USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 903 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 94 ASN : amide:sc= -0.31 K(o=-0.097,f=-1.9!) USER MOD Set 1.2: A 113 SER OG : rot 160:sc= 0.213 USER MOD Single : A 14 HIS :FLIP no HE2:sc= -1.07 F(o=-1.8,f=-1.1) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.192 K(o=-0.19,f=-3.8!) USER MOD Single : A 21 SER OG : rot 170:sc= -0.206 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -2.7 K(o=-2.7,f=-11!) USER MOD Single : A 35 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00381) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 158:sc= -0.814 (180deg=-1.6!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl -171:sc= -2.3! (180deg=-2.72!) USER MOD Single : A 60 THR OG1 : rot -86:sc= 0.782 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 160:sc= -2.73 USER MOD Single : A 70 THR OG1 : rot 120:sc= -2.04 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 150:sc= -0.586 USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.995 USER MOD Single : A 83 HIS : no HD1:sc= -2.41! X(o=-2.4!,f=-2.7) USER MOD Single : A 99 GLN : amide:sc= -0.0207 K(o=-0.021,f=-1.1) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.149 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -0.136 K(o=-0.14,f=-2.1!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= -0.0147 X(o=-0.015,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -11:sc= 0.775 USER MOD ----------------------------------------------------------------- ATOM 156 N HIS A 14 -14.810 1.280 -16.076 1.00 0.00 N ATOM 157 CA HIS A 14 -13.401 0.925 -16.054 1.00 0.00 C ATOM 158 C HIS A 14 -12.827 1.186 -14.660 1.00 0.00 C ATOM 159 O HIS A 14 -12.769 2.331 -14.214 1.00 0.00 O ATOM 160 CB HIS A 14 -12.638 1.661 -17.157 1.00 0.00 C ATOM 161 CG HIS A 14 -12.783 3.163 -17.107 1.00 0.00 C ATOM 162 ND1 HIS A 14 -13.590 3.956 -16.344 1.00 0.00 N flip ATOM 163 CD2 HIS A 14 -12.042 4.015 -17.907 1.00 0.00 C flip ATOM 164 CE1 HIS A 14 -13.354 5.223 -16.661 1.00 0.00 C flip ATOM 165 NE2 HIS A 14 -12.395 5.262 -17.630 1.00 0.00 N flip ATOM 0 HA HIS A 14 -13.287 -0.139 -16.262 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -11.581 1.406 -17.086 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -12.987 1.305 -18.126 1.00 0.00 H new ATOM 0 HD1 HIS A 14 -14.261 3.630 -15.648 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -11.302 3.715 -18.634 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -13.841 6.082 -16.224 1.00 0.00 H new ATOM 173 N PRO A 15 -12.406 0.077 -13.995 1.00 0.00 N ATOM 174 CA PRO A 15 -11.839 0.176 -12.661 1.00 0.00 C ATOM 175 C PRO A 15 -10.413 0.729 -12.711 1.00 0.00 C ATOM 176 O PRO A 15 -10.013 1.501 -11.841 1.00 0.00 O ATOM 177 CB PRO A 15 -11.909 -1.235 -12.099 1.00 0.00 C ATOM 178 CG PRO A 15 -12.080 -2.153 -13.298 1.00 0.00 C ATOM 179 CD PRO A 15 -12.459 -1.294 -14.493 1.00 0.00 C ATOM 0 HA PRO A 15 -12.383 0.873 -12.023 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -11.003 -1.480 -11.545 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -12.744 -1.338 -11.406 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -11.157 -2.697 -13.497 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -12.853 -2.897 -13.102 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -11.767 -1.441 -15.322 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -13.454 -1.544 -14.861 1.00 0.00 H new ATOM 187 N VAL A 16 -9.687 0.313 -13.737 1.00 0.00 N ATOM 188 CA VAL A 16 -8.314 0.758 -13.912 1.00 0.00 C ATOM 189 C VAL A 16 -8.262 1.813 -15.018 1.00 0.00 C ATOM 190 O VAL A 16 -9.066 1.783 -15.949 1.00 0.00 O ATOM 191 CB VAL A 16 -7.407 -0.443 -14.187 1.00 0.00 C ATOM 192 CG1 VAL A 16 -7.836 -1.656 -13.360 1.00 0.00 C ATOM 193 CG2 VAL A 16 -7.379 -0.779 -15.680 1.00 0.00 C ATOM 0 H VAL A 16 -10.023 -0.328 -14.456 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.944 1.226 -13.000 1.00 0.00 H new ATOM 0 HB VAL A 16 -6.395 -0.174 -13.885 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.175 -2.495 -13.575 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -7.779 -1.412 -12.299 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -8.860 -1.927 -13.616 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -6.727 -1.636 -15.848 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.387 -1.018 -16.018 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.003 0.078 -16.239 1.00 0.00 H new ATOM 203 N THR A 17 -7.307 2.721 -14.881 1.00 0.00 N ATOM 204 CA THR A 17 -7.139 3.784 -15.857 1.00 0.00 C ATOM 205 C THR A 17 -5.679 4.240 -15.903 1.00 0.00 C ATOM 206 O THR A 17 -5.111 4.621 -14.881 1.00 0.00 O ATOM 207 CB THR A 17 -8.115 4.908 -15.505 1.00 0.00 C ATOM 208 OG1 THR A 17 -8.292 4.786 -14.096 1.00 0.00 O ATOM 209 CG2 THR A 17 -9.514 4.670 -16.078 1.00 0.00 C ATOM 0 H THR A 17 -6.641 2.742 -14.108 1.00 0.00 H new ATOM 0 HA THR A 17 -7.370 3.436 -16.864 1.00 0.00 H new ATOM 0 HB THR A 17 -7.726 5.856 -15.878 1.00 0.00 H new ATOM 0 HG1 THR A 17 -8.910 5.479 -13.783 1.00 0.00 H new ATOM 0 HG21 THR A 17 -10.167 5.497 -15.799 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.456 4.604 -17.164 1.00 0.00 H new ATOM 0 HG23 THR A 17 -9.917 3.739 -15.679 1.00 0.00 H new ATOM 217 N TRP A 18 -5.113 4.185 -17.100 1.00 0.00 N ATOM 218 CA TRP A 18 -3.730 4.587 -17.293 1.00 0.00 C ATOM 219 C TRP A 18 -3.724 5.896 -18.086 1.00 0.00 C ATOM 220 O TRP A 18 -4.028 5.904 -19.278 1.00 0.00 O ATOM 221 CB TRP A 18 -2.925 3.475 -17.968 1.00 0.00 C ATOM 222 CG TRP A 18 -2.669 2.261 -17.073 1.00 0.00 C ATOM 223 CD1 TRP A 18 -3.452 1.188 -16.895 1.00 0.00 C ATOM 224 CD2 TRP A 18 -1.514 2.037 -16.237 1.00 0.00 C ATOM 225 NE1 TRP A 18 -2.889 0.293 -16.008 1.00 0.00 N ATOM 226 CE2 TRP A 18 -1.673 0.826 -15.595 1.00 0.00 C ATOM 227 CE3 TRP A 18 -0.373 2.832 -16.029 1.00 0.00 C ATOM 228 CZ2 TRP A 18 -0.730 0.301 -14.703 1.00 0.00 C ATOM 229 CZ3 TRP A 18 0.560 2.294 -15.135 1.00 0.00 C ATOM 230 CH2 TRP A 18 0.415 1.076 -14.481 1.00 0.00 C ATOM 0 H TRP A 18 -5.587 3.868 -17.946 1.00 0.00 H new ATOM 0 HA TRP A 18 -3.241 4.759 -16.334 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -3.455 3.149 -18.863 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -1.968 3.881 -18.295 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.404 1.042 -17.384 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.291 -0.596 -15.710 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -0.228 3.783 -16.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -0.878 -0.650 -14.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 1.455 2.865 -14.940 1.00 0.00 H new ATOM 0 HH2 TRP A 18 1.182 0.729 -13.805 1.00 0.00 H new ATOM 241 N GLN A 19 -3.376 6.969 -17.392 1.00 0.00 N ATOM 242 CA GLN A 19 -3.327 8.280 -18.017 1.00 0.00 C ATOM 243 C GLN A 19 -2.068 9.031 -17.578 1.00 0.00 C ATOM 244 O GLN A 19 -1.576 8.831 -16.468 1.00 0.00 O ATOM 245 CB GLN A 19 -4.586 9.088 -17.697 1.00 0.00 C ATOM 246 CG GLN A 19 -5.827 8.432 -18.305 1.00 0.00 C ATOM 247 CD GLN A 19 -6.012 8.857 -19.764 1.00 0.00 C ATOM 248 OE1 GLN A 19 -5.071 8.951 -20.534 1.00 0.00 O ATOM 249 NE2 GLN A 19 -7.275 9.106 -20.098 1.00 0.00 N ATOM 0 H GLN A 19 -3.125 6.958 -16.403 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.287 8.144 -19.098 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -4.706 9.169 -16.617 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -4.480 10.102 -18.083 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -5.735 7.347 -18.247 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.709 8.708 -17.727 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -8.015 9.008 -19.403 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.503 9.395 -21.049 1.00 0.00 H new ATOM 258 N PRO A 20 -1.568 9.901 -18.496 1.00 0.00 N ATOM 259 CA PRO A 20 -0.376 10.683 -18.215 1.00 0.00 C ATOM 260 C PRO A 20 -0.685 11.826 -17.247 1.00 0.00 C ATOM 261 O PRO A 20 -1.834 12.250 -17.128 1.00 0.00 O ATOM 262 CB PRO A 20 0.106 11.167 -19.572 1.00 0.00 C ATOM 263 CG PRO A 20 -1.083 11.032 -20.509 1.00 0.00 C ATOM 264 CD PRO A 20 -2.123 10.164 -19.820 1.00 0.00 C ATOM 0 HA PRO A 20 0.400 10.102 -17.716 1.00 0.00 H new ATOM 0 HB2 PRO A 20 0.446 12.201 -19.519 1.00 0.00 H new ATOM 0 HB3 PRO A 20 0.949 10.571 -19.922 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -1.498 12.012 -20.743 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -0.776 10.583 -21.453 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -3.083 10.675 -19.752 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -2.293 9.238 -20.369 1.00 0.00 H new ATOM 272 N SER A 21 0.360 12.293 -16.580 1.00 0.00 N ATOM 273 CA SER A 21 0.214 13.380 -15.626 1.00 0.00 C ATOM 274 C SER A 21 -0.027 14.697 -16.366 1.00 0.00 C ATOM 275 O SER A 21 -0.126 14.715 -17.592 1.00 0.00 O ATOM 276 CB SER A 21 1.447 13.494 -14.728 1.00 0.00 C ATOM 277 OG SER A 21 2.566 14.036 -15.423 1.00 0.00 O ATOM 0 H SER A 21 1.311 11.939 -16.681 1.00 0.00 H new ATOM 0 HA SER A 21 -0.646 13.165 -14.991 1.00 0.00 H new ATOM 0 HB2 SER A 21 1.213 14.124 -13.870 1.00 0.00 H new ATOM 0 HB3 SER A 21 1.704 12.509 -14.339 1.00 0.00 H new ATOM 0 HG SER A 21 3.279 14.243 -14.784 1.00 0.00 H new ATOM 283 N LYS A 22 -0.114 15.768 -15.590 1.00 0.00 N ATOM 284 CA LYS A 22 -0.342 17.086 -16.156 1.00 0.00 C ATOM 285 C LYS A 22 0.657 17.328 -17.290 1.00 0.00 C ATOM 286 O LYS A 22 0.265 17.678 -18.403 1.00 0.00 O ATOM 287 CB LYS A 22 -0.300 18.154 -15.062 1.00 0.00 C ATOM 288 CG LYS A 22 -1.707 18.654 -14.730 1.00 0.00 C ATOM 289 CD LYS A 22 -1.917 18.736 -13.216 1.00 0.00 C ATOM 290 CE LYS A 22 -3.406 18.698 -12.867 1.00 0.00 C ATOM 291 NZ LYS A 22 -3.605 18.941 -11.420 1.00 0.00 N ATOM 0 H LYS A 22 -0.031 15.749 -14.574 1.00 0.00 H new ATOM 0 HA LYS A 22 -1.340 17.147 -16.590 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.165 17.743 -14.166 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.319 18.990 -15.388 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.862 19.636 -15.176 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -2.447 17.984 -15.168 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.404 17.907 -12.729 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.473 19.655 -12.833 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.941 19.452 -13.445 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -3.825 17.730 -13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -4.621 18.912 -11.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -3.111 18.207 -10.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -3.223 19.875 -11.169 1.00 0.00 H new ATOM 305 N ASP A 23 1.927 17.133 -16.969 1.00 0.00 N ATOM 306 CA ASP A 23 2.984 17.325 -17.947 1.00 0.00 C ATOM 307 C ASP A 23 2.779 16.355 -19.112 1.00 0.00 C ATOM 308 O ASP A 23 2.375 16.762 -20.200 1.00 0.00 O ATOM 309 CB ASP A 23 4.358 17.046 -17.335 1.00 0.00 C ATOM 310 CG ASP A 23 5.301 18.250 -17.285 1.00 0.00 C ATOM 311 OD1 ASP A 23 5.032 19.147 -16.457 1.00 0.00 O ATOM 312 OD2 ASP A 23 6.270 18.246 -18.075 1.00 0.00 O ATOM 0 H ASP A 23 2.248 16.844 -16.045 1.00 0.00 H new ATOM 0 HA ASP A 23 2.944 18.360 -18.287 1.00 0.00 H new ATOM 0 HB2 ASP A 23 4.218 16.671 -16.321 1.00 0.00 H new ATOM 0 HB3 ASP A 23 4.838 16.251 -17.905 1.00 0.00 H new ATOM 317 N GLY A 24 3.067 15.090 -18.844 1.00 0.00 N ATOM 318 CA GLY A 24 2.919 14.058 -19.856 1.00 0.00 C ATOM 319 C GLY A 24 4.107 13.094 -19.835 1.00 0.00 C ATOM 320 O GLY A 24 3.955 11.908 -20.121 1.00 0.00 O ATOM 0 H GLY A 24 3.402 14.756 -17.940 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.995 13.506 -19.685 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.837 14.518 -20.841 1.00 0.00 H new ATOM 324 N ASP A 25 5.265 13.641 -19.492 1.00 0.00 N ATOM 325 CA ASP A 25 6.479 12.845 -19.430 1.00 0.00 C ATOM 326 C ASP A 25 6.276 11.689 -18.447 1.00 0.00 C ATOM 327 O ASP A 25 6.978 10.682 -18.515 1.00 0.00 O ATOM 328 CB ASP A 25 7.662 13.681 -18.938 1.00 0.00 C ATOM 329 CG ASP A 25 7.761 15.081 -19.547 1.00 0.00 C ATOM 330 OD1 ASP A 25 7.091 15.300 -20.580 1.00 0.00 O ATOM 331 OD2 ASP A 25 8.504 15.901 -18.967 1.00 0.00 O ATOM 0 H ASP A 25 5.388 14.625 -19.254 1.00 0.00 H new ATOM 0 HA ASP A 25 6.691 12.476 -20.433 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.595 13.776 -17.854 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.584 13.141 -19.154 1.00 0.00 H new ATOM 336 N ARG A 26 5.313 11.875 -17.556 1.00 0.00 N ATOM 337 CA ARG A 26 5.009 10.861 -16.561 1.00 0.00 C ATOM 338 C ARG A 26 3.700 10.150 -16.910 1.00 0.00 C ATOM 339 O ARG A 26 2.873 10.690 -17.644 1.00 0.00 O ATOM 340 CB ARG A 26 4.891 11.477 -15.166 1.00 0.00 C ATOM 341 CG ARG A 26 6.271 11.676 -14.536 1.00 0.00 C ATOM 342 CD ARG A 26 6.810 10.361 -13.969 1.00 0.00 C ATOM 343 NE ARG A 26 8.259 10.246 -14.246 1.00 0.00 N ATOM 344 CZ ARG A 26 9.215 10.808 -13.494 1.00 0.00 C ATOM 345 NH1 ARG A 26 8.881 11.528 -12.414 1.00 0.00 N ATOM 346 NH2 ARG A 26 10.505 10.651 -13.822 1.00 0.00 N ATOM 0 H ARG A 26 4.733 12.713 -17.503 1.00 0.00 H new ATOM 0 HA ARG A 26 5.828 10.141 -16.560 1.00 0.00 H new ATOM 0 HB2 ARG A 26 4.375 12.435 -15.230 1.00 0.00 H new ATOM 0 HB3 ARG A 26 4.286 10.831 -14.529 1.00 0.00 H new ATOM 0 HG2 ARG A 26 6.963 12.065 -15.283 1.00 0.00 H new ATOM 0 HG3 ARG A 26 6.208 12.420 -13.742 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.632 10.319 -12.894 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.279 9.519 -14.413 1.00 0.00 H new ATOM 0 HE ARG A 26 8.548 9.705 -15.061 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.899 11.648 -12.165 1.00 0.00 H new ATOM 0 HH12 ARG A 26 9.609 11.956 -11.841 1.00 0.00 H new ATOM 0 HH21 ARG A 26 10.759 10.104 -14.644 1.00 0.00 H new ATOM 0 HH22 ARG A 26 11.233 11.079 -13.249 1.00 0.00 H new ATOM 360 N LEU A 27 3.552 8.951 -16.367 1.00 0.00 N ATOM 361 CA LEU A 27 2.357 8.161 -16.612 1.00 0.00 C ATOM 362 C LEU A 27 1.711 7.794 -15.274 1.00 0.00 C ATOM 363 O LEU A 27 2.376 7.272 -14.381 1.00 0.00 O ATOM 364 CB LEU A 27 2.685 6.951 -17.488 1.00 0.00 C ATOM 365 CG LEU A 27 1.688 6.643 -18.608 1.00 0.00 C ATOM 366 CD1 LEU A 27 0.305 7.210 -18.281 1.00 0.00 C ATOM 367 CD2 LEU A 27 2.208 7.143 -19.957 1.00 0.00 C ATOM 0 H LEU A 27 4.240 8.507 -15.758 1.00 0.00 H new ATOM 0 HA LEU A 27 1.624 8.742 -17.172 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.667 7.107 -17.935 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.763 6.073 -16.846 1.00 0.00 H new ATOM 0 HG LEU A 27 1.583 5.561 -18.685 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.385 6.978 -19.092 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.061 6.766 -17.355 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.374 8.291 -18.162 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.481 6.912 -20.736 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.360 8.221 -19.911 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.154 6.653 -20.187 1.00 0.00 H new ATOM 379 N ILE A 28 0.421 8.082 -15.178 1.00 0.00 N ATOM 380 CA ILE A 28 -0.323 7.789 -13.965 1.00 0.00 C ATOM 381 C ILE A 28 -1.240 6.590 -14.211 1.00 0.00 C ATOM 382 O ILE A 28 -2.194 6.682 -14.982 1.00 0.00 O ATOM 383 CB ILE A 28 -1.060 9.037 -13.474 1.00 0.00 C ATOM 384 CG1 ILE A 28 -0.118 10.241 -13.414 1.00 0.00 C ATOM 385 CG2 ILE A 28 -1.744 8.776 -12.131 1.00 0.00 C ATOM 386 CD1 ILE A 28 1.188 9.881 -12.704 1.00 0.00 C ATOM 0 H ILE A 28 -0.128 8.515 -15.921 1.00 0.00 H new ATOM 0 HA ILE A 28 0.356 7.511 -13.159 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.844 9.277 -14.193 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.097 10.589 -14.424 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.606 11.063 -12.890 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.261 9.679 -11.804 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.464 7.965 -12.241 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -0.995 8.498 -11.389 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.839 10.755 -12.675 1.00 0.00 H new ATOM 0 HD12 ILE A 28 0.971 9.556 -11.686 1.00 0.00 H new ATOM 0 HD13 ILE A 28 1.685 9.075 -13.244 1.00 0.00 H new ATOM 398 N GLY A 29 -0.920 5.492 -13.542 1.00 0.00 N ATOM 399 CA GLY A 29 -1.703 4.276 -13.679 1.00 0.00 C ATOM 400 C GLY A 29 -2.578 4.046 -12.444 1.00 0.00 C ATOM 401 O GLY A 29 -2.108 4.173 -11.314 1.00 0.00 O ATOM 0 H GLY A 29 -0.128 5.419 -12.903 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.331 4.342 -14.567 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.038 3.425 -13.822 1.00 0.00 H new ATOM 405 N ARG A 30 -3.833 3.711 -12.702 1.00 0.00 N ATOM 406 CA ARG A 30 -4.778 3.462 -11.626 1.00 0.00 C ATOM 407 C ARG A 30 -5.344 2.045 -11.735 1.00 0.00 C ATOM 408 O ARG A 30 -5.800 1.635 -12.801 1.00 0.00 O ATOM 409 CB ARG A 30 -5.930 4.468 -11.660 1.00 0.00 C ATOM 410 CG ARG A 30 -5.928 5.346 -10.407 1.00 0.00 C ATOM 411 CD ARG A 30 -5.483 6.773 -10.737 1.00 0.00 C ATOM 412 NE ARG A 30 -6.089 7.726 -9.782 1.00 0.00 N ATOM 413 CZ ARG A 30 -6.085 9.056 -9.943 1.00 0.00 C ATOM 414 NH1 ARG A 30 -5.505 9.599 -11.022 1.00 0.00 N ATOM 415 NH2 ARG A 30 -6.659 9.844 -9.024 1.00 0.00 N ATOM 0 H ARG A 30 -4.218 3.606 -13.641 1.00 0.00 H new ATOM 0 HA ARG A 30 -4.243 3.572 -10.683 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -5.844 5.095 -12.548 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -6.879 3.937 -11.735 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -6.926 5.365 -9.970 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -5.261 4.917 -9.659 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.396 6.843 -10.693 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -5.778 7.028 -11.755 1.00 0.00 H new ATOM 0 HE ARG A 30 -6.538 7.347 -8.948 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -5.066 9.000 -11.721 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.502 10.612 -11.144 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -7.099 9.431 -8.202 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -6.656 10.857 -9.147 1.00 0.00 H new ATOM 429 N ILE A 31 -5.296 1.336 -10.617 1.00 0.00 N ATOM 430 CA ILE A 31 -5.799 -0.027 -10.573 1.00 0.00 C ATOM 431 C ILE A 31 -6.805 -0.158 -9.427 1.00 0.00 C ATOM 432 O ILE A 31 -6.441 -0.031 -8.259 1.00 0.00 O ATOM 433 CB ILE A 31 -4.640 -1.023 -10.491 1.00 0.00 C ATOM 434 CG1 ILE A 31 -3.917 -1.135 -11.835 1.00 0.00 C ATOM 435 CG2 ILE A 31 -5.122 -2.384 -9.985 1.00 0.00 C ATOM 436 CD1 ILE A 31 -2.736 -0.164 -11.904 1.00 0.00 C ATOM 0 H ILE A 31 -4.917 1.679 -9.735 1.00 0.00 H new ATOM 0 HA ILE A 31 -6.331 -0.267 -11.494 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.917 -0.647 -9.767 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.562 -2.156 -11.977 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.614 -0.924 -12.646 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.279 -3.073 -9.936 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.556 -2.270 -8.992 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -5.875 -2.780 -10.666 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.239 -0.263 -12.869 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.097 0.857 -11.785 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -2.029 -0.394 -11.107 1.00 0.00 H new ATOM 448 N LEU A 32 -8.050 -0.411 -9.802 1.00 0.00 N ATOM 449 CA LEU A 32 -9.111 -0.561 -8.821 1.00 0.00 C ATOM 450 C LEU A 32 -9.579 -2.017 -8.801 1.00 0.00 C ATOM 451 O LEU A 32 -9.724 -2.641 -9.851 1.00 0.00 O ATOM 452 CB LEU A 32 -10.235 0.442 -9.090 1.00 0.00 C ATOM 453 CG LEU A 32 -11.423 0.392 -8.127 1.00 0.00 C ATOM 454 CD1 LEU A 32 -12.355 -0.773 -8.467 1.00 0.00 C ATOM 455 CD2 LEU A 32 -10.949 0.341 -6.673 1.00 0.00 C ATOM 0 H LEU A 32 -8.348 -0.516 -10.772 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.741 -0.331 -7.822 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -9.813 1.447 -9.063 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -10.606 0.279 -10.102 1.00 0.00 H new ATOM 0 HG LEU A 32 -11.998 1.310 -8.246 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -13.191 -0.786 -7.768 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -12.733 -0.652 -9.482 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.806 -1.712 -8.394 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.813 0.306 -6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.338 -0.549 -6.520 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.357 1.229 -6.452 1.00 0.00 H new ATOM 467 N LEU A 33 -9.803 -2.517 -7.594 1.00 0.00 N ATOM 468 CA LEU A 33 -10.251 -3.888 -7.423 1.00 0.00 C ATOM 469 C LEU A 33 -11.600 -3.893 -6.701 1.00 0.00 C ATOM 470 O LEU A 33 -11.852 -3.048 -5.844 1.00 0.00 O ATOM 471 CB LEU A 33 -9.175 -4.720 -6.722 1.00 0.00 C ATOM 472 CG LEU A 33 -7.818 -4.791 -7.424 1.00 0.00 C ATOM 473 CD1 LEU A 33 -7.990 -4.910 -8.939 1.00 0.00 C ATOM 474 CD2 LEU A 33 -6.939 -3.599 -7.039 1.00 0.00 C ATOM 0 H LEU A 33 -9.682 -1.996 -6.725 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.406 -4.362 -8.392 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.024 -4.313 -5.722 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -9.552 -5.735 -6.599 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.305 -5.692 -7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -7.010 -4.959 -9.414 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -8.551 -5.815 -9.171 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.532 -4.041 -9.313 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.980 -3.674 -7.552 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -7.435 -2.673 -7.329 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.775 -3.601 -5.961 1.00 0.00 H new ATOM 486 N ASN A 34 -12.431 -4.855 -7.074 1.00 0.00 N ATOM 487 CA ASN A 34 -13.748 -4.981 -6.473 1.00 0.00 C ATOM 488 C ASN A 34 -13.984 -6.438 -6.073 1.00 0.00 C ATOM 489 O ASN A 34 -13.752 -7.349 -6.867 1.00 0.00 O ATOM 490 CB ASN A 34 -14.845 -4.578 -7.461 1.00 0.00 C ATOM 491 CG ASN A 34 -16.181 -4.376 -6.743 1.00 0.00 C ATOM 492 OD1 ASN A 34 -16.633 -5.206 -5.972 1.00 0.00 O ATOM 493 ND2 ASN A 34 -16.787 -3.229 -7.040 1.00 0.00 N ATOM 0 H ASN A 34 -12.218 -5.555 -7.785 1.00 0.00 H new ATOM 0 HA ASN A 34 -13.786 -4.324 -5.604 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -14.560 -3.658 -7.972 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -14.952 -5.347 -8.226 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -17.685 -3.001 -6.613 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -16.353 -2.578 -7.694 1.00 0.00 H new ATOM 500 N LYS A 35 -14.443 -6.614 -4.843 1.00 0.00 N ATOM 501 CA LYS A 35 -14.713 -7.946 -4.328 1.00 0.00 C ATOM 502 C LYS A 35 -16.222 -8.122 -4.148 1.00 0.00 C ATOM 503 O LYS A 35 -16.739 -9.233 -4.260 1.00 0.00 O ATOM 504 CB LYS A 35 -13.908 -8.201 -3.052 1.00 0.00 C ATOM 505 CG LYS A 35 -12.474 -7.686 -3.196 1.00 0.00 C ATOM 506 CD LYS A 35 -12.149 -6.657 -2.112 1.00 0.00 C ATOM 507 CE LYS A 35 -11.397 -7.306 -0.948 1.00 0.00 C ATOM 508 NZ LYS A 35 -12.311 -8.151 -0.147 1.00 0.00 N ATOM 0 H LYS A 35 -14.635 -5.856 -4.188 1.00 0.00 H new ATOM 0 HA LYS A 35 -14.386 -8.703 -5.040 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -14.392 -7.709 -2.208 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -13.894 -9.269 -2.834 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -11.776 -8.521 -3.131 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -12.342 -7.236 -4.180 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -11.546 -5.854 -2.537 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -13.071 -6.204 -1.747 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -10.575 -7.911 -1.331 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -10.958 -6.534 -0.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -11.793 -8.557 0.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -13.100 -7.572 0.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -12.684 -8.919 -0.741 1.00 0.00 H new ATOM 522 N ARG A 36 -16.887 -7.010 -3.872 1.00 0.00 N ATOM 523 CA ARG A 36 -18.326 -7.027 -3.675 1.00 0.00 C ATOM 524 C ARG A 36 -18.986 -7.987 -4.668 1.00 0.00 C ATOM 525 O ARG A 36 -19.076 -7.689 -5.858 1.00 0.00 O ATOM 526 CB ARG A 36 -18.924 -5.630 -3.854 1.00 0.00 C ATOM 527 CG ARG A 36 -18.914 -4.857 -2.533 1.00 0.00 C ATOM 528 CD ARG A 36 -19.165 -3.366 -2.769 1.00 0.00 C ATOM 529 NE ARG A 36 -18.100 -2.804 -3.630 1.00 0.00 N ATOM 530 CZ ARG A 36 -18.215 -1.658 -4.315 1.00 0.00 C ATOM 531 NH1 ARG A 36 -19.348 -0.945 -4.244 1.00 0.00 N ATOM 532 NH2 ARG A 36 -17.197 -1.224 -5.071 1.00 0.00 N ATOM 0 H ARG A 36 -16.455 -6.091 -3.780 1.00 0.00 H new ATOM 0 HA ARG A 36 -18.517 -7.363 -2.656 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -18.356 -5.081 -4.605 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -19.946 -5.712 -4.224 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -19.679 -5.257 -1.867 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -17.954 -4.994 -2.035 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -20.138 -3.222 -3.239 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -19.190 -2.838 -1.816 1.00 0.00 H new ATOM 0 HE ARG A 36 -17.224 -3.321 -3.707 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -20.123 -1.275 -3.668 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -19.435 -0.073 -4.766 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -16.335 -1.766 -5.125 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -17.285 -0.352 -5.592 1.00 0.00 H new ATOM 546 N LEU A 37 -19.430 -9.119 -4.142 1.00 0.00 N ATOM 547 CA LEU A 37 -20.079 -10.124 -4.967 1.00 0.00 C ATOM 548 C LEU A 37 -21.348 -9.531 -5.581 1.00 0.00 C ATOM 549 O LEU A 37 -21.578 -8.326 -5.499 1.00 0.00 O ATOM 550 CB LEU A 37 -20.323 -11.402 -4.162 1.00 0.00 C ATOM 551 CG LEU A 37 -19.087 -12.042 -3.528 1.00 0.00 C ATOM 552 CD1 LEU A 37 -19.445 -12.751 -2.221 1.00 0.00 C ATOM 553 CD2 LEU A 37 -18.389 -12.980 -4.516 1.00 0.00 C ATOM 0 H LEU A 37 -19.353 -9.363 -3.155 1.00 0.00 H new ATOM 0 HA LEU A 37 -19.431 -10.415 -5.794 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -21.038 -11.178 -3.370 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -20.792 -12.136 -4.817 1.00 0.00 H new ATOM 0 HG LEU A 37 -18.381 -11.249 -3.281 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -18.548 -13.197 -1.792 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -19.864 -12.030 -1.519 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -20.179 -13.532 -2.420 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -17.513 -13.422 -4.041 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -19.077 -13.770 -4.816 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -18.079 -12.416 -5.396 1.00 0.00 H new ATOM 565 N LYS A 38 -22.140 -10.407 -6.183 1.00 0.00 N ATOM 566 CA LYS A 38 -23.381 -9.985 -6.811 1.00 0.00 C ATOM 567 C LYS A 38 -24.258 -9.279 -5.774 1.00 0.00 C ATOM 568 O LYS A 38 -24.907 -8.280 -6.082 1.00 0.00 O ATOM 569 CB LYS A 38 -24.067 -11.171 -7.491 1.00 0.00 C ATOM 570 CG LYS A 38 -24.524 -10.804 -8.904 1.00 0.00 C ATOM 571 CD LYS A 38 -25.293 -11.959 -9.550 1.00 0.00 C ATOM 572 CE LYS A 38 -25.520 -11.701 -11.040 1.00 0.00 C ATOM 573 NZ LYS A 38 -25.925 -12.948 -11.727 1.00 0.00 N ATOM 0 H LYS A 38 -21.947 -11.406 -6.249 1.00 0.00 H new ATOM 0 HA LYS A 38 -23.181 -9.264 -7.604 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -23.380 -12.016 -7.535 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -24.925 -11.488 -6.898 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -25.157 -9.917 -8.866 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -23.658 -10.552 -9.516 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -24.739 -12.888 -9.419 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -26.253 -12.087 -9.049 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -26.290 -10.941 -11.170 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -24.607 -11.311 -11.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -26.075 -12.755 -12.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -25.177 -13.663 -11.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -26.808 -13.304 -11.308 1.00 0.00 H new ATOM 587 N ASP A 39 -24.249 -9.826 -4.568 1.00 0.00 N ATOM 588 CA ASP A 39 -25.035 -9.261 -3.484 1.00 0.00 C ATOM 589 C ASP A 39 -24.422 -7.925 -3.058 1.00 0.00 C ATOM 590 O ASP A 39 -25.142 -6.994 -2.699 1.00 0.00 O ATOM 591 CB ASP A 39 -25.042 -10.188 -2.267 1.00 0.00 C ATOM 592 CG ASP A 39 -26.369 -10.904 -2.007 1.00 0.00 C ATOM 593 OD1 ASP A 39 -26.937 -11.421 -2.993 1.00 0.00 O ATOM 594 OD2 ASP A 39 -26.785 -10.917 -0.829 1.00 0.00 O ATOM 0 H ASP A 39 -23.710 -10.655 -4.317 1.00 0.00 H new ATOM 0 HA ASP A 39 -26.056 -9.128 -3.841 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -24.261 -10.938 -2.396 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -24.782 -9.605 -1.384 1.00 0.00 H new ATOM 599 N GLY A 40 -23.099 -7.874 -3.111 1.00 0.00 N ATOM 600 CA GLY A 40 -22.382 -6.668 -2.734 1.00 0.00 C ATOM 601 C GLY A 40 -22.133 -6.626 -1.225 1.00 0.00 C ATOM 602 O GLY A 40 -22.462 -5.642 -0.565 1.00 0.00 O ATOM 0 H GLY A 40 -22.505 -8.648 -3.409 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -21.431 -6.626 -3.264 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -22.955 -5.791 -3.036 1.00 0.00 H new ATOM 606 N SER A 41 -21.554 -7.707 -0.723 1.00 0.00 N ATOM 607 CA SER A 41 -21.258 -7.806 0.696 1.00 0.00 C ATOM 608 C SER A 41 -19.832 -8.324 0.898 1.00 0.00 C ATOM 609 O SER A 41 -19.431 -8.626 2.021 1.00 0.00 O ATOM 610 CB SER A 41 -22.260 -8.719 1.405 1.00 0.00 C ATOM 611 OG SER A 41 -22.514 -8.296 2.742 1.00 0.00 O ATOM 0 H SER A 41 -21.282 -8.522 -1.273 1.00 0.00 H new ATOM 0 HA SER A 41 -21.342 -6.811 1.133 1.00 0.00 H new ATOM 0 HB2 SER A 41 -23.195 -8.734 0.846 1.00 0.00 H new ATOM 0 HB3 SER A 41 -21.877 -9.740 1.414 1.00 0.00 H new ATOM 0 HG SER A 41 -23.160 -8.903 3.160 1.00 0.00 H new ATOM 617 N VAL A 42 -19.106 -8.411 -0.207 1.00 0.00 N ATOM 618 CA VAL A 42 -17.734 -8.887 -0.166 1.00 0.00 C ATOM 619 C VAL A 42 -17.714 -10.325 0.356 1.00 0.00 C ATOM 620 O VAL A 42 -18.383 -10.643 1.338 1.00 0.00 O ATOM 621 CB VAL A 42 -16.875 -7.935 0.670 1.00 0.00 C ATOM 622 CG1 VAL A 42 -15.642 -8.653 1.223 1.00 0.00 C ATOM 623 CG2 VAL A 42 -16.475 -6.702 -0.142 1.00 0.00 C ATOM 0 H VAL A 42 -19.442 -8.160 -1.137 1.00 0.00 H new ATOM 0 HA VAL A 42 -17.303 -8.898 -1.167 1.00 0.00 H new ATOM 0 HB VAL A 42 -17.474 -7.598 1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.049 -7.955 1.813 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -15.957 -9.484 1.854 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -15.041 -9.032 0.397 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -15.865 -6.042 0.475 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -15.903 -7.012 -1.016 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -17.371 -6.172 -0.464 1.00 0.00 H new ATOM 633 N PRO A 43 -16.917 -11.178 -0.342 1.00 0.00 N ATOM 634 CA PRO A 43 -16.801 -12.575 0.040 1.00 0.00 C ATOM 635 C PRO A 43 -15.931 -12.731 1.290 1.00 0.00 C ATOM 636 O PRO A 43 -15.289 -11.777 1.726 1.00 0.00 O ATOM 637 CB PRO A 43 -16.218 -13.270 -1.180 1.00 0.00 C ATOM 638 CG PRO A 43 -15.598 -12.171 -2.028 1.00 0.00 C ATOM 639 CD PRO A 43 -16.110 -10.837 -1.510 1.00 0.00 C ATOM 0 HA PRO A 43 -17.759 -13.017 0.313 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.470 -14.008 -0.889 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -16.992 -13.801 -1.734 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.510 -12.211 -1.969 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -15.865 -12.301 -3.077 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -15.287 -10.174 -1.243 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.704 -10.321 -2.264 1.00 0.00 H new ATOM 647 N ARG A 44 -15.938 -13.941 1.829 1.00 0.00 N ATOM 648 CA ARG A 44 -15.158 -14.234 3.020 1.00 0.00 C ATOM 649 C ARG A 44 -13.809 -13.515 2.960 1.00 0.00 C ATOM 650 O ARG A 44 -13.401 -12.871 3.925 1.00 0.00 O ATOM 651 CB ARG A 44 -14.921 -15.738 3.166 1.00 0.00 C ATOM 652 CG ARG A 44 -15.598 -16.279 4.428 1.00 0.00 C ATOM 653 CD ARG A 44 -14.636 -16.262 5.617 1.00 0.00 C ATOM 654 NE ARG A 44 -15.118 -17.180 6.672 1.00 0.00 N ATOM 655 CZ ARG A 44 -14.500 -17.367 7.846 1.00 0.00 C ATOM 656 NH1 ARG A 44 -13.371 -16.700 8.122 1.00 0.00 N ATOM 657 NH2 ARG A 44 -15.011 -18.220 8.744 1.00 0.00 N ATOM 0 H ARG A 44 -16.471 -14.730 1.463 1.00 0.00 H new ATOM 0 HA ARG A 44 -15.723 -13.882 3.883 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.308 -16.258 2.290 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -13.851 -15.939 3.208 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -16.478 -15.678 4.659 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -15.945 -17.297 4.251 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -13.639 -16.559 5.293 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -14.553 -15.250 6.014 1.00 0.00 H new ATOM 0 HE ARG A 44 -15.975 -17.704 6.495 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -12.982 -16.050 7.438 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -12.900 -16.842 9.016 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -15.871 -18.727 8.534 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -14.540 -18.362 9.638 1.00 0.00 H new ATOM 671 N ASP A 45 -13.152 -13.651 1.817 1.00 0.00 N ATOM 672 CA ASP A 45 -11.857 -13.023 1.619 1.00 0.00 C ATOM 673 C ASP A 45 -11.386 -13.277 0.186 1.00 0.00 C ATOM 674 O ASP A 45 -10.561 -14.158 -0.054 1.00 0.00 O ATOM 675 CB ASP A 45 -10.811 -13.606 2.571 1.00 0.00 C ATOM 676 CG ASP A 45 -10.982 -15.093 2.887 1.00 0.00 C ATOM 677 OD1 ASP A 45 -10.755 -15.900 1.960 1.00 0.00 O ATOM 678 OD2 ASP A 45 -11.334 -15.389 4.049 1.00 0.00 O ATOM 0 H ASP A 45 -13.493 -14.187 1.019 1.00 0.00 H new ATOM 0 HA ASP A 45 -11.966 -11.956 1.813 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -9.822 -13.453 2.138 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -10.840 -13.046 3.506 1.00 0.00 H new ATOM 683 N SER A 46 -11.930 -12.490 -0.731 1.00 0.00 N ATOM 684 CA SER A 46 -11.576 -12.618 -2.134 1.00 0.00 C ATOM 685 C SER A 46 -10.059 -12.510 -2.302 1.00 0.00 C ATOM 686 O SER A 46 -9.440 -13.360 -2.941 1.00 0.00 O ATOM 687 CB SER A 46 -12.281 -11.556 -2.980 1.00 0.00 C ATOM 688 OG SER A 46 -12.989 -12.129 -4.075 1.00 0.00 O ATOM 0 H SER A 46 -12.614 -11.761 -0.529 1.00 0.00 H new ATOM 0 HA SER A 46 -11.905 -13.597 -2.482 1.00 0.00 H new ATOM 0 HB2 SER A 46 -12.975 -10.995 -2.353 1.00 0.00 H new ATOM 0 HB3 SER A 46 -11.545 -10.845 -3.356 1.00 0.00 H new ATOM 0 HG SER A 46 -13.427 -11.419 -4.589 1.00 0.00 H new ATOM 694 N GLY A 47 -9.504 -11.458 -1.719 1.00 0.00 N ATOM 695 CA GLY A 47 -8.071 -11.228 -1.796 1.00 0.00 C ATOM 696 C GLY A 47 -7.678 -9.957 -1.041 1.00 0.00 C ATOM 697 O GLY A 47 -7.646 -8.872 -1.619 1.00 0.00 O ATOM 0 H GLY A 47 -10.021 -10.755 -1.191 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.539 -12.083 -1.378 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.768 -11.143 -2.840 1.00 0.00 H new ATOM 701 N ALA A 48 -7.389 -10.134 0.240 1.00 0.00 N ATOM 702 CA ALA A 48 -7.000 -9.015 1.081 1.00 0.00 C ATOM 703 C ALA A 48 -5.838 -8.268 0.423 1.00 0.00 C ATOM 704 O ALA A 48 -5.890 -7.050 0.261 1.00 0.00 O ATOM 705 CB ALA A 48 -6.648 -9.525 2.480 1.00 0.00 C ATOM 0 H ALA A 48 -7.417 -11.036 0.716 1.00 0.00 H new ATOM 0 HA ALA A 48 -7.825 -8.311 1.189 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -6.356 -8.685 3.111 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.515 -10.021 2.915 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -5.821 -10.232 2.412 1.00 0.00 H new ATOM 711 N MET A 49 -4.816 -9.030 0.061 1.00 0.00 N ATOM 712 CA MET A 49 -3.643 -8.456 -0.576 1.00 0.00 C ATOM 713 C MET A 49 -3.876 -8.254 -2.074 1.00 0.00 C ATOM 714 O MET A 49 -2.947 -7.929 -2.812 1.00 0.00 O ATOM 715 CB MET A 49 -2.443 -9.382 -0.366 1.00 0.00 C ATOM 716 CG MET A 49 -1.355 -8.692 0.459 1.00 0.00 C ATOM 717 SD MET A 49 0.150 -8.573 -0.493 1.00 0.00 S ATOM 718 CE MET A 49 0.341 -6.799 -0.552 1.00 0.00 C ATOM 0 H MET A 49 -4.776 -10.040 0.197 1.00 0.00 H new ATOM 0 HA MET A 49 -3.447 -7.484 -0.124 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.766 -10.292 0.140 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.037 -9.681 -1.332 1.00 0.00 H new ATOM 0 HG2 MET A 49 -1.688 -7.697 0.755 1.00 0.00 H new ATOM 0 HG3 MET A 49 -1.172 -9.253 1.376 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.384 -6.552 -0.750 1.00 0.00 H new ATOM 0 HE2 MET A 49 -0.285 -6.392 -1.346 1.00 0.00 H new ATOM 0 HE3 MET A 49 0.041 -6.369 0.404 1.00 0.00 H new ATOM 728 N LEU A 50 -5.122 -8.455 -2.479 1.00 0.00 N ATOM 729 CA LEU A 50 -5.489 -8.299 -3.876 1.00 0.00 C ATOM 730 C LEU A 50 -4.862 -9.431 -4.693 1.00 0.00 C ATOM 731 O LEU A 50 -5.570 -10.191 -5.353 1.00 0.00 O ATOM 732 CB LEU A 50 -5.117 -6.902 -4.375 1.00 0.00 C ATOM 733 CG LEU A 50 -5.854 -5.735 -3.715 1.00 0.00 C ATOM 734 CD1 LEU A 50 -7.295 -5.641 -4.219 1.00 0.00 C ATOM 735 CD2 LEU A 50 -5.786 -5.837 -2.190 1.00 0.00 C ATOM 0 H LEU A 50 -5.890 -8.724 -1.864 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.569 -8.378 -3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.046 -6.759 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.300 -6.861 -5.449 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.353 -4.810 -3.999 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.796 -4.803 -3.734 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.294 -5.488 -5.298 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.823 -6.565 -3.985 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.317 -4.996 -1.745 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.248 -6.770 -1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.744 -5.818 -1.870 1.00 0.00 H new ATOM 747 N GLY A 51 -3.541 -9.508 -4.622 1.00 0.00 N ATOM 748 CA GLY A 51 -2.812 -10.534 -5.347 1.00 0.00 C ATOM 749 C GLY A 51 -1.372 -10.093 -5.622 1.00 0.00 C ATOM 750 O GLY A 51 -0.499 -10.926 -5.861 1.00 0.00 O ATOM 0 H GLY A 51 -2.957 -8.877 -4.074 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.809 -11.459 -4.771 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.317 -10.747 -6.289 1.00 0.00 H new ATOM 754 N LEU A 52 -1.170 -8.785 -5.578 1.00 0.00 N ATOM 755 CA LEU A 52 0.148 -8.223 -5.819 1.00 0.00 C ATOM 756 C LEU A 52 0.799 -7.868 -4.481 1.00 0.00 C ATOM 757 O LEU A 52 0.106 -7.611 -3.498 1.00 0.00 O ATOM 758 CB LEU A 52 0.059 -7.044 -6.791 1.00 0.00 C ATOM 759 CG LEU A 52 -0.004 -5.654 -6.155 1.00 0.00 C ATOM 760 CD1 LEU A 52 -1.199 -5.539 -5.206 1.00 0.00 C ATOM 761 CD2 LEU A 52 1.315 -5.308 -5.461 1.00 0.00 C ATOM 0 H LEU A 52 -1.897 -8.098 -5.379 1.00 0.00 H new ATOM 0 HA LEU A 52 0.792 -8.957 -6.303 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.923 -7.080 -7.454 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -0.826 -7.178 -7.413 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.152 -4.922 -6.949 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.221 -4.541 -4.767 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.122 -5.712 -5.760 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.107 -6.282 -4.414 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.243 -4.315 -5.017 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.518 -6.041 -4.680 1.00 0.00 H new ATOM 0 HD23 LEU A 52 2.125 -5.322 -6.191 1.00 0.00 H new ATOM 773 N LYS A 53 2.124 -7.866 -4.486 1.00 0.00 N ATOM 774 CA LYS A 53 2.877 -7.548 -3.285 1.00 0.00 C ATOM 775 C LYS A 53 3.507 -6.162 -3.435 1.00 0.00 C ATOM 776 O LYS A 53 3.800 -5.727 -4.548 1.00 0.00 O ATOM 777 CB LYS A 53 3.890 -8.653 -2.978 1.00 0.00 C ATOM 778 CG LYS A 53 4.045 -8.850 -1.469 1.00 0.00 C ATOM 779 CD LYS A 53 5.171 -7.975 -0.915 1.00 0.00 C ATOM 780 CE LYS A 53 6.115 -8.791 -0.029 1.00 0.00 C ATOM 781 NZ LYS A 53 5.457 -9.136 1.250 1.00 0.00 N ATOM 0 H LYS A 53 2.696 -8.080 -5.303 1.00 0.00 H new ATOM 0 HA LYS A 53 2.214 -7.506 -2.421 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.567 -9.586 -3.439 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.855 -8.399 -3.416 1.00 0.00 H new ATOM 0 HG2 LYS A 53 3.109 -8.604 -0.968 1.00 0.00 H new ATOM 0 HG3 LYS A 53 4.255 -9.898 -1.255 1.00 0.00 H new ATOM 0 HD2 LYS A 53 5.731 -7.533 -1.739 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.747 -7.152 -0.340 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.414 -9.702 -0.548 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.024 -8.222 0.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.112 -9.690 1.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.194 -8.264 1.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 4.603 -9.698 1.060 1.00 0.00 H new ATOM 795 N VAL A 54 3.695 -5.506 -2.299 1.00 0.00 N ATOM 796 CA VAL A 54 4.285 -4.178 -2.291 1.00 0.00 C ATOM 797 C VAL A 54 5.215 -4.045 -1.083 1.00 0.00 C ATOM 798 O VAL A 54 4.885 -4.498 0.012 1.00 0.00 O ATOM 799 CB VAL A 54 3.183 -3.116 -2.316 1.00 0.00 C ATOM 800 CG1 VAL A 54 3.771 -1.713 -2.156 1.00 0.00 C ATOM 801 CG2 VAL A 54 2.351 -3.220 -3.596 1.00 0.00 C ATOM 0 H VAL A 54 3.449 -5.869 -1.378 1.00 0.00 H new ATOM 0 HA VAL A 54 4.889 -4.023 -3.185 1.00 0.00 H new ATOM 0 HB VAL A 54 2.520 -3.300 -1.470 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.967 -0.977 -2.177 1.00 0.00 H new ATOM 0 HG12 VAL A 54 4.299 -1.646 -1.205 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.466 -1.515 -2.972 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.575 -2.454 -3.589 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.996 -3.074 -4.462 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.888 -4.205 -3.650 1.00 0.00 H new ATOM 811 N VAL A 55 6.359 -3.422 -1.324 1.00 0.00 N ATOM 812 CA VAL A 55 7.339 -3.224 -0.270 1.00 0.00 C ATOM 813 C VAL A 55 7.557 -1.725 -0.056 1.00 0.00 C ATOM 814 O VAL A 55 8.096 -1.042 -0.926 1.00 0.00 O ATOM 815 CB VAL A 55 8.630 -3.974 -0.608 1.00 0.00 C ATOM 816 CG1 VAL A 55 9.828 -3.357 0.118 1.00 0.00 C ATOM 817 CG2 VAL A 55 8.500 -5.463 -0.284 1.00 0.00 C ATOM 0 H VAL A 55 6.629 -3.048 -2.234 1.00 0.00 H new ATOM 0 HA VAL A 55 6.976 -3.637 0.671 1.00 0.00 H new ATOM 0 HB VAL A 55 8.802 -3.879 -1.680 1.00 0.00 H new ATOM 0 HG11 VAL A 55 10.733 -3.908 -0.139 1.00 0.00 H new ATOM 0 HG12 VAL A 55 9.939 -2.316 -0.184 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.666 -3.407 1.195 1.00 0.00 H new ATOM 0 HG21 VAL A 55 9.431 -5.972 -0.534 1.00 0.00 H new ATOM 0 HG22 VAL A 55 8.292 -5.587 0.779 1.00 0.00 H new ATOM 0 HG23 VAL A 55 7.684 -5.892 -0.866 1.00 0.00 H new ATOM 827 N GLY A 56 7.127 -1.257 1.106 1.00 0.00 N ATOM 828 CA GLY A 56 7.268 0.149 1.445 1.00 0.00 C ATOM 829 C GLY A 56 8.492 0.379 2.333 1.00 0.00 C ATOM 830 O GLY A 56 9.253 -0.549 2.600 1.00 0.00 O ATOM 0 H GLY A 56 6.681 -1.826 1.825 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.360 0.739 0.533 1.00 0.00 H new ATOM 0 HA3 GLY A 56 6.371 0.494 1.959 1.00 0.00 H new ATOM 834 N GLY A 57 8.644 1.622 2.766 1.00 0.00 N ATOM 835 CA GLY A 57 9.762 1.986 3.619 1.00 0.00 C ATOM 836 C GLY A 57 11.094 1.780 2.894 1.00 0.00 C ATOM 837 O GLY A 57 12.145 1.708 3.529 1.00 0.00 O ATOM 0 H GLY A 57 8.011 2.390 2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 57 9.667 3.028 3.924 1.00 0.00 H new ATOM 0 HA3 GLY A 57 9.742 1.385 4.528 1.00 0.00 H new ATOM 841 N LYS A 58 11.005 1.691 1.575 1.00 0.00 N ATOM 842 CA LYS A 58 12.190 1.494 0.758 1.00 0.00 C ATOM 843 C LYS A 58 12.936 2.823 0.621 1.00 0.00 C ATOM 844 O LYS A 58 12.400 3.787 0.075 1.00 0.00 O ATOM 845 CB LYS A 58 11.817 0.858 -0.583 1.00 0.00 C ATOM 846 CG LYS A 58 13.044 0.722 -1.486 1.00 0.00 C ATOM 847 CD LYS A 58 13.169 -0.702 -2.031 1.00 0.00 C ATOM 848 CE LYS A 58 12.455 -0.840 -3.377 1.00 0.00 C ATOM 849 NZ LYS A 58 13.231 -1.708 -4.289 1.00 0.00 N ATOM 0 H LYS A 58 10.131 1.752 1.052 1.00 0.00 H new ATOM 0 HA LYS A 58 12.872 0.792 1.239 1.00 0.00 H new ATOM 0 HB2 LYS A 58 11.375 -0.124 -0.413 1.00 0.00 H new ATOM 0 HB3 LYS A 58 11.061 1.466 -1.080 1.00 0.00 H new ATOM 0 HG2 LYS A 58 12.970 1.427 -2.314 1.00 0.00 H new ATOM 0 HG3 LYS A 58 13.943 0.981 -0.926 1.00 0.00 H new ATOM 0 HD2 LYS A 58 14.222 -0.960 -2.146 1.00 0.00 H new ATOM 0 HD3 LYS A 58 12.744 -1.407 -1.316 1.00 0.00 H new ATOM 0 HE2 LYS A 58 11.460 -1.259 -3.226 1.00 0.00 H new ATOM 0 HE3 LYS A 58 12.322 0.144 -3.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 12.732 -1.791 -5.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 14.171 -1.293 -4.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 13.336 -2.652 -3.865 1.00 0.00 H new ATOM 863 N MET A 59 14.161 2.832 1.125 1.00 0.00 N ATOM 864 CA MET A 59 14.986 4.027 1.066 1.00 0.00 C ATOM 865 C MET A 59 15.643 4.172 -0.308 1.00 0.00 C ATOM 866 O MET A 59 16.532 3.399 -0.660 1.00 0.00 O ATOM 867 CB MET A 59 16.069 3.953 2.145 1.00 0.00 C ATOM 868 CG MET A 59 16.344 5.335 2.741 1.00 0.00 C ATOM 869 SD MET A 59 15.222 5.650 4.093 1.00 0.00 S ATOM 870 CE MET A 59 14.692 7.303 3.678 1.00 0.00 C ATOM 0 H MET A 59 14.602 2.031 1.576 1.00 0.00 H new ATOM 0 HA MET A 59 14.349 4.895 1.237 1.00 0.00 H new ATOM 0 HB2 MET A 59 15.756 3.269 2.933 1.00 0.00 H new ATOM 0 HB3 MET A 59 16.986 3.548 1.718 1.00 0.00 H new ATOM 0 HG2 MET A 59 17.374 5.390 3.092 1.00 0.00 H new ATOM 0 HG3 MET A 59 16.227 6.101 1.974 1.00 0.00 H new ATOM 0 HE1 MET A 59 14.111 7.716 4.502 1.00 0.00 H new ATOM 0 HE2 MET A 59 15.565 7.931 3.499 1.00 0.00 H new ATOM 0 HE3 MET A 59 14.076 7.273 2.779 1.00 0.00 H new ATOM 880 N THR A 60 15.178 5.169 -1.047 1.00 0.00 N ATOM 881 CA THR A 60 15.709 5.426 -2.375 1.00 0.00 C ATOM 882 C THR A 60 17.049 6.159 -2.282 1.00 0.00 C ATOM 883 O THR A 60 17.682 6.170 -1.227 1.00 0.00 O ATOM 884 CB THR A 60 14.650 6.194 -3.168 1.00 0.00 C ATOM 885 OG1 THR A 60 14.524 7.431 -2.470 1.00 0.00 O ATOM 886 CG2 THR A 60 13.262 5.561 -3.057 1.00 0.00 C ATOM 0 H THR A 60 14.440 5.808 -0.751 1.00 0.00 H new ATOM 0 HA THR A 60 15.919 4.496 -2.903 1.00 0.00 H new ATOM 0 HB THR A 60 14.945 6.241 -4.216 1.00 0.00 H new ATOM 0 HG1 THR A 60 13.879 7.330 -1.739 1.00 0.00 H new ATOM 0 HG21 THR A 60 12.548 6.145 -3.638 1.00 0.00 H new ATOM 0 HG22 THR A 60 13.295 4.542 -3.442 1.00 0.00 H new ATOM 0 HG23 THR A 60 12.952 5.545 -2.012 1.00 0.00 H new ATOM 894 N GLU A 61 17.441 6.754 -3.399 1.00 0.00 N ATOM 895 CA GLU A 61 18.694 7.488 -3.456 1.00 0.00 C ATOM 896 C GLU A 61 18.518 8.885 -2.857 1.00 0.00 C ATOM 897 O GLU A 61 19.455 9.442 -2.286 1.00 0.00 O ATOM 898 CB GLU A 61 19.217 7.569 -4.891 1.00 0.00 C ATOM 899 CG GLU A 61 20.745 7.506 -4.922 1.00 0.00 C ATOM 900 CD GLU A 61 21.264 7.495 -6.362 1.00 0.00 C ATOM 901 OE1 GLU A 61 21.327 8.596 -6.951 1.00 0.00 O ATOM 902 OE2 GLU A 61 21.586 6.386 -6.840 1.00 0.00 O ATOM 0 H GLU A 61 16.913 6.743 -4.272 1.00 0.00 H new ATOM 0 HA GLU A 61 19.435 6.951 -2.864 1.00 0.00 H new ATOM 0 HB2 GLU A 61 18.804 6.750 -5.479 1.00 0.00 H new ATOM 0 HB3 GLU A 61 18.878 8.496 -5.354 1.00 0.00 H new ATOM 0 HG2 GLU A 61 21.159 8.362 -4.389 1.00 0.00 H new ATOM 0 HG3 GLU A 61 21.086 6.611 -4.402 1.00 0.00 H new ATOM 909 N SER A 62 17.311 9.411 -3.006 1.00 0.00 N ATOM 910 CA SER A 62 17.001 10.732 -2.487 1.00 0.00 C ATOM 911 C SER A 62 16.467 10.620 -1.058 1.00 0.00 C ATOM 912 O SER A 62 15.789 11.524 -0.572 1.00 0.00 O ATOM 913 CB SER A 62 15.986 11.450 -3.378 1.00 0.00 C ATOM 914 OG SER A 62 16.379 12.790 -3.663 1.00 0.00 O ATOM 0 H SER A 62 16.536 8.946 -3.479 1.00 0.00 H new ATOM 0 HA SER A 62 17.918 11.321 -2.481 1.00 0.00 H new ATOM 0 HB2 SER A 62 15.870 10.900 -4.312 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.012 11.454 -2.888 1.00 0.00 H new ATOM 0 HG SER A 62 15.706 13.214 -4.235 1.00 0.00 H new ATOM 920 N GLY A 63 16.793 9.503 -0.424 1.00 0.00 N ATOM 921 CA GLY A 63 16.354 9.262 0.940 1.00 0.00 C ATOM 922 C GLY A 63 14.827 9.267 1.034 1.00 0.00 C ATOM 923 O GLY A 63 14.269 9.428 2.118 1.00 0.00 O ATOM 0 H GLY A 63 17.356 8.755 -0.830 1.00 0.00 H new ATOM 0 HA2 GLY A 63 16.740 8.303 1.286 1.00 0.00 H new ATOM 0 HA3 GLY A 63 16.765 10.027 1.599 1.00 0.00 H new ATOM 927 N ARG A 64 14.195 9.089 -0.116 1.00 0.00 N ATOM 928 CA ARG A 64 12.743 9.071 -0.178 1.00 0.00 C ATOM 929 C ARG A 64 12.221 7.645 0.003 1.00 0.00 C ATOM 930 O ARG A 64 12.915 6.681 -0.318 1.00 0.00 O ATOM 931 CB ARG A 64 12.241 9.625 -1.513 1.00 0.00 C ATOM 932 CG ARG A 64 11.680 11.038 -1.345 1.00 0.00 C ATOM 933 CD ARG A 64 10.272 11.002 -0.749 1.00 0.00 C ATOM 934 NE ARG A 64 9.606 12.310 -0.942 1.00 0.00 N ATOM 935 CZ ARG A 64 8.438 12.649 -0.380 1.00 0.00 C ATOM 936 NH1 ARG A 64 7.799 11.779 0.414 1.00 0.00 N ATOM 937 NH2 ARG A 64 7.909 13.858 -0.611 1.00 0.00 N ATOM 0 H ARG A 64 14.662 8.956 -1.013 1.00 0.00 H new ATOM 0 HA ARG A 64 12.370 9.703 0.628 1.00 0.00 H new ATOM 0 HB2 ARG A 64 13.057 9.638 -2.235 1.00 0.00 H new ATOM 0 HB3 ARG A 64 11.469 8.969 -1.916 1.00 0.00 H new ATOM 0 HG2 ARG A 64 12.337 11.620 -0.699 1.00 0.00 H new ATOM 0 HG3 ARG A 64 11.657 11.541 -2.312 1.00 0.00 H new ATOM 0 HD2 ARG A 64 9.688 10.214 -1.223 1.00 0.00 H new ATOM 0 HD3 ARG A 64 10.324 10.765 0.314 1.00 0.00 H new ATOM 0 HE ARG A 64 10.065 12.996 -1.541 1.00 0.00 H new ATOM 0 HH11 ARG A 64 8.202 10.859 0.591 1.00 0.00 H new ATOM 0 HH12 ARG A 64 6.910 12.037 0.842 1.00 0.00 H new ATOM 0 HH21 ARG A 64 8.395 14.521 -1.215 1.00 0.00 H new ATOM 0 HH22 ARG A 64 7.020 14.116 -0.183 1.00 0.00 H new ATOM 951 N LEU A 65 11.003 7.555 0.517 1.00 0.00 N ATOM 952 CA LEU A 65 10.381 6.262 0.745 1.00 0.00 C ATOM 953 C LEU A 65 9.195 6.097 -0.208 1.00 0.00 C ATOM 954 O LEU A 65 8.411 7.026 -0.396 1.00 0.00 O ATOM 955 CB LEU A 65 10.012 6.097 2.221 1.00 0.00 C ATOM 956 CG LEU A 65 11.155 6.272 3.222 1.00 0.00 C ATOM 957 CD1 LEU A 65 10.617 6.465 4.641 1.00 0.00 C ATOM 958 CD2 LEU A 65 12.141 5.105 3.137 1.00 0.00 C ATOM 0 H LEU A 65 10.430 8.356 0.782 1.00 0.00 H new ATOM 0 HA LEU A 65 11.083 5.457 0.524 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.231 6.818 2.462 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.584 5.104 2.359 1.00 0.00 H new ATOM 0 HG LEU A 65 11.703 7.177 2.960 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.451 6.587 5.333 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.986 7.353 4.673 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.031 5.593 4.930 1.00 0.00 H new ATOM 0 HD21 LEU A 65 12.944 5.254 3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.622 4.173 3.359 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.561 5.056 2.132 1.00 0.00 H new ATOM 970 N CYS A 66 9.101 4.907 -0.783 1.00 0.00 N ATOM 971 CA CYS A 66 8.024 4.608 -1.712 1.00 0.00 C ATOM 972 C CYS A 66 7.809 3.094 -1.727 1.00 0.00 C ATOM 973 O CYS A 66 8.727 2.330 -1.433 1.00 0.00 O ATOM 974 CB CYS A 66 8.314 5.157 -3.111 1.00 0.00 C ATOM 975 SG CYS A 66 6.763 5.735 -3.891 1.00 0.00 S ATOM 0 H CYS A 66 9.753 4.139 -0.624 1.00 0.00 H new ATOM 0 HA CYS A 66 7.109 5.101 -1.382 1.00 0.00 H new ATOM 0 HB2 CYS A 66 9.027 5.979 -3.047 1.00 0.00 H new ATOM 0 HB3 CYS A 66 8.774 4.383 -3.726 1.00 0.00 H new ATOM 0 HG CYS A 66 7.044 6.562 -4.854 1.00 0.00 H new ATOM 981 N ALA A 67 6.590 2.705 -2.071 1.00 0.00 N ATOM 982 CA ALA A 67 6.242 1.295 -2.128 1.00 0.00 C ATOM 983 C ALA A 67 6.287 0.821 -3.582 1.00 0.00 C ATOM 984 O ALA A 67 5.589 1.364 -4.437 1.00 0.00 O ATOM 985 CB ALA A 67 4.870 1.081 -1.487 1.00 0.00 C ATOM 0 H ALA A 67 5.831 3.342 -2.313 1.00 0.00 H new ATOM 0 HA ALA A 67 6.961 0.700 -1.565 1.00 0.00 H new ATOM 0 HB1 ALA A 67 4.609 0.024 -1.530 1.00 0.00 H new ATOM 0 HB2 ALA A 67 4.900 1.405 -0.447 1.00 0.00 H new ATOM 0 HB3 ALA A 67 4.122 1.661 -2.027 1.00 0.00 H new ATOM 991 N PHE A 68 7.115 -0.186 -3.818 1.00 0.00 N ATOM 992 CA PHE A 68 7.260 -0.739 -5.154 1.00 0.00 C ATOM 993 C PHE A 68 6.827 -2.206 -5.190 1.00 0.00 C ATOM 994 O PHE A 68 7.051 -2.946 -4.233 1.00 0.00 O ATOM 995 CB PHE A 68 8.743 -0.648 -5.517 1.00 0.00 C ATOM 996 CG PHE A 68 9.348 0.743 -5.319 1.00 0.00 C ATOM 997 CD1 PHE A 68 9.236 1.680 -6.299 1.00 0.00 C ATOM 998 CD2 PHE A 68 9.998 1.044 -4.163 1.00 0.00 C ATOM 999 CE1 PHE A 68 9.798 2.971 -6.115 1.00 0.00 C ATOM 1000 CE2 PHE A 68 10.560 2.335 -3.979 1.00 0.00 C ATOM 1001 CZ PHE A 68 10.448 3.271 -4.959 1.00 0.00 C ATOM 0 H PHE A 68 7.693 -0.634 -3.106 1.00 0.00 H new ATOM 0 HA PHE A 68 6.635 -0.186 -5.855 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.299 -1.364 -4.912 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.870 -0.943 -6.558 1.00 0.00 H new ATOM 0 HD1 PHE A 68 8.720 1.442 -7.217 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.087 0.301 -3.384 1.00 0.00 H new ATOM 0 HE1 PHE A 68 9.709 3.715 -6.893 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.076 2.573 -3.061 1.00 0.00 H new ATOM 0 HZ PHE A 68 10.875 4.253 -4.819 1.00 0.00 H new ATOM 1011 N ILE A 69 6.216 -2.582 -6.303 1.00 0.00 N ATOM 1012 CA ILE A 69 5.750 -3.948 -6.477 1.00 0.00 C ATOM 1013 C ILE A 69 6.952 -4.894 -6.491 1.00 0.00 C ATOM 1014 O ILE A 69 7.928 -4.653 -7.199 1.00 0.00 O ATOM 1015 CB ILE A 69 4.865 -4.058 -7.720 1.00 0.00 C ATOM 1016 CG1 ILE A 69 3.612 -3.192 -7.580 1.00 0.00 C ATOM 1017 CG2 ILE A 69 4.522 -5.518 -8.021 1.00 0.00 C ATOM 1018 CD1 ILE A 69 2.790 -3.204 -8.871 1.00 0.00 C ATOM 0 H ILE A 69 6.032 -1.965 -7.094 1.00 0.00 H new ATOM 0 HA ILE A 69 5.120 -4.246 -5.639 1.00 0.00 H new ATOM 0 HB ILE A 69 5.426 -3.676 -8.573 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.003 -3.558 -6.753 1.00 0.00 H new ATOM 0 HG13 ILE A 69 3.898 -2.169 -7.336 1.00 0.00 H new ATOM 0 HG21 ILE A 69 3.892 -5.568 -8.909 1.00 0.00 H new ATOM 0 HG22 ILE A 69 5.440 -6.079 -8.195 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.989 -5.949 -7.173 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.905 -2.581 -8.745 1.00 0.00 H new ATOM 0 HD12 ILE A 69 3.394 -2.815 -9.691 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.485 -4.225 -9.099 1.00 0.00 H new ATOM 1030 N THR A 70 6.841 -5.952 -5.701 1.00 0.00 N ATOM 1031 CA THR A 70 7.906 -6.936 -5.613 1.00 0.00 C ATOM 1032 C THR A 70 7.527 -8.202 -6.384 1.00 0.00 C ATOM 1033 O THR A 70 8.367 -8.798 -7.057 1.00 0.00 O ATOM 1034 CB THR A 70 8.196 -7.189 -4.133 1.00 0.00 C ATOM 1035 OG1 THR A 70 6.938 -7.594 -3.598 1.00 0.00 O ATOM 1036 CG2 THR A 70 8.528 -5.904 -3.372 1.00 0.00 C ATOM 0 H THR A 70 6.029 -6.149 -5.116 1.00 0.00 H new ATOM 0 HA THR A 70 8.821 -6.571 -6.079 1.00 0.00 H new ATOM 0 HB THR A 70 9.026 -7.889 -4.041 1.00 0.00 H new ATOM 0 HG1 THR A 70 7.017 -8.496 -3.224 1.00 0.00 H new ATOM 0 HG21 THR A 70 8.725 -6.141 -2.327 1.00 0.00 H new ATOM 0 HG22 THR A 70 9.410 -5.439 -3.811 1.00 0.00 H new ATOM 0 HG23 THR A 70 7.685 -5.216 -3.435 1.00 0.00 H new ATOM 1044 N LYS A 71 6.262 -8.575 -6.260 1.00 0.00 N ATOM 1045 CA LYS A 71 5.762 -9.760 -6.937 1.00 0.00 C ATOM 1046 C LYS A 71 4.244 -9.649 -7.093 1.00 0.00 C ATOM 1047 O LYS A 71 3.559 -9.151 -6.202 1.00 0.00 O ATOM 1048 CB LYS A 71 6.214 -11.026 -6.206 1.00 0.00 C ATOM 1049 CG LYS A 71 5.762 -12.282 -6.954 1.00 0.00 C ATOM 1050 CD LYS A 71 6.910 -13.285 -7.083 1.00 0.00 C ATOM 1051 CE LYS A 71 7.456 -13.313 -8.512 1.00 0.00 C ATOM 1052 NZ LYS A 71 8.886 -13.694 -8.513 1.00 0.00 N ATOM 0 H LYS A 71 5.568 -8.078 -5.701 1.00 0.00 H new ATOM 0 HA LYS A 71 6.182 -9.832 -7.940 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.300 -11.027 -6.110 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.804 -11.033 -5.196 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.928 -12.744 -6.426 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.400 -12.009 -7.945 1.00 0.00 H new ATOM 0 HD2 LYS A 71 7.709 -13.020 -6.390 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.562 -14.279 -6.803 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.885 -14.021 -9.112 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.334 -12.333 -8.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 9.241 -13.708 -9.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.430 -13.003 -7.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 8.994 -14.639 -8.092 1.00 0.00 H new ATOM 1066 N VAL A 72 3.763 -10.122 -8.234 1.00 0.00 N ATOM 1067 CA VAL A 72 2.338 -10.083 -8.519 1.00 0.00 C ATOM 1068 C VAL A 72 1.907 -11.420 -9.125 1.00 0.00 C ATOM 1069 O VAL A 72 2.316 -11.764 -10.233 1.00 0.00 O ATOM 1070 CB VAL A 72 2.018 -8.887 -9.418 1.00 0.00 C ATOM 1071 CG1 VAL A 72 3.067 -8.734 -10.521 1.00 0.00 C ATOM 1072 CG2 VAL A 72 0.613 -9.009 -10.011 1.00 0.00 C ATOM 0 H VAL A 72 4.334 -10.534 -8.972 1.00 0.00 H new ATOM 0 HA VAL A 72 1.767 -9.944 -7.601 1.00 0.00 H new ATOM 0 HB VAL A 72 2.046 -7.988 -8.803 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.816 -7.877 -11.146 1.00 0.00 H new ATOM 0 HG12 VAL A 72 4.048 -8.580 -10.071 1.00 0.00 H new ATOM 0 HG13 VAL A 72 3.086 -9.636 -11.133 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.410 -8.147 -10.646 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.547 -9.921 -10.605 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.120 -9.047 -9.205 1.00 0.00 H new ATOM 1082 N LYS A 73 1.086 -12.137 -8.372 1.00 0.00 N ATOM 1083 CA LYS A 73 0.595 -13.429 -8.821 1.00 0.00 C ATOM 1084 C LYS A 73 -0.075 -13.267 -10.188 1.00 0.00 C ATOM 1085 O LYS A 73 -0.744 -12.267 -10.440 1.00 0.00 O ATOM 1086 CB LYS A 73 -0.314 -14.054 -7.761 1.00 0.00 C ATOM 1087 CG LYS A 73 -0.628 -15.513 -8.100 1.00 0.00 C ATOM 1088 CD LYS A 73 0.471 -16.444 -7.584 1.00 0.00 C ATOM 1089 CE LYS A 73 0.931 -17.409 -8.679 1.00 0.00 C ATOM 1090 NZ LYS A 73 1.285 -18.723 -8.097 1.00 0.00 N ATOM 0 H LYS A 73 0.748 -11.848 -7.454 1.00 0.00 H new ATOM 0 HA LYS A 73 1.422 -14.127 -8.951 1.00 0.00 H new ATOM 0 HB2 LYS A 73 0.168 -13.999 -6.785 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -1.241 -13.485 -7.691 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -1.585 -15.795 -7.660 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -0.728 -15.626 -9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 73 1.318 -15.854 -7.235 1.00 0.00 H new ATOM 0 HD3 LYS A 73 0.102 -17.009 -6.728 1.00 0.00 H new ATOM 0 HE2 LYS A 73 0.140 -17.533 -9.418 1.00 0.00 H new ATOM 0 HE3 LYS A 73 1.792 -16.992 -9.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.595 -19.366 -8.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.055 -18.602 -7.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.454 -19.126 -7.619 1.00 0.00 H new ATOM 1104 N LYS A 74 0.130 -14.267 -11.033 1.00 0.00 N ATOM 1105 CA LYS A 74 -0.445 -14.249 -12.367 1.00 0.00 C ATOM 1106 C LYS A 74 -1.822 -14.916 -12.333 1.00 0.00 C ATOM 1107 O LYS A 74 -1.921 -16.138 -12.238 1.00 0.00 O ATOM 1108 CB LYS A 74 0.519 -14.878 -13.375 1.00 0.00 C ATOM 1109 CG LYS A 74 -0.214 -15.282 -14.656 1.00 0.00 C ATOM 1110 CD LYS A 74 -0.347 -16.803 -14.755 1.00 0.00 C ATOM 1111 CE LYS A 74 -0.013 -17.291 -16.166 1.00 0.00 C ATOM 1112 NZ LYS A 74 -0.061 -18.769 -16.227 1.00 0.00 N ATOM 0 H LYS A 74 0.686 -15.095 -10.819 1.00 0.00 H new ATOM 0 HA LYS A 74 -0.596 -13.223 -12.703 1.00 0.00 H new ATOM 0 HB2 LYS A 74 1.313 -14.171 -13.614 1.00 0.00 H new ATOM 0 HB3 LYS A 74 0.994 -15.753 -12.932 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -1.203 -14.825 -14.673 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.327 -14.903 -15.523 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.319 -17.278 -14.035 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -1.363 -17.101 -14.494 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.720 -16.868 -16.880 1.00 0.00 H new ATOM 0 HE3 LYS A 74 0.979 -16.941 -16.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 0.168 -19.084 -17.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.630 -19.167 -15.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -1.015 -19.096 -15.973 1.00 0.00 H new ATOM 1126 N GLY A 75 -2.849 -14.084 -12.414 1.00 0.00 N ATOM 1127 CA GLY A 75 -4.216 -14.577 -12.393 1.00 0.00 C ATOM 1128 C GLY A 75 -4.967 -14.064 -11.163 1.00 0.00 C ATOM 1129 O GLY A 75 -5.946 -14.670 -10.731 1.00 0.00 O ATOM 0 H GLY A 75 -2.762 -13.071 -12.494 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.734 -14.260 -13.298 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.213 -15.667 -12.393 1.00 0.00 H new ATOM 1133 N SER A 76 -4.479 -12.951 -10.634 1.00 0.00 N ATOM 1134 CA SER A 76 -5.092 -12.349 -9.462 1.00 0.00 C ATOM 1135 C SER A 76 -5.654 -10.970 -9.815 1.00 0.00 C ATOM 1136 O SER A 76 -5.344 -10.422 -10.872 1.00 0.00 O ATOM 1137 CB SER A 76 -4.088 -12.234 -8.313 1.00 0.00 C ATOM 1138 OG SER A 76 -4.708 -12.411 -7.043 1.00 0.00 O ATOM 0 H SER A 76 -3.667 -12.451 -10.995 1.00 0.00 H new ATOM 0 HA SER A 76 -5.907 -12.994 -9.134 1.00 0.00 H new ATOM 0 HB2 SER A 76 -3.304 -12.980 -8.441 1.00 0.00 H new ATOM 0 HB3 SER A 76 -3.607 -11.257 -8.348 1.00 0.00 H new ATOM 0 HG SER A 76 -4.064 -12.802 -6.416 1.00 0.00 H new ATOM 1144 N LEU A 77 -6.469 -10.450 -8.911 1.00 0.00 N ATOM 1145 CA LEU A 77 -7.077 -9.146 -9.114 1.00 0.00 C ATOM 1146 C LEU A 77 -6.026 -8.177 -9.660 1.00 0.00 C ATOM 1147 O LEU A 77 -6.143 -7.701 -10.789 1.00 0.00 O ATOM 1148 CB LEU A 77 -7.749 -8.661 -7.827 1.00 0.00 C ATOM 1149 CG LEU A 77 -9.176 -9.159 -7.587 1.00 0.00 C ATOM 1150 CD1 LEU A 77 -9.459 -9.312 -6.092 1.00 0.00 C ATOM 1151 CD2 LEU A 77 -10.196 -8.248 -8.273 1.00 0.00 C ATOM 0 H LEU A 77 -6.723 -10.908 -8.036 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.871 -9.209 -9.858 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.132 -8.965 -6.981 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.762 -7.571 -7.836 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.273 -10.148 -8.036 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -10.480 -9.667 -5.949 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.761 -10.030 -5.661 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.338 -8.348 -5.598 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.202 -8.624 -8.087 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -10.107 -7.237 -7.875 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.007 -8.233 -9.346 1.00 0.00 H new ATOM 1163 N ALA A 78 -5.023 -7.915 -8.835 1.00 0.00 N ATOM 1164 CA ALA A 78 -3.953 -7.012 -9.222 1.00 0.00 C ATOM 1165 C ALA A 78 -3.056 -7.703 -10.251 1.00 0.00 C ATOM 1166 O ALA A 78 -1.856 -7.858 -10.029 1.00 0.00 O ATOM 1167 CB ALA A 78 -3.180 -6.573 -7.977 1.00 0.00 C ATOM 0 H ALA A 78 -4.929 -8.312 -7.900 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.358 -6.114 -9.688 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.377 -5.895 -8.267 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.855 -6.062 -7.291 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.756 -7.448 -7.485 1.00 0.00 H new ATOM 1173 N ASP A 79 -3.672 -8.099 -11.355 1.00 0.00 N ATOM 1174 CA ASP A 79 -2.944 -8.770 -12.419 1.00 0.00 C ATOM 1175 C ASP A 79 -3.906 -9.094 -13.563 1.00 0.00 C ATOM 1176 O ASP A 79 -3.573 -8.902 -14.732 1.00 0.00 O ATOM 1177 CB ASP A 79 -2.336 -10.084 -11.926 1.00 0.00 C ATOM 1178 CG ASP A 79 -1.226 -10.654 -12.811 1.00 0.00 C ATOM 1179 OD1 ASP A 79 -0.071 -10.210 -12.631 1.00 0.00 O ATOM 1180 OD2 ASP A 79 -1.557 -11.522 -13.648 1.00 0.00 O ATOM 0 H ASP A 79 -4.667 -7.968 -11.536 1.00 0.00 H new ATOM 0 HA ASP A 79 -2.146 -8.106 -12.753 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -1.937 -9.929 -10.923 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.130 -10.826 -11.842 1.00 0.00 H new ATOM 1185 N THR A 80 -5.080 -9.579 -13.188 1.00 0.00 N ATOM 1186 CA THR A 80 -6.093 -9.932 -14.168 1.00 0.00 C ATOM 1187 C THR A 80 -6.914 -8.699 -14.554 1.00 0.00 C ATOM 1188 O THR A 80 -7.249 -8.513 -15.722 1.00 0.00 O ATOM 1189 CB THR A 80 -6.938 -11.067 -13.588 1.00 0.00 C ATOM 1190 OG1 THR A 80 -7.352 -10.577 -12.315 1.00 0.00 O ATOM 1191 CG2 THR A 80 -6.105 -12.307 -13.257 1.00 0.00 C ATOM 0 H THR A 80 -5.353 -9.736 -12.218 1.00 0.00 H new ATOM 0 HA THR A 80 -5.640 -10.286 -15.094 1.00 0.00 H new ATOM 0 HB THR A 80 -7.721 -11.335 -14.297 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.907 -11.251 -11.870 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.753 -13.082 -12.849 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.625 -12.676 -14.164 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.342 -12.048 -12.523 1.00 0.00 H new ATOM 1199 N VAL A 81 -7.215 -7.890 -13.549 1.00 0.00 N ATOM 1200 CA VAL A 81 -7.990 -6.681 -13.768 1.00 0.00 C ATOM 1201 C VAL A 81 -7.062 -5.466 -13.703 1.00 0.00 C ATOM 1202 O VAL A 81 -7.206 -4.528 -14.485 1.00 0.00 O ATOM 1203 CB VAL A 81 -9.141 -6.608 -12.762 1.00 0.00 C ATOM 1204 CG1 VAL A 81 -10.256 -7.587 -13.133 1.00 0.00 C ATOM 1205 CG2 VAL A 81 -8.642 -6.860 -11.338 1.00 0.00 C ATOM 0 H VAL A 81 -6.936 -8.048 -12.581 1.00 0.00 H new ATOM 0 HA VAL A 81 -8.442 -6.692 -14.760 1.00 0.00 H new ATOM 0 HB VAL A 81 -9.554 -5.600 -12.799 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -11.061 -7.515 -12.402 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.641 -7.342 -14.123 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -9.861 -8.603 -13.139 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -9.480 -6.802 -10.643 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.191 -7.850 -11.281 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -7.899 -6.107 -11.074 1.00 0.00 H new ATOM 1215 N GLY A 82 -6.129 -5.523 -12.763 1.00 0.00 N ATOM 1216 CA GLY A 82 -5.178 -4.440 -12.586 1.00 0.00 C ATOM 1217 C GLY A 82 -4.060 -4.516 -13.628 1.00 0.00 C ATOM 1218 O GLY A 82 -3.583 -3.489 -14.108 1.00 0.00 O ATOM 0 H GLY A 82 -6.012 -6.303 -12.116 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -5.692 -3.483 -12.668 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.750 -4.487 -11.584 1.00 0.00 H new ATOM 1222 N HIS A 83 -3.675 -5.743 -13.948 1.00 0.00 N ATOM 1223 CA HIS A 83 -2.622 -5.967 -14.924 1.00 0.00 C ATOM 1224 C HIS A 83 -1.333 -5.291 -14.453 1.00 0.00 C ATOM 1225 O HIS A 83 -0.632 -4.663 -15.245 1.00 0.00 O ATOM 1226 CB HIS A 83 -3.062 -5.501 -16.313 1.00 0.00 C ATOM 1227 CG HIS A 83 -4.285 -6.213 -16.841 1.00 0.00 C ATOM 1228 ND1 HIS A 83 -4.284 -7.555 -17.179 1.00 0.00 N ATOM 1229 CD2 HIS A 83 -5.547 -5.756 -17.084 1.00 0.00 C ATOM 1230 CE1 HIS A 83 -5.495 -7.880 -17.606 1.00 0.00 C ATOM 1231 NE2 HIS A 83 -6.276 -6.763 -17.547 1.00 0.00 N ATOM 0 H HIS A 83 -4.074 -6.593 -13.548 1.00 0.00 H new ATOM 0 HA HIS A 83 -2.421 -7.035 -15.009 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -3.264 -4.430 -16.279 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -2.239 -5.648 -17.012 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -5.894 -4.745 -16.926 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -5.809 -8.857 -17.942 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -7.259 -6.711 -17.815 1.00 0.00 H new ATOM 1239 N LEU A 84 -1.060 -5.442 -13.165 1.00 0.00 N ATOM 1240 CA LEU A 84 0.132 -4.854 -12.579 1.00 0.00 C ATOM 1241 C LEU A 84 1.338 -5.745 -12.884 1.00 0.00 C ATOM 1242 O LEU A 84 1.191 -6.811 -13.481 1.00 0.00 O ATOM 1243 CB LEU A 84 -0.077 -4.593 -11.086 1.00 0.00 C ATOM 1244 CG LEU A 84 -1.205 -3.624 -10.726 1.00 0.00 C ATOM 1245 CD1 LEU A 84 -1.839 -3.994 -9.384 1.00 0.00 C ATOM 1246 CD2 LEU A 84 -0.711 -2.176 -10.747 1.00 0.00 C ATOM 0 H LEU A 84 -1.644 -5.963 -12.511 1.00 0.00 H new ATOM 0 HA LEU A 84 0.334 -3.880 -13.024 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.273 -5.546 -10.595 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.854 -4.206 -10.671 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.984 -3.710 -11.484 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.638 -3.289 -9.152 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.250 -5.002 -9.441 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.082 -3.955 -8.601 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.532 -1.508 -10.488 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.096 -2.056 -10.024 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.345 -1.931 -11.744 1.00 0.00 H new ATOM 1258 N ARG A 85 2.502 -5.276 -12.461 1.00 0.00 N ATOM 1259 CA ARG A 85 3.733 -6.017 -12.681 1.00 0.00 C ATOM 1260 C ARG A 85 4.747 -5.701 -11.581 1.00 0.00 C ATOM 1261 O ARG A 85 4.701 -4.630 -10.978 1.00 0.00 O ATOM 1262 CB ARG A 85 4.344 -5.677 -14.042 1.00 0.00 C ATOM 1263 CG ARG A 85 3.838 -6.634 -15.124 1.00 0.00 C ATOM 1264 CD ARG A 85 3.526 -5.880 -16.419 1.00 0.00 C ATOM 1265 NE ARG A 85 3.943 -6.687 -17.587 1.00 0.00 N ATOM 1266 CZ ARG A 85 3.362 -7.838 -17.952 1.00 0.00 C ATOM 1267 NH1 ARG A 85 2.335 -8.324 -17.242 1.00 0.00 N ATOM 1268 NH2 ARG A 85 3.807 -8.503 -19.027 1.00 0.00 N ATOM 0 H ARG A 85 2.619 -4.392 -11.967 1.00 0.00 H new ATOM 0 HA ARG A 85 3.489 -7.079 -12.660 1.00 0.00 H new ATOM 0 HB2 ARG A 85 4.092 -4.651 -14.312 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.431 -5.733 -13.981 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.589 -7.401 -15.317 1.00 0.00 H new ATOM 0 HG3 ARG A 85 2.942 -7.146 -14.772 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.459 -5.666 -16.477 1.00 0.00 H new ATOM 0 HD3 ARG A 85 4.044 -4.921 -16.425 1.00 0.00 H new ATOM 0 HE ARG A 85 4.722 -6.346 -18.150 1.00 0.00 H new ATOM 0 HH11 ARG A 85 1.996 -7.818 -16.424 1.00 0.00 H new ATOM 0 HH12 ARG A 85 1.892 -9.200 -17.519 1.00 0.00 H new ATOM 0 HH21 ARG A 85 4.589 -8.133 -19.568 1.00 0.00 H new ATOM 0 HH22 ARG A 85 3.364 -9.379 -19.304 1.00 0.00 H new ATOM 1282 N PRO A 86 5.664 -6.678 -11.346 1.00 0.00 N ATOM 1283 CA PRO A 86 6.689 -6.514 -10.329 1.00 0.00 C ATOM 1284 C PRO A 86 7.782 -5.554 -10.801 1.00 0.00 C ATOM 1285 O PRO A 86 8.650 -5.933 -11.586 1.00 0.00 O ATOM 1286 CB PRO A 86 7.206 -7.918 -10.063 1.00 0.00 C ATOM 1287 CG PRO A 86 6.786 -8.752 -11.262 1.00 0.00 C ATOM 1288 CD PRO A 86 5.749 -7.959 -12.041 1.00 0.00 C ATOM 0 HA PRO A 86 6.305 -6.065 -9.413 1.00 0.00 H new ATOM 0 HB2 PRO A 86 8.290 -7.919 -9.947 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.786 -8.320 -9.141 1.00 0.00 H new ATOM 0 HG2 PRO A 86 7.647 -8.976 -11.892 1.00 0.00 H new ATOM 0 HG3 PRO A 86 6.372 -9.706 -10.937 1.00 0.00 H new ATOM 0 HD2 PRO A 86 6.050 -7.827 -13.080 1.00 0.00 H new ATOM 0 HD3 PRO A 86 4.786 -8.469 -12.051 1.00 0.00 H new ATOM 1296 N GLY A 87 7.704 -4.328 -10.303 1.00 0.00 N ATOM 1297 CA GLY A 87 8.676 -3.311 -10.665 1.00 0.00 C ATOM 1298 C GLY A 87 8.042 -1.918 -10.652 1.00 0.00 C ATOM 1299 O GLY A 87 8.748 -0.912 -10.600 1.00 0.00 O ATOM 0 H GLY A 87 6.983 -4.017 -9.652 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.514 -3.340 -9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 87 9.077 -3.523 -11.656 1.00 0.00 H new ATOM 1303 N ASP A 88 6.718 -1.905 -10.701 1.00 0.00 N ATOM 1304 CA ASP A 88 5.982 -0.653 -10.696 1.00 0.00 C ATOM 1305 C ASP A 88 6.139 0.021 -9.332 1.00 0.00 C ATOM 1306 O ASP A 88 6.743 -0.545 -8.422 1.00 0.00 O ATOM 1307 CB ASP A 88 4.490 -0.890 -10.937 1.00 0.00 C ATOM 1308 CG ASP A 88 3.986 -0.485 -12.324 1.00 0.00 C ATOM 1309 OD1 ASP A 88 4.831 -0.025 -13.123 1.00 0.00 O ATOM 1310 OD2 ASP A 88 2.768 -0.643 -12.554 1.00 0.00 O ATOM 0 H ASP A 88 6.136 -2.742 -10.744 1.00 0.00 H new ATOM 0 HA ASP A 88 6.381 -0.025 -11.493 1.00 0.00 H new ATOM 0 HB2 ASP A 88 4.276 -1.948 -10.784 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.924 -0.339 -10.186 1.00 0.00 H new ATOM 1315 N GLU A 89 5.584 1.220 -9.232 1.00 0.00 N ATOM 1316 CA GLU A 89 5.654 1.977 -7.994 1.00 0.00 C ATOM 1317 C GLU A 89 4.262 2.463 -7.588 1.00 0.00 C ATOM 1318 O GLU A 89 3.746 3.424 -8.158 1.00 0.00 O ATOM 1319 CB GLU A 89 6.629 3.149 -8.122 1.00 0.00 C ATOM 1320 CG GLU A 89 6.771 3.893 -6.793 1.00 0.00 C ATOM 1321 CD GLU A 89 7.575 5.183 -6.969 1.00 0.00 C ATOM 1322 OE1 GLU A 89 7.283 5.904 -7.948 1.00 0.00 O ATOM 1323 OE2 GLU A 89 8.463 5.419 -6.121 1.00 0.00 O ATOM 0 H GLU A 89 5.084 1.686 -9.989 1.00 0.00 H new ATOM 0 HA GLU A 89 6.029 1.319 -7.210 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.604 2.782 -8.443 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.278 3.836 -8.892 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.783 4.127 -6.396 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.263 3.250 -6.063 1.00 0.00 H new ATOM 1330 N VAL A 90 3.692 1.778 -6.608 1.00 0.00 N ATOM 1331 CA VAL A 90 2.369 2.128 -6.120 1.00 0.00 C ATOM 1332 C VAL A 90 2.458 3.415 -5.297 1.00 0.00 C ATOM 1333 O VAL A 90 2.853 3.386 -4.133 1.00 0.00 O ATOM 1334 CB VAL A 90 1.774 0.957 -5.335 1.00 0.00 C ATOM 1335 CG1 VAL A 90 2.724 0.502 -4.225 1.00 0.00 C ATOM 1336 CG2 VAL A 90 0.400 1.320 -4.767 1.00 0.00 C ATOM 0 H VAL A 90 4.123 0.982 -6.138 1.00 0.00 H new ATOM 0 HA VAL A 90 1.693 2.320 -6.953 1.00 0.00 H new ATOM 0 HB VAL A 90 1.642 0.123 -6.025 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.277 -0.331 -3.682 1.00 0.00 H new ATOM 0 HG12 VAL A 90 3.670 0.184 -4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.903 1.329 -3.537 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.001 0.471 -4.214 1.00 0.00 H new ATOM 0 HG22 VAL A 90 0.497 2.175 -4.099 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -0.276 1.573 -5.584 1.00 0.00 H new ATOM 1346 N LEU A 91 2.084 4.515 -5.935 1.00 0.00 N ATOM 1347 CA LEU A 91 2.117 5.810 -5.277 1.00 0.00 C ATOM 1348 C LEU A 91 1.115 5.814 -4.120 1.00 0.00 C ATOM 1349 O LEU A 91 1.484 6.079 -2.977 1.00 0.00 O ATOM 1350 CB LEU A 91 1.889 6.932 -6.292 1.00 0.00 C ATOM 1351 CG LEU A 91 2.977 7.108 -7.353 1.00 0.00 C ATOM 1352 CD1 LEU A 91 2.528 8.083 -8.443 1.00 0.00 C ATOM 1353 CD2 LEU A 91 4.302 7.531 -6.715 1.00 0.00 C ATOM 0 H LEU A 91 1.757 4.536 -6.901 1.00 0.00 H new ATOM 0 HA LEU A 91 3.102 5.995 -4.848 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.941 6.749 -6.799 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.784 7.871 -5.748 1.00 0.00 H new ATOM 0 HG LEU A 91 3.145 6.144 -7.833 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.320 8.190 -9.184 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.629 7.700 -8.925 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.315 9.054 -7.997 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.058 7.649 -7.491 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.168 8.478 -6.192 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.625 6.768 -6.007 1.00 0.00 H new ATOM 1365 N GLU A 92 -0.131 5.518 -4.457 1.00 0.00 N ATOM 1366 CA GLU A 92 -1.188 5.484 -3.461 1.00 0.00 C ATOM 1367 C GLU A 92 -1.829 4.096 -3.413 1.00 0.00 C ATOM 1368 O GLU A 92 -1.591 3.268 -4.291 1.00 0.00 O ATOM 1369 CB GLU A 92 -2.237 6.563 -3.738 1.00 0.00 C ATOM 1370 CG GLU A 92 -1.595 7.951 -3.793 1.00 0.00 C ATOM 1371 CD GLU A 92 -2.179 8.780 -4.939 1.00 0.00 C ATOM 1372 OE1 GLU A 92 -3.216 9.433 -4.696 1.00 0.00 O ATOM 1373 OE2 GLU A 92 -1.575 8.741 -6.033 1.00 0.00 O ATOM 0 H GLU A 92 -0.433 5.299 -5.407 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.748 5.693 -2.486 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -2.739 6.353 -4.682 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.000 6.542 -2.960 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.756 8.468 -2.847 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.517 7.852 -3.923 1.00 0.00 H new ATOM 1380 N TRP A 93 -2.629 3.884 -2.379 1.00 0.00 N ATOM 1381 CA TRP A 93 -3.306 2.610 -2.205 1.00 0.00 C ATOM 1382 C TRP A 93 -4.671 2.882 -1.570 1.00 0.00 C ATOM 1383 O TRP A 93 -4.787 2.960 -0.348 1.00 0.00 O ATOM 1384 CB TRP A 93 -2.449 1.641 -1.388 1.00 0.00 C ATOM 1385 CG TRP A 93 -3.120 0.292 -1.118 1.00 0.00 C ATOM 1386 CD1 TRP A 93 -4.094 0.017 -0.239 1.00 0.00 C ATOM 1387 CD2 TRP A 93 -2.826 -0.961 -1.771 1.00 0.00 C ATOM 1388 NE1 TRP A 93 -4.447 -1.317 -0.278 1.00 0.00 N ATOM 1389 CE2 TRP A 93 -3.652 -1.930 -1.239 1.00 0.00 C ATOM 1390 CE3 TRP A 93 -1.893 -1.265 -2.777 1.00 0.00 C ATOM 1391 CZ2 TRP A 93 -3.628 -3.268 -1.650 1.00 0.00 C ATOM 1392 CZ3 TRP A 93 -1.881 -2.606 -3.178 1.00 0.00 C ATOM 1393 CH2 TRP A 93 -2.706 -3.594 -2.652 1.00 0.00 C ATOM 0 H TRP A 93 -2.824 4.573 -1.653 1.00 0.00 H new ATOM 0 HA TRP A 93 -3.461 2.121 -3.167 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -1.510 1.469 -1.915 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -2.199 2.108 -0.435 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -4.545 0.747 0.417 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -5.160 -1.770 0.294 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -1.237 -0.522 -3.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -4.285 -4.008 -1.218 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -1.182 -2.893 -3.950 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -2.636 -4.609 -3.015 1.00 0.00 H new ATOM 1404 N ASN A 94 -5.671 3.019 -2.428 1.00 0.00 N ATOM 1405 CA ASN A 94 -7.023 3.281 -1.966 1.00 0.00 C ATOM 1406 C ASN A 94 -7.144 4.752 -1.563 1.00 0.00 C ATOM 1407 O ASN A 94 -8.047 5.122 -0.814 1.00 0.00 O ATOM 1408 CB ASN A 94 -7.363 2.427 -0.744 1.00 0.00 C ATOM 1409 CG ASN A 94 -8.719 1.738 -0.915 1.00 0.00 C ATOM 1410 OD1 ASN A 94 -9.541 2.123 -1.731 1.00 0.00 O ATOM 1411 ND2 ASN A 94 -8.906 0.702 -0.104 1.00 0.00 N ATOM 0 H ASN A 94 -5.572 2.953 -3.441 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.709 3.038 -2.778 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -6.587 1.677 -0.593 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -7.379 3.053 0.148 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -9.779 0.176 -0.142 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -8.176 0.433 0.556 1.00 0.00 H new ATOM 1418 N GLY A 95 -6.221 5.551 -2.078 1.00 0.00 N ATOM 1419 CA GLY A 95 -6.212 6.974 -1.781 1.00 0.00 C ATOM 1420 C GLY A 95 -5.121 7.315 -0.765 1.00 0.00 C ATOM 1421 O GLY A 95 -4.835 8.487 -0.526 1.00 0.00 O ATOM 0 H GLY A 95 -5.474 5.240 -2.699 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.049 7.540 -2.698 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -7.184 7.274 -1.390 1.00 0.00 H new ATOM 1425 N ARG A 96 -4.540 6.270 -0.194 1.00 0.00 N ATOM 1426 CA ARG A 96 -3.486 6.444 0.791 1.00 0.00 C ATOM 1427 C ARG A 96 -2.125 6.548 0.099 1.00 0.00 C ATOM 1428 O ARG A 96 -1.646 5.577 -0.484 1.00 0.00 O ATOM 1429 CB ARG A 96 -3.460 5.278 1.781 1.00 0.00 C ATOM 1430 CG ARG A 96 -4.556 5.431 2.838 1.00 0.00 C ATOM 1431 CD ARG A 96 -3.960 5.807 4.196 1.00 0.00 C ATOM 1432 NE ARG A 96 -4.850 5.346 5.284 1.00 0.00 N ATOM 1433 CZ ARG A 96 -5.904 6.039 5.737 1.00 0.00 C ATOM 1434 NH1 ARG A 96 -6.206 7.228 5.197 1.00 0.00 N ATOM 1435 NH2 ARG A 96 -6.657 5.542 6.728 1.00 0.00 N ATOM 0 H ARG A 96 -4.779 5.299 -0.395 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.691 7.365 1.337 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -3.595 4.338 1.245 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.485 5.231 2.267 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -5.265 6.197 2.524 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -5.113 4.498 2.927 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -2.973 5.357 4.307 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -3.826 6.887 4.257 1.00 0.00 H new ATOM 0 HE ARG A 96 -4.649 4.444 5.716 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -5.634 7.605 4.442 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -7.008 7.756 5.541 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.428 4.636 7.138 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -7.459 6.069 7.073 1.00 0.00 H new ATOM 1449 N LEU A 97 -1.542 7.734 0.187 1.00 0.00 N ATOM 1450 CA LEU A 97 -0.245 7.977 -0.423 1.00 0.00 C ATOM 1451 C LEU A 97 0.814 7.131 0.286 1.00 0.00 C ATOM 1452 O LEU A 97 0.884 7.118 1.514 1.00 0.00 O ATOM 1453 CB LEU A 97 0.070 9.474 -0.433 1.00 0.00 C ATOM 1454 CG LEU A 97 1.398 9.876 -1.078 1.00 0.00 C ATOM 1455 CD1 LEU A 97 1.165 10.611 -2.399 1.00 0.00 C ATOM 1456 CD2 LEU A 97 2.252 10.696 -0.109 1.00 0.00 C ATOM 0 H LEU A 97 -1.943 8.537 0.671 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.252 7.669 -1.469 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.736 9.991 -0.954 1.00 0.00 H new ATOM 0 HB3 LEU A 97 0.065 9.833 0.596 1.00 0.00 H new ATOM 0 HG LEU A 97 1.955 8.968 -1.308 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.125 10.886 -2.837 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.625 9.960 -3.087 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.579 11.512 -2.216 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.190 10.969 -0.592 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.714 11.600 0.175 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.462 10.104 0.782 1.00 0.00 H new ATOM 1468 N LEU A 98 1.612 6.444 -0.519 1.00 0.00 N ATOM 1469 CA LEU A 98 2.665 5.597 0.016 1.00 0.00 C ATOM 1470 C LEU A 98 3.983 6.373 0.026 1.00 0.00 C ATOM 1471 O LEU A 98 4.894 6.047 0.785 1.00 0.00 O ATOM 1472 CB LEU A 98 2.734 4.277 -0.755 1.00 0.00 C ATOM 1473 CG LEU A 98 1.411 3.526 -0.919 1.00 0.00 C ATOM 1474 CD1 LEU A 98 1.639 2.139 -1.521 1.00 0.00 C ATOM 1475 CD2 LEU A 98 0.651 3.458 0.407 1.00 0.00 C ATOM 0 H LEU A 98 1.550 6.457 -1.537 1.00 0.00 H new ATOM 0 HA LEU A 98 2.447 5.325 1.049 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.140 4.479 -1.746 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.441 3.620 -0.249 1.00 0.00 H new ATOM 0 HG LEU A 98 0.787 4.082 -1.619 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.683 1.627 -1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.107 2.240 -2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.290 1.560 -0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.285 2.919 0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.258 2.938 1.148 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.438 4.468 0.757 1.00 0.00 H new ATOM 1487 N GLN A 99 4.043 7.386 -0.827 1.00 0.00 N ATOM 1488 CA GLN A 99 5.234 8.211 -0.926 1.00 0.00 C ATOM 1489 C GLN A 99 5.604 8.777 0.446 1.00 0.00 C ATOM 1490 O GLN A 99 4.846 9.553 1.026 1.00 0.00 O ATOM 1491 CB GLN A 99 5.040 9.334 -1.948 1.00 0.00 C ATOM 1492 CG GLN A 99 5.592 8.930 -3.317 1.00 0.00 C ATOM 1493 CD GLN A 99 5.855 10.161 -4.186 1.00 0.00 C ATOM 1494 OE1 GLN A 99 5.540 11.284 -3.829 1.00 0.00 O ATOM 1495 NE2 GLN A 99 6.449 9.889 -5.345 1.00 0.00 N ATOM 0 H GLN A 99 3.285 7.653 -1.456 1.00 0.00 H new ATOM 0 HA GLN A 99 6.057 7.586 -1.273 1.00 0.00 H new ATOM 0 HB2 GLN A 99 3.980 9.572 -2.035 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.542 10.237 -1.601 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.516 8.367 -3.189 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.884 8.271 -3.819 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.686 8.926 -5.583 1.00 0.00 H new ATOM 0 HE22 GLN A 99 6.667 10.644 -5.996 1.00 0.00 H new ATOM 1504 N GLY A 100 6.769 8.367 0.926 1.00 0.00 N ATOM 1505 CA GLY A 100 7.248 8.823 2.220 1.00 0.00 C ATOM 1506 C GLY A 100 6.833 7.856 3.331 1.00 0.00 C ATOM 1507 O GLY A 100 7.532 7.721 4.334 1.00 0.00 O ATOM 0 H GLY A 100 7.395 7.724 0.442 1.00 0.00 H new ATOM 0 HA2 GLY A 100 8.334 8.913 2.198 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.850 9.816 2.430 1.00 0.00 H new ATOM 1511 N ALA A 101 5.699 7.207 3.113 1.00 0.00 N ATOM 1512 CA ALA A 101 5.183 6.256 4.084 1.00 0.00 C ATOM 1513 C ALA A 101 6.254 5.206 4.381 1.00 0.00 C ATOM 1514 O ALA A 101 6.956 4.756 3.477 1.00 0.00 O ATOM 1515 CB ALA A 101 3.889 5.636 3.552 1.00 0.00 C ATOM 0 H ALA A 101 5.123 7.320 2.279 1.00 0.00 H new ATOM 0 HA ALA A 101 4.943 6.756 5.022 1.00 0.00 H new ATOM 0 HB1 ALA A 101 3.501 4.923 4.279 1.00 0.00 H new ATOM 0 HB2 ALA A 101 3.151 6.421 3.385 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.091 5.122 2.612 1.00 0.00 H new ATOM 1521 N THR A 102 6.346 4.845 5.653 1.00 0.00 N ATOM 1522 CA THR A 102 7.321 3.855 6.081 1.00 0.00 C ATOM 1523 C THR A 102 6.855 2.448 5.700 1.00 0.00 C ATOM 1524 O THR A 102 5.718 2.263 5.269 1.00 0.00 O ATOM 1525 CB THR A 102 7.548 4.034 7.583 1.00 0.00 C ATOM 1526 OG1 THR A 102 6.429 3.387 8.183 1.00 0.00 O ATOM 1527 CG2 THR A 102 7.416 5.493 8.025 1.00 0.00 C ATOM 0 H THR A 102 5.762 5.220 6.401 1.00 0.00 H new ATOM 0 HA THR A 102 8.276 3.995 5.574 1.00 0.00 H new ATOM 0 HB THR A 102 8.538 3.663 7.847 1.00 0.00 H new ATOM 0 HG1 THR A 102 6.497 3.454 9.158 1.00 0.00 H new ATOM 0 HG21 THR A 102 7.586 5.565 9.099 1.00 0.00 H new ATOM 0 HG22 THR A 102 8.153 6.100 7.500 1.00 0.00 H new ATOM 0 HG23 THR A 102 6.415 5.855 7.792 1.00 0.00 H new ATOM 1535 N PHE A 103 7.757 1.494 5.874 1.00 0.00 N ATOM 1536 CA PHE A 103 7.452 0.109 5.554 1.00 0.00 C ATOM 1537 C PHE A 103 6.138 -0.327 6.204 1.00 0.00 C ATOM 1538 O PHE A 103 5.323 -0.999 5.574 1.00 0.00 O ATOM 1539 CB PHE A 103 8.593 -0.741 6.117 1.00 0.00 C ATOM 1540 CG PHE A 103 8.403 -2.246 5.918 1.00 0.00 C ATOM 1541 CD1 PHE A 103 7.683 -2.966 6.819 1.00 0.00 C ATOM 1542 CD2 PHE A 103 8.956 -2.864 4.839 1.00 0.00 C ATOM 1543 CE1 PHE A 103 7.507 -4.363 6.634 1.00 0.00 C ATOM 1544 CE2 PHE A 103 8.780 -4.261 4.655 1.00 0.00 C ATOM 1545 CZ PHE A 103 8.060 -4.981 5.555 1.00 0.00 C ATOM 0 H PHE A 103 8.699 1.652 6.232 1.00 0.00 H new ATOM 0 HA PHE A 103 7.349 -0.010 4.475 1.00 0.00 H new ATOM 0 HB2 PHE A 103 9.527 -0.437 5.644 1.00 0.00 H new ATOM 0 HB3 PHE A 103 8.694 -0.535 7.183 1.00 0.00 H new ATOM 0 HD1 PHE A 103 7.245 -2.475 7.676 1.00 0.00 H new ATOM 0 HD2 PHE A 103 9.528 -2.292 4.123 1.00 0.00 H new ATOM 0 HE1 PHE A 103 6.934 -4.935 7.349 1.00 0.00 H new ATOM 0 HE2 PHE A 103 9.219 -4.752 3.799 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.927 -6.043 5.414 1.00 0.00 H new ATOM 1555 N GLU A 104 5.972 0.073 7.456 1.00 0.00 N ATOM 1556 CA GLU A 104 4.771 -0.268 8.198 1.00 0.00 C ATOM 1557 C GLU A 104 3.565 0.486 7.633 1.00 0.00 C ATOM 1558 O GLU A 104 2.540 -0.118 7.324 1.00 0.00 O ATOM 1559 CB GLU A 104 4.947 0.020 9.690 1.00 0.00 C ATOM 1560 CG GLU A 104 5.935 -0.961 10.325 1.00 0.00 C ATOM 1561 CD GLU A 104 5.818 -0.946 11.851 1.00 0.00 C ATOM 1562 OE1 GLU A 104 4.800 -1.476 12.348 1.00 0.00 O ATOM 1563 OE2 GLU A 104 6.749 -0.406 12.486 1.00 0.00 O ATOM 0 H GLU A 104 6.650 0.631 7.975 1.00 0.00 H new ATOM 0 HA GLU A 104 4.591 -1.337 8.087 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.304 1.041 9.827 1.00 0.00 H new ATOM 0 HB3 GLU A 104 3.983 -0.052 10.194 1.00 0.00 H new ATOM 0 HG2 GLU A 104 5.745 -1.967 9.952 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.952 -0.700 10.032 1.00 0.00 H new ATOM 1570 N GLU A 105 3.729 1.796 7.515 1.00 0.00 N ATOM 1571 CA GLU A 105 2.667 2.639 6.993 1.00 0.00 C ATOM 1572 C GLU A 105 2.057 2.008 5.740 1.00 0.00 C ATOM 1573 O GLU A 105 0.837 1.897 5.628 1.00 0.00 O ATOM 1574 CB GLU A 105 3.181 4.050 6.701 1.00 0.00 C ATOM 1575 CG GLU A 105 3.237 4.889 7.979 1.00 0.00 C ATOM 1576 CD GLU A 105 3.160 6.383 7.659 1.00 0.00 C ATOM 1577 OE1 GLU A 105 4.225 6.946 7.323 1.00 0.00 O ATOM 1578 OE2 GLU A 105 2.040 6.928 7.757 1.00 0.00 O ATOM 0 H GLU A 105 4.581 2.294 7.772 1.00 0.00 H new ATOM 0 HA GLU A 105 1.888 2.721 7.751 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.174 3.994 6.255 1.00 0.00 H new ATOM 0 HB3 GLU A 105 2.531 4.534 5.972 1.00 0.00 H new ATOM 0 HG2 GLU A 105 2.413 4.612 8.637 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.160 4.676 8.518 1.00 0.00 H new ATOM 1585 N VAL A 106 2.933 1.610 4.829 1.00 0.00 N ATOM 1586 CA VAL A 106 2.495 0.993 3.588 1.00 0.00 C ATOM 1587 C VAL A 106 1.673 -0.257 3.908 1.00 0.00 C ATOM 1588 O VAL A 106 0.600 -0.460 3.342 1.00 0.00 O ATOM 1589 CB VAL A 106 3.702 0.703 2.694 1.00 0.00 C ATOM 1590 CG1 VAL A 106 3.286 -0.088 1.452 1.00 0.00 C ATOM 1591 CG2 VAL A 106 4.420 1.997 2.306 1.00 0.00 C ATOM 0 H VAL A 106 3.944 1.703 4.925 1.00 0.00 H new ATOM 0 HA VAL A 106 1.850 1.672 3.030 1.00 0.00 H new ATOM 0 HB VAL A 106 4.401 0.090 3.263 1.00 0.00 H new ATOM 0 HG11 VAL A 106 4.162 -0.281 0.833 1.00 0.00 H new ATOM 0 HG12 VAL A 106 2.841 -1.035 1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 106 2.558 0.488 0.881 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.274 1.763 1.671 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.732 2.646 1.765 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.766 2.505 3.206 1.00 0.00 H new ATOM 1601 N TYR A 107 2.208 -1.062 4.814 1.00 0.00 N ATOM 1602 CA TYR A 107 1.537 -2.287 5.216 1.00 0.00 C ATOM 1603 C TYR A 107 0.214 -1.982 5.921 1.00 0.00 C ATOM 1604 O TYR A 107 -0.837 -2.476 5.516 1.00 0.00 O ATOM 1605 CB TYR A 107 2.479 -2.979 6.203 1.00 0.00 C ATOM 1606 CG TYR A 107 1.901 -4.250 6.828 1.00 0.00 C ATOM 1607 CD1 TYR A 107 0.979 -4.159 7.850 1.00 0.00 C ATOM 1608 CD2 TYR A 107 2.302 -5.489 6.368 1.00 0.00 C ATOM 1609 CE1 TYR A 107 0.435 -5.356 8.438 1.00 0.00 C ATOM 1610 CE2 TYR A 107 1.758 -6.685 6.956 1.00 0.00 C ATOM 1611 CZ TYR A 107 0.851 -6.560 7.962 1.00 0.00 C ATOM 1612 OH TYR A 107 0.337 -7.690 8.518 1.00 0.00 O ATOM 0 H TYR A 107 3.098 -0.890 5.281 1.00 0.00 H new ATOM 0 HA TYR A 107 1.314 -2.905 4.346 1.00 0.00 H new ATOM 0 HB2 TYR A 107 3.407 -3.229 5.689 1.00 0.00 H new ATOM 0 HB3 TYR A 107 2.734 -2.279 6.998 1.00 0.00 H new ATOM 0 HD1 TYR A 107 0.665 -3.190 8.209 1.00 0.00 H new ATOM 0 HD2 TYR A 107 3.023 -5.561 5.567 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -0.287 -5.299 9.239 1.00 0.00 H new ATOM 0 HE2 TYR A 107 2.063 -7.660 6.606 1.00 0.00 H new ATOM 0 HH TYR A 107 0.723 -8.476 8.078 1.00 0.00 H new ATOM 1622 N ASN A 108 0.309 -1.169 6.963 1.00 0.00 N ATOM 1623 CA ASN A 108 -0.867 -0.793 7.728 1.00 0.00 C ATOM 1624 C ASN A 108 -2.015 -0.476 6.767 1.00 0.00 C ATOM 1625 O ASN A 108 -3.161 -0.846 7.020 1.00 0.00 O ATOM 1626 CB ASN A 108 -0.599 0.455 8.572 1.00 0.00 C ATOM 1627 CG ASN A 108 0.071 0.087 9.897 1.00 0.00 C ATOM 1628 OD1 ASN A 108 0.149 -1.067 10.284 1.00 0.00 O ATOM 1629 ND2 ASN A 108 0.549 1.131 10.569 1.00 0.00 N ATOM 0 H ASN A 108 1.183 -0.760 7.295 1.00 0.00 H new ATOM 0 HA ASN A 108 -1.122 -1.625 8.385 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.038 1.144 8.017 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.537 0.975 8.767 1.00 0.00 H new ATOM 0 HD21 ASN A 108 1.014 0.991 11.466 1.00 0.00 H new ATOM 0 HD22 ASN A 108 0.450 2.072 10.188 1.00 0.00 H new ATOM 1636 N ILE A 109 -1.668 0.204 5.685 1.00 0.00 N ATOM 1637 CA ILE A 109 -2.655 0.575 4.685 1.00 0.00 C ATOM 1638 C ILE A 109 -3.352 -0.687 4.171 1.00 0.00 C ATOM 1639 O ILE A 109 -4.508 -0.941 4.505 1.00 0.00 O ATOM 1640 CB ILE A 109 -2.010 1.414 3.580 1.00 0.00 C ATOM 1641 CG1 ILE A 109 -1.526 2.760 4.126 1.00 0.00 C ATOM 1642 CG2 ILE A 109 -2.962 1.585 2.395 1.00 0.00 C ATOM 1643 CD1 ILE A 109 -0.394 3.325 3.266 1.00 0.00 C ATOM 0 H ILE A 109 -0.717 0.508 5.478 1.00 0.00 H new ATOM 0 HA ILE A 109 -3.424 1.209 5.126 1.00 0.00 H new ATOM 0 HB ILE A 109 -1.133 0.881 3.213 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -2.356 3.466 4.151 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -1.181 2.637 5.153 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -2.479 2.185 1.624 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -3.215 0.606 1.988 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -3.871 2.086 2.728 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -0.069 4.281 3.675 1.00 0.00 H new ATOM 0 HD12 ILE A 109 0.444 2.628 3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -0.749 3.469 2.246 1.00 0.00 H new ATOM 1655 N ILE A 110 -2.619 -1.443 3.367 1.00 0.00 N ATOM 1656 CA ILE A 110 -3.153 -2.671 2.803 1.00 0.00 C ATOM 1657 C ILE A 110 -3.849 -3.472 3.905 1.00 0.00 C ATOM 1658 O ILE A 110 -4.953 -3.978 3.707 1.00 0.00 O ATOM 1659 CB ILE A 110 -2.053 -3.450 2.078 1.00 0.00 C ATOM 1660 CG1 ILE A 110 -1.517 -2.658 0.884 1.00 0.00 C ATOM 1661 CG2 ILE A 110 -2.544 -4.841 1.670 1.00 0.00 C ATOM 1662 CD1 ILE A 110 0.012 -2.690 0.847 1.00 0.00 C ATOM 0 H ILE A 110 -1.660 -1.229 3.093 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.905 -2.448 2.047 1.00 0.00 H new ATOM 0 HB ILE A 110 -1.222 -3.592 2.769 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -1.916 -3.074 -0.041 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -1.861 -1.626 0.944 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -1.743 -5.373 1.157 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -2.838 -5.398 2.559 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.400 -4.743 1.003 1.00 0.00 H new ATOM 0 HD11 ILE A 110 0.367 -2.120 -0.011 1.00 0.00 H new ATOM 0 HD12 ILE A 110 0.407 -2.251 1.763 1.00 0.00 H new ATOM 0 HD13 ILE A 110 0.352 -3.722 0.763 1.00 0.00 H new ATOM 1674 N LEU A 111 -3.176 -3.563 5.043 1.00 0.00 N ATOM 1675 CA LEU A 111 -3.716 -4.294 6.176 1.00 0.00 C ATOM 1676 C LEU A 111 -5.038 -3.654 6.606 1.00 0.00 C ATOM 1677 O LEU A 111 -5.963 -4.352 7.020 1.00 0.00 O ATOM 1678 CB LEU A 111 -2.681 -4.381 7.300 1.00 0.00 C ATOM 1679 CG LEU A 111 -3.158 -5.027 8.602 1.00 0.00 C ATOM 1680 CD1 LEU A 111 -3.836 -3.998 9.509 1.00 0.00 C ATOM 1681 CD2 LEU A 111 -4.065 -6.227 8.319 1.00 0.00 C ATOM 0 H LEU A 111 -2.261 -3.142 5.204 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.936 -5.324 5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.821 -4.942 6.933 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.332 -3.373 7.524 1.00 0.00 H new ATOM 0 HG LEU A 111 -2.285 -5.402 9.137 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.166 -4.484 10.427 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.129 -3.205 9.752 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -4.697 -3.571 8.995 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.390 -6.668 9.261 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -4.936 -5.899 7.752 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.515 -6.970 7.741 1.00 0.00 H new ATOM 1693 N GLU A 112 -5.085 -2.335 6.493 1.00 0.00 N ATOM 1694 CA GLU A 112 -6.278 -1.594 6.865 1.00 0.00 C ATOM 1695 C GLU A 112 -7.347 -1.728 5.778 1.00 0.00 C ATOM 1696 O GLU A 112 -8.539 -1.777 6.077 1.00 0.00 O ATOM 1697 CB GLU A 112 -5.950 -0.124 7.134 1.00 0.00 C ATOM 1698 CG GLU A 112 -5.247 0.043 8.482 1.00 0.00 C ATOM 1699 CD GLU A 112 -6.096 0.877 9.444 1.00 0.00 C ATOM 1700 OE1 GLU A 112 -7.172 0.374 9.832 1.00 0.00 O ATOM 1701 OE2 GLU A 112 -5.650 1.998 9.768 1.00 0.00 O ATOM 0 H GLU A 112 -4.316 -1.760 6.149 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.672 -2.018 7.789 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -5.314 0.262 6.338 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -6.867 0.465 7.123 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.053 -0.937 8.919 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -4.280 0.524 8.335 1.00 0.00 H new ATOM 1708 N SER A 113 -6.880 -1.782 4.539 1.00 0.00 N ATOM 1709 CA SER A 113 -7.781 -1.909 3.406 1.00 0.00 C ATOM 1710 C SER A 113 -7.975 -3.385 3.054 1.00 0.00 C ATOM 1711 O SER A 113 -8.293 -3.719 1.913 1.00 0.00 O ATOM 1712 CB SER A 113 -7.252 -1.140 2.193 1.00 0.00 C ATOM 1713 OG SER A 113 -7.217 0.266 2.426 1.00 0.00 O ATOM 0 H SER A 113 -5.890 -1.740 4.295 1.00 0.00 H new ATOM 0 HA SER A 113 -8.743 -1.479 3.685 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.250 -1.492 1.949 1.00 0.00 H new ATOM 0 HB3 SER A 113 -7.882 -1.349 1.328 1.00 0.00 H new ATOM 0 HG SER A 113 -6.599 0.687 1.793 1.00 0.00 H new ATOM 1719 N LYS A 114 -7.777 -4.230 4.055 1.00 0.00 N ATOM 1720 CA LYS A 114 -7.926 -5.663 3.866 1.00 0.00 C ATOM 1721 C LYS A 114 -9.409 -5.998 3.694 1.00 0.00 C ATOM 1722 O LYS A 114 -9.789 -6.675 2.740 1.00 0.00 O ATOM 1723 CB LYS A 114 -7.251 -6.427 5.007 1.00 0.00 C ATOM 1724 CG LYS A 114 -5.865 -6.922 4.590 1.00 0.00 C ATOM 1725 CD LYS A 114 -5.314 -7.929 5.603 1.00 0.00 C ATOM 1726 CE LYS A 114 -6.020 -9.280 5.472 1.00 0.00 C ATOM 1727 NZ LYS A 114 -5.980 -10.012 6.757 1.00 0.00 N ATOM 0 H LYS A 114 -7.515 -3.950 5.000 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.419 -5.982 2.956 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -7.163 -5.781 5.880 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -7.871 -7.274 5.299 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -5.922 -7.386 3.605 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -5.183 -6.076 4.505 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.243 -8.058 5.447 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.445 -7.542 6.614 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.055 -9.128 5.165 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.541 -9.874 4.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -6.463 -10.927 6.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.991 -10.173 7.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.458 -9.451 7.491 1.00 0.00 H new ATOM 1741 N PRO A 115 -10.227 -5.497 4.658 1.00 0.00 N ATOM 1742 CA PRO A 115 -11.660 -5.737 4.622 1.00 0.00 C ATOM 1743 C PRO A 115 -12.333 -4.874 3.553 1.00 0.00 C ATOM 1744 O PRO A 115 -13.432 -5.189 3.098 1.00 0.00 O ATOM 1745 CB PRO A 115 -12.146 -5.426 6.029 1.00 0.00 C ATOM 1746 CG PRO A 115 -11.055 -4.584 6.670 1.00 0.00 C ATOM 1747 CD PRO A 115 -9.812 -4.692 5.803 1.00 0.00 C ATOM 0 HA PRO A 115 -11.909 -6.762 4.346 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -13.093 -4.886 6.005 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -12.316 -6.342 6.595 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -11.374 -3.545 6.752 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -10.847 -4.935 7.681 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -9.461 -3.709 5.489 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -8.992 -5.165 6.343 1.00 0.00 H new ATOM 1755 N GLU A 116 -11.647 -3.803 3.184 1.00 0.00 N ATOM 1756 CA GLU A 116 -12.165 -2.892 2.177 1.00 0.00 C ATOM 1757 C GLU A 116 -12.787 -3.678 1.020 1.00 0.00 C ATOM 1758 O GLU A 116 -12.275 -4.727 0.631 1.00 0.00 O ATOM 1759 CB GLU A 116 -11.069 -1.951 1.673 1.00 0.00 C ATOM 1760 CG GLU A 116 -11.195 -0.569 2.318 1.00 0.00 C ATOM 1761 CD GLU A 116 -11.962 0.393 1.408 1.00 0.00 C ATOM 1762 OE1 GLU A 116 -11.680 0.369 0.191 1.00 0.00 O ATOM 1763 OE2 GLU A 116 -12.813 1.130 1.951 1.00 0.00 O ATOM 0 H GLU A 116 -10.736 -3.545 3.564 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.942 -2.280 2.634 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.090 -2.374 1.898 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.135 -1.858 0.589 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.708 -0.656 3.276 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.203 -0.168 2.523 1.00 0.00 H new ATOM 1770 N PRO A 117 -13.911 -3.127 0.489 1.00 0.00 N ATOM 1771 CA PRO A 117 -14.608 -3.764 -0.615 1.00 0.00 C ATOM 1772 C PRO A 117 -13.849 -3.568 -1.929 1.00 0.00 C ATOM 1773 O PRO A 117 -13.895 -4.425 -2.810 1.00 0.00 O ATOM 1774 CB PRO A 117 -15.989 -3.131 -0.626 1.00 0.00 C ATOM 1775 CG PRO A 117 -15.863 -1.841 0.167 1.00 0.00 C ATOM 1776 CD PRO A 117 -14.546 -1.886 0.924 1.00 0.00 C ATOM 0 HA PRO A 117 -14.681 -4.845 -0.498 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -16.319 -2.932 -1.646 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -16.727 -3.795 -0.176 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -15.891 -0.979 -0.499 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -16.698 -1.736 0.860 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -13.925 -1.021 0.691 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -14.708 -1.881 2.002 1.00 0.00 H new ATOM 1784 N GLN A 118 -13.169 -2.434 -2.019 1.00 0.00 N ATOM 1785 CA GLN A 118 -12.401 -2.115 -3.210 1.00 0.00 C ATOM 1786 C GLN A 118 -11.072 -1.462 -2.826 1.00 0.00 C ATOM 1787 O GLN A 118 -10.934 -0.926 -1.727 1.00 0.00 O ATOM 1788 CB GLN A 118 -13.202 -1.214 -4.153 1.00 0.00 C ATOM 1789 CG GLN A 118 -13.378 0.184 -3.558 1.00 0.00 C ATOM 1790 CD GLN A 118 -14.663 0.839 -4.067 1.00 0.00 C ATOM 1791 OE1 GLN A 118 -15.577 1.141 -3.317 1.00 0.00 O ATOM 1792 NE2 GLN A 118 -14.683 1.042 -5.382 1.00 0.00 N ATOM 0 H GLN A 118 -13.134 -1.725 -1.286 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.187 -3.043 -3.740 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.692 -1.143 -5.114 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -14.179 -1.658 -4.343 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -13.405 0.119 -2.470 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -12.521 0.805 -3.819 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -13.884 0.766 -5.953 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -15.497 1.474 -5.819 1.00 0.00 H new ATOM 1801 N VAL A 119 -10.127 -1.527 -3.753 1.00 0.00 N ATOM 1802 CA VAL A 119 -8.814 -0.949 -3.525 1.00 0.00 C ATOM 1803 C VAL A 119 -8.350 -0.232 -4.794 1.00 0.00 C ATOM 1804 O VAL A 119 -8.089 -0.870 -5.812 1.00 0.00 O ATOM 1805 CB VAL A 119 -7.839 -2.033 -3.060 1.00 0.00 C ATOM 1806 CG1 VAL A 119 -6.503 -1.421 -2.632 1.00 0.00 C ATOM 1807 CG2 VAL A 119 -8.446 -2.870 -1.933 1.00 0.00 C ATOM 0 H VAL A 119 -10.245 -1.971 -4.664 1.00 0.00 H new ATOM 0 HA VAL A 119 -8.857 -0.206 -2.729 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.648 -2.697 -3.903 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.828 -2.212 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.060 -0.890 -3.474 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.669 -0.724 -1.810 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -7.732 -3.633 -1.621 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -8.680 -2.225 -1.086 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -9.358 -3.350 -2.287 1.00 0.00 H new ATOM 1817 N GLU A 120 -8.263 1.086 -4.691 1.00 0.00 N ATOM 1818 CA GLU A 120 -7.835 1.898 -5.818 1.00 0.00 C ATOM 1819 C GLU A 120 -6.342 2.212 -5.710 1.00 0.00 C ATOM 1820 O GLU A 120 -5.935 3.033 -4.889 1.00 0.00 O ATOM 1821 CB GLU A 120 -8.660 3.183 -5.914 1.00 0.00 C ATOM 1822 CG GLU A 120 -8.251 4.008 -7.135 1.00 0.00 C ATOM 1823 CD GLU A 120 -8.489 5.500 -6.893 1.00 0.00 C ATOM 1824 OE1 GLU A 120 -9.655 5.922 -7.051 1.00 0.00 O ATOM 1825 OE2 GLU A 120 -7.499 6.185 -6.556 1.00 0.00 O ATOM 0 H GLU A 120 -8.481 1.612 -3.845 1.00 0.00 H new ATOM 0 HA GLU A 120 -8.001 1.330 -6.733 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -9.720 2.935 -5.977 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -8.524 3.775 -5.009 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -7.198 3.836 -7.359 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -8.820 3.682 -8.006 1.00 0.00 H new ATOM 1832 N LEU A 121 -5.566 1.543 -6.550 1.00 0.00 N ATOM 1833 CA LEU A 121 -4.126 1.741 -6.558 1.00 0.00 C ATOM 1834 C LEU A 121 -3.783 2.918 -7.473 1.00 0.00 C ATOM 1835 O LEU A 121 -4.591 3.313 -8.312 1.00 0.00 O ATOM 1836 CB LEU A 121 -3.409 0.442 -6.932 1.00 0.00 C ATOM 1837 CG LEU A 121 -3.630 -0.742 -5.988 1.00 0.00 C ATOM 1838 CD1 LEU A 121 -2.431 -1.693 -6.012 1.00 0.00 C ATOM 1839 CD2 LEU A 121 -3.951 -0.261 -4.572 1.00 0.00 C ATOM 0 H LEU A 121 -5.907 0.863 -7.230 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.771 1.998 -5.560 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.729 0.149 -7.932 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.339 0.643 -6.986 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.495 -1.304 -6.341 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -2.613 -2.526 -5.333 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.289 -2.074 -7.023 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -1.535 -1.157 -5.697 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -4.104 -1.122 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -3.122 0.337 -4.194 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -4.857 0.345 -4.590 1.00 0.00 H new ATOM 1851 N VAL A 122 -2.583 3.445 -7.281 1.00 0.00 N ATOM 1852 CA VAL A 122 -2.123 4.569 -8.078 1.00 0.00 C ATOM 1853 C VAL A 122 -0.608 4.470 -8.265 1.00 0.00 C ATOM 1854 O VAL A 122 0.156 4.781 -7.352 1.00 0.00 O ATOM 1855 CB VAL A 122 -2.561 5.885 -7.430 1.00 0.00 C ATOM 1856 CG1 VAL A 122 -2.229 7.076 -8.331 1.00 0.00 C ATOM 1857 CG2 VAL A 122 -4.051 5.856 -7.084 1.00 0.00 C ATOM 0 H VAL A 122 -1.915 3.114 -6.585 1.00 0.00 H new ATOM 0 HA VAL A 122 -2.575 4.544 -9.069 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.004 6.003 -6.500 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.550 7.999 -7.848 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.153 7.113 -8.504 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.746 6.967 -9.284 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.336 6.803 -6.625 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.633 5.704 -7.993 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.247 5.041 -6.387 1.00 0.00 H new ATOM 1867 N VAL A 123 -0.217 4.037 -9.455 1.00 0.00 N ATOM 1868 CA VAL A 123 1.193 3.893 -9.773 1.00 0.00 C ATOM 1869 C VAL A 123 1.600 4.981 -10.769 1.00 0.00 C ATOM 1870 O VAL A 123 0.753 5.540 -11.463 1.00 0.00 O ATOM 1871 CB VAL A 123 1.472 2.479 -10.285 1.00 0.00 C ATOM 1872 CG1 VAL A 123 0.384 2.023 -11.260 1.00 0.00 C ATOM 1873 CG2 VAL A 123 2.857 2.392 -10.930 1.00 0.00 C ATOM 0 H VAL A 123 -0.853 3.781 -10.211 1.00 0.00 H new ATOM 0 HA VAL A 123 1.802 4.026 -8.879 1.00 0.00 H new ATOM 0 HB VAL A 123 1.458 1.805 -9.429 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.607 1.015 -11.609 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -0.582 2.027 -10.755 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.351 2.702 -12.112 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.030 1.376 -11.285 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.911 3.084 -11.770 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.618 2.653 -10.195 1.00 0.00 H new ATOM 1883 N SER A 124 2.897 5.248 -10.807 1.00 0.00 N ATOM 1884 CA SER A 124 3.427 6.259 -11.707 1.00 0.00 C ATOM 1885 C SER A 124 4.509 5.649 -12.600 1.00 0.00 C ATOM 1886 O SER A 124 5.421 4.984 -12.111 1.00 0.00 O ATOM 1887 CB SER A 124 3.990 7.449 -10.927 1.00 0.00 C ATOM 1888 OG SER A 124 5.157 7.986 -11.544 1.00 0.00 O ATOM 0 H SER A 124 3.597 4.782 -10.229 1.00 0.00 H new ATOM 0 HA SER A 124 2.612 6.622 -12.333 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.229 8.226 -10.852 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.228 7.136 -9.910 1.00 0.00 H new ATOM 0 HG SER A 124 5.486 8.745 -11.018 1.00 0.00 H new ATOM 1894 N ARG A 125 4.373 5.898 -13.894 1.00 0.00 N ATOM 1895 CA ARG A 125 5.328 5.381 -14.860 1.00 0.00 C ATOM 1896 C ARG A 125 6.114 6.530 -15.495 1.00 0.00 C ATOM 1897 O ARG A 125 5.685 7.682 -15.447 1.00 0.00 O ATOM 1898 CB ARG A 125 4.622 4.586 -15.960 1.00 0.00 C ATOM 1899 CG ARG A 125 5.139 3.147 -16.014 1.00 0.00 C ATOM 1900 CD ARG A 125 4.178 2.247 -16.793 1.00 0.00 C ATOM 1901 NE ARG A 125 4.121 0.906 -16.169 1.00 0.00 N ATOM 1902 CZ ARG A 125 3.634 -0.184 -16.776 1.00 0.00 C ATOM 1903 NH1 ARG A 125 3.159 -0.100 -18.026 1.00 0.00 N ATOM 1904 NH2 ARG A 125 3.622 -1.360 -16.133 1.00 0.00 N ATOM 0 H ARG A 125 3.616 6.451 -14.296 1.00 0.00 H new ATOM 0 HA ARG A 125 6.011 4.718 -14.330 1.00 0.00 H new ATOM 0 HB2 ARG A 125 3.547 4.584 -15.779 1.00 0.00 H new ATOM 0 HB3 ARG A 125 4.782 5.070 -16.923 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.122 3.128 -16.484 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.262 2.763 -15.001 1.00 0.00 H new ATOM 0 HD2 ARG A 125 3.183 2.692 -16.810 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.506 2.161 -17.829 1.00 0.00 H new ATOM 0 HE ARG A 125 4.475 0.806 -15.218 1.00 0.00 H new ATOM 0 HH11 ARG A 125 3.168 0.795 -18.516 1.00 0.00 H new ATOM 0 HH12 ARG A 125 2.788 -0.931 -18.488 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.984 -1.425 -15.181 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.251 -2.190 -16.595 1.00 0.00 H new ATOM 1918 N SER A 126 7.251 6.176 -16.076 1.00 0.00 N ATOM 1919 CA SER A 126 8.101 7.163 -16.719 1.00 0.00 C ATOM 1920 C SER A 126 8.006 7.024 -18.240 1.00 0.00 C ATOM 1921 O SER A 126 8.407 6.004 -18.799 1.00 0.00 O ATOM 1922 CB SER A 126 9.555 7.020 -16.263 1.00 0.00 C ATOM 1923 OG SER A 126 10.264 6.055 -17.035 1.00 0.00 O ATOM 0 H SER A 126 7.603 5.219 -16.115 1.00 0.00 H new ATOM 0 HA SER A 126 7.753 8.154 -16.428 1.00 0.00 H new ATOM 0 HB2 SER A 126 10.056 7.985 -16.340 1.00 0.00 H new ATOM 0 HB3 SER A 126 9.579 6.732 -15.212 1.00 0.00 H new ATOM 0 HG SER A 126 9.633 5.554 -17.592 1.00 0.00 H new