USER MOD reduce.3.24.130724 H: found=0, std=0, add=765, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 766 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 Set 1.1: A 83 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 86 GLN : amide:sc= -1.84! C(o=-1.8!,f=-1.8!) USER MOD Set 2.1: A 22 ASN : amide:sc= -2.35 K(o=-3,f=-5.9!) USER MOD Set 2.2: A 67 THR OG1 : rot 76:sc= -0.688! USER MOD Set 3.1: A 58 HIS : no HE2:sc= -5.9! C(o=-10!,f=-13!) USER MOD Set 3.2: A 62 GLN : amide:sc= -4.19! C(o=-10!,f=-7.6!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.051 X(o=-0.051,f=-0.27) USER MOD Single : A 18 THR OG1 : rot 100:sc= 0.988 USER MOD Single : A 19 CYS SG : rot 180:sc= -0.868 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.303 K(o=-0.3,f=-2.4!) USER MOD Single : A 30 THR OG1 : rot 98:sc= -0.306 USER MOD Single : A 32 GLN : amide:sc= -0.804 X(o=-0.8,f=-0.57) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.0116 X(o=-0.012,f=0.3) USER MOD Single : A 37 MET CE :methyl 146:sc= -4.45! (180deg=-6.09!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.282 K(o=-0.28,f=-2!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 55 GLN : amide:sc= -0.217 K(o=-0.22,f=-2.4!) USER MOD Single : A 57 GLN : amide:sc= -2.88! K(o=-2.9!,f=-0.82) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -50:sc= -2.93! USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.0166 X(o=-0.017,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.124 K(o=-0.12,f=-1.1) USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 92 GLN : amide:sc= -0.0661 K(o=-0.066,f=-1.8!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -151:sc= -0.663 (180deg=-2.52!) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.0448 K(o=-0.045,f=-1.4) USER MOD Single : A 106 ASN : amide:sc= -0.0318 X(o=-0.032,f=-0.16) USER MOD Single : A 108 GLN : amide:sc= -0.127 K(o=-0.13,f=-1.3!) USER MOD Single : A 111 GLN : amide:sc= -1.62 K(o=-1.6,f=-5.5!) USER MOD Single : A 115 SER OG : rot 79:sc= 1.22 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 126 N ASP A 11 9.189 -17.655 -2.641 1.00 0.00 N ATOM 127 CA ASP A 11 8.274 -18.623 -2.060 1.00 0.00 C ATOM 128 C ASP A 11 7.105 -17.884 -1.405 1.00 0.00 C ATOM 129 O ASP A 11 7.270 -16.769 -0.911 1.00 0.00 O ATOM 130 CB ASP A 11 8.968 -19.459 -0.983 1.00 0.00 C ATOM 131 CG ASP A 11 8.143 -20.626 -0.439 1.00 0.00 C ATOM 132 OD1 ASP A 11 7.550 -21.340 -1.276 1.00 0.00 O ATOM 133 OD2 ASP A 11 8.124 -20.778 0.802 1.00 0.00 O ATOM 0 HA ASP A 11 7.926 -19.279 -2.858 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.899 -19.852 -1.393 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.236 -18.805 -0.153 1.00 0.00 H new ATOM 138 N PHE A 12 5.951 -18.534 -1.422 1.00 0.00 N ATOM 139 CA PHE A 12 4.756 -17.953 -0.835 1.00 0.00 C ATOM 140 C PHE A 12 5.100 -17.121 0.401 1.00 0.00 C ATOM 141 O PHE A 12 4.857 -15.916 0.430 1.00 0.00 O ATOM 142 CB PHE A 12 3.852 -19.115 -0.418 1.00 0.00 C ATOM 143 CG PHE A 12 2.500 -18.679 0.149 1.00 0.00 C ATOM 144 CD1 PHE A 12 2.414 -18.222 1.428 1.00 0.00 C ATOM 145 CD2 PHE A 12 1.383 -18.748 -0.624 1.00 0.00 C ATOM 146 CE1 PHE A 12 1.159 -17.817 1.954 1.00 0.00 C ATOM 147 CE2 PHE A 12 0.128 -18.343 -0.097 1.00 0.00 C ATOM 148 CZ PHE A 12 0.043 -17.886 1.181 1.00 0.00 C ATOM 0 H PHE A 12 5.818 -19.458 -1.833 1.00 0.00 H new ATOM 0 HA PHE A 12 4.269 -17.297 -1.557 1.00 0.00 H new ATOM 0 HB2 PHE A 12 3.682 -19.758 -1.282 1.00 0.00 H new ATOM 0 HB3 PHE A 12 4.371 -19.716 0.329 1.00 0.00 H new ATOM 0 HD1 PHE A 12 3.300 -18.167 2.043 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.451 -19.111 -1.639 1.00 0.00 H new ATOM 0 HE1 PHE A 12 1.091 -17.454 2.969 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -0.759 -18.398 -0.711 1.00 0.00 H new ATOM 0 HZ PHE A 12 -0.911 -17.578 1.582 1.00 0.00 H new ATOM 158 N SER A 13 5.661 -17.797 1.393 1.00 0.00 N ATOM 159 CA SER A 13 6.042 -17.135 2.629 1.00 0.00 C ATOM 160 C SER A 13 6.877 -15.891 2.321 1.00 0.00 C ATOM 161 O SER A 13 6.638 -14.824 2.883 1.00 0.00 O ATOM 162 CB SER A 13 6.820 -18.083 3.545 1.00 0.00 C ATOM 163 OG SER A 13 7.021 -17.527 4.841 1.00 0.00 O ATOM 0 H SER A 13 5.861 -18.797 1.366 1.00 0.00 H new ATOM 0 HA SER A 13 5.133 -16.835 3.150 1.00 0.00 H new ATOM 0 HB2 SER A 13 6.280 -19.025 3.635 1.00 0.00 H new ATOM 0 HB3 SER A 13 7.786 -18.311 3.094 1.00 0.00 H new ATOM 0 HG SER A 13 7.520 -18.163 5.396 1.00 0.00 H new ATOM 169 N SER A 14 7.840 -16.070 1.428 1.00 0.00 N ATOM 170 CA SER A 14 8.712 -14.975 1.039 1.00 0.00 C ATOM 171 C SER A 14 7.882 -13.823 0.469 1.00 0.00 C ATOM 172 O SER A 14 8.213 -12.655 0.671 1.00 0.00 O ATOM 173 CB SER A 14 9.752 -15.436 0.016 1.00 0.00 C ATOM 174 OG SER A 14 10.584 -16.473 0.531 1.00 0.00 O ATOM 0 H SER A 14 8.035 -16.957 0.963 1.00 0.00 H new ATOM 0 HA SER A 14 9.243 -14.629 1.926 1.00 0.00 H new ATOM 0 HB2 SER A 14 9.245 -15.790 -0.882 1.00 0.00 H new ATOM 0 HB3 SER A 14 10.370 -14.588 -0.280 1.00 0.00 H new ATOM 0 HG SER A 14 11.233 -16.741 -0.152 1.00 0.00 H new ATOM 180 N ILE A 15 6.820 -14.191 -0.232 1.00 0.00 N ATOM 181 CA ILE A 15 5.940 -13.203 -0.833 1.00 0.00 C ATOM 182 C ILE A 15 4.989 -12.657 0.235 1.00 0.00 C ATOM 183 O ILE A 15 4.630 -11.481 0.208 1.00 0.00 O ATOM 184 CB ILE A 15 5.224 -13.791 -2.050 1.00 0.00 C ATOM 185 CG1 ILE A 15 6.207 -14.534 -2.958 1.00 0.00 C ATOM 186 CG2 ILE A 15 4.450 -12.711 -2.807 1.00 0.00 C ATOM 187 CD1 ILE A 15 5.465 -15.375 -3.998 1.00 0.00 C ATOM 0 H ILE A 15 6.549 -15.160 -0.397 1.00 0.00 H new ATOM 0 HA ILE A 15 6.517 -12.359 -1.210 1.00 0.00 H new ATOM 0 HB ILE A 15 4.495 -14.521 -1.697 1.00 0.00 H new ATOM 0 HG12 ILE A 15 6.856 -13.817 -3.461 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.849 -15.177 -2.356 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.951 -13.157 -3.667 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.706 -12.266 -2.146 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.141 -11.940 -3.148 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.187 -15.892 -4.630 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.836 -16.107 -3.492 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.843 -14.726 -4.614 1.00 0.00 H new ATOM 199 N ILE A 16 4.609 -13.537 1.149 1.00 0.00 N ATOM 200 CA ILE A 16 3.707 -13.158 2.224 1.00 0.00 C ATOM 201 C ILE A 16 4.278 -11.944 2.959 1.00 0.00 C ATOM 202 O ILE A 16 3.684 -10.867 2.940 1.00 0.00 O ATOM 203 CB ILE A 16 3.428 -14.354 3.136 1.00 0.00 C ATOM 204 CG1 ILE A 16 2.605 -15.418 2.409 1.00 0.00 C ATOM 205 CG2 ILE A 16 2.763 -13.906 4.439 1.00 0.00 C ATOM 206 CD1 ILE A 16 1.110 -15.099 2.481 1.00 0.00 C ATOM 0 H ILE A 16 4.909 -14.512 1.168 1.00 0.00 H new ATOM 0 HA ILE A 16 2.739 -12.861 1.822 1.00 0.00 H new ATOM 0 HB ILE A 16 4.381 -14.811 3.401 1.00 0.00 H new ATOM 0 HG12 ILE A 16 2.918 -15.476 1.367 1.00 0.00 H new ATOM 0 HG13 ILE A 16 2.794 -16.395 2.853 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.575 -14.775 5.069 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.421 -13.213 4.963 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.819 -13.411 4.214 1.00 0.00 H new ATOM 0 HD11 ILE A 16 0.548 -15.871 1.956 1.00 0.00 H new ATOM 0 HD12 ILE A 16 0.795 -15.066 3.524 1.00 0.00 H new ATOM 0 HD13 ILE A 16 0.921 -14.132 2.014 1.00 0.00 H new ATOM 218 N GLN A 17 5.425 -12.158 3.588 1.00 0.00 N ATOM 219 CA GLN A 17 6.082 -11.094 4.327 1.00 0.00 C ATOM 220 C GLN A 17 6.087 -9.802 3.508 1.00 0.00 C ATOM 221 O GLN A 17 5.622 -8.764 3.977 1.00 0.00 O ATOM 222 CB GLN A 17 7.504 -11.499 4.721 1.00 0.00 C ATOM 223 CG GLN A 17 7.641 -11.613 6.241 1.00 0.00 C ATOM 224 CD GLN A 17 8.439 -10.437 6.809 1.00 0.00 C ATOM 225 OE1 GLN A 17 9.498 -10.079 6.322 1.00 0.00 O ATOM 226 NE2 GLN A 17 7.872 -9.859 7.865 1.00 0.00 N ATOM 0 H GLN A 17 5.915 -13.052 3.601 1.00 0.00 H new ATOM 0 HA GLN A 17 5.522 -10.916 5.245 1.00 0.00 H new ATOM 0 HB2 GLN A 17 7.756 -12.453 4.257 1.00 0.00 H new ATOM 0 HB3 GLN A 17 8.214 -10.763 4.343 1.00 0.00 H new ATOM 0 HG2 GLN A 17 6.652 -11.640 6.698 1.00 0.00 H new ATOM 0 HG3 GLN A 17 8.136 -12.550 6.496 1.00 0.00 H new ATOM 0 HE21 GLN A 17 6.983 -10.209 8.222 1.00 0.00 H new ATOM 0 HE22 GLN A 17 8.326 -9.066 8.317 1.00 0.00 H new ATOM 235 N THR A 18 6.617 -9.908 2.299 1.00 0.00 N ATOM 236 CA THR A 18 6.689 -8.761 1.410 1.00 0.00 C ATOM 237 C THR A 18 5.301 -8.142 1.226 1.00 0.00 C ATOM 238 O THR A 18 5.165 -6.921 1.166 1.00 0.00 O ATOM 239 CB THR A 18 7.329 -9.218 0.098 1.00 0.00 C ATOM 240 OG1 THR A 18 8.542 -9.847 0.504 1.00 0.00 O ATOM 241 CG2 THR A 18 7.790 -8.044 -0.769 1.00 0.00 C ATOM 0 H THR A 18 7.001 -10.771 1.914 1.00 0.00 H new ATOM 0 HA THR A 18 7.310 -7.971 1.833 1.00 0.00 H new ATOM 0 HB THR A 18 6.617 -9.824 -0.461 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.420 -10.819 0.511 1.00 0.00 H new ATOM 0 HG21 THR A 18 8.237 -8.424 -1.688 1.00 0.00 H new ATOM 0 HG22 THR A 18 6.934 -7.415 -1.014 1.00 0.00 H new ATOM 0 HG23 THR A 18 8.528 -7.456 -0.223 1.00 0.00 H new ATOM 249 N CYS A 19 4.307 -9.013 1.140 1.00 0.00 N ATOM 250 CA CYS A 19 2.935 -8.568 0.964 1.00 0.00 C ATOM 251 C CYS A 19 2.512 -7.805 2.221 1.00 0.00 C ATOM 252 O CYS A 19 2.043 -6.671 2.135 1.00 0.00 O ATOM 253 CB CYS A 19 1.995 -9.737 0.663 1.00 0.00 C ATOM 254 SG CYS A 19 2.126 -10.206 -1.101 1.00 0.00 S ATOM 0 H CYS A 19 4.424 -10.025 1.189 1.00 0.00 H new ATOM 0 HA CYS A 19 2.873 -7.906 0.100 1.00 0.00 H new ATOM 0 HB2 CYS A 19 2.247 -10.589 1.294 1.00 0.00 H new ATOM 0 HB3 CYS A 19 0.968 -9.459 0.899 1.00 0.00 H new ATOM 0 HG CYS A 19 1.326 -11.201 -1.346 1.00 0.00 H new ATOM 260 N SER A 20 2.694 -8.458 3.360 1.00 0.00 N ATOM 261 CA SER A 20 2.337 -7.855 4.633 1.00 0.00 C ATOM 262 C SER A 20 3.059 -6.517 4.799 1.00 0.00 C ATOM 263 O SER A 20 2.419 -5.473 4.920 1.00 0.00 O ATOM 264 CB SER A 20 2.674 -8.788 5.798 1.00 0.00 C ATOM 265 OG SER A 20 2.439 -8.172 7.061 1.00 0.00 O ATOM 0 H SER A 20 3.084 -9.398 3.428 1.00 0.00 H new ATOM 0 HA SER A 20 1.261 -7.683 4.640 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.075 -9.696 5.720 1.00 0.00 H new ATOM 0 HB3 SER A 20 3.719 -9.089 5.731 1.00 0.00 H new ATOM 0 HG SER A 20 2.665 -8.800 7.778 1.00 0.00 H new ATOM 271 N GLY A 21 4.382 -6.590 4.799 1.00 0.00 N ATOM 272 CA GLY A 21 5.197 -5.397 4.948 1.00 0.00 C ATOM 273 C GLY A 21 4.680 -4.265 4.058 1.00 0.00 C ATOM 274 O GLY A 21 4.395 -3.170 4.543 1.00 0.00 O ATOM 0 H GLY A 21 4.910 -7.457 4.698 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.192 -5.077 5.990 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.231 -5.624 4.690 1.00 0.00 H new ATOM 278 N ASN A 22 4.576 -4.566 2.772 1.00 0.00 N ATOM 279 CA ASN A 22 4.098 -3.587 1.811 1.00 0.00 C ATOM 280 C ASN A 22 2.796 -2.969 2.323 1.00 0.00 C ATOM 281 O ASN A 22 2.692 -1.750 2.451 1.00 0.00 O ATOM 282 CB ASN A 22 3.811 -4.240 0.457 1.00 0.00 C ATOM 283 CG ASN A 22 5.069 -4.274 -0.413 1.00 0.00 C ATOM 284 OD1 ASN A 22 6.151 -3.890 -0.001 1.00 0.00 O ATOM 285 ND2 ASN A 22 4.868 -4.755 -1.637 1.00 0.00 N ATOM 0 H ASN A 22 4.815 -5.474 2.373 1.00 0.00 H new ATOM 0 HA ASN A 22 4.871 -2.828 1.690 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.442 -5.254 0.609 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.024 -3.689 -0.057 1.00 0.00 H new ATOM 0 HD21 ASN A 22 5.646 -4.819 -2.294 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.936 -5.060 -1.919 1.00 0.00 H new ATOM 292 N ILE A 23 1.835 -3.837 2.601 1.00 0.00 N ATOM 293 CA ILE A 23 0.544 -3.391 3.097 1.00 0.00 C ATOM 294 C ILE A 23 0.756 -2.317 4.165 1.00 0.00 C ATOM 295 O ILE A 23 0.247 -1.204 4.041 1.00 0.00 O ATOM 296 CB ILE A 23 -0.286 -4.583 3.579 1.00 0.00 C ATOM 297 CG1 ILE A 23 -0.823 -5.391 2.396 1.00 0.00 C ATOM 298 CG2 ILE A 23 -1.405 -4.128 4.518 1.00 0.00 C ATOM 299 CD1 ILE A 23 -1.675 -6.567 2.877 1.00 0.00 C ATOM 0 H ILE A 23 1.924 -4.847 2.492 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.035 -2.933 2.295 1.00 0.00 H new ATOM 0 HB ILE A 23 0.365 -5.244 4.151 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.419 -4.746 1.751 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.009 -5.761 1.796 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.980 -4.994 4.846 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.972 -3.630 5.386 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.062 -3.435 3.992 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.044 -7.125 2.016 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -1.070 -7.223 3.502 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.519 -6.192 3.456 1.00 0.00 H new ATOM 311 N GLN A 24 1.508 -2.688 5.191 1.00 0.00 N ATOM 312 CA GLN A 24 1.793 -1.770 6.281 1.00 0.00 C ATOM 313 C GLN A 24 2.180 -0.396 5.730 1.00 0.00 C ATOM 314 O GLN A 24 1.498 0.594 5.988 1.00 0.00 O ATOM 315 CB GLN A 24 2.891 -2.325 7.191 1.00 0.00 C ATOM 316 CG GLN A 24 2.354 -3.454 8.072 1.00 0.00 C ATOM 317 CD GLN A 24 3.357 -3.819 9.168 1.00 0.00 C ATOM 318 OE1 GLN A 24 4.517 -3.442 9.135 1.00 0.00 O ATOM 319 NE2 GLN A 24 2.848 -4.571 10.140 1.00 0.00 N ATOM 0 H GLN A 24 1.929 -3.612 5.291 1.00 0.00 H new ATOM 0 HA GLN A 24 0.890 -1.658 6.882 1.00 0.00 H new ATOM 0 HB2 GLN A 24 3.718 -2.694 6.585 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.287 -1.526 7.818 1.00 0.00 H new ATOM 0 HG2 GLN A 24 1.410 -3.149 8.525 1.00 0.00 H new ATOM 0 HG3 GLN A 24 2.145 -4.331 7.459 1.00 0.00 H new ATOM 0 HE21 GLN A 24 1.868 -4.852 10.107 1.00 0.00 H new ATOM 0 HE22 GLN A 24 3.438 -4.866 10.918 1.00 0.00 H new ATOM 328 N ARG A 25 3.273 -0.380 4.981 1.00 0.00 N ATOM 329 CA ARG A 25 3.758 0.856 4.392 1.00 0.00 C ATOM 330 C ARG A 25 2.594 1.660 3.810 1.00 0.00 C ATOM 331 O ARG A 25 2.361 2.800 4.210 1.00 0.00 O ATOM 332 CB ARG A 25 4.778 0.575 3.286 1.00 0.00 C ATOM 333 CG ARG A 25 6.207 0.653 3.825 1.00 0.00 C ATOM 334 CD ARG A 25 6.857 -0.732 3.858 1.00 0.00 C ATOM 335 NE ARG A 25 7.570 -0.926 5.141 1.00 0.00 N ATOM 336 CZ ARG A 25 8.351 -1.979 5.414 1.00 0.00 C ATOM 337 NH1 ARG A 25 8.525 -2.941 4.497 1.00 0.00 N ATOM 338 NH2 ARG A 25 8.958 -2.072 6.605 1.00 0.00 N ATOM 0 H ARG A 25 3.836 -1.203 4.769 1.00 0.00 H new ATOM 0 HA ARG A 25 4.242 1.431 5.181 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.598 -0.414 2.864 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.651 1.295 2.478 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.799 1.322 3.200 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.198 1.079 4.828 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.096 -1.503 3.735 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.553 -0.836 3.026 1.00 0.00 H new ATOM 0 HE ARG A 25 7.459 -0.213 5.862 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.062 -2.871 3.591 1.00 0.00 H new ATOM 0 HH12 ARG A 25 9.120 -3.743 4.706 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.825 -1.341 7.304 1.00 0.00 H new ATOM 0 HH22 ARG A 25 9.553 -2.874 6.813 1.00 0.00 H new ATOM 352 N ILE A 26 1.893 1.035 2.876 1.00 0.00 N ATOM 353 CA ILE A 26 0.758 1.678 2.236 1.00 0.00 C ATOM 354 C ILE A 26 -0.091 2.380 3.298 1.00 0.00 C ATOM 355 O ILE A 26 -0.439 3.550 3.145 1.00 0.00 O ATOM 356 CB ILE A 26 -0.024 0.669 1.392 1.00 0.00 C ATOM 357 CG1 ILE A 26 0.852 0.088 0.281 1.00 0.00 C ATOM 358 CG2 ILE A 26 -1.308 1.293 0.843 1.00 0.00 C ATOM 359 CD1 ILE A 26 0.438 -1.347 -0.050 1.00 0.00 C ATOM 0 H ILE A 26 2.089 0.090 2.547 1.00 0.00 H new ATOM 0 HA ILE A 26 1.098 2.445 1.540 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.319 -0.160 2.036 1.00 0.00 H new ATOM 0 HG12 ILE A 26 0.772 0.708 -0.612 1.00 0.00 H new ATOM 0 HG13 ILE A 26 1.897 0.107 0.590 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.845 0.555 0.247 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -1.938 1.618 1.671 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.058 2.151 0.219 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.077 -1.736 -0.843 1.00 0.00 H new ATOM 0 HD12 ILE A 26 0.542 -1.970 0.838 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.600 -1.359 -0.382 1.00 0.00 H new ATOM 371 N SER A 27 -0.398 1.636 4.351 1.00 0.00 N ATOM 372 CA SER A 27 -1.199 2.173 5.438 1.00 0.00 C ATOM 373 C SER A 27 -0.397 3.220 6.212 1.00 0.00 C ATOM 374 O SER A 27 -0.964 4.172 6.746 1.00 0.00 O ATOM 375 CB SER A 27 -1.667 1.061 6.378 1.00 0.00 C ATOM 376 OG SER A 27 -3.085 1.042 6.520 1.00 0.00 O ATOM 0 H SER A 27 -0.107 0.666 4.474 1.00 0.00 H new ATOM 0 HA SER A 27 -2.083 2.646 5.010 1.00 0.00 H new ATOM 0 HB2 SER A 27 -1.328 0.098 5.997 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.207 1.196 7.357 1.00 0.00 H new ATOM 0 HG SER A 27 -3.343 0.317 7.127 1.00 0.00 H new ATOM 382 N GLN A 28 0.911 3.010 6.248 1.00 0.00 N ATOM 383 CA GLN A 28 1.798 3.924 6.948 1.00 0.00 C ATOM 384 C GLN A 28 1.826 5.280 6.241 1.00 0.00 C ATOM 385 O GLN A 28 1.386 6.284 6.799 1.00 0.00 O ATOM 386 CB GLN A 28 3.206 3.338 7.067 1.00 0.00 C ATOM 387 CG GLN A 28 3.212 2.106 7.975 1.00 0.00 C ATOM 388 CD GLN A 28 4.466 2.076 8.851 1.00 0.00 C ATOM 389 OE1 GLN A 28 5.139 3.074 9.049 1.00 0.00 O ATOM 390 NE2 GLN A 28 4.740 0.880 9.363 1.00 0.00 N ATOM 0 H GLN A 28 1.378 2.220 5.803 1.00 0.00 H new ATOM 0 HA GLN A 28 1.415 4.070 7.958 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.576 3.067 6.078 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.885 4.092 7.466 1.00 0.00 H new ATOM 0 HG2 GLN A 28 2.323 2.111 8.606 1.00 0.00 H new ATOM 0 HG3 GLN A 28 3.167 1.202 7.368 1.00 0.00 H new ATOM 0 HE21 GLN A 28 4.134 0.086 9.157 1.00 0.00 H new ATOM 0 HE22 GLN A 28 5.556 0.757 9.962 1.00 0.00 H new ATOM 399 N ALA A 29 2.350 5.267 5.024 1.00 0.00 N ATOM 400 CA ALA A 29 2.442 6.484 4.235 1.00 0.00 C ATOM 401 C ALA A 29 1.094 7.208 4.263 1.00 0.00 C ATOM 402 O ALA A 29 1.046 8.432 4.368 1.00 0.00 O ATOM 403 CB ALA A 29 2.889 6.138 2.813 1.00 0.00 C ATOM 0 H ALA A 29 2.715 4.433 4.565 1.00 0.00 H new ATOM 0 HA ALA A 29 3.187 7.159 4.656 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.958 7.051 2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 29 3.864 5.652 2.846 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.163 5.464 2.357 1.00 0.00 H new ATOM 409 N THR A 30 0.033 6.420 4.168 1.00 0.00 N ATOM 410 CA THR A 30 -1.311 6.970 4.181 1.00 0.00 C ATOM 411 C THR A 30 -1.576 7.700 5.500 1.00 0.00 C ATOM 412 O THR A 30 -2.362 8.645 5.543 1.00 0.00 O ATOM 413 CB THR A 30 -2.293 5.828 3.911 1.00 0.00 C ATOM 414 OG1 THR A 30 -2.250 5.661 2.496 1.00 0.00 O ATOM 415 CG2 THR A 30 -3.743 6.222 4.196 1.00 0.00 C ATOM 0 H THR A 30 0.077 5.405 4.082 1.00 0.00 H new ATOM 0 HA THR A 30 -1.439 7.719 3.399 1.00 0.00 H new ATOM 0 HB THR A 30 -2.025 4.967 4.523 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.646 4.923 2.272 1.00 0.00 H new ATOM 0 HG21 THR A 30 -4.398 5.376 3.988 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.843 6.509 5.243 1.00 0.00 H new ATOM 0 HG23 THR A 30 -4.023 7.062 3.561 1.00 0.00 H new ATOM 423 N ALA A 31 -0.905 7.233 6.542 1.00 0.00 N ATOM 424 CA ALA A 31 -1.058 7.829 7.858 1.00 0.00 C ATOM 425 C ALA A 31 -0.228 9.112 7.932 1.00 0.00 C ATOM 426 O ALA A 31 -0.663 10.105 8.514 1.00 0.00 O ATOM 427 CB ALA A 31 -0.656 6.813 8.929 1.00 0.00 C ATOM 0 H ALA A 31 -0.254 6.449 6.502 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.099 8.098 8.038 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -0.771 7.260 9.916 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.294 5.933 8.853 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.384 6.521 8.782 1.00 0.00 H new ATOM 433 N GLN A 32 0.953 9.051 7.333 1.00 0.00 N ATOM 434 CA GLN A 32 1.847 10.195 7.324 1.00 0.00 C ATOM 435 C GLN A 32 1.185 11.381 6.620 1.00 0.00 C ATOM 436 O GLN A 32 1.373 12.529 7.019 1.00 0.00 O ATOM 437 CB GLN A 32 3.182 9.843 6.665 1.00 0.00 C ATOM 438 CG GLN A 32 4.167 9.276 7.689 1.00 0.00 C ATOM 439 CD GLN A 32 4.754 7.947 7.209 1.00 0.00 C ATOM 440 OE1 GLN A 32 4.108 6.912 7.224 1.00 0.00 O ATOM 441 NE2 GLN A 32 6.011 8.033 6.782 1.00 0.00 N ATOM 0 H GLN A 32 1.311 8.226 6.851 1.00 0.00 H new ATOM 0 HA GLN A 32 2.052 10.478 8.356 1.00 0.00 H new ATOM 0 HB2 GLN A 32 3.019 9.115 5.871 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.607 10.732 6.200 1.00 0.00 H new ATOM 0 HG2 GLN A 32 4.971 9.992 7.860 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.661 9.130 8.643 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.494 8.931 6.796 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.492 7.201 6.440 1.00 0.00 H new ATOM 450 N ILE A 33 0.423 11.063 5.584 1.00 0.00 N ATOM 451 CA ILE A 33 -0.269 12.088 4.820 1.00 0.00 C ATOM 452 C ILE A 33 -1.329 12.748 5.704 1.00 0.00 C ATOM 453 O ILE A 33 -1.443 13.972 5.734 1.00 0.00 O ATOM 454 CB ILE A 33 -0.828 11.503 3.522 1.00 0.00 C ATOM 455 CG1 ILE A 33 0.283 11.295 2.491 1.00 0.00 C ATOM 456 CG2 ILE A 33 -1.964 12.370 2.974 1.00 0.00 C ATOM 457 CD1 ILE A 33 0.185 9.908 1.852 1.00 0.00 C ATOM 0 H ILE A 33 0.269 10.110 5.255 1.00 0.00 H new ATOM 0 HA ILE A 33 0.426 12.871 4.516 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.249 10.522 3.743 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.215 12.061 1.718 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.255 11.411 2.970 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.343 11.932 2.051 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -2.768 12.423 3.708 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.591 13.374 2.772 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.986 9.786 1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 33 0.277 9.144 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.779 9.805 1.353 1.00 0.00 H new ATOM 469 N LYS A 34 -2.078 11.907 6.403 1.00 0.00 N ATOM 470 CA LYS A 34 -3.125 12.394 7.285 1.00 0.00 C ATOM 471 C LYS A 34 -2.490 13.144 8.458 1.00 0.00 C ATOM 472 O LYS A 34 -3.035 14.140 8.930 1.00 0.00 O ATOM 473 CB LYS A 34 -4.042 11.246 7.713 1.00 0.00 C ATOM 474 CG LYS A 34 -5.197 11.069 6.726 1.00 0.00 C ATOM 475 CD LYS A 34 -6.148 9.964 7.187 1.00 0.00 C ATOM 476 CE LYS A 34 -7.325 9.814 6.221 1.00 0.00 C ATOM 477 NZ LYS A 34 -8.518 10.516 6.743 1.00 0.00 N ATOM 0 H LYS A 34 -1.980 10.892 6.376 1.00 0.00 H new ATOM 0 HA LYS A 34 -3.765 13.104 6.761 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -3.468 10.322 7.776 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.438 11.444 8.709 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.744 12.007 6.629 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.803 10.826 5.739 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.608 9.020 7.256 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.520 10.193 8.186 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.056 10.219 5.245 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -7.552 8.758 6.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -9.307 10.404 6.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -8.784 10.112 7.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.303 11.527 6.858 1.00 0.00 H new ATOM 491 N ASN A 35 -1.346 12.636 8.894 1.00 0.00 N ATOM 492 CA ASN A 35 -0.631 13.245 10.002 1.00 0.00 C ATOM 493 C ASN A 35 0.014 14.550 9.531 1.00 0.00 C ATOM 494 O ASN A 35 -0.031 15.558 10.235 1.00 0.00 O ATOM 495 CB ASN A 35 0.480 12.326 10.513 1.00 0.00 C ATOM 496 CG ASN A 35 -0.050 11.367 11.581 1.00 0.00 C ATOM 497 OD1 ASN A 35 -0.959 10.586 11.355 1.00 0.00 O ATOM 498 ND2 ASN A 35 0.567 11.470 12.755 1.00 0.00 N ATOM 0 H ASN A 35 -0.897 11.809 8.500 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.345 13.427 10.805 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.897 11.757 9.682 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.291 12.925 10.927 1.00 0.00 H new ATOM 0 HD21 ASN A 35 0.286 10.873 13.533 1.00 0.00 H new ATOM 0 HD22 ASN A 35 1.321 12.146 12.877 1.00 0.00 H new ATOM 505 N LEU A 36 0.600 14.489 8.345 1.00 0.00 N ATOM 506 CA LEU A 36 1.254 15.653 7.772 1.00 0.00 C ATOM 507 C LEU A 36 0.192 16.627 7.258 1.00 0.00 C ATOM 508 O LEU A 36 0.493 17.787 6.977 1.00 0.00 O ATOM 509 CB LEU A 36 2.267 15.229 6.706 1.00 0.00 C ATOM 510 CG LEU A 36 3.509 14.496 7.216 1.00 0.00 C ATOM 511 CD1 LEU A 36 4.233 13.782 6.072 1.00 0.00 C ATOM 512 CD2 LEU A 36 4.436 15.450 7.973 1.00 0.00 C ATOM 0 H LEU A 36 0.636 13.651 7.764 1.00 0.00 H new ATOM 0 HA LEU A 36 1.829 16.180 8.533 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.760 14.586 5.986 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.591 16.119 6.166 1.00 0.00 H new ATOM 0 HG LEU A 36 3.188 13.730 7.922 1.00 0.00 H new ATOM 0 HD11 LEU A 36 5.112 13.269 6.462 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.562 13.055 5.614 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.541 14.513 5.324 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.311 14.904 8.325 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.753 16.253 7.308 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.905 15.873 8.826 1.00 0.00 H new ATOM 524 N MET A 37 -1.027 16.121 7.150 1.00 0.00 N ATOM 525 CA MET A 37 -2.135 16.932 6.675 1.00 0.00 C ATOM 526 C MET A 37 -2.404 18.103 7.623 1.00 0.00 C ATOM 527 O MET A 37 -2.259 19.263 7.239 1.00 0.00 O ATOM 528 CB MET A 37 -3.392 16.066 6.564 1.00 0.00 C ATOM 529 CG MET A 37 -4.088 16.279 5.219 1.00 0.00 C ATOM 530 SD MET A 37 -5.426 15.113 5.032 1.00 0.00 S ATOM 531 CE MET A 37 -4.554 13.763 4.255 1.00 0.00 C ATOM 0 H MET A 37 -1.272 15.159 7.383 1.00 0.00 H new ATOM 0 HA MET A 37 -1.872 17.334 5.696 1.00 0.00 H new ATOM 0 HB2 MET A 37 -3.125 15.015 6.677 1.00 0.00 H new ATOM 0 HB3 MET A 37 -4.078 16.309 7.375 1.00 0.00 H new ATOM 0 HG2 MET A 37 -4.471 17.298 5.156 1.00 0.00 H new ATOM 0 HG3 MET A 37 -3.372 16.157 4.406 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.978 12.816 4.588 1.00 0.00 H new ATOM 0 HE2 MET A 37 -4.650 13.843 3.172 1.00 0.00 H new ATOM 0 HE3 MET A 37 -3.500 13.805 4.529 1.00 0.00 H new ATOM 541 N SER A 38 -2.790 17.759 8.842 1.00 0.00 N ATOM 542 CA SER A 38 -3.080 18.767 9.848 1.00 0.00 C ATOM 543 C SER A 38 -1.928 19.771 9.929 1.00 0.00 C ATOM 544 O SER A 38 -2.152 20.980 9.902 1.00 0.00 O ATOM 545 CB SER A 38 -3.323 18.126 11.216 1.00 0.00 C ATOM 546 OG SER A 38 -4.708 17.892 11.457 1.00 0.00 O ATOM 0 H SER A 38 -2.909 16.796 9.157 1.00 0.00 H new ATOM 0 HA SER A 38 -3.990 19.291 9.556 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.780 17.183 11.276 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.924 18.774 11.996 1.00 0.00 H new ATOM 0 HG SER A 38 -4.822 17.481 12.339 1.00 0.00 H new ATOM 755 N ASN A 52 6.810 16.013 1.175 1.00 0.00 N ATOM 756 CA ASN A 52 6.730 14.722 1.835 1.00 0.00 C ATOM 757 C ASN A 52 5.433 14.023 1.423 1.00 0.00 C ATOM 758 O ASN A 52 5.443 12.843 1.074 1.00 0.00 O ATOM 759 CB ASN A 52 6.719 14.880 3.357 1.00 0.00 C ATOM 760 CG ASN A 52 7.744 13.953 4.012 1.00 0.00 C ATOM 761 OD1 ASN A 52 8.272 13.039 3.402 1.00 0.00 O ATOM 762 ND2 ASN A 52 7.994 14.239 5.287 1.00 0.00 N ATOM 0 HA ASN A 52 7.602 14.138 1.540 1.00 0.00 H new ATOM 0 HB2 ASN A 52 6.939 15.915 3.620 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.724 14.657 3.742 1.00 0.00 H new ATOM 0 HD21 ASN A 52 8.663 13.678 5.814 1.00 0.00 H new ATOM 0 HD22 ASN A 52 7.516 15.019 5.738 1.00 0.00 H new ATOM 769 N LEU A 53 4.347 14.780 1.477 1.00 0.00 N ATOM 770 CA LEU A 53 3.045 14.249 1.114 1.00 0.00 C ATOM 771 C LEU A 53 3.157 13.500 -0.216 1.00 0.00 C ATOM 772 O LEU A 53 2.881 12.303 -0.284 1.00 0.00 O ATOM 773 CB LEU A 53 1.995 15.361 1.106 1.00 0.00 C ATOM 774 CG LEU A 53 1.839 16.146 2.410 1.00 0.00 C ATOM 775 CD1 LEU A 53 0.929 17.360 2.215 1.00 0.00 C ATOM 776 CD2 LEU A 53 1.350 15.238 3.541 1.00 0.00 C ATOM 0 H LEU A 53 4.343 15.758 1.767 1.00 0.00 H new ATOM 0 HA LEU A 53 2.707 13.529 1.859 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.244 16.063 0.310 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.031 14.921 0.852 1.00 0.00 H new ATOM 0 HG LEU A 53 2.819 16.523 2.701 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.836 17.900 3.157 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.358 18.019 1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.056 17.027 1.888 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.247 15.820 4.457 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.384 14.811 3.273 1.00 0.00 H new ATOM 0 HD23 LEU A 53 2.070 14.435 3.700 1.00 0.00 H new ATOM 788 N GLN A 54 3.563 14.236 -1.240 1.00 0.00 N ATOM 789 CA GLN A 54 3.715 13.657 -2.564 1.00 0.00 C ATOM 790 C GLN A 54 4.579 12.396 -2.496 1.00 0.00 C ATOM 791 O GLN A 54 4.080 11.287 -2.676 1.00 0.00 O ATOM 792 CB GLN A 54 4.305 14.674 -3.543 1.00 0.00 C ATOM 793 CG GLN A 54 3.202 15.499 -4.209 1.00 0.00 C ATOM 794 CD GLN A 54 2.698 14.815 -5.481 1.00 0.00 C ATOM 795 OE1 GLN A 54 1.875 13.914 -5.449 1.00 0.00 O ATOM 796 NE2 GLN A 54 3.236 15.290 -6.601 1.00 0.00 N ATOM 0 H GLN A 54 3.791 15.228 -1.180 1.00 0.00 H new ATOM 0 HA GLN A 54 2.728 13.378 -2.933 1.00 0.00 H new ATOM 0 HB2 GLN A 54 4.991 15.337 -3.015 1.00 0.00 H new ATOM 0 HB3 GLN A 54 4.886 14.155 -4.305 1.00 0.00 H new ATOM 0 HG2 GLN A 54 2.374 15.635 -3.513 1.00 0.00 H new ATOM 0 HG3 GLN A 54 3.581 16.492 -4.452 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.920 16.046 -6.558 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.965 14.899 -7.503 1.00 0.00 H new ATOM 805 N GLN A 55 5.861 12.609 -2.235 1.00 0.00 N ATOM 806 CA GLN A 55 6.799 11.504 -2.141 1.00 0.00 C ATOM 807 C GLN A 55 6.142 10.307 -1.452 1.00 0.00 C ATOM 808 O GLN A 55 6.195 9.188 -1.959 1.00 0.00 O ATOM 809 CB GLN A 55 8.073 11.928 -1.407 1.00 0.00 C ATOM 810 CG GLN A 55 9.282 11.898 -2.344 1.00 0.00 C ATOM 811 CD GLN A 55 9.974 10.534 -2.303 1.00 0.00 C ATOM 812 OE1 GLN A 55 9.762 9.728 -1.413 1.00 0.00 O ATOM 813 NE2 GLN A 55 10.812 10.323 -3.315 1.00 0.00 N ATOM 0 H GLN A 55 6.271 13.531 -2.086 1.00 0.00 H new ATOM 0 HA GLN A 55 7.082 11.206 -3.151 1.00 0.00 H new ATOM 0 HB2 GLN A 55 7.947 12.932 -1.003 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.248 11.263 -0.561 1.00 0.00 H new ATOM 0 HG2 GLN A 55 8.962 12.117 -3.363 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.988 12.677 -2.057 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.943 11.041 -4.027 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.324 9.443 -3.379 1.00 0.00 H new ATOM 822 N LEU A 56 5.536 10.583 -0.306 1.00 0.00 N ATOM 823 CA LEU A 56 4.868 9.543 0.458 1.00 0.00 C ATOM 824 C LEU A 56 3.837 8.846 -0.431 1.00 0.00 C ATOM 825 O LEU A 56 3.827 7.620 -0.533 1.00 0.00 O ATOM 826 CB LEU A 56 4.280 10.119 1.747 1.00 0.00 C ATOM 827 CG LEU A 56 5.263 10.320 2.902 1.00 0.00 C ATOM 828 CD1 LEU A 56 4.991 11.639 3.630 1.00 0.00 C ATOM 829 CD2 LEU A 56 5.241 9.124 3.856 1.00 0.00 C ATOM 0 H LEU A 56 5.494 11.513 0.112 1.00 0.00 H new ATOM 0 HA LEU A 56 5.583 8.783 0.773 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.821 11.080 1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.482 9.458 2.086 1.00 0.00 H new ATOM 0 HG LEU A 56 6.269 10.382 2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.703 11.758 4.446 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.098 12.469 2.932 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.978 11.631 4.031 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.949 9.293 4.668 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.239 9.005 4.267 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.520 8.221 3.314 1.00 0.00 H new ATOM 841 N GLN A 57 2.994 9.657 -1.053 1.00 0.00 N ATOM 842 CA GLN A 57 1.960 9.133 -1.930 1.00 0.00 C ATOM 843 C GLN A 57 2.573 8.190 -2.968 1.00 0.00 C ATOM 844 O GLN A 57 2.323 6.986 -2.943 1.00 0.00 O ATOM 845 CB GLN A 57 1.189 10.268 -2.608 1.00 0.00 C ATOM 846 CG GLN A 57 0.229 10.941 -1.625 1.00 0.00 C ATOM 847 CD GLN A 57 -0.434 12.166 -2.259 1.00 0.00 C ATOM 848 OE1 GLN A 57 -1.055 12.095 -3.306 1.00 0.00 O ATOM 849 NE2 GLN A 57 -0.267 13.289 -1.567 1.00 0.00 N ATOM 0 H GLN A 57 3.006 10.673 -0.967 1.00 0.00 H new ATOM 0 HA GLN A 57 1.251 8.566 -1.326 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.890 11.005 -3.000 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.630 9.876 -3.458 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.536 10.230 -1.313 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.771 11.240 -0.728 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.265 13.277 -0.697 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -0.671 14.162 -1.906 1.00 0.00 H new ATOM 858 N HIS A 58 3.364 8.774 -3.857 1.00 0.00 N ATOM 859 CA HIS A 58 4.014 8.001 -4.901 1.00 0.00 C ATOM 860 C HIS A 58 4.540 6.688 -4.317 1.00 0.00 C ATOM 861 O HIS A 58 4.176 5.609 -4.780 1.00 0.00 O ATOM 862 CB HIS A 58 5.107 8.824 -5.586 1.00 0.00 C ATOM 863 CG HIS A 58 5.957 8.034 -6.552 1.00 0.00 C ATOM 864 ND1 HIS A 58 5.994 8.302 -7.910 1.00 0.00 N ATOM 865 CD2 HIS A 58 6.800 6.983 -6.344 1.00 0.00 C ATOM 866 CE1 HIS A 58 6.825 7.444 -8.483 1.00 0.00 C ATOM 867 NE2 HIS A 58 7.323 6.626 -7.511 1.00 0.00 N ATOM 0 H HIS A 58 3.569 9.773 -3.875 1.00 0.00 H new ATOM 0 HA HIS A 58 3.289 7.749 -5.675 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.642 9.652 -6.121 1.00 0.00 H new ATOM 0 HB3 HIS A 58 5.752 9.259 -4.823 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.470 9.035 -8.388 1.00 0.00 H new ATOM 0 HD2 HIS A 58 7.007 6.519 -5.391 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.066 7.400 -9.535 1.00 0.00 H new ATOM 875 N SER A 59 5.387 6.824 -3.307 1.00 0.00 N ATOM 876 CA SER A 59 5.966 5.662 -2.654 1.00 0.00 C ATOM 877 C SER A 59 4.916 4.557 -2.526 1.00 0.00 C ATOM 878 O SER A 59 5.110 3.449 -3.024 1.00 0.00 O ATOM 879 CB SER A 59 6.525 6.025 -1.277 1.00 0.00 C ATOM 880 OG SER A 59 7.919 6.316 -1.327 1.00 0.00 O ATOM 0 H SER A 59 5.686 7.721 -2.925 1.00 0.00 H new ATOM 0 HA SER A 59 6.792 5.301 -3.267 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.988 6.888 -0.884 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.351 5.200 -0.586 1.00 0.00 H new ATOM 0 HG SER A 59 8.238 6.545 -0.429 1.00 0.00 H new ATOM 886 N THR A 60 3.825 4.896 -1.854 1.00 0.00 N ATOM 887 CA THR A 60 2.744 3.946 -1.654 1.00 0.00 C ATOM 888 C THR A 60 2.211 3.453 -3.000 1.00 0.00 C ATOM 889 O THR A 60 2.004 2.255 -3.189 1.00 0.00 O ATOM 890 CB THR A 60 1.677 4.619 -0.788 1.00 0.00 C ATOM 891 OG1 THR A 60 2.296 4.747 0.489 1.00 0.00 O ATOM 892 CG2 THR A 60 0.473 3.711 -0.529 1.00 0.00 C ATOM 0 H THR A 60 3.667 5.815 -1.441 1.00 0.00 H new ATOM 0 HA THR A 60 3.093 3.055 -1.132 1.00 0.00 H new ATOM 0 HB THR A 60 1.342 5.536 -1.273 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.678 3.885 0.755 1.00 0.00 H new ATOM 0 HG21 THR A 60 -0.253 4.238 0.090 1.00 0.00 H new ATOM 0 HG22 THR A 60 0.011 3.439 -1.478 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.802 2.808 -0.014 1.00 0.00 H new ATOM 900 N ASN A 61 2.004 4.401 -3.902 1.00 0.00 N ATOM 901 CA ASN A 61 1.500 4.078 -5.226 1.00 0.00 C ATOM 902 C ASN A 61 2.233 2.846 -5.760 1.00 0.00 C ATOM 903 O ASN A 61 1.617 1.811 -6.007 1.00 0.00 O ATOM 904 CB ASN A 61 1.738 5.231 -6.203 1.00 0.00 C ATOM 905 CG ASN A 61 0.457 5.579 -6.964 1.00 0.00 C ATOM 906 OD1 ASN A 61 -0.349 6.388 -6.536 1.00 0.00 O ATOM 907 ND2 ASN A 61 0.315 4.924 -8.112 1.00 0.00 N ATOM 0 H ASN A 61 2.176 5.394 -3.742 1.00 0.00 H new ATOM 0 HA ASN A 61 0.429 3.892 -5.143 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.091 6.107 -5.658 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.522 4.958 -6.909 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.507 5.086 -8.693 1.00 0.00 H new ATOM 0 HD22 ASN A 61 1.028 4.260 -8.412 1.00 0.00 H new ATOM 914 N GLN A 62 3.539 2.999 -5.922 1.00 0.00 N ATOM 915 CA GLN A 62 4.363 1.912 -6.423 1.00 0.00 C ATOM 916 C GLN A 62 4.131 0.646 -5.595 1.00 0.00 C ATOM 917 O GLN A 62 3.739 -0.389 -6.133 1.00 0.00 O ATOM 918 CB GLN A 62 5.843 2.302 -6.426 1.00 0.00 C ATOM 919 CG GLN A 62 6.030 3.739 -6.915 1.00 0.00 C ATOM 920 CD GLN A 62 7.232 3.845 -7.856 1.00 0.00 C ATOM 921 OE1 GLN A 62 8.315 3.358 -7.579 1.00 0.00 O ATOM 922 NE2 GLN A 62 6.981 4.508 -8.982 1.00 0.00 N ATOM 0 H GLN A 62 4.047 3.859 -5.715 1.00 0.00 H new ATOM 0 HA GLN A 62 4.073 1.707 -7.454 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.252 2.200 -5.421 1.00 0.00 H new ATOM 0 HB3 GLN A 62 6.401 1.620 -7.068 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.129 4.072 -7.431 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.172 4.402 -6.062 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.051 4.891 -9.152 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.719 4.633 -9.675 1.00 0.00 H new ATOM 931 N LEU A 63 4.384 0.769 -4.301 1.00 0.00 N ATOM 932 CA LEU A 63 4.208 -0.353 -3.394 1.00 0.00 C ATOM 933 C LEU A 63 2.956 -1.135 -3.794 1.00 0.00 C ATOM 934 O LEU A 63 3.018 -2.344 -4.012 1.00 0.00 O ATOM 935 CB LEU A 63 4.193 0.130 -1.942 1.00 0.00 C ATOM 936 CG LEU A 63 5.549 0.162 -1.232 1.00 0.00 C ATOM 937 CD1 LEU A 63 5.481 1.009 0.040 1.00 0.00 C ATOM 938 CD2 LEU A 63 6.056 -1.254 -0.953 1.00 0.00 C ATOM 0 H LEU A 63 4.710 1.628 -3.858 1.00 0.00 H new ATOM 0 HA LEU A 63 5.051 -1.040 -3.469 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.769 1.134 -1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.522 -0.513 -1.373 1.00 0.00 H new ATOM 0 HG LEU A 63 6.272 0.636 -1.896 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.457 1.015 0.525 1.00 0.00 H new ATOM 0 HD12 LEU A 63 5.197 2.029 -0.217 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.741 0.586 0.719 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.021 -1.202 -0.448 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.342 -1.778 -0.318 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.167 -1.793 -1.894 1.00 0.00 H new ATOM 950 N ALA A 64 1.848 -0.413 -3.879 1.00 0.00 N ATOM 951 CA ALA A 64 0.583 -1.025 -4.250 1.00 0.00 C ATOM 952 C ALA A 64 0.767 -1.825 -5.541 1.00 0.00 C ATOM 953 O ALA A 64 0.497 -3.024 -5.576 1.00 0.00 O ATOM 954 CB ALA A 64 -0.489 0.059 -4.384 1.00 0.00 C ATOM 0 H ALA A 64 1.800 0.590 -3.697 1.00 0.00 H new ATOM 0 HA ALA A 64 0.251 -1.718 -3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.438 -0.400 -4.662 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.602 0.578 -3.432 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.191 0.772 -5.153 1.00 0.00 H new ATOM 960 N LYS A 65 1.225 -1.128 -6.571 1.00 0.00 N ATOM 961 CA LYS A 65 1.448 -1.759 -7.861 1.00 0.00 C ATOM 962 C LYS A 65 2.137 -3.109 -7.651 1.00 0.00 C ATOM 963 O LYS A 65 1.745 -4.109 -8.251 1.00 0.00 O ATOM 964 CB LYS A 65 2.213 -0.816 -8.793 1.00 0.00 C ATOM 965 CG LYS A 65 1.458 0.501 -8.980 1.00 0.00 C ATOM 966 CD LYS A 65 1.955 1.246 -10.221 1.00 0.00 C ATOM 967 CE LYS A 65 2.671 2.541 -9.833 1.00 0.00 C ATOM 968 NZ LYS A 65 4.004 2.609 -10.472 1.00 0.00 N ATOM 0 H LYS A 65 1.448 -0.133 -6.538 1.00 0.00 H new ATOM 0 HA LYS A 65 0.498 -1.959 -8.357 1.00 0.00 H new ATOM 0 HB2 LYS A 65 3.203 -0.617 -8.382 1.00 0.00 H new ATOM 0 HB3 LYS A 65 2.360 -1.296 -9.761 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.390 0.302 -9.074 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.589 1.128 -8.098 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.633 0.607 -10.786 1.00 0.00 H new ATOM 0 HD3 LYS A 65 1.113 1.474 -10.874 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.072 3.399 -10.136 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.778 2.594 -8.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.476 3.494 -10.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.579 1.800 -10.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.895 2.581 -11.506 1.00 0.00 H new ATOM 982 N GLU A 66 3.151 -3.094 -6.799 1.00 0.00 N ATOM 983 CA GLU A 66 3.897 -4.305 -6.503 1.00 0.00 C ATOM 984 C GLU A 66 3.012 -5.306 -5.758 1.00 0.00 C ATOM 985 O GLU A 66 2.932 -6.473 -6.138 1.00 0.00 O ATOM 986 CB GLU A 66 5.161 -3.988 -5.701 1.00 0.00 C ATOM 987 CG GLU A 66 6.417 -4.206 -6.547 1.00 0.00 C ATOM 988 CD GLU A 66 7.115 -5.513 -6.165 1.00 0.00 C ATOM 989 OE1 GLU A 66 7.335 -5.704 -4.949 1.00 0.00 O ATOM 990 OE2 GLU A 66 7.414 -6.290 -7.097 1.00 0.00 O ATOM 0 H GLU A 66 3.474 -2.262 -6.304 1.00 0.00 H new ATOM 0 HA GLU A 66 4.207 -4.756 -7.445 1.00 0.00 H new ATOM 0 HB2 GLU A 66 5.127 -2.955 -5.355 1.00 0.00 H new ATOM 0 HB3 GLU A 66 5.201 -4.621 -4.814 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.149 -4.228 -7.603 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.102 -3.370 -6.409 1.00 0.00 H new ATOM 997 N THR A 67 2.368 -4.812 -4.710 1.00 0.00 N ATOM 998 CA THR A 67 1.492 -5.649 -3.908 1.00 0.00 C ATOM 999 C THR A 67 0.523 -6.421 -4.806 1.00 0.00 C ATOM 1000 O THR A 67 0.426 -7.644 -4.713 1.00 0.00 O ATOM 1001 CB THR A 67 0.789 -4.753 -2.886 1.00 0.00 C ATOM 1002 OG1 THR A 67 1.766 -3.770 -2.555 1.00 0.00 O ATOM 1003 CG2 THR A 67 0.522 -5.473 -1.562 1.00 0.00 C ATOM 0 H THR A 67 2.436 -3.843 -4.398 1.00 0.00 H new ATOM 0 HA THR A 67 2.057 -6.407 -3.365 1.00 0.00 H new ATOM 0 HB THR A 67 -0.153 -4.398 -3.303 1.00 0.00 H new ATOM 0 HG1 THR A 67 1.834 -3.118 -3.283 1.00 0.00 H new ATOM 0 HG21 THR A 67 0.022 -4.793 -0.872 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.113 -6.340 -1.741 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.467 -5.799 -1.128 1.00 0.00 H new ATOM 1011 N ASN A 68 -0.168 -5.676 -5.656 1.00 0.00 N ATOM 1012 CA ASN A 68 -1.125 -6.275 -6.570 1.00 0.00 C ATOM 1013 C ASN A 68 -0.418 -7.332 -7.421 1.00 0.00 C ATOM 1014 O ASN A 68 -1.014 -8.348 -7.778 1.00 0.00 O ATOM 1015 CB ASN A 68 -1.716 -5.227 -7.515 1.00 0.00 C ATOM 1016 CG ASN A 68 -2.723 -5.860 -8.476 1.00 0.00 C ATOM 1017 OD1 ASN A 68 -3.723 -6.436 -8.078 1.00 0.00 O ATOM 1018 ND2 ASN A 68 -2.406 -5.723 -9.760 1.00 0.00 N ATOM 0 H ASN A 68 -0.084 -4.662 -5.731 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.925 -6.718 -5.977 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -2.204 -4.444 -6.935 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -0.916 -4.752 -8.082 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -3.015 -6.112 -10.480 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -1.554 -5.229 -10.025 1.00 0.00 H new ATOM 1025 N GLU A 69 0.843 -7.058 -7.721 1.00 0.00 N ATOM 1026 CA GLU A 69 1.638 -7.973 -8.523 1.00 0.00 C ATOM 1027 C GLU A 69 2.015 -9.207 -7.702 1.00 0.00 C ATOM 1028 O GLU A 69 2.249 -10.279 -8.259 1.00 0.00 O ATOM 1029 CB GLU A 69 2.885 -7.278 -9.074 1.00 0.00 C ATOM 1030 CG GLU A 69 2.577 -6.559 -10.389 1.00 0.00 C ATOM 1031 CD GLU A 69 3.489 -7.056 -11.512 1.00 0.00 C ATOM 1032 OE1 GLU A 69 4.706 -6.789 -11.415 1.00 0.00 O ATOM 1033 OE2 GLU A 69 2.949 -7.693 -12.442 1.00 0.00 O ATOM 0 H GLU A 69 1.334 -6.215 -7.423 1.00 0.00 H new ATOM 0 HA GLU A 69 1.038 -8.296 -9.373 1.00 0.00 H new ATOM 0 HB2 GLU A 69 3.259 -6.561 -8.343 1.00 0.00 H new ATOM 0 HB3 GLU A 69 3.674 -8.013 -9.233 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.535 -6.724 -10.662 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.706 -5.485 -10.259 1.00 0.00 H new ATOM 1040 N LEU A 70 2.063 -9.016 -6.392 1.00 0.00 N ATOM 1041 CA LEU A 70 2.408 -10.101 -5.489 1.00 0.00 C ATOM 1042 C LEU A 70 1.143 -10.884 -5.134 1.00 0.00 C ATOM 1043 O LEU A 70 1.186 -12.104 -4.984 1.00 0.00 O ATOM 1044 CB LEU A 70 3.162 -9.564 -4.271 1.00 0.00 C ATOM 1045 CG LEU A 70 4.493 -8.865 -4.560 1.00 0.00 C ATOM 1046 CD1 LEU A 70 5.033 -8.175 -3.305 1.00 0.00 C ATOM 1047 CD2 LEU A 70 5.507 -9.842 -5.158 1.00 0.00 C ATOM 0 H LEU A 70 1.869 -8.126 -5.934 1.00 0.00 H new ATOM 0 HA LEU A 70 3.090 -10.800 -5.974 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.513 -8.863 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.351 -10.394 -3.590 1.00 0.00 H new ATOM 0 HG LEU A 70 4.317 -8.089 -5.304 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.979 -7.686 -3.537 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.315 -7.431 -2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.190 -8.916 -2.521 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.444 -9.320 -5.354 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.685 -10.656 -4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.115 -10.247 -6.091 1.00 0.00 H new ATOM 1059 N LEU A 71 0.047 -10.151 -5.008 1.00 0.00 N ATOM 1060 CA LEU A 71 -1.228 -10.762 -4.673 1.00 0.00 C ATOM 1061 C LEU A 71 -1.637 -11.724 -5.790 1.00 0.00 C ATOM 1062 O LEU A 71 -2.431 -12.637 -5.568 1.00 0.00 O ATOM 1063 CB LEU A 71 -2.274 -9.688 -4.372 1.00 0.00 C ATOM 1064 CG LEU A 71 -2.043 -8.861 -3.105 1.00 0.00 C ATOM 1065 CD1 LEU A 71 -2.843 -7.558 -3.147 1.00 0.00 C ATOM 1066 CD2 LEU A 71 -2.349 -9.682 -1.851 1.00 0.00 C ATOM 0 H LEU A 71 0.015 -9.139 -5.132 1.00 0.00 H new ATOM 0 HA LEU A 71 -1.140 -11.352 -3.761 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.322 -9.008 -5.222 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.249 -10.170 -4.294 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.988 -8.589 -3.062 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.661 -6.990 -2.235 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -2.533 -6.969 -4.010 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -3.906 -7.786 -3.226 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.177 -9.071 -0.965 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.390 -10.005 -1.872 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.699 -10.556 -1.821 1.00 0.00 H new ATOM 1078 N LYS A 72 -1.077 -11.485 -6.967 1.00 0.00 N ATOM 1079 CA LYS A 72 -1.374 -12.319 -8.120 1.00 0.00 C ATOM 1080 C LYS A 72 -0.398 -13.496 -8.157 1.00 0.00 C ATOM 1081 O LYS A 72 -0.796 -14.630 -8.420 1.00 0.00 O ATOM 1082 CB LYS A 72 -1.376 -11.481 -9.400 1.00 0.00 C ATOM 1083 CG LYS A 72 -0.029 -10.785 -9.602 1.00 0.00 C ATOM 1084 CD LYS A 72 0.092 -10.227 -11.022 1.00 0.00 C ATOM 1085 CE LYS A 72 1.385 -10.700 -11.688 1.00 0.00 C ATOM 1086 NZ LYS A 72 1.243 -10.689 -13.161 1.00 0.00 N ATOM 0 H LYS A 72 -0.420 -10.726 -7.147 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.377 -12.739 -8.039 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.591 -12.120 -10.257 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.170 -10.736 -9.350 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.079 -9.976 -8.879 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.781 -11.490 -9.414 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.765 -10.545 -11.616 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.072 -9.138 -10.992 1.00 0.00 H new ATOM 0 HE2 LYS A 72 2.211 -10.054 -11.392 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.629 -11.706 -11.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.130 -11.013 -13.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.468 -11.324 -13.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.032 -9.723 -13.482 1.00 0.00 H new ATOM 1100 N GLU A 73 0.863 -13.188 -7.890 1.00 0.00 N ATOM 1101 CA GLU A 73 1.899 -14.206 -7.890 1.00 0.00 C ATOM 1102 C GLU A 73 1.694 -15.172 -6.721 1.00 0.00 C ATOM 1103 O GLU A 73 2.066 -16.341 -6.805 1.00 0.00 O ATOM 1104 CB GLU A 73 3.291 -13.573 -7.839 1.00 0.00 C ATOM 1105 CG GLU A 73 3.766 -13.408 -6.394 1.00 0.00 C ATOM 1106 CD GLU A 73 5.195 -12.862 -6.346 1.00 0.00 C ATOM 1107 OE1 GLU A 73 5.758 -12.648 -7.441 1.00 0.00 O ATOM 1108 OE2 GLU A 73 5.691 -12.671 -5.215 1.00 0.00 O ATOM 0 H GLU A 73 1.190 -12.247 -7.672 1.00 0.00 H new ATOM 0 HA GLU A 73 1.826 -14.770 -8.820 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.997 -14.195 -8.389 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.271 -12.601 -8.332 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.096 -12.732 -5.862 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.722 -14.369 -5.881 1.00 0.00 H new ATOM 1115 N LEU A 74 1.102 -14.647 -5.658 1.00 0.00 N ATOM 1116 CA LEU A 74 0.842 -15.448 -4.474 1.00 0.00 C ATOM 1117 C LEU A 74 0.035 -16.687 -4.868 1.00 0.00 C ATOM 1118 O LEU A 74 0.545 -17.806 -4.821 1.00 0.00 O ATOM 1119 CB LEU A 74 0.176 -14.600 -3.389 1.00 0.00 C ATOM 1120 CG LEU A 74 0.968 -14.430 -2.091 1.00 0.00 C ATOM 1121 CD1 LEU A 74 0.112 -13.770 -1.009 1.00 0.00 C ATOM 1122 CD2 LEU A 74 1.552 -15.765 -1.625 1.00 0.00 C ATOM 0 H LEU A 74 0.795 -13.677 -5.592 1.00 0.00 H new ATOM 0 HA LEU A 74 1.778 -15.801 -4.041 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -0.025 -13.611 -3.801 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.788 -15.047 -3.147 1.00 0.00 H new ATOM 0 HG LEU A 74 1.808 -13.764 -2.289 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.699 -13.661 -0.097 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.213 -12.787 -1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.761 -14.391 -0.807 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.110 -15.615 -0.701 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.743 -16.475 -1.450 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.219 -16.158 -2.392 1.00 0.00 H new ATOM 1134 N GLY A 75 -1.211 -16.446 -5.249 1.00 0.00 N ATOM 1135 CA GLY A 75 -2.093 -17.528 -5.651 1.00 0.00 C ATOM 1136 C GLY A 75 -1.514 -18.294 -6.842 1.00 0.00 C ATOM 1137 O GLY A 75 -1.835 -19.464 -7.048 1.00 0.00 O ATOM 0 H GLY A 75 -1.630 -15.517 -5.288 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.243 -18.210 -4.814 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.071 -17.126 -5.914 1.00 0.00 H new ATOM 1141 N SER A 76 -0.669 -17.604 -7.595 1.00 0.00 N ATOM 1142 CA SER A 76 -0.042 -18.205 -8.759 1.00 0.00 C ATOM 1143 C SER A 76 0.781 -19.425 -8.339 1.00 0.00 C ATOM 1144 O SER A 76 0.838 -20.419 -9.062 1.00 0.00 O ATOM 1145 CB SER A 76 0.843 -17.194 -9.492 1.00 0.00 C ATOM 1146 OG SER A 76 0.850 -17.413 -10.900 1.00 0.00 O ATOM 0 H SER A 76 -0.404 -16.634 -7.421 1.00 0.00 H new ATOM 0 HA SER A 76 -0.828 -18.523 -9.444 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.489 -16.184 -9.284 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.862 -17.260 -9.110 1.00 0.00 H new ATOM 0 HG SER A 76 1.424 -16.747 -11.332 1.00 0.00 H new ATOM 1152 N LEU A 77 1.399 -19.308 -7.173 1.00 0.00 N ATOM 1153 CA LEU A 77 2.217 -20.389 -6.648 1.00 0.00 C ATOM 1154 C LEU A 77 1.424 -21.696 -6.704 1.00 0.00 C ATOM 1155 O LEU A 77 0.194 -21.680 -6.730 1.00 0.00 O ATOM 1156 CB LEU A 77 2.731 -20.041 -5.250 1.00 0.00 C ATOM 1157 CG LEU A 77 3.535 -18.745 -5.134 1.00 0.00 C ATOM 1158 CD1 LEU A 77 3.776 -18.377 -3.668 1.00 0.00 C ATOM 1159 CD2 LEU A 77 4.842 -18.838 -5.924 1.00 0.00 C ATOM 0 H LEU A 77 1.350 -18.482 -6.577 1.00 0.00 H new ATOM 0 HA LEU A 77 3.106 -20.528 -7.264 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.877 -19.977 -4.576 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.353 -20.864 -4.898 1.00 0.00 H new ATOM 0 HG LEU A 77 2.948 -17.939 -5.575 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.350 -17.452 -3.615 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.819 -18.240 -3.165 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.331 -19.177 -3.179 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.394 -17.904 -5.825 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.445 -19.659 -5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.619 -19.018 -6.976 1.00 0.00 H new ATOM 1171 N PRO A 78 2.180 -22.827 -6.722 1.00 0.00 N ATOM 1172 CA PRO A 78 1.561 -24.140 -6.775 1.00 0.00 C ATOM 1173 C PRO A 78 0.964 -24.519 -5.418 1.00 0.00 C ATOM 1174 O PRO A 78 1.217 -23.853 -4.416 1.00 0.00 O ATOM 1175 CB PRO A 78 2.669 -25.080 -7.220 1.00 0.00 C ATOM 1176 CG PRO A 78 3.972 -24.344 -6.952 1.00 0.00 C ATOM 1177 CD PRO A 78 3.638 -22.884 -6.693 1.00 0.00 C ATOM 0 HA PRO A 78 0.720 -24.181 -7.468 1.00 0.00 H new ATOM 0 HB2 PRO A 78 2.630 -26.019 -6.668 1.00 0.00 H new ATOM 0 HB3 PRO A 78 2.570 -25.327 -8.277 1.00 0.00 H new ATOM 0 HG2 PRO A 78 4.485 -24.776 -6.093 1.00 0.00 H new ATOM 0 HG3 PRO A 78 4.645 -24.436 -7.805 1.00 0.00 H new ATOM 0 HD2 PRO A 78 4.028 -22.553 -5.730 1.00 0.00 H new ATOM 0 HD3 PRO A 78 4.075 -22.237 -7.454 1.00 0.00 H new ATOM 1185 N LEU A 79 0.182 -25.589 -5.430 1.00 0.00 N ATOM 1186 CA LEU A 79 -0.453 -26.065 -4.213 1.00 0.00 C ATOM 1187 C LEU A 79 0.198 -27.382 -3.784 1.00 0.00 C ATOM 1188 O LEU A 79 0.574 -28.196 -4.627 1.00 0.00 O ATOM 1189 CB LEU A 79 -1.968 -26.162 -4.402 1.00 0.00 C ATOM 1190 CG LEU A 79 -2.724 -24.832 -4.455 1.00 0.00 C ATOM 1191 CD1 LEU A 79 -3.571 -24.734 -5.725 1.00 0.00 C ATOM 1192 CD2 LEU A 79 -3.560 -24.626 -3.191 1.00 0.00 C ATOM 0 H LEU A 79 -0.026 -26.139 -6.263 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.300 -25.354 -3.401 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.165 -26.706 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.378 -26.758 -3.587 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.993 -24.024 -4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.098 -23.780 -5.738 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.924 -24.804 -6.600 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -4.295 -25.549 -5.743 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.087 -23.674 -3.254 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.284 -25.436 -3.097 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.906 -24.621 -2.319 1.00 0.00 H new ATOM 1204 N PRO A 80 0.315 -27.555 -2.441 1.00 0.00 N ATOM 1205 CA PRO A 80 0.914 -28.758 -1.890 1.00 0.00 C ATOM 1206 C PRO A 80 -0.045 -29.946 -1.994 1.00 0.00 C ATOM 1207 O PRO A 80 -1.238 -29.765 -2.236 1.00 0.00 O ATOM 1208 CB PRO A 80 1.265 -28.402 -0.454 1.00 0.00 C ATOM 1209 CG PRO A 80 0.433 -27.176 -0.114 1.00 0.00 C ATOM 1210 CD PRO A 80 -0.119 -26.612 -1.413 1.00 0.00 C ATOM 0 HA PRO A 80 1.803 -29.073 -2.437 1.00 0.00 H new ATOM 0 HB2 PRO A 80 1.037 -29.228 0.220 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.330 -28.192 -0.353 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -0.379 -27.442 0.562 1.00 0.00 H new ATOM 0 HG3 PRO A 80 1.043 -26.431 0.397 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -1.206 -26.534 -1.381 1.00 0.00 H new ATOM 0 HD3 PRO A 80 0.267 -25.611 -1.606 1.00 0.00 H new ATOM 1218 N LEU A 81 0.512 -31.133 -1.807 1.00 0.00 N ATOM 1219 CA LEU A 81 -0.280 -32.350 -1.877 1.00 0.00 C ATOM 1220 C LEU A 81 -1.252 -32.390 -0.696 1.00 0.00 C ATOM 1221 O LEU A 81 -2.355 -32.921 -0.814 1.00 0.00 O ATOM 1222 CB LEU A 81 0.630 -33.577 -1.966 1.00 0.00 C ATOM 1223 CG LEU A 81 1.241 -33.861 -3.340 1.00 0.00 C ATOM 1224 CD1 LEU A 81 0.391 -34.866 -4.120 1.00 0.00 C ATOM 1225 CD2 LEU A 81 1.458 -32.565 -4.122 1.00 0.00 C ATOM 0 H LEU A 81 1.502 -31.279 -1.607 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.882 -32.361 -2.786 1.00 0.00 H new ATOM 0 HB2 LEU A 81 1.441 -33.456 -1.248 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.058 -34.452 -1.657 1.00 0.00 H new ATOM 0 HG LEU A 81 2.221 -34.315 -3.191 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.847 -35.051 -5.093 1.00 0.00 H new ATOM 0 HD12 LEU A 81 0.332 -35.801 -3.564 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.612 -34.463 -4.260 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.893 -32.795 -5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.502 -32.060 -4.262 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.134 -31.914 -3.567 1.00 0.00 H new ATOM 1237 N SER A 82 -0.807 -31.821 0.415 1.00 0.00 N ATOM 1238 CA SER A 82 -1.624 -31.784 1.616 1.00 0.00 C ATOM 1239 C SER A 82 -2.581 -30.592 1.561 1.00 0.00 C ATOM 1240 O SER A 82 -2.149 -29.452 1.399 1.00 0.00 O ATOM 1241 CB SER A 82 -0.754 -31.710 2.872 1.00 0.00 C ATOM 1242 OG SER A 82 -0.660 -32.969 3.531 1.00 0.00 O ATOM 0 H SER A 82 0.109 -31.382 0.509 1.00 0.00 H new ATOM 0 HA SER A 82 -2.204 -32.705 1.664 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.245 -31.367 2.602 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.170 -30.972 3.558 1.00 0.00 H new ATOM 0 HG SER A 82 -0.095 -32.880 4.327 1.00 0.00 H new ATOM 1248 N THR A 83 -3.863 -30.896 1.701 1.00 0.00 N ATOM 1249 CA THR A 83 -4.885 -29.863 1.670 1.00 0.00 C ATOM 1250 C THR A 83 -4.732 -28.925 2.869 1.00 0.00 C ATOM 1251 O THR A 83 -4.880 -27.712 2.736 1.00 0.00 O ATOM 1252 CB THR A 83 -6.250 -30.551 1.607 1.00 0.00 C ATOM 1253 OG1 THR A 83 -6.172 -31.372 0.445 1.00 0.00 O ATOM 1254 CG2 THR A 83 -7.385 -29.572 1.296 1.00 0.00 C ATOM 0 H THR A 83 -4.218 -31.843 1.836 1.00 0.00 H new ATOM 0 HA THR A 83 -4.782 -29.231 0.788 1.00 0.00 H new ATOM 0 HB THR A 83 -6.450 -31.049 2.556 1.00 0.00 H new ATOM 0 HG1 THR A 83 -7.016 -31.856 0.329 1.00 0.00 H new ATOM 0 HG21 THR A 83 -8.332 -30.111 1.263 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.430 -28.808 2.072 1.00 0.00 H new ATOM 0 HG23 THR A 83 -7.203 -29.099 0.331 1.00 0.00 H new ATOM 1262 N SER A 84 -4.437 -29.524 4.014 1.00 0.00 N ATOM 1263 CA SER A 84 -4.262 -28.757 5.236 1.00 0.00 C ATOM 1264 C SER A 84 -3.410 -27.517 4.958 1.00 0.00 C ATOM 1265 O SER A 84 -3.611 -26.471 5.573 1.00 0.00 O ATOM 1266 CB SER A 84 -3.618 -29.608 6.333 1.00 0.00 C ATOM 1267 OG SER A 84 -4.291 -29.468 7.581 1.00 0.00 O ATOM 0 H SER A 84 -4.315 -30.531 4.121 1.00 0.00 H new ATOM 0 HA SER A 84 -5.245 -28.444 5.587 1.00 0.00 H new ATOM 0 HB2 SER A 84 -3.627 -30.655 6.032 1.00 0.00 H new ATOM 0 HB3 SER A 84 -2.574 -29.319 6.450 1.00 0.00 H new ATOM 0 HG SER A 84 -3.851 -30.028 8.254 1.00 0.00 H new ATOM 1273 N GLU A 85 -2.476 -27.675 4.031 1.00 0.00 N ATOM 1274 CA GLU A 85 -1.593 -26.581 3.665 1.00 0.00 C ATOM 1275 C GLU A 85 -2.270 -25.675 2.634 1.00 0.00 C ATOM 1276 O GLU A 85 -2.209 -24.451 2.743 1.00 0.00 O ATOM 1277 CB GLU A 85 -0.257 -27.108 3.138 1.00 0.00 C ATOM 1278 CG GLU A 85 0.678 -27.482 4.290 1.00 0.00 C ATOM 1279 CD GLU A 85 0.910 -26.288 5.218 1.00 0.00 C ATOM 1280 OE1 GLU A 85 1.041 -25.168 4.678 1.00 0.00 O ATOM 1281 OE2 GLU A 85 0.952 -26.522 6.445 1.00 0.00 O ATOM 0 H GLU A 85 -2.312 -28.544 3.523 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.387 -25.992 4.558 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.429 -27.980 2.507 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.216 -26.351 2.513 1.00 0.00 H new ATOM 0 HG2 GLU A 85 0.250 -28.309 4.856 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.632 -27.828 3.891 1.00 0.00 H new ATOM 1288 N GLN A 86 -2.899 -26.311 1.657 1.00 0.00 N ATOM 1289 CA GLN A 86 -3.587 -25.578 0.608 1.00 0.00 C ATOM 1290 C GLN A 86 -4.388 -24.420 1.207 1.00 0.00 C ATOM 1291 O GLN A 86 -4.280 -23.284 0.749 1.00 0.00 O ATOM 1292 CB GLN A 86 -4.489 -26.505 -0.208 1.00 0.00 C ATOM 1293 CG GLN A 86 -3.664 -27.553 -0.958 1.00 0.00 C ATOM 1294 CD GLN A 86 -4.565 -28.636 -1.556 1.00 0.00 C ATOM 1295 OE1 GLN A 86 -5.659 -28.377 -2.031 1.00 0.00 O ATOM 1296 NE2 GLN A 86 -4.047 -29.859 -1.506 1.00 0.00 N ATOM 0 H GLN A 86 -2.947 -27.326 1.570 1.00 0.00 H new ATOM 0 HA GLN A 86 -2.840 -25.165 -0.069 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -5.199 -27.001 0.453 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.071 -25.919 -0.919 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -3.093 -27.071 -1.752 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -2.944 -28.009 -0.278 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -3.125 -30.006 -1.095 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -4.571 -30.650 -1.879 1.00 0.00 H new ATOM 1305 N ARG A 87 -5.175 -24.750 2.221 1.00 0.00 N ATOM 1306 CA ARG A 87 -5.994 -23.752 2.887 1.00 0.00 C ATOM 1307 C ARG A 87 -5.110 -22.757 3.642 1.00 0.00 C ATOM 1308 O ARG A 87 -5.133 -21.560 3.358 1.00 0.00 O ATOM 1309 CB ARG A 87 -6.968 -24.405 3.870 1.00 0.00 C ATOM 1310 CG ARG A 87 -8.358 -23.776 3.764 1.00 0.00 C ATOM 1311 CD ARG A 87 -9.402 -24.817 3.355 1.00 0.00 C ATOM 1312 NE ARG A 87 -10.604 -24.691 4.209 1.00 0.00 N ATOM 1313 CZ ARG A 87 -11.771 -25.300 3.959 1.00 0.00 C ATOM 1314 NH1 ARG A 87 -11.901 -26.081 2.877 1.00 0.00 N ATOM 1315 NH2 ARG A 87 -12.808 -25.128 4.789 1.00 0.00 N ATOM 0 H ARG A 87 -5.263 -25.694 2.597 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.565 -23.228 2.121 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -7.032 -25.474 3.668 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -6.592 -24.295 4.887 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -8.635 -23.335 4.721 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.340 -22.967 3.033 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -9.674 -24.680 2.308 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -8.984 -25.819 3.447 1.00 0.00 H new ATOM 0 HE ARG A 87 -10.540 -24.104 5.040 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -11.112 -26.211 2.244 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -12.789 -26.545 2.687 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -12.710 -24.533 5.612 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -13.696 -25.592 4.598 1.00 0.00 H new ATOM 1329 N GLN A 88 -4.351 -23.289 4.589 1.00 0.00 N ATOM 1330 CA GLN A 88 -3.461 -22.463 5.387 1.00 0.00 C ATOM 1331 C GLN A 88 -2.774 -21.418 4.505 1.00 0.00 C ATOM 1332 O GLN A 88 -2.417 -20.340 4.978 1.00 0.00 O ATOM 1333 CB GLN A 88 -2.431 -23.320 6.125 1.00 0.00 C ATOM 1334 CG GLN A 88 -3.094 -24.142 7.232 1.00 0.00 C ATOM 1335 CD GLN A 88 -3.449 -23.260 8.431 1.00 0.00 C ATOM 1336 OE1 GLN A 88 -2.774 -22.294 8.745 1.00 0.00 O ATOM 1337 NE2 GLN A 88 -4.544 -23.646 9.080 1.00 0.00 N ATOM 0 H GLN A 88 -4.334 -24.282 4.822 1.00 0.00 H new ATOM 0 HA GLN A 88 -4.056 -21.943 6.138 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -1.935 -23.987 5.420 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -1.660 -22.680 6.554 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -3.996 -24.618 6.846 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -2.423 -24.940 7.549 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -5.063 -24.465 8.763 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -4.865 -23.123 9.895 1.00 0.00 H new ATOM 1346 N GLN A 89 -2.609 -21.774 3.240 1.00 0.00 N ATOM 1347 CA GLN A 89 -1.972 -20.881 2.288 1.00 0.00 C ATOM 1348 C GLN A 89 -2.929 -19.754 1.893 1.00 0.00 C ATOM 1349 O GLN A 89 -2.725 -18.601 2.270 1.00 0.00 O ATOM 1350 CB GLN A 89 -1.489 -21.647 1.055 1.00 0.00 C ATOM 1351 CG GLN A 89 0.037 -21.751 1.036 1.00 0.00 C ATOM 1352 CD GLN A 89 0.524 -22.439 -0.241 1.00 0.00 C ATOM 1353 OE1 GLN A 89 -0.206 -22.609 -1.203 1.00 0.00 O ATOM 1354 NE2 GLN A 89 1.797 -22.825 -0.196 1.00 0.00 N ATOM 0 H GLN A 89 -2.906 -22.669 2.852 1.00 0.00 H new ATOM 0 HA GLN A 89 -1.098 -20.438 2.765 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -1.925 -22.646 1.049 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -1.834 -21.144 0.152 1.00 0.00 H new ATOM 0 HG2 GLN A 89 0.474 -20.755 1.106 1.00 0.00 H new ATOM 0 HG3 GLN A 89 0.378 -22.310 1.907 1.00 0.00 H new ATOM 0 HE21 GLN A 89 2.353 -22.652 0.641 1.00 0.00 H new ATOM 0 HE22 GLN A 89 2.216 -23.294 -0.999 1.00 0.00 H new ATOM 1363 N ARG A 90 -3.952 -20.127 1.139 1.00 0.00 N ATOM 1364 CA ARG A 90 -4.942 -19.163 0.690 1.00 0.00 C ATOM 1365 C ARG A 90 -5.481 -18.363 1.877 1.00 0.00 C ATOM 1366 O ARG A 90 -5.786 -17.179 1.745 1.00 0.00 O ATOM 1367 CB ARG A 90 -6.106 -19.858 -0.020 1.00 0.00 C ATOM 1368 CG ARG A 90 -6.719 -20.943 0.867 1.00 0.00 C ATOM 1369 CD ARG A 90 -7.639 -21.859 0.057 1.00 0.00 C ATOM 1370 NE ARG A 90 -8.968 -21.940 0.701 1.00 0.00 N ATOM 1371 CZ ARG A 90 -9.913 -20.995 0.597 1.00 0.00 C ATOM 1372 NH1 ARG A 90 -9.680 -19.892 -0.127 1.00 0.00 N ATOM 1373 NH2 ARG A 90 -11.090 -21.153 1.217 1.00 0.00 N ATOM 0 H ARG A 90 -4.117 -21.084 0.827 1.00 0.00 H new ATOM 0 HA ARG A 90 -4.453 -18.489 -0.014 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -6.868 -19.124 -0.282 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -5.756 -20.300 -0.953 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -5.926 -21.533 1.327 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.282 -20.480 1.677 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.741 -21.479 -0.959 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -7.201 -22.854 -0.018 1.00 0.00 H new ATOM 0 HE ARG A 90 -9.179 -22.767 1.259 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -8.784 -19.772 -0.599 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -10.399 -19.173 -0.206 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.267 -21.993 1.768 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -11.809 -20.434 1.138 1.00 0.00 H new ATOM 1387 N LEU A 91 -5.583 -19.043 3.010 1.00 0.00 N ATOM 1388 CA LEU A 91 -6.080 -18.410 4.220 1.00 0.00 C ATOM 1389 C LEU A 91 -5.254 -17.156 4.512 1.00 0.00 C ATOM 1390 O LEU A 91 -5.799 -16.129 4.912 1.00 0.00 O ATOM 1391 CB LEU A 91 -6.107 -19.412 5.376 1.00 0.00 C ATOM 1392 CG LEU A 91 -7.194 -20.487 5.308 1.00 0.00 C ATOM 1393 CD1 LEU A 91 -7.185 -21.357 6.566 1.00 0.00 C ATOM 1394 CD2 LEU A 91 -8.567 -19.862 5.053 1.00 0.00 C ATOM 0 H LEU A 91 -5.330 -20.025 3.115 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.112 -18.087 4.084 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -5.137 -19.907 5.424 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.229 -18.859 6.307 1.00 0.00 H new ATOM 0 HG LEU A 91 -6.975 -21.141 4.464 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.967 -22.113 6.491 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -6.216 -21.846 6.663 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.366 -20.733 7.441 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.322 -20.647 5.009 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.808 -19.172 5.861 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.551 -19.321 4.107 1.00 0.00 H new ATOM 1406 N GLN A 92 -3.952 -17.282 4.300 1.00 0.00 N ATOM 1407 CA GLN A 92 -3.045 -16.171 4.535 1.00 0.00 C ATOM 1408 C GLN A 92 -3.252 -15.084 3.479 1.00 0.00 C ATOM 1409 O GLN A 92 -3.727 -13.993 3.790 1.00 0.00 O ATOM 1410 CB GLN A 92 -1.591 -16.646 4.556 1.00 0.00 C ATOM 1411 CG GLN A 92 -1.307 -17.489 5.801 1.00 0.00 C ATOM 1412 CD GLN A 92 -0.928 -16.603 6.989 1.00 0.00 C ATOM 1413 OE1 GLN A 92 -1.705 -15.790 7.463 1.00 0.00 O ATOM 1414 NE2 GLN A 92 0.306 -16.804 7.442 1.00 0.00 N ATOM 0 H GLN A 92 -3.504 -18.136 3.968 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.268 -15.746 5.514 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -1.383 -17.232 3.661 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -0.923 -15.785 4.536 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.187 -18.082 6.051 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -0.499 -18.190 5.593 1.00 0.00 H new ATOM 0 HE21 GLN A 92 0.905 -17.501 6.999 1.00 0.00 H new ATOM 0 HE22 GLN A 92 0.654 -16.261 8.233 1.00 0.00 H new ATOM 1423 N LYS A 93 -2.884 -15.420 2.251 1.00 0.00 N ATOM 1424 CA LYS A 93 -3.024 -14.486 1.146 1.00 0.00 C ATOM 1425 C LYS A 93 -4.415 -13.852 1.193 1.00 0.00 C ATOM 1426 O LYS A 93 -4.565 -12.656 0.946 1.00 0.00 O ATOM 1427 CB LYS A 93 -2.706 -15.175 -0.182 1.00 0.00 C ATOM 1428 CG LYS A 93 -3.951 -15.850 -0.761 1.00 0.00 C ATOM 1429 CD LYS A 93 -3.597 -16.696 -1.986 1.00 0.00 C ATOM 1430 CE LYS A 93 -4.716 -16.647 -3.028 1.00 0.00 C ATOM 1431 NZ LYS A 93 -5.640 -17.789 -2.850 1.00 0.00 N ATOM 0 H LYS A 93 -2.489 -16.326 1.997 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.301 -13.676 1.238 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.321 -14.443 -0.892 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.922 -15.917 -0.032 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.414 -16.480 -0.001 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.684 -15.092 -1.037 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.669 -16.333 -2.427 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.423 -17.728 -1.682 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -5.265 -15.710 -2.937 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.289 -16.670 -4.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.394 -17.741 -3.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.115 -18.680 -2.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -6.061 -17.750 -1.900 1.00 0.00 H new ATOM 1445 N GLU A 94 -5.398 -14.681 1.511 1.00 0.00 N ATOM 1446 CA GLU A 94 -6.773 -14.217 1.593 1.00 0.00 C ATOM 1447 C GLU A 94 -6.855 -12.950 2.448 1.00 0.00 C ATOM 1448 O GLU A 94 -7.326 -11.913 1.984 1.00 0.00 O ATOM 1449 CB GLU A 94 -7.689 -15.311 2.144 1.00 0.00 C ATOM 1450 CG GLU A 94 -8.177 -16.232 1.024 1.00 0.00 C ATOM 1451 CD GLU A 94 -9.490 -15.722 0.426 1.00 0.00 C ATOM 1452 OE1 GLU A 94 -10.317 -15.220 1.218 1.00 0.00 O ATOM 1453 OE2 GLU A 94 -9.636 -15.844 -0.809 1.00 0.00 O ATOM 0 H GLU A 94 -5.270 -15.672 1.715 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.116 -13.976 0.587 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -7.154 -15.895 2.893 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -8.544 -14.857 2.645 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -7.418 -16.295 0.244 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -8.318 -17.240 1.413 1.00 0.00 H new ATOM 1460 N ARG A 95 -6.389 -13.077 3.682 1.00 0.00 N ATOM 1461 CA ARG A 95 -6.404 -11.955 4.605 1.00 0.00 C ATOM 1462 C ARG A 95 -5.620 -10.777 4.024 1.00 0.00 C ATOM 1463 O ARG A 95 -6.051 -9.630 4.124 1.00 0.00 O ATOM 1464 CB ARG A 95 -5.798 -12.346 5.955 1.00 0.00 C ATOM 1465 CG ARG A 95 -6.892 -12.608 6.992 1.00 0.00 C ATOM 1466 CD ARG A 95 -7.323 -14.076 6.975 1.00 0.00 C ATOM 1467 NE ARG A 95 -8.528 -14.259 7.815 1.00 0.00 N ATOM 1468 CZ ARG A 95 -9.073 -15.450 8.096 1.00 0.00 C ATOM 1469 NH1 ARG A 95 -8.525 -16.570 7.607 1.00 0.00 N ATOM 1470 NH2 ARG A 95 -10.167 -15.521 8.867 1.00 0.00 N ATOM 0 H ARG A 95 -5.999 -13.939 4.064 1.00 0.00 H new ATOM 0 HA ARG A 95 -7.443 -11.664 4.756 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -5.183 -13.238 5.837 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -5.141 -11.550 6.307 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -6.528 -12.344 7.985 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -7.752 -11.970 6.788 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -7.531 -14.391 5.952 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -6.513 -14.706 7.344 1.00 0.00 H new ATOM 0 HE ARG A 95 -8.971 -13.427 8.204 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -7.692 -16.516 7.020 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -8.940 -17.477 7.821 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -10.584 -14.668 9.240 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -10.582 -16.428 9.081 1.00 0.00 H new ATOM 1484 N LEU A 96 -4.482 -11.102 3.428 1.00 0.00 N ATOM 1485 CA LEU A 96 -3.633 -10.085 2.830 1.00 0.00 C ATOM 1486 C LEU A 96 -4.448 -9.279 1.816 1.00 0.00 C ATOM 1487 O LEU A 96 -4.379 -8.051 1.795 1.00 0.00 O ATOM 1488 CB LEU A 96 -2.372 -10.719 2.240 1.00 0.00 C ATOM 1489 CG LEU A 96 -1.286 -11.112 3.244 1.00 0.00 C ATOM 1490 CD1 LEU A 96 -0.867 -12.571 3.055 1.00 0.00 C ATOM 1491 CD2 LEU A 96 -0.093 -10.158 3.163 1.00 0.00 C ATOM 0 H LEU A 96 -4.128 -12.055 3.346 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.285 -9.385 3.589 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.664 -11.610 1.683 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.940 -10.021 1.522 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.701 -11.024 4.248 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.094 -12.825 3.781 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.730 -13.220 3.203 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.477 -12.710 2.047 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.664 -10.460 3.887 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.331 -10.190 2.159 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -0.423 -9.143 3.385 1.00 0.00 H new ATOM 1503 N MET A 97 -5.201 -10.003 1.001 1.00 0.00 N ATOM 1504 CA MET A 97 -6.028 -9.370 -0.012 1.00 0.00 C ATOM 1505 C MET A 97 -7.011 -8.382 0.620 1.00 0.00 C ATOM 1506 O MET A 97 -7.149 -7.253 0.153 1.00 0.00 O ATOM 1507 CB MET A 97 -6.804 -10.442 -0.780 1.00 0.00 C ATOM 1508 CG MET A 97 -5.907 -11.143 -1.802 1.00 0.00 C ATOM 1509 SD MET A 97 -5.578 -10.052 -3.176 1.00 0.00 S ATOM 1510 CE MET A 97 -7.246 -9.582 -3.605 1.00 0.00 C ATOM 0 H MET A 97 -5.256 -11.021 1.022 1.00 0.00 H new ATOM 0 HA MET A 97 -5.378 -8.821 -0.693 1.00 0.00 H new ATOM 0 HB2 MET A 97 -7.207 -11.175 -0.081 1.00 0.00 H new ATOM 0 HB3 MET A 97 -7.654 -9.986 -1.289 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.970 -11.441 -1.332 1.00 0.00 H new ATOM 0 HG3 MET A 97 -6.389 -12.054 -2.157 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.298 -9.356 -4.670 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.926 -10.402 -3.374 1.00 0.00 H new ATOM 0 HE3 MET A 97 -7.534 -8.700 -3.033 1.00 0.00 H new ATOM 1520 N ASN A 98 -7.669 -8.844 1.673 1.00 0.00 N ATOM 1521 CA ASN A 98 -8.635 -8.016 2.374 1.00 0.00 C ATOM 1522 C ASN A 98 -7.899 -6.895 3.112 1.00 0.00 C ATOM 1523 O ASN A 98 -8.292 -5.732 3.033 1.00 0.00 O ATOM 1524 CB ASN A 98 -9.413 -8.832 3.408 1.00 0.00 C ATOM 1525 CG ASN A 98 -10.905 -8.868 3.069 1.00 0.00 C ATOM 1526 OD1 ASN A 98 -11.741 -8.323 3.771 1.00 0.00 O ATOM 1527 ND2 ASN A 98 -11.190 -9.537 1.956 1.00 0.00 N ATOM 0 H ASN A 98 -7.552 -9.781 2.058 1.00 0.00 H new ATOM 0 HA ASN A 98 -9.330 -7.612 1.638 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -9.020 -9.848 3.445 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -9.272 -8.400 4.399 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -12.157 -9.618 1.643 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -10.441 -9.970 1.415 1.00 0.00 H new ATOM 1534 N ASP A 99 -6.845 -7.286 3.814 1.00 0.00 N ATOM 1535 CA ASP A 99 -6.051 -6.329 4.566 1.00 0.00 C ATOM 1536 C ASP A 99 -5.513 -5.259 3.613 1.00 0.00 C ATOM 1537 O ASP A 99 -5.727 -4.067 3.829 1.00 0.00 O ATOM 1538 CB ASP A 99 -4.855 -7.010 5.234 1.00 0.00 C ATOM 1539 CG ASP A 99 -5.052 -7.358 6.711 1.00 0.00 C ATOM 1540 OD1 ASP A 99 -5.332 -6.416 7.483 1.00 0.00 O ATOM 1541 OD2 ASP A 99 -4.917 -8.558 7.034 1.00 0.00 O ATOM 0 H ASP A 99 -6.523 -8.252 3.878 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.690 -5.889 5.332 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.625 -7.925 4.688 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -3.987 -6.358 5.142 1.00 0.00 H new ATOM 1546 N PHE A 100 -4.826 -5.723 2.580 1.00 0.00 N ATOM 1547 CA PHE A 100 -4.256 -4.820 1.594 1.00 0.00 C ATOM 1548 C PHE A 100 -5.300 -3.815 1.103 1.00 0.00 C ATOM 1549 O PHE A 100 -4.971 -2.669 0.802 1.00 0.00 O ATOM 1550 CB PHE A 100 -3.798 -5.679 0.414 1.00 0.00 C ATOM 1551 CG PHE A 100 -3.565 -4.890 -0.876 1.00 0.00 C ATOM 1552 CD1 PHE A 100 -2.514 -4.031 -0.968 1.00 0.00 C ATOM 1553 CD2 PHE A 100 -4.408 -5.049 -1.932 1.00 0.00 C ATOM 1554 CE1 PHE A 100 -2.298 -3.299 -2.165 1.00 0.00 C ATOM 1555 CE2 PHE A 100 -4.191 -4.317 -3.129 1.00 0.00 C ATOM 1556 CZ PHE A 100 -3.141 -3.457 -3.221 1.00 0.00 C ATOM 0 H PHE A 100 -4.651 -6.712 2.404 1.00 0.00 H new ATOM 0 HA PHE A 100 -3.431 -4.260 2.035 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.875 -6.191 0.687 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -4.546 -6.449 0.227 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -1.844 -3.906 -0.130 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -5.242 -5.732 -1.860 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -1.464 -2.616 -2.237 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -4.860 -4.443 -3.967 1.00 0.00 H new ATOM 0 HZ PHE A 100 -2.977 -2.900 -4.132 1.00 0.00 H new ATOM 1566 N SER A 101 -6.539 -4.282 1.036 1.00 0.00 N ATOM 1567 CA SER A 101 -7.633 -3.439 0.587 1.00 0.00 C ATOM 1568 C SER A 101 -7.901 -2.337 1.614 1.00 0.00 C ATOM 1569 O SER A 101 -7.853 -1.152 1.286 1.00 0.00 O ATOM 1570 CB SER A 101 -8.901 -4.261 0.348 1.00 0.00 C ATOM 1571 OG SER A 101 -10.066 -3.600 0.834 1.00 0.00 O ATOM 0 H SER A 101 -6.809 -5.234 1.285 1.00 0.00 H new ATOM 0 HA SER A 101 -7.345 -2.982 -0.360 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.012 -4.454 -0.719 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.803 -5.230 0.838 1.00 0.00 H new ATOM 0 HG SER A 101 -10.854 -4.156 0.661 1.00 0.00 H new ATOM 1577 N ALA A 102 -8.177 -2.766 2.837 1.00 0.00 N ATOM 1578 CA ALA A 102 -8.453 -1.831 3.914 1.00 0.00 C ATOM 1579 C ALA A 102 -7.395 -0.726 3.907 1.00 0.00 C ATOM 1580 O ALA A 102 -7.719 0.450 4.064 1.00 0.00 O ATOM 1581 CB ALA A 102 -8.500 -2.585 5.245 1.00 0.00 C ATOM 0 H ALA A 102 -8.215 -3.749 3.106 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.425 -1.358 3.773 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.707 -1.884 6.053 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.286 -3.339 5.208 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -7.540 -3.070 5.422 1.00 0.00 H new ATOM 1587 N ALA A 103 -6.150 -1.143 3.724 1.00 0.00 N ATOM 1588 CA ALA A 103 -5.043 -0.203 3.695 1.00 0.00 C ATOM 1589 C ALA A 103 -5.116 0.625 2.411 1.00 0.00 C ATOM 1590 O ALA A 103 -4.797 1.813 2.415 1.00 0.00 O ATOM 1591 CB ALA A 103 -3.723 -0.966 3.823 1.00 0.00 C ATOM 0 H ALA A 103 -5.884 -2.119 3.594 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.103 0.488 4.536 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.892 -0.261 3.801 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.709 -1.514 4.765 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.626 -1.667 2.994 1.00 0.00 H new ATOM 1597 N LEU A 104 -5.538 -0.035 1.342 1.00 0.00 N ATOM 1598 CA LEU A 104 -5.657 0.625 0.053 1.00 0.00 C ATOM 1599 C LEU A 104 -6.709 1.731 0.147 1.00 0.00 C ATOM 1600 O LEU A 104 -6.401 2.905 -0.052 1.00 0.00 O ATOM 1601 CB LEU A 104 -5.936 -0.398 -1.049 1.00 0.00 C ATOM 1602 CG LEU A 104 -6.536 0.157 -2.343 1.00 0.00 C ATOM 1603 CD1 LEU A 104 -5.473 0.874 -3.177 1.00 0.00 C ATOM 1604 CD2 LEU A 104 -7.241 -0.945 -3.137 1.00 0.00 C ATOM 0 H LEU A 104 -5.802 -1.020 1.342 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.716 1.102 -0.219 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.002 -0.904 -1.293 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.614 -1.154 -0.653 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.291 0.897 -2.079 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.926 1.259 -4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.057 1.701 -2.602 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.678 0.174 -3.433 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.658 -0.524 -4.052 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.524 -1.726 -3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.043 -1.371 -2.535 1.00 0.00 H new ATOM 1616 N ASN A 105 -7.931 1.317 0.450 1.00 0.00 N ATOM 1617 CA ASN A 105 -9.031 2.258 0.573 1.00 0.00 C ATOM 1618 C ASN A 105 -8.547 3.509 1.309 1.00 0.00 C ATOM 1619 O ASN A 105 -8.808 4.630 0.874 1.00 0.00 O ATOM 1620 CB ASN A 105 -10.186 1.655 1.376 1.00 0.00 C ATOM 1621 CG ASN A 105 -11.509 2.343 1.036 1.00 0.00 C ATOM 1622 OD1 ASN A 105 -11.566 3.292 0.271 1.00 0.00 O ATOM 1623 ND2 ASN A 105 -12.566 1.814 1.645 1.00 0.00 N ATOM 0 H ASN A 105 -8.183 0.342 0.614 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.379 2.502 -0.431 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -10.262 0.588 1.165 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -9.983 1.755 2.442 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -13.495 2.203 1.484 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -12.448 1.019 2.274 1.00 0.00 H new ATOM 1630 N ASN A 106 -7.851 3.276 2.412 1.00 0.00 N ATOM 1631 CA ASN A 106 -7.328 4.370 3.213 1.00 0.00 C ATOM 1632 C ASN A 106 -6.620 5.372 2.299 1.00 0.00 C ATOM 1633 O ASN A 106 -7.016 6.534 2.221 1.00 0.00 O ATOM 1634 CB ASN A 106 -6.311 3.865 4.238 1.00 0.00 C ATOM 1635 CG ASN A 106 -6.705 4.288 5.655 1.00 0.00 C ATOM 1636 OD1 ASN A 106 -7.117 5.409 5.904 1.00 0.00 O ATOM 1637 ND2 ASN A 106 -6.556 3.330 6.566 1.00 0.00 N ATOM 0 H ASN A 106 -7.637 2.345 2.770 1.00 0.00 H new ATOM 0 HA ASN A 106 -8.164 4.836 3.734 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -6.244 2.778 4.184 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -5.323 4.258 3.999 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -6.792 3.513 7.541 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -6.206 2.413 6.289 1.00 0.00 H new ATOM 1644 N PHE A 107 -5.585 4.885 1.630 1.00 0.00 N ATOM 1645 CA PHE A 107 -4.818 5.723 0.724 1.00 0.00 C ATOM 1646 C PHE A 107 -5.739 6.487 -0.229 1.00 0.00 C ATOM 1647 O PHE A 107 -5.582 7.692 -0.418 1.00 0.00 O ATOM 1648 CB PHE A 107 -3.917 4.794 -0.091 1.00 0.00 C ATOM 1649 CG PHE A 107 -2.815 5.518 -0.867 1.00 0.00 C ATOM 1650 CD1 PHE A 107 -2.169 6.575 -0.304 1.00 0.00 C ATOM 1651 CD2 PHE A 107 -2.481 5.105 -2.119 1.00 0.00 C ATOM 1652 CE1 PHE A 107 -1.146 7.247 -1.024 1.00 0.00 C ATOM 1653 CE2 PHE A 107 -1.458 5.777 -2.839 1.00 0.00 C ATOM 1654 CZ PHE A 107 -0.812 6.834 -2.276 1.00 0.00 C ATOM 0 H PHE A 107 -5.260 3.921 1.697 1.00 0.00 H new ATOM 0 HA PHE A 107 -4.241 6.453 1.292 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -3.458 4.069 0.581 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -4.533 4.232 -0.793 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -2.434 6.903 0.690 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.994 4.266 -2.566 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -0.633 8.086 -0.577 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.193 5.449 -3.833 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.034 7.345 -2.823 1.00 0.00 H new ATOM 1664 N GLN A 108 -6.680 5.753 -0.806 1.00 0.00 N ATOM 1665 CA GLN A 108 -7.626 6.346 -1.735 1.00 0.00 C ATOM 1666 C GLN A 108 -8.356 7.518 -1.075 1.00 0.00 C ATOM 1667 O GLN A 108 -8.257 8.654 -1.536 1.00 0.00 O ATOM 1668 CB GLN A 108 -8.619 5.301 -2.248 1.00 0.00 C ATOM 1669 CG GLN A 108 -8.025 4.503 -3.410 1.00 0.00 C ATOM 1670 CD GLN A 108 -9.114 4.076 -4.396 1.00 0.00 C ATOM 1671 OE1 GLN A 108 -10.082 4.779 -4.634 1.00 0.00 O ATOM 1672 NE2 GLN A 108 -8.902 2.888 -4.954 1.00 0.00 N ATOM 0 H GLN A 108 -6.807 4.753 -0.648 1.00 0.00 H new ATOM 0 HA GLN A 108 -7.072 6.726 -2.593 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -8.890 4.624 -1.438 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -9.536 5.794 -2.572 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -7.279 5.107 -3.926 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -7.512 3.622 -3.026 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -8.070 2.351 -4.710 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -9.571 2.514 -5.626 1.00 0.00 H new ATOM 1681 N ALA A 109 -9.071 7.201 -0.006 1.00 0.00 N ATOM 1682 CA ALA A 109 -9.817 8.214 0.722 1.00 0.00 C ATOM 1683 C ALA A 109 -8.883 9.373 1.076 1.00 0.00 C ATOM 1684 O ALA A 109 -9.339 10.488 1.326 1.00 0.00 O ATOM 1685 CB ALA A 109 -10.458 7.584 1.960 1.00 0.00 C ATOM 0 H ALA A 109 -9.150 6.258 0.374 1.00 0.00 H new ATOM 0 HA ALA A 109 -10.622 8.615 0.106 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -11.018 8.343 2.506 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -11.134 6.786 1.653 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -9.680 7.174 2.604 1.00 0.00 H new ATOM 1691 N VAL A 110 -7.593 9.070 1.084 1.00 0.00 N ATOM 1692 CA VAL A 110 -6.591 10.073 1.402 1.00 0.00 C ATOM 1693 C VAL A 110 -6.173 10.795 0.120 1.00 0.00 C ATOM 1694 O VAL A 110 -5.828 11.975 0.152 1.00 0.00 O ATOM 1695 CB VAL A 110 -5.414 9.424 2.134 1.00 0.00 C ATOM 1696 CG1 VAL A 110 -4.237 10.394 2.248 1.00 0.00 C ATOM 1697 CG2 VAL A 110 -5.840 8.913 3.512 1.00 0.00 C ATOM 0 H VAL A 110 -7.219 8.144 0.875 1.00 0.00 H new ATOM 0 HA VAL A 110 -7.003 10.823 2.078 1.00 0.00 H new ATOM 0 HB VAL A 110 -5.085 8.567 1.546 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.414 9.908 2.772 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.909 10.687 1.251 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.548 11.279 2.803 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.985 8.456 4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.208 9.746 4.111 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.631 8.172 3.397 1.00 0.00 H new ATOM 1707 N GLN A 111 -6.218 10.056 -0.979 1.00 0.00 N ATOM 1708 CA GLN A 111 -5.848 10.611 -2.270 1.00 0.00 C ATOM 1709 C GLN A 111 -6.905 11.613 -2.739 1.00 0.00 C ATOM 1710 O GLN A 111 -6.579 12.610 -3.382 1.00 0.00 O ATOM 1711 CB GLN A 111 -5.645 9.503 -3.305 1.00 0.00 C ATOM 1712 CG GLN A 111 -6.877 9.358 -4.201 1.00 0.00 C ATOM 1713 CD GLN A 111 -6.744 8.144 -5.123 1.00 0.00 C ATOM 1714 OE1 GLN A 111 -6.380 7.055 -4.710 1.00 0.00 O ATOM 1715 NE2 GLN A 111 -7.058 8.391 -6.391 1.00 0.00 N ATOM 0 H GLN A 111 -6.505 9.078 -1.002 1.00 0.00 H new ATOM 0 HA GLN A 111 -4.900 11.138 -2.160 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -4.771 9.727 -3.916 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -5.446 8.559 -2.798 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -7.770 9.255 -3.584 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -7.005 10.261 -4.798 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -7.356 9.326 -6.670 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -7.001 7.646 -7.085 1.00 0.00 H new ATOM 1724 N ARG A 112 -8.150 11.314 -2.399 1.00 0.00 N ATOM 1725 CA ARG A 112 -9.257 12.176 -2.778 1.00 0.00 C ATOM 1726 C ARG A 112 -9.327 13.390 -1.848 1.00 0.00 C ATOM 1727 O ARG A 112 -9.755 14.467 -2.259 1.00 0.00 O ATOM 1728 CB ARG A 112 -10.587 11.422 -2.721 1.00 0.00 C ATOM 1729 CG ARG A 112 -10.916 10.997 -1.288 1.00 0.00 C ATOM 1730 CD ARG A 112 -11.865 11.997 -0.624 1.00 0.00 C ATOM 1731 NE ARG A 112 -13.211 11.897 -1.232 1.00 0.00 N ATOM 1732 CZ ARG A 112 -14.076 10.905 -0.983 1.00 0.00 C ATOM 1733 NH1 ARG A 112 -13.742 9.921 -0.137 1.00 0.00 N ATOM 1734 NH2 ARG A 112 -15.276 10.896 -1.581 1.00 0.00 N ATOM 0 H ARG A 112 -8.417 10.487 -1.865 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.084 12.507 -3.802 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -11.385 12.055 -3.108 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.538 10.542 -3.363 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.371 10.007 -1.294 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -9.997 10.922 -0.707 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -11.925 11.799 0.446 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.479 13.010 -0.740 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.498 12.629 -1.881 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -12.829 9.927 0.318 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -14.401 9.166 0.052 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -15.530 11.645 -2.226 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -15.935 10.141 -1.391 1.00 0.00 H new ATOM 1748 N ARG A 113 -8.899 13.174 -0.613 1.00 0.00 N ATOM 1749 CA ARG A 113 -8.908 14.237 0.378 1.00 0.00 C ATOM 1750 C ARG A 113 -7.709 15.165 0.171 1.00 0.00 C ATOM 1751 O ARG A 113 -7.792 16.362 0.443 1.00 0.00 O ATOM 1752 CB ARG A 113 -8.863 13.667 1.797 1.00 0.00 C ATOM 1753 CG ARG A 113 -10.249 13.700 2.445 1.00 0.00 C ATOM 1754 CD ARG A 113 -10.141 13.846 3.964 1.00 0.00 C ATOM 1755 NE ARG A 113 -10.979 14.976 4.424 1.00 0.00 N ATOM 1756 CZ ARG A 113 -10.605 16.261 4.366 1.00 0.00 C ATOM 1757 NH1 ARG A 113 -9.405 16.588 3.866 1.00 0.00 N ATOM 1758 NH2 ARG A 113 -11.431 17.220 4.807 1.00 0.00 N ATOM 0 H ARG A 113 -8.544 12.279 -0.276 1.00 0.00 H new ATOM 0 HA ARG A 113 -9.833 14.799 0.253 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -8.495 12.641 1.769 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -8.161 14.241 2.402 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -10.826 14.530 2.036 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -10.790 12.786 2.202 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -10.460 12.924 4.450 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -9.102 14.013 4.249 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.899 14.763 4.809 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -8.777 15.858 3.530 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -9.120 17.566 3.822 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -12.344 16.971 5.187 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -11.146 18.198 4.763 1.00 0.00 H new ATOM 1772 N VAL A 114 -6.622 14.578 -0.307 1.00 0.00 N ATOM 1773 CA VAL A 114 -5.408 15.337 -0.554 1.00 0.00 C ATOM 1774 C VAL A 114 -5.649 16.316 -1.704 1.00 0.00 C ATOM 1775 O VAL A 114 -5.398 17.513 -1.568 1.00 0.00 O ATOM 1776 CB VAL A 114 -4.239 14.385 -0.814 1.00 0.00 C ATOM 1777 CG1 VAL A 114 -3.038 15.137 -1.391 1.00 0.00 C ATOM 1778 CG2 VAL A 114 -3.852 13.630 0.460 1.00 0.00 C ATOM 0 H VAL A 114 -6.557 13.585 -0.530 1.00 0.00 H new ATOM 0 HA VAL A 114 -5.141 15.926 0.323 1.00 0.00 H new ATOM 0 HB VAL A 114 -4.562 13.652 -1.553 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.221 14.437 -1.567 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -3.321 15.608 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -2.715 15.903 -0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.019 12.960 0.247 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.557 14.343 1.230 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.704 13.048 0.811 1.00 0.00 H new ATOM 1788 N SER A 115 -6.132 15.772 -2.811 1.00 0.00 N ATOM 1789 CA SER A 115 -6.409 16.583 -3.985 1.00 0.00 C ATOM 1790 C SER A 115 -7.278 17.782 -3.599 1.00 0.00 C ATOM 1791 O SER A 115 -6.954 18.921 -3.933 1.00 0.00 O ATOM 1792 CB SER A 115 -7.097 15.758 -5.074 1.00 0.00 C ATOM 1793 OG SER A 115 -6.450 14.506 -5.285 1.00 0.00 O ATOM 0 H SER A 115 -6.339 14.779 -2.920 1.00 0.00 H new ATOM 0 HA SER A 115 -5.461 16.943 -4.384 1.00 0.00 H new ATOM 0 HB2 SER A 115 -8.137 15.586 -4.796 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.105 16.323 -6.006 1.00 0.00 H new ATOM 0 HG SER A 115 -6.718 13.877 -4.583 1.00 0.00 H new ATOM 1799 N GLU A 116 -8.363 17.485 -2.899 1.00 0.00 N ATOM 1800 CA GLU A 116 -9.281 18.525 -2.465 1.00 0.00 C ATOM 1801 C GLU A 116 -8.516 19.647 -1.761 1.00 0.00 C ATOM 1802 O GLU A 116 -8.818 20.824 -1.951 1.00 0.00 O ATOM 1803 CB GLU A 116 -10.370 17.950 -1.556 1.00 0.00 C ATOM 1804 CG GLU A 116 -11.640 17.641 -2.351 1.00 0.00 C ATOM 1805 CD GLU A 116 -12.745 17.113 -1.434 1.00 0.00 C ATOM 1806 OE1 GLU A 116 -12.432 16.208 -0.630 1.00 0.00 O ATOM 1807 OE2 GLU A 116 -13.878 17.626 -1.558 1.00 0.00 O ATOM 0 H GLU A 116 -8.627 16.540 -2.622 1.00 0.00 H new ATOM 0 HA GLU A 116 -9.771 18.942 -3.345 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.006 17.041 -1.077 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.598 18.660 -0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.984 18.542 -2.859 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.420 16.904 -3.123 1.00 0.00 H new ATOM 1814 N LYS A 117 -7.539 19.244 -0.962 1.00 0.00 N ATOM 1815 CA LYS A 117 -6.728 20.201 -0.229 1.00 0.00 C ATOM 1816 C LYS A 117 -5.990 21.103 -1.220 1.00 0.00 C ATOM 1817 O LYS A 117 -6.155 22.322 -1.198 1.00 0.00 O ATOM 1818 CB LYS A 117 -5.802 19.479 0.752 1.00 0.00 C ATOM 1819 CG LYS A 117 -4.993 20.479 1.580 1.00 0.00 C ATOM 1820 CD LYS A 117 -5.554 20.598 2.999 1.00 0.00 C ATOM 1821 CE LYS A 117 -6.102 22.003 3.256 1.00 0.00 C ATOM 1822 NZ LYS A 117 -6.027 22.333 4.696 1.00 0.00 N ATOM 0 H LYS A 117 -7.291 18.267 -0.806 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.360 20.847 0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -6.391 18.845 1.415 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.125 18.824 0.204 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.951 20.162 1.623 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -5.010 21.455 1.096 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -6.346 19.863 3.144 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -4.772 20.371 3.723 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -5.533 22.733 2.680 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -7.136 22.064 2.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -6.403 23.290 4.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -6.589 21.647 5.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -5.036 22.295 5.010 1.00 0.00 H new ATOM 1836 N GLU A 118 -5.192 20.469 -2.067 1.00 0.00 N ATOM 1837 CA GLU A 118 -4.428 21.199 -3.064 1.00 0.00 C ATOM 1838 C GLU A 118 -5.369 21.962 -3.999 1.00 0.00 C ATOM 1839 O GLU A 118 -4.936 22.853 -4.729 1.00 0.00 O ATOM 1840 CB GLU A 118 -3.516 20.258 -3.853 1.00 0.00 C ATOM 1841 CG GLU A 118 -2.196 20.026 -3.113 1.00 0.00 C ATOM 1842 CD GLU A 118 -1.183 21.124 -3.442 1.00 0.00 C ATOM 1843 OE1 GLU A 118 -1.362 22.240 -2.907 1.00 0.00 O ATOM 1844 OE2 GLU A 118 -0.252 20.823 -4.220 1.00 0.00 O ATOM 0 H GLU A 118 -5.058 19.458 -2.083 1.00 0.00 H new ATOM 0 HA GLU A 118 -3.793 21.921 -2.550 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -4.021 19.305 -4.012 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -3.316 20.680 -4.838 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -2.377 20.003 -2.038 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -1.787 19.054 -3.388 1.00 0.00 H new