G A 12 6.906 -2.379 9.524 1.00 0.36 C ATOM 950 N7 G A 12 6.754 -3.223 8.542 1.00 0.36 N ATOM 951 C5 G A 12 5.499 -3.776 8.757 1.00 0.33 C ATOM 952 C6 G A 12 4.785 -4.742 8.009 1.00 0.36 C ATOM 953 O6 G A 12 5.136 -5.327 6.980 1.00 0.40 O ATOM 954 N1 G A 12 3.538 -5.010 8.569 1.00 0.36 N ATOM 955 C2 G A 12 3.050 -4.420 9.709 1.00 0.34 C ATOM 956 N2 G A 12 1.826 -4.816 10.099 1.00 0.37 N ATOM 957 N3 G A 12 3.706 -3.516 10.416 1.00 0.31 N ATOM 958 C4 G A 12 4.915 -3.242 9.885 1.00 0.31 C ATOM 0 H5' G A 12 9.355 -1.934 13.379 1.00 0.47 H new ATOM 0 H5'' G A 12 9.227 -1.012 11.895 1.00 0.47 H new ATOM 0 H4' G A 12 7.184 -0.330 13.830 1.00 0.42 H new ATOM 0 H3' G A 12 7.420 -3.249 13.106 1.00 0.39 H new ATOM 0 H2' G A 12 5.024 -3.330 12.644 1.00 0.35 H new ATOM 0 HO2' G A 12 4.804 -1.725 14.585 1.00 0.37 H new ATOM 0 H1' G A 12 4.829 -0.846 11.416 1.00 0.35 H new ATOM 0 H8 G A 12 7.790 -1.772 9.655 1.00 0.36 H new ATOM 0 H1 G A 12 2.945 -5.694 8.099 1.00 0.36 H new ATOM 0 H21 G A 12 1.404 -4.417 10.938 1.00 0.37 H new ATOM 0 H22 G A 12 1.319 -5.515 9.556 1.00 0.37 H new ATOM 970 P G A 13 7.473 -3.762 15.593 1.00 0.51 P ATOM 971 OP1 G A 13 7.824 -3.325 16.968 1.00 0.59 O ATOM 972 OP2 G A 13 8.536 -4.279 14.693 1.00 0.57 O ATOM 973 O5' G A 13 6.330 -4.866 15.702 1.00 0.57 O ATOM 974 C5' G A 13 5.110 -4.601 16.421 1.00 0.62 C ATOM 975 C4' G A 13 4.031 -5.559 15.987 1.00 0.60 C ATOM 976 O4' G A 13 3.657 -5.224 14.627 1.00 0.59 O ATOM 977 C3' G A 13 4.481 -7.005 15.902 1.00 0.59 C ATOM 978 O3' G A 13 4.358 -7.667 17.169 1.00 0.66 O ATOM 979 C2' G A 13 3.548 -7.594 14.851 1.00 0.57 C ATOM 980 O2' G A 13 2.319 -8.068 15.365 1.00 0.63 O ATOM 981 C1' G A 13 3.291 -6.401 13.931 1.00 0.54 C ATOM 982 N9 G A 13 4.075 -6.474 12.703 1.00 0.50 N ATOM 983 C8 G A 13 5.209 -5.767 12.387 1.00 0.54 C ATOM 984 N7 G A 13 5.683 -6.062 11.207 1.00 0.56 N ATOM 985 C5 G A 13 4.810 -7.023 10.716 1.00 0.50 C ATOM 986 C6 G A 13 4.813 -7.725 9.483 1.00 0.53 C ATOM 987 O6 G A 13 5.616 -7.634 8.546 1.00 0.60 O ATOM 988 N1 G A 13 3.743 -8.613 9.394 1.00 0.51 N ATOM 989 C2 G A 13 2.798 -8.801 10.374 1.00 0.48 C ATOM 990 N2 G A 13 1.843 -9.704 10.110 1.00 0.52 N ATOM 991 N3 G A 13 2.785 -8.153 11.525 1.00 0.47 N ATOM 992 C4 G A 13 3.812 -7.287 11.627 1.00 0.47 C ATOM 0 H5' G A 13 4.789 -3.575 16.241 1.00 0.62 H new ATOM 0 H5'' G A 13 5.283 -4.698 17.493 1.00 0.62 H new ATOM 0 H4' G A 13 3.238 -5.468 16.729 1.00 0.60 H new ATOM 0 H3' G A 13 5.533 -7.116 15.638 1.00 0.59 H new ATOM 0 H2' G A 13 3.995 -8.468 14.377 1.00 0.57 H new ATOM 0 HO2' G A 13 1.843 -7.333 15.805 1.00 0.63 H new ATOM 0 H1' G A 13 2.236 -6.402 13.656 1.00 0.54 H new ATOM 0 H8 G A 13 5.662 -5.042 13.047 1.00 0.54 H new ATOM 0 H1 G A 13 3.655 -9.163 8.540 1.00 0.51 H new ATOM 0 H21 G A 13 1.112 -9.889 10.797 1.00 0.52 H new ATOM 0 H22 G A 13 1.847 -10.206 9.222 1.00 0.52 H new ATOM 1004 P G A 14 2.904 -7.969 17.794 1.00 0.74 P ATOM 1005 OP1 G A 14 1.953 -6.969 17.246 1.00 0.80 O ATOM 1006 OP2 G A 14 3.056 -8.103 19.265 1.00 0.90 O ATOM 1007 O5' G A 14 2.522 -9.403 17.210 1.00 0.68 O ATOM 1008 C5' G A 14 1.145 -9.823 17.115 1.00 0.70 C ATOM 1009 C4' G A 14 1.056 -11.196 16.482 1.00 0.68 C ATOM 1010 O4' G A 14 0.931 -11.039 15.046 1.00 0.67 O ATOM 1011 C3' G A 14 2.294 -12.055 16.631 1.00 0.67 C ATOM 1012 O3' G A 14 2.301 -12.728 17.885 1.00 0.77 O ATOM 1013 C2' G A 14 2.147 -13.037 15.475 1.00 0.67 C ATOM 1014 O2' G A 14 1.289 -14.120 15.780 1.00 0.80 O ATOM 1015 C1' G A 14 1.505 -12.162 14.396 1.00 0.61 C ATOM 1016 N9 G A 14 2.498 -11.669 13.449 1.00 0.50 N ATOM 1017 C8 G A 14 3.290 -10.562 13.606 1.00 0.50 C ATOM 1018 N7 G A 14 4.110 -10.371 12.611 1.00 0.47 N ATOM 1019 C5 G A 14 3.841 -11.418 11.741 1.00 0.41 C ATOM 1020 C6 G A 14 4.439 -11.751 10.502 1.00 0.40 C ATOM 1021 O6 G A 14 5.342 -11.157 9.903 1.00 0.45 O ATOM 1022 N1 G A 14 3.885 -12.908 9.956 1.00 0.41 N ATOM 1023 C2 G A 14 2.882 -13.645 10.541 1.00 0.46 C ATOM 1024 N2 G A 14 2.474 -14.727 9.863 1.00 0.55 N ATOM 1025 N3 G A 14 2.319 -13.345 11.700 1.00 0.49 N ATOM 1026 C4 G A 14 2.845 -12.227 12.240 1.00 0.44 C ATOM 0 H5' G A 14 0.579 -9.105 16.522 1.00 0.70 H new ATOM 0 H5'' G A 14 0.695 -9.843 18.107 1.00 0.70 H new ATOM 0 H4' G A 14 0.215 -11.672 16.986 1.00 0.68 H new ATOM 0 H3' G A 14 3.226 -11.491 16.606 1.00 0.67 H new ATOM 0 H2' G A 14 3.096 -13.497 15.200 1.00 0.67 H new ATOM 0 HO2' G A 14 1.229 -14.718 15.006 1.00 0.80 H new ATOM 0 H1' G A 14 0.768 -12.753 13.852 1.00 0.61 H new ATOM 0 H8 G A 14 3.240 -9.913 14.468 1.00 0.50 H new ATOM 0 H1 G A 14 4.249 -13.231 9.060 1.00 0.41 H new ATOM 0 H21 G A 14 1.733 -15.317 10.242 1.00 0.55 H new ATOM 0 H22 G A 14 2.904 -14.960 8.968 1.00 0.55 H new ATOM 1038 P C A 15 3.700 -13.184 18.531 1.00 0.87 P ATOM 1039 OP1 C A 15 3.423 -13.828 19.839 1.00 1.02 O ATOM 1040 OP2 C A 15 4.621 -12.021 18.465 1.00 0.91 O ATOM 1041 O5' C A 15 4.232 -14.299 17.525 1.00 0.85 O ATOM 1042 C5' C A 15 3.466 -15.489 17.281 1.00 0.94 C ATOM 1043 C4' C A 15 4.137 -16.341 16.229 1.00 0.97 C ATOM 1044 O4' C A 15 3.979 -15.720 14.932 1.00 0.84 O ATOM 1045 C3' C A 15 5.642 -16.448 16.381 1.00 1.09 C ATOM 1046 O3' C A 15 5.989 -17.476 17.317 1.00 1.31 O ATOM 1047 C2' C A 15 6.093 -16.820 14.972 1.00 1.09 C ATOM 1048 O2' C A 15 6.067 -18.215 14.736 1.00 1.30 O ATOM 1049 C1' C A 15 5.052 -16.119 14.097 1.00 0.89 C ATOM 1050 N1 C A 15 5.597 -14.927 13.433 1.00 0.75 N ATOM 1051 C2 C A 15 6.311 -15.092 12.243 1.00 0.77 C ATOM 1052 O2 C A 15 6.455 -16.230 11.778 1.00 0.89 O ATOM 1053 N3 C A 15 6.827 -14.010 11.628 1.00 0.70 N ATOM 1054 C4 C A 15 6.654 -12.800 12.154 1.00 0.66 C ATOM 1055 N4 C A 15 7.182 -11.772 11.505 1.00 0.71 N ATOM 1056 C5 C A 15 5.929 -12.599 13.364 1.00 0.64 C ATOM 1057 C6 C A 15 5.421 -13.681 13.967 1.00 0.66 C ATOM 0 H5' C A 15 2.461 -15.222 16.955 1.00 0.94 H new ATOM 0 H5'' C A 15 3.361 -16.057 18.205 1.00 0.94 H new ATOM 0 H4' C A 15 3.671 -17.321 16.335 1.00 0.97 H new ATOM 0 H3' C A 15 6.107 -15.538 16.760 1.00 1.09 H new ATOM 0 H2' C A 15 7.125 -16.526 14.780 1.00 1.09 H new ATOM 0 HO2' C A 15 5.992 -18.690 15.590 1.00 1.30 H new ATOM 0 HO3' C A 15 6.964 -17.529 17.398 1.00 1.31 H new ATOM 0 H1' C A 15 4.730 -16.813 13.321 1.00 0.89 H new ATOM 0 H41 C A 15 7.074 -10.827 11.873 1.00 0.71 H new ATOM 0 H42 C A 15 7.697 -11.926 10.638 1.00 0.71 H new ATOM 0 H5 C A 15 5.794 -11.611 13.779 1.00 0.64 H new ATOM 0 H6 C A 15 4.866 -13.568 14.886 1.00 0.66 H new TER 1069 C A 15