USER MOD reduce.3.24.130724 H: found=0, std=0, add=512, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 513 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 62 THR OG1 : rot 180:sc= 0.147 USER MOD Set 1.2: A 65 LYS NZ :NH3+ -153:sc= 0.933 (180deg=0.5) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot -49:sc= -3.08 USER MOD Single : A 22 MET CE :methyl -168:sc= -6.94! (180deg=-8.85!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 30:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0.0463 K(o=0.046,f=-0.72) USER MOD Single : A 29 ASN : amide:sc= -0.203 K(o=-0.2,f=-3.1) USER MOD Single : A 30 GLN : amide:sc= -4.96! C(o=-5!,f=-5.7!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 151:sc= 0.181 (180deg=0.00101) USER MOD Single : A 42 ASN : amide:sc= 1.2 K(o=1.2,f=-0.084) USER MOD Single : A 44 CYS SG : rot 180:sc= -1.75 USER MOD Single : A 45 ASN : amide:sc= -2.86! C(o=-2.9!,f=-12!) USER MOD Single : A 49 GLN : amide:sc= -0.397 X(o=-0.4,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= -0.143 (180deg=-0.143) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= -0.129 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 72 ASN : amide:sc= -1.05 K(o=-1,f=-0.083) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 166 N TRP A 14 11.501 -11.035 -2.170 1.00 0.00 N ATOM 167 CA TRP A 14 10.389 -11.677 -2.863 1.00 0.00 C ATOM 168 C TRP A 14 10.734 -11.932 -4.326 1.00 0.00 C ATOM 169 O TRP A 14 10.561 -11.059 -5.176 1.00 0.00 O ATOM 170 CB TRP A 14 9.133 -10.810 -2.767 1.00 0.00 C ATOM 171 CG TRP A 14 8.290 -11.117 -1.566 1.00 0.00 C ATOM 172 CD1 TRP A 14 7.933 -10.251 -0.572 1.00 0.00 C ATOM 173 CD2 TRP A 14 7.700 -12.378 -1.233 1.00 0.00 C ATOM 174 NE1 TRP A 14 7.157 -10.898 0.359 1.00 0.00 N ATOM 175 CE2 TRP A 14 6.999 -12.204 -0.024 1.00 0.00 C ATOM 176 CE3 TRP A 14 7.695 -13.637 -1.839 1.00 0.00 C ATOM 177 CZ2 TRP A 14 6.302 -13.242 0.588 1.00 0.00 C ATOM 178 CZ3 TRP A 14 7.003 -14.667 -1.230 1.00 0.00 C ATOM 179 CH2 TRP A 14 6.314 -14.465 -0.027 1.00 0.00 C ATOM 0 HA TRP A 14 10.198 -12.636 -2.381 1.00 0.00 H new ATOM 0 HB2 TRP A 14 9.426 -9.761 -2.738 1.00 0.00 H new ATOM 0 HB3 TRP A 14 8.534 -10.949 -3.667 1.00 0.00 H new ATOM 0 HD1 TRP A 14 8.219 -9.211 -0.525 1.00 0.00 H new ATOM 0 HE1 TRP A 14 6.763 -10.475 1.199 1.00 0.00 H new ATOM 0 HE3 TRP A 14 8.222 -13.802 -2.767 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 5.770 -13.088 1.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.993 -15.644 -1.689 1.00 0.00 H new ATOM 0 HH2 TRP A 14 5.782 -15.290 0.424 1.00 0.00 H new ATOM 190 N ARG A 15 11.223 -13.135 -4.613 1.00 0.00 N ATOM 191 CA ARG A 15 11.593 -13.504 -5.973 1.00 0.00 C ATOM 192 C ARG A 15 10.433 -13.267 -6.936 1.00 0.00 C ATOM 193 O ARG A 15 9.270 -13.465 -6.584 1.00 0.00 O ATOM 194 CB ARG A 15 12.023 -14.971 -6.027 1.00 0.00 C ATOM 195 CG ARG A 15 13.379 -15.233 -5.392 1.00 0.00 C ATOM 196 CD ARG A 15 13.357 -14.953 -3.897 1.00 0.00 C ATOM 197 NE ARG A 15 12.277 -15.669 -3.223 1.00 0.00 N ATOM 198 CZ ARG A 15 12.064 -15.612 -1.913 1.00 0.00 C ATOM 199 NH1 ARG A 15 12.852 -14.877 -1.141 1.00 0.00 N ATOM 200 NH2 ARG A 15 11.060 -16.292 -1.372 1.00 0.00 N ATOM 0 H ARG A 15 11.372 -13.870 -3.921 1.00 0.00 H new ATOM 0 HA ARG A 15 12.430 -12.876 -6.278 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.272 -15.580 -5.523 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.050 -15.295 -7.067 1.00 0.00 H new ATOM 0 HG2 ARG A 15 13.669 -16.269 -5.565 1.00 0.00 H new ATOM 0 HG3 ARG A 15 14.133 -14.607 -5.870 1.00 0.00 H new ATOM 0 HD2 ARG A 15 14.312 -15.243 -3.460 1.00 0.00 H new ATOM 0 HD3 ARG A 15 13.242 -13.882 -3.730 1.00 0.00 H new ATOM 0 HE ARG A 15 11.653 -16.244 -3.789 1.00 0.00 H new ATOM 0 HH11 ARG A 15 13.624 -14.353 -1.552 1.00 0.00 H new ATOM 0 HH12 ARG A 15 12.686 -14.835 -0.135 1.00 0.00 H new ATOM 0 HH21 ARG A 15 10.451 -16.859 -1.962 1.00 0.00 H new ATOM 0 HH22 ARG A 15 10.897 -16.247 -0.366 1.00 0.00 H new ATOM 214 N LYS A 16 10.757 -12.842 -8.152 1.00 0.00 N ATOM 215 CA LYS A 16 9.744 -12.578 -9.167 1.00 0.00 C ATOM 216 C LYS A 16 8.875 -13.810 -9.401 1.00 0.00 C ATOM 217 O LYS A 16 7.684 -13.695 -9.687 1.00 0.00 O ATOM 218 CB LYS A 16 10.405 -12.150 -10.479 1.00 0.00 C ATOM 219 CG LYS A 16 9.468 -11.415 -11.421 1.00 0.00 C ATOM 220 CD LYS A 16 9.331 -9.950 -11.040 1.00 0.00 C ATOM 221 CE LYS A 16 8.658 -9.148 -12.142 1.00 0.00 C ATOM 222 NZ LYS A 16 8.242 -7.797 -11.672 1.00 0.00 N ATOM 0 H LYS A 16 11.715 -12.673 -8.459 1.00 0.00 H new ATOM 0 HA LYS A 16 9.108 -11.769 -8.808 1.00 0.00 H new ATOM 0 HB2 LYS A 16 11.257 -11.509 -10.254 1.00 0.00 H new ATOM 0 HB3 LYS A 16 10.795 -13.033 -10.984 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.842 -11.493 -12.442 1.00 0.00 H new ATOM 0 HG3 LYS A 16 8.487 -11.890 -11.404 1.00 0.00 H new ATOM 0 HD2 LYS A 16 8.751 -9.865 -10.121 1.00 0.00 H new ATOM 0 HD3 LYS A 16 10.317 -9.533 -10.835 1.00 0.00 H new ATOM 0 HE2 LYS A 16 9.342 -9.044 -12.985 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.785 -9.691 -12.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.787 -7.282 -12.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 7.570 -7.895 -10.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 9.078 -7.269 -11.350 1.00 0.00 H new ATOM 236 N GLU A 17 9.479 -14.988 -9.276 1.00 0.00 N ATOM 237 CA GLU A 17 8.759 -16.240 -9.474 1.00 0.00 C ATOM 238 C GLU A 17 7.690 -16.428 -8.402 1.00 0.00 C ATOM 239 O GLU A 17 6.553 -16.794 -8.702 1.00 0.00 O ATOM 240 CB GLU A 17 9.731 -17.422 -9.453 1.00 0.00 C ATOM 241 CG GLU A 17 10.928 -17.241 -10.371 1.00 0.00 C ATOM 242 CD GLU A 17 10.572 -17.410 -11.835 1.00 0.00 C ATOM 243 OE1 GLU A 17 9.577 -16.798 -12.278 1.00 0.00 O ATOM 244 OE2 GLU A 17 11.288 -18.154 -12.538 1.00 0.00 O ATOM 0 H GLU A 17 10.465 -15.101 -9.039 1.00 0.00 H new ATOM 0 HA GLU A 17 8.270 -16.198 -10.447 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.085 -17.572 -8.433 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.196 -18.327 -9.741 1.00 0.00 H new ATOM 0 HG2 GLU A 17 11.353 -16.249 -10.217 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.699 -17.963 -10.103 1.00 0.00 H new ATOM 251 N CYS A 18 8.063 -16.176 -7.152 1.00 0.00 N ATOM 252 CA CYS A 18 7.136 -16.318 -6.035 1.00 0.00 C ATOM 253 C CYS A 18 6.058 -15.240 -6.081 1.00 0.00 C ATOM 254 O CYS A 18 4.951 -15.433 -5.577 1.00 0.00 O ATOM 255 CB CYS A 18 7.892 -16.244 -4.707 1.00 0.00 C ATOM 256 SG CYS A 18 9.352 -17.307 -4.628 1.00 0.00 S ATOM 0 H CYS A 18 9.000 -15.873 -6.887 1.00 0.00 H new ATOM 0 HA CYS A 18 6.653 -17.292 -6.117 1.00 0.00 H new ATOM 0 HB2 CYS A 18 8.197 -15.212 -4.532 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.213 -16.517 -3.899 1.00 0.00 H new ATOM 0 HG CYS A 18 9.040 -18.503 -5.030 1.00 0.00 H new ATOM 262 N LEU A 19 6.389 -14.106 -6.688 1.00 0.00 N ATOM 263 CA LEU A 19 5.450 -12.995 -6.799 1.00 0.00 C ATOM 264 C LEU A 19 4.366 -13.300 -7.829 1.00 0.00 C ATOM 265 O LEU A 19 3.195 -12.981 -7.625 1.00 0.00 O ATOM 266 CB LEU A 19 6.189 -11.713 -7.184 1.00 0.00 C ATOM 267 CG LEU A 19 7.111 -11.124 -6.116 1.00 0.00 C ATOM 268 CD1 LEU A 19 7.737 -9.827 -6.607 1.00 0.00 C ATOM 269 CD2 LEU A 19 6.348 -10.892 -4.820 1.00 0.00 C ATOM 0 H LEU A 19 7.301 -13.931 -7.111 1.00 0.00 H new ATOM 0 HA LEU A 19 4.975 -12.855 -5.828 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.781 -11.913 -8.077 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.450 -10.958 -7.454 1.00 0.00 H new ATOM 0 HG LEU A 19 7.910 -11.839 -5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.390 -9.422 -5.834 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.319 -10.022 -7.508 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.951 -9.106 -6.832 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.021 -10.473 -4.072 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.527 -10.198 -5.000 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.949 -11.840 -4.458 1.00 0.00 H new ATOM 281 N ALA A 20 4.765 -13.921 -8.934 1.00 0.00 N ATOM 282 CA ALA A 20 3.828 -14.272 -9.993 1.00 0.00 C ATOM 283 C ALA A 20 2.785 -15.267 -9.496 1.00 0.00 C ATOM 284 O ALA A 20 1.613 -15.189 -9.863 1.00 0.00 O ATOM 285 CB ALA A 20 4.575 -14.842 -11.190 1.00 0.00 C ATOM 0 H ALA A 20 5.731 -14.191 -9.119 1.00 0.00 H new ATOM 0 HA ALA A 20 3.309 -13.364 -10.300 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.863 -15.100 -11.974 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.277 -14.099 -11.568 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.120 -15.736 -10.887 1.00 0.00 H new ATOM 291 N VAL A 21 3.219 -16.203 -8.657 1.00 0.00 N ATOM 292 CA VAL A 21 2.322 -17.213 -8.109 1.00 0.00 C ATOM 293 C VAL A 21 1.353 -16.600 -7.103 1.00 0.00 C ATOM 294 O VAL A 21 0.163 -16.914 -7.102 1.00 0.00 O ATOM 295 CB VAL A 21 3.106 -18.347 -7.423 1.00 0.00 C ATOM 296 CG1 VAL A 21 2.158 -19.424 -6.918 1.00 0.00 C ATOM 297 CG2 VAL A 21 4.134 -18.936 -8.377 1.00 0.00 C ATOM 0 H VAL A 21 4.186 -16.282 -8.342 1.00 0.00 H new ATOM 0 HA VAL A 21 1.760 -17.625 -8.947 1.00 0.00 H new ATOM 0 HB VAL A 21 3.635 -17.931 -6.565 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.731 -20.216 -6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.464 -18.990 -6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.599 -19.839 -7.757 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.679 -19.736 -7.876 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.628 -19.337 -9.255 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.833 -18.158 -8.684 1.00 0.00 H new ATOM 307 N MET A 22 1.871 -15.724 -6.249 1.00 0.00 N ATOM 308 CA MET A 22 1.051 -15.065 -5.239 1.00 0.00 C ATOM 309 C MET A 22 -0.055 -14.241 -5.890 1.00 0.00 C ATOM 310 O MET A 22 -1.184 -14.205 -5.401 1.00 0.00 O ATOM 311 CB MET A 22 1.918 -14.167 -4.354 1.00 0.00 C ATOM 312 CG MET A 22 2.587 -14.908 -3.208 1.00 0.00 C ATOM 313 SD MET A 22 2.986 -13.827 -1.821 1.00 0.00 S ATOM 314 CE MET A 22 4.464 -13.021 -2.435 1.00 0.00 C ATOM 0 H MET A 22 2.854 -15.454 -6.236 1.00 0.00 H new ATOM 0 HA MET A 22 0.590 -15.836 -4.621 1.00 0.00 H new ATOM 0 HB2 MET A 22 2.685 -13.696 -4.969 1.00 0.00 H new ATOM 0 HB3 MET A 22 1.300 -13.366 -3.947 1.00 0.00 H new ATOM 0 HG2 MET A 22 1.930 -15.707 -2.864 1.00 0.00 H new ATOM 0 HG3 MET A 22 3.500 -15.380 -3.570 1.00 0.00 H new ATOM 0 HE1 MET A 22 4.951 -12.485 -1.620 1.00 0.00 H new ATOM 0 HE2 MET A 22 5.147 -13.770 -2.836 1.00 0.00 H new ATOM 0 HE3 MET A 22 4.194 -12.317 -3.222 1.00 0.00 H new ATOM 324 N GLU A 23 0.277 -13.580 -6.995 1.00 0.00 N ATOM 325 CA GLU A 23 -0.690 -12.756 -7.711 1.00 0.00 C ATOM 326 C GLU A 23 -1.821 -13.611 -8.277 1.00 0.00 C ATOM 327 O GLU A 23 -2.974 -13.184 -8.319 1.00 0.00 O ATOM 328 CB GLU A 23 -0.001 -11.990 -8.842 1.00 0.00 C ATOM 329 CG GLU A 23 0.557 -10.643 -8.413 1.00 0.00 C ATOM 330 CD GLU A 23 1.735 -10.203 -9.260 1.00 0.00 C ATOM 331 OE1 GLU A 23 2.417 -11.081 -9.828 1.00 0.00 O ATOM 332 OE2 GLU A 23 1.975 -8.981 -9.355 1.00 0.00 O ATOM 0 H GLU A 23 1.207 -13.599 -7.413 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.115 -12.043 -7.004 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.810 -12.599 -9.241 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.713 -11.837 -9.653 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.230 -9.892 -8.474 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.865 -10.698 -7.369 1.00 0.00 H new ATOM 339 N SER A 24 -1.481 -14.821 -8.710 1.00 0.00 N ATOM 340 CA SER A 24 -2.466 -15.734 -9.277 1.00 0.00 C ATOM 341 C SER A 24 -3.484 -16.158 -8.222 1.00 0.00 C ATOM 342 O SER A 24 -4.691 -16.136 -8.465 1.00 0.00 O ATOM 343 CB SER A 24 -1.773 -16.969 -9.857 1.00 0.00 C ATOM 344 OG SER A 24 -2.712 -17.983 -10.166 1.00 0.00 O ATOM 0 H SER A 24 -0.531 -15.191 -8.679 1.00 0.00 H new ATOM 0 HA SER A 24 -2.992 -15.211 -10.076 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.223 -16.692 -10.756 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.044 -17.350 -9.142 1.00 0.00 H new ATOM 0 HG SER A 24 -2.244 -18.760 -10.536 1.00 0.00 H new ATOM 350 N TYR A 25 -2.988 -16.542 -7.051 1.00 0.00 N ATOM 351 CA TYR A 25 -3.853 -16.974 -5.960 1.00 0.00 C ATOM 352 C TYR A 25 -4.700 -15.813 -5.445 1.00 0.00 C ATOM 353 O TYR A 25 -5.824 -16.007 -4.982 1.00 0.00 O ATOM 354 CB TYR A 25 -3.018 -17.556 -4.819 1.00 0.00 C ATOM 355 CG TYR A 25 -2.670 -19.016 -5.007 1.00 0.00 C ATOM 356 CD1 TYR A 25 -1.867 -19.428 -6.064 1.00 0.00 C ATOM 357 CD2 TYR A 25 -3.145 -19.982 -4.129 1.00 0.00 C ATOM 358 CE1 TYR A 25 -1.547 -20.760 -6.241 1.00 0.00 C ATOM 359 CE2 TYR A 25 -2.828 -21.317 -4.297 1.00 0.00 C ATOM 360 CZ TYR A 25 -2.030 -21.700 -5.354 1.00 0.00 C ATOM 361 OH TYR A 25 -1.714 -23.029 -5.526 1.00 0.00 O ATOM 0 H TYR A 25 -1.992 -16.563 -6.833 1.00 0.00 H new ATOM 0 HA TYR A 25 -4.521 -17.746 -6.343 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -2.097 -16.981 -4.724 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -3.565 -17.439 -3.883 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -1.487 -18.694 -6.759 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -3.772 -19.685 -3.301 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -0.923 -21.064 -7.068 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -3.203 -22.056 -3.604 1.00 0.00 H new ATOM 0 HH TYR A 25 -0.836 -23.104 -5.955 1.00 0.00 H new ATOM 371 N PHE A 26 -4.150 -14.606 -5.529 1.00 0.00 N ATOM 372 CA PHE A 26 -4.853 -13.413 -5.071 1.00 0.00 C ATOM 373 C PHE A 26 -6.032 -13.092 -5.985 1.00 0.00 C ATOM 374 O PHE A 26 -7.071 -12.614 -5.531 1.00 0.00 O ATOM 375 CB PHE A 26 -3.896 -12.221 -5.018 1.00 0.00 C ATOM 376 CG PHE A 26 -4.458 -11.032 -4.292 1.00 0.00 C ATOM 377 CD1 PHE A 26 -5.444 -10.251 -4.874 1.00 0.00 C ATOM 378 CD2 PHE A 26 -4.001 -10.695 -3.028 1.00 0.00 C ATOM 379 CE1 PHE A 26 -5.964 -9.157 -4.208 1.00 0.00 C ATOM 380 CE2 PHE A 26 -4.518 -9.603 -2.358 1.00 0.00 C ATOM 381 CZ PHE A 26 -5.500 -8.832 -2.949 1.00 0.00 C ATOM 0 H PHE A 26 -3.221 -14.428 -5.910 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.235 -13.609 -4.069 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -2.971 -12.530 -4.531 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.638 -11.927 -6.035 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.810 -10.500 -5.859 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.232 -11.293 -2.561 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.733 -8.557 -4.672 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.154 -9.352 -1.372 1.00 0.00 H new ATOM 0 HZ PHE A 26 -5.904 -7.977 -2.427 1.00 0.00 H new ATOM 391 N ASN A 27 -5.862 -13.359 -7.276 1.00 0.00 N ATOM 392 CA ASN A 27 -6.911 -13.098 -8.255 1.00 0.00 C ATOM 393 C ASN A 27 -8.114 -14.007 -8.019 1.00 0.00 C ATOM 394 O ASN A 27 -9.259 -13.597 -8.204 1.00 0.00 O ATOM 395 CB ASN A 27 -6.376 -13.300 -9.673 1.00 0.00 C ATOM 396 CG ASN A 27 -5.639 -12.080 -10.193 1.00 0.00 C ATOM 397 OD1 ASN A 27 -5.976 -11.539 -11.246 1.00 0.00 O ATOM 398 ND2 ASN A 27 -4.627 -11.641 -9.453 1.00 0.00 N ATOM 0 H ASN A 27 -5.008 -13.756 -7.668 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.232 -12.063 -8.139 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.705 -14.159 -9.686 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -7.205 -13.532 -10.341 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -4.094 -10.824 -9.751 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -4.383 -12.121 -8.587 1.00 0.00 H new ATOM 405 N GLU A 28 -7.844 -15.242 -7.608 1.00 0.00 N ATOM 406 CA GLU A 28 -8.904 -16.208 -7.347 1.00 0.00 C ATOM 407 C GLU A 28 -9.493 -16.006 -5.954 1.00 0.00 C ATOM 408 O GLU A 28 -10.685 -16.219 -5.736 1.00 0.00 O ATOM 409 CB GLU A 28 -8.369 -17.635 -7.484 1.00 0.00 C ATOM 410 CG GLU A 28 -7.480 -18.066 -6.329 1.00 0.00 C ATOM 411 CD GLU A 28 -7.362 -19.573 -6.214 1.00 0.00 C ATOM 412 OE1 GLU A 28 -7.512 -20.261 -7.245 1.00 0.00 O ATOM 413 OE2 GLU A 28 -7.120 -20.065 -5.092 1.00 0.00 O ATOM 0 H GLU A 28 -6.901 -15.597 -7.449 1.00 0.00 H new ATOM 0 HA GLU A 28 -9.693 -16.051 -8.083 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.210 -18.324 -7.560 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.806 -17.715 -8.414 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.487 -17.637 -6.460 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.880 -17.665 -5.398 1.00 0.00 H new ATOM 420 N ASN A 29 -8.648 -15.595 -5.014 1.00 0.00 N ATOM 421 CA ASN A 29 -9.084 -15.365 -3.641 1.00 0.00 C ATOM 422 C ASN A 29 -8.210 -14.316 -2.961 1.00 0.00 C ATOM 423 O ASN A 29 -6.984 -14.417 -2.969 1.00 0.00 O ATOM 424 CB ASN A 29 -9.044 -16.672 -2.846 1.00 0.00 C ATOM 425 CG ASN A 29 -9.562 -16.503 -1.431 1.00 0.00 C ATOM 426 OD1 ASN A 29 -10.244 -15.526 -1.120 1.00 0.00 O ATOM 427 ND2 ASN A 29 -9.240 -17.457 -0.565 1.00 0.00 N ATOM 0 H ASN A 29 -7.658 -15.414 -5.178 1.00 0.00 H new ATOM 0 HA ASN A 29 -10.109 -14.995 -3.669 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -9.640 -17.426 -3.361 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.020 -17.043 -2.813 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -9.560 -17.398 0.402 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.673 -18.249 -0.867 1.00 0.00 H new ATOM 434 N GLN A 30 -8.851 -13.310 -2.374 1.00 0.00 N ATOM 435 CA GLN A 30 -8.131 -12.243 -1.690 1.00 0.00 C ATOM 436 C GLN A 30 -7.521 -12.746 -0.386 1.00 0.00 C ATOM 437 O GLN A 30 -6.407 -12.368 -0.024 1.00 0.00 O ATOM 438 CB GLN A 30 -9.068 -11.067 -1.407 1.00 0.00 C ATOM 439 CG GLN A 30 -9.755 -10.524 -2.650 1.00 0.00 C ATOM 440 CD GLN A 30 -8.853 -9.621 -3.468 1.00 0.00 C ATOM 441 OE1 GLN A 30 -8.414 -9.986 -4.559 1.00 0.00 O ATOM 442 NE2 GLN A 30 -8.572 -8.434 -2.944 1.00 0.00 N ATOM 0 H GLN A 30 -9.866 -13.212 -2.359 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.324 -11.908 -2.342 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.827 -11.382 -0.691 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -8.499 -10.265 -0.937 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.088 -11.357 -3.270 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -10.646 -9.970 -2.355 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -8.958 -8.173 -2.037 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -7.970 -7.783 -3.449 1.00 0.00 H new ATOM 451 N TYR A 31 -8.258 -13.601 0.315 1.00 0.00 N ATOM 452 CA TYR A 31 -7.790 -14.154 1.580 1.00 0.00 C ATOM 453 C TYR A 31 -7.678 -15.674 1.502 1.00 0.00 C ATOM 454 O TYR A 31 -8.633 -16.407 1.762 1.00 0.00 O ATOM 455 CB TYR A 31 -8.737 -13.759 2.715 1.00 0.00 C ATOM 456 CG TYR A 31 -9.239 -12.336 2.617 1.00 0.00 C ATOM 457 CD1 TYR A 31 -10.111 -11.954 1.605 1.00 0.00 C ATOM 458 CD2 TYR A 31 -8.842 -11.374 3.538 1.00 0.00 C ATOM 459 CE1 TYR A 31 -10.571 -10.655 1.512 1.00 0.00 C ATOM 460 CE2 TYR A 31 -9.298 -10.073 3.453 1.00 0.00 C ATOM 461 CZ TYR A 31 -10.162 -9.718 2.438 1.00 0.00 C ATOM 462 OH TYR A 31 -10.619 -8.423 2.349 1.00 0.00 O ATOM 0 H TYR A 31 -9.181 -13.926 0.028 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.800 -13.745 1.782 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.590 -14.437 2.718 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.223 -13.889 3.668 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -10.435 -12.685 0.879 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -8.165 -11.648 4.334 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -11.247 -10.374 0.718 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -8.980 -9.338 4.177 1.00 0.00 H new ATOM 0 HH TYR A 31 -10.237 -7.890 3.078 1.00 0.00 H new ATOM 472 N PRO A 32 -6.483 -16.159 1.136 1.00 0.00 N ATOM 473 CA PRO A 32 -6.215 -17.596 1.016 1.00 0.00 C ATOM 474 C PRO A 32 -6.195 -18.297 2.370 1.00 0.00 C ATOM 475 O PRO A 32 -5.386 -17.969 3.238 1.00 0.00 O ATOM 476 CB PRO A 32 -4.829 -17.645 0.367 1.00 0.00 C ATOM 477 CG PRO A 32 -4.188 -16.354 0.744 1.00 0.00 C ATOM 478 CD PRO A 32 -5.300 -15.344 0.812 1.00 0.00 C ATOM 0 HA PRO A 32 -6.987 -18.109 0.443 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.251 -18.495 0.731 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.902 -17.749 -0.716 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.677 -16.437 1.703 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.439 -16.061 0.009 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.111 -14.589 1.575 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.422 -14.817 -0.134 1.00 0.00 H new ATOM 486 N ASP A 33 -7.089 -19.264 2.543 1.00 0.00 N ATOM 487 CA ASP A 33 -7.173 -20.013 3.791 1.00 0.00 C ATOM 488 C ASP A 33 -5.812 -20.586 4.174 1.00 0.00 C ATOM 489 O ASP A 33 -4.854 -20.501 3.405 1.00 0.00 O ATOM 490 CB ASP A 33 -8.198 -21.141 3.666 1.00 0.00 C ATOM 491 CG ASP A 33 -9.410 -20.734 2.851 1.00 0.00 C ATOM 492 OD1 ASP A 33 -9.907 -19.606 3.050 1.00 0.00 O ATOM 493 OD2 ASP A 33 -9.860 -21.544 2.014 1.00 0.00 O ATOM 0 H ASP A 33 -7.766 -19.548 1.835 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.493 -19.328 4.576 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.726 -22.007 3.202 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -8.519 -21.448 4.661 1.00 0.00 H new ATOM 498 N GLU A 34 -5.734 -21.168 5.366 1.00 0.00 N ATOM 499 CA GLU A 34 -4.489 -21.753 5.850 1.00 0.00 C ATOM 500 C GLU A 34 -3.957 -22.791 4.866 1.00 0.00 C ATOM 501 O GLU A 34 -2.759 -22.845 4.593 1.00 0.00 O ATOM 502 CB GLU A 34 -4.702 -22.397 7.222 1.00 0.00 C ATOM 503 CG GLU A 34 -3.408 -22.761 7.931 1.00 0.00 C ATOM 504 CD GLU A 34 -3.613 -23.060 9.403 1.00 0.00 C ATOM 505 OE1 GLU A 34 -3.901 -24.228 9.738 1.00 0.00 O ATOM 506 OE2 GLU A 34 -3.486 -22.124 10.221 1.00 0.00 O ATOM 0 H GLU A 34 -6.518 -21.247 6.014 1.00 0.00 H new ATOM 0 HA GLU A 34 -3.753 -20.954 5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.271 -21.712 7.851 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.306 -23.296 7.102 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.965 -23.631 7.446 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.698 -21.941 7.826 1.00 0.00 H new ATOM 513 N ALA A 35 -4.858 -23.614 4.339 1.00 0.00 N ATOM 514 CA ALA A 35 -4.480 -24.650 3.385 1.00 0.00 C ATOM 515 C ALA A 35 -4.046 -24.040 2.056 1.00 0.00 C ATOM 516 O ALA A 35 -3.087 -24.497 1.435 1.00 0.00 O ATOM 517 CB ALA A 35 -5.635 -25.617 3.172 1.00 0.00 C ATOM 0 H ALA A 35 -5.854 -23.584 4.556 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.633 -25.198 3.797 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.339 -26.385 2.458 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.897 -26.085 4.121 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.497 -25.074 2.785 1.00 0.00 H new ATOM 523 N LYS A 36 -4.759 -23.005 1.625 1.00 0.00 N ATOM 524 CA LYS A 36 -4.447 -22.331 0.370 1.00 0.00 C ATOM 525 C LYS A 36 -3.083 -21.652 0.440 1.00 0.00 C ATOM 526 O LYS A 36 -2.315 -21.680 -0.522 1.00 0.00 O ATOM 527 CB LYS A 36 -5.527 -21.297 0.040 1.00 0.00 C ATOM 528 CG LYS A 36 -5.339 -20.631 -1.312 1.00 0.00 C ATOM 529 CD LYS A 36 -5.658 -21.584 -2.452 1.00 0.00 C ATOM 530 CE LYS A 36 -7.156 -21.667 -2.706 1.00 0.00 C ATOM 531 NZ LYS A 36 -7.482 -22.647 -3.778 1.00 0.00 N ATOM 0 H LYS A 36 -5.557 -22.615 2.126 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.418 -23.083 -0.419 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.502 -21.783 0.064 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -5.533 -20.531 0.815 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -5.982 -19.754 -1.379 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.311 -20.281 -1.406 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.152 -21.251 -3.358 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.272 -22.576 -2.217 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -7.665 -21.952 -1.786 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -7.532 -20.683 -2.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.428 -23.044 -3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -7.467 -22.169 -4.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -6.779 -23.413 -3.773 1.00 0.00 H new ATOM 545 N ARG A 37 -2.788 -21.045 1.585 1.00 0.00 N ATOM 546 CA ARG A 37 -1.516 -20.360 1.780 1.00 0.00 C ATOM 547 C ARG A 37 -0.347 -21.324 1.605 1.00 0.00 C ATOM 548 O ARG A 37 0.640 -21.003 0.945 1.00 0.00 O ATOM 549 CB ARG A 37 -1.464 -19.724 3.171 1.00 0.00 C ATOM 550 CG ARG A 37 -2.239 -18.421 3.275 1.00 0.00 C ATOM 551 CD ARG A 37 -1.890 -17.665 4.548 1.00 0.00 C ATOM 552 NE ARG A 37 -2.589 -18.202 5.712 1.00 0.00 N ATOM 553 CZ ARG A 37 -3.820 -17.843 6.060 1.00 0.00 C ATOM 554 NH1 ARG A 37 -4.484 -16.952 5.337 1.00 0.00 N ATOM 555 NH2 ARG A 37 -4.389 -18.377 7.134 1.00 0.00 N ATOM 0 H ARG A 37 -3.412 -21.014 2.391 1.00 0.00 H new ATOM 0 HA ARG A 37 -1.434 -19.577 1.026 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.860 -20.431 3.900 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.423 -19.540 3.438 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.021 -17.797 2.408 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.309 -18.630 3.256 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.814 -17.715 4.716 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -2.145 -16.612 4.426 1.00 0.00 H new ATOM 0 HE ARG A 37 -2.106 -18.890 6.289 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -4.050 -16.540 4.511 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -5.429 -16.678 5.607 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.881 -19.063 7.692 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.334 -18.101 7.401 1.00 0.00 H new ATOM 569 N GLU A 38 -0.466 -22.505 2.202 1.00 0.00 N ATOM 570 CA GLU A 38 0.582 -23.515 2.113 1.00 0.00 C ATOM 571 C GLU A 38 0.772 -23.976 0.671 1.00 0.00 C ATOM 572 O GLU A 38 1.897 -24.186 0.219 1.00 0.00 O ATOM 573 CB GLU A 38 0.245 -24.713 3.003 1.00 0.00 C ATOM 574 CG GLU A 38 0.519 -24.472 4.478 1.00 0.00 C ATOM 575 CD GLU A 38 1.919 -24.886 4.886 1.00 0.00 C ATOM 576 OE1 GLU A 38 2.340 -26.003 4.519 1.00 0.00 O ATOM 577 OE2 GLU A 38 2.595 -24.092 5.573 1.00 0.00 O ATOM 0 H GLU A 38 -1.277 -22.786 2.752 1.00 0.00 H new ATOM 0 HA GLU A 38 1.513 -23.066 2.459 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.807 -24.966 2.874 1.00 0.00 H new ATOM 0 HB3 GLU A 38 0.823 -25.575 2.671 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.377 -23.415 4.702 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.207 -25.025 5.074 1.00 0.00 H new ATOM 584 N GLU A 39 -0.337 -24.132 -0.046 1.00 0.00 N ATOM 585 CA GLU A 39 -0.292 -24.569 -1.436 1.00 0.00 C ATOM 586 C GLU A 39 0.427 -23.543 -2.306 1.00 0.00 C ATOM 587 O GLU A 39 1.287 -23.894 -3.115 1.00 0.00 O ATOM 588 CB GLU A 39 -1.709 -24.800 -1.966 1.00 0.00 C ATOM 589 CG GLU A 39 -1.755 -25.638 -3.233 1.00 0.00 C ATOM 590 CD GLU A 39 -1.290 -27.063 -3.008 1.00 0.00 C ATOM 591 OE1 GLU A 39 -0.067 -27.271 -2.858 1.00 0.00 O ATOM 592 OE2 GLU A 39 -2.147 -27.971 -2.981 1.00 0.00 O ATOM 0 H GLU A 39 -1.277 -23.962 0.313 1.00 0.00 H new ATOM 0 HA GLU A 39 0.262 -25.507 -1.478 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.301 -25.291 -1.194 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -2.177 -23.835 -2.161 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.774 -25.649 -3.620 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.130 -25.172 -3.995 1.00 0.00 H new ATOM 599 N ILE A 40 0.070 -22.275 -2.134 1.00 0.00 N ATOM 600 CA ILE A 40 0.681 -21.198 -2.903 1.00 0.00 C ATOM 601 C ILE A 40 2.116 -20.946 -2.451 1.00 0.00 C ATOM 602 O ILE A 40 2.978 -20.596 -3.256 1.00 0.00 O ATOM 603 CB ILE A 40 -0.122 -19.890 -2.778 1.00 0.00 C ATOM 604 CG1 ILE A 40 0.262 -18.921 -3.897 1.00 0.00 C ATOM 605 CG2 ILE A 40 0.111 -19.254 -1.416 1.00 0.00 C ATOM 606 CD1 ILE A 40 1.689 -18.427 -3.807 1.00 0.00 C ATOM 0 H ILE A 40 -0.640 -21.968 -1.469 1.00 0.00 H new ATOM 0 HA ILE A 40 0.681 -21.516 -3.946 1.00 0.00 H new ATOM 0 HB ILE A 40 -1.183 -20.122 -2.873 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.117 -19.414 -4.858 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.412 -18.065 -3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.463 -18.330 -1.343 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.208 -19.943 -0.634 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.171 -19.033 -1.294 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.890 -17.744 -4.632 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.834 -17.905 -2.861 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.372 -19.275 -3.863 1.00 0.00 H new ATOM 618 N ALA A 41 2.364 -21.128 -1.158 1.00 0.00 N ATOM 619 CA ALA A 41 3.694 -20.924 -0.599 1.00 0.00 C ATOM 620 C ALA A 41 4.663 -21.998 -1.083 1.00 0.00 C ATOM 621 O ALA A 41 5.778 -21.696 -1.506 1.00 0.00 O ATOM 622 CB ALA A 41 3.632 -20.913 0.921 1.00 0.00 C ATOM 0 H ALA A 41 1.661 -21.416 -0.478 1.00 0.00 H new ATOM 0 HA ALA A 41 4.062 -19.957 -0.943 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.633 -20.760 1.325 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.979 -20.106 1.253 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.239 -21.866 1.276 1.00 0.00 H new ATOM 628 N ASN A 42 4.230 -23.253 -1.017 1.00 0.00 N ATOM 629 CA ASN A 42 5.061 -24.372 -1.447 1.00 0.00 C ATOM 630 C ASN A 42 5.468 -24.216 -2.909 1.00 0.00 C ATOM 631 O ASN A 42 6.601 -24.518 -3.284 1.00 0.00 O ATOM 632 CB ASN A 42 4.314 -25.693 -1.252 1.00 0.00 C ATOM 633 CG ASN A 42 4.559 -26.299 0.116 1.00 0.00 C ATOM 634 OD1 ASN A 42 5.310 -27.265 0.254 1.00 0.00 O ATOM 635 ND2 ASN A 42 3.924 -25.733 1.136 1.00 0.00 N ATOM 0 H ASN A 42 3.309 -23.521 -0.670 1.00 0.00 H new ATOM 0 HA ASN A 42 5.963 -24.379 -0.836 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.245 -25.526 -1.386 1.00 0.00 H new ATOM 0 HB3 ASN A 42 4.625 -26.400 -2.021 1.00 0.00 H new ATOM 0 HD21 ASN A 42 4.049 -26.097 2.080 1.00 0.00 H new ATOM 0 HD22 ASN A 42 3.311 -24.934 0.975 1.00 0.00 H new ATOM 642 N ALA A 43 4.537 -23.741 -3.730 1.00 0.00 N ATOM 643 CA ALA A 43 4.800 -23.543 -5.150 1.00 0.00 C ATOM 644 C ALA A 43 5.877 -22.485 -5.366 1.00 0.00 C ATOM 645 O ALA A 43 6.741 -22.633 -6.231 1.00 0.00 O ATOM 646 CB ALA A 43 3.520 -23.152 -5.874 1.00 0.00 C ATOM 0 H ALA A 43 3.594 -23.486 -3.436 1.00 0.00 H new ATOM 0 HA ALA A 43 5.164 -24.484 -5.562 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.731 -23.007 -6.934 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.779 -23.943 -5.756 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.132 -22.225 -5.452 1.00 0.00 H new ATOM 652 N CYS A 44 5.818 -21.418 -4.576 1.00 0.00 N ATOM 653 CA CYS A 44 6.789 -20.334 -4.683 1.00 0.00 C ATOM 654 C CYS A 44 8.201 -20.840 -4.408 1.00 0.00 C ATOM 655 O CYS A 44 9.153 -20.449 -5.082 1.00 0.00 O ATOM 656 CB CYS A 44 6.438 -19.210 -3.707 1.00 0.00 C ATOM 657 SG CYS A 44 4.958 -18.275 -4.161 1.00 0.00 S ATOM 0 H CYS A 44 5.109 -21.280 -3.855 1.00 0.00 H new ATOM 0 HA CYS A 44 6.754 -19.946 -5.701 1.00 0.00 H new ATOM 0 HB2 CYS A 44 6.295 -19.637 -2.714 1.00 0.00 H new ATOM 0 HB3 CYS A 44 7.282 -18.524 -3.641 1.00 0.00 H new ATOM 0 HG CYS A 44 4.741 -17.349 -3.275 1.00 0.00 H new ATOM 663 N ASN A 45 8.329 -21.711 -3.413 1.00 0.00 N ATOM 664 CA ASN A 45 9.626 -22.269 -3.047 1.00 0.00 C ATOM 665 C ASN A 45 10.150 -23.192 -4.142 1.00 0.00 C ATOM 666 O ASN A 45 11.356 -23.287 -4.365 1.00 0.00 O ATOM 667 CB ASN A 45 9.521 -23.034 -1.726 1.00 0.00 C ATOM 668 CG ASN A 45 9.669 -22.127 -0.519 1.00 0.00 C ATOM 669 OD1 ASN A 45 10.599 -21.325 -0.442 1.00 0.00 O ATOM 670 ND2 ASN A 45 8.748 -22.251 0.430 1.00 0.00 N ATOM 0 H ASN A 45 7.551 -22.046 -2.845 1.00 0.00 H new ATOM 0 HA ASN A 45 10.328 -21.444 -2.926 1.00 0.00 H new ATOM 0 HB2 ASN A 45 8.558 -23.542 -1.679 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.290 -23.805 -1.694 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.795 -21.667 1.265 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.994 -22.930 0.324 1.00 0.00 H new ATOM 677 N ALA A 46 9.233 -23.871 -4.824 1.00 0.00 N ATOM 678 CA ALA A 46 9.601 -24.785 -5.898 1.00 0.00 C ATOM 679 C ALA A 46 10.110 -24.023 -7.117 1.00 0.00 C ATOM 680 O ALA A 46 11.143 -24.368 -7.691 1.00 0.00 O ATOM 681 CB ALA A 46 8.415 -25.660 -6.277 1.00 0.00 C ATOM 0 H ALA A 46 8.230 -23.805 -4.651 1.00 0.00 H new ATOM 0 HA ALA A 46 10.408 -25.423 -5.538 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.705 -26.337 -7.080 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.099 -26.240 -5.410 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.591 -25.030 -6.613 1.00 0.00 H new ATOM 687 N VAL A 47 9.377 -22.986 -7.509 1.00 0.00 N ATOM 688 CA VAL A 47 9.754 -22.175 -8.661 1.00 0.00 C ATOM 689 C VAL A 47 11.145 -21.578 -8.480 1.00 0.00 C ATOM 690 O VAL A 47 11.851 -21.319 -9.455 1.00 0.00 O ATOM 691 CB VAL A 47 8.745 -21.036 -8.899 1.00 0.00 C ATOM 692 CG1 VAL A 47 7.453 -21.581 -9.489 1.00 0.00 C ATOM 693 CG2 VAL A 47 8.474 -20.285 -7.604 1.00 0.00 C ATOM 0 H VAL A 47 8.519 -22.687 -7.046 1.00 0.00 H new ATOM 0 HA VAL A 47 9.755 -22.836 -9.528 1.00 0.00 H new ATOM 0 HB VAL A 47 9.176 -20.336 -9.615 1.00 0.00 H new ATOM 0 HG11 VAL A 47 6.753 -20.762 -9.650 1.00 0.00 H new ATOM 0 HG12 VAL A 47 7.665 -22.070 -10.440 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.015 -22.303 -8.800 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.759 -19.484 -7.791 1.00 0.00 H new ATOM 0 HG22 VAL A 47 8.064 -20.972 -6.864 1.00 0.00 H new ATOM 0 HG23 VAL A 47 9.405 -19.860 -7.228 1.00 0.00 H new ATOM 703 N ILE A 48 11.532 -21.362 -7.228 1.00 0.00 N ATOM 704 CA ILE A 48 12.840 -20.797 -6.919 1.00 0.00 C ATOM 705 C ILE A 48 13.858 -21.894 -6.627 1.00 0.00 C ATOM 706 O ILE A 48 15.036 -21.764 -6.959 1.00 0.00 O ATOM 707 CB ILE A 48 12.770 -19.842 -5.713 1.00 0.00 C ATOM 708 CG1 ILE A 48 12.244 -20.580 -4.480 1.00 0.00 C ATOM 709 CG2 ILE A 48 11.889 -18.644 -6.036 1.00 0.00 C ATOM 710 CD1 ILE A 48 12.168 -19.713 -3.243 1.00 0.00 C ATOM 0 H ILE A 48 10.958 -21.570 -6.410 1.00 0.00 H new ATOM 0 HA ILE A 48 13.157 -20.236 -7.798 1.00 0.00 H new ATOM 0 HB ILE A 48 13.775 -19.481 -5.496 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.252 -20.975 -4.699 1.00 0.00 H new ATOM 0 HG13 ILE A 48 12.889 -21.435 -4.276 1.00 0.00 H new ATOM 0 HG21 ILE A 48 11.850 -17.978 -5.174 1.00 0.00 H new ATOM 0 HG22 ILE A 48 12.303 -18.108 -6.890 1.00 0.00 H new ATOM 0 HG23 ILE A 48 10.883 -18.987 -6.276 1.00 0.00 H new ATOM 0 HD11 ILE A 48 11.787 -20.302 -2.409 1.00 0.00 H new ATOM 0 HD12 ILE A 48 13.162 -19.339 -2.999 1.00 0.00 H new ATOM 0 HD13 ILE A 48 11.500 -18.872 -3.429 1.00 0.00 H new ATOM 722 N GLN A 49 13.394 -22.974 -6.006 1.00 0.00 N ATOM 723 CA GLN A 49 14.265 -24.094 -5.670 1.00 0.00 C ATOM 724 C GLN A 49 15.149 -24.470 -6.854 1.00 0.00 C ATOM 725 O GLN A 49 14.660 -24.920 -7.891 1.00 0.00 O ATOM 726 CB GLN A 49 13.432 -25.302 -5.237 1.00 0.00 C ATOM 727 CG GLN A 49 14.266 -26.532 -4.916 1.00 0.00 C ATOM 728 CD GLN A 49 13.627 -27.411 -3.860 1.00 0.00 C ATOM 729 OE1 GLN A 49 12.807 -28.277 -4.168 1.00 0.00 O ATOM 730 NE2 GLN A 49 14.000 -27.194 -2.604 1.00 0.00 N ATOM 0 H GLN A 49 12.421 -23.097 -5.726 1.00 0.00 H new ATOM 0 HA GLN A 49 14.907 -23.788 -4.844 1.00 0.00 H new ATOM 0 HB2 GLN A 49 12.845 -25.032 -4.359 1.00 0.00 H new ATOM 0 HB3 GLN A 49 12.726 -25.549 -6.030 1.00 0.00 H new ATOM 0 HG2 GLN A 49 14.414 -27.113 -5.826 1.00 0.00 H new ATOM 0 HG3 GLN A 49 15.252 -26.218 -4.574 1.00 0.00 H new ATOM 0 HE21 GLN A 49 14.683 -26.466 -2.393 1.00 0.00 H new ATOM 0 HE22 GLN A 49 13.604 -27.755 -1.850 1.00 0.00 H new ATOM 739 N LYS A 50 16.455 -24.281 -6.695 1.00 0.00 N ATOM 740 CA LYS A 50 17.409 -24.601 -7.749 1.00 0.00 C ATOM 741 C LYS A 50 17.961 -26.012 -7.574 1.00 0.00 C ATOM 742 O LYS A 50 18.024 -26.547 -6.467 1.00 0.00 O ATOM 743 CB LYS A 50 18.558 -23.589 -7.750 1.00 0.00 C ATOM 744 CG LYS A 50 18.099 -22.149 -7.898 1.00 0.00 C ATOM 745 CD LYS A 50 19.176 -21.172 -7.456 1.00 0.00 C ATOM 746 CE LYS A 50 19.174 -20.987 -5.946 1.00 0.00 C ATOM 747 NZ LYS A 50 20.472 -20.451 -5.451 1.00 0.00 N ATOM 0 H LYS A 50 16.877 -23.907 -5.845 1.00 0.00 H new ATOM 0 HA LYS A 50 16.887 -24.550 -8.704 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.120 -23.689 -6.821 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.242 -23.829 -8.564 1.00 0.00 H new ATOM 0 HG2 LYS A 50 17.835 -21.955 -8.938 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.198 -21.991 -7.306 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.152 -21.535 -7.778 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.017 -20.209 -7.942 1.00 0.00 H new ATOM 0 HE2 LYS A 50 18.370 -20.308 -5.664 1.00 0.00 H new ATOM 0 HE3 LYS A 50 18.968 -21.942 -5.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.430 -20.339 -4.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 21.237 -21.111 -5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.657 -19.527 -5.892 1.00 0.00 H new ATOM 761 N PRO A 51 18.373 -26.630 -8.691 1.00 0.00 N ATOM 762 CA PRO A 51 18.929 -27.986 -8.687 1.00 0.00 C ATOM 763 C PRO A 51 20.304 -28.047 -8.029 1.00 0.00 C ATOM 764 O PRO A 51 21.205 -27.288 -8.382 1.00 0.00 O ATOM 765 CB PRO A 51 19.032 -28.333 -10.174 1.00 0.00 C ATOM 766 CG PRO A 51 19.141 -27.017 -10.863 1.00 0.00 C ATOM 767 CD PRO A 51 18.328 -26.052 -10.045 1.00 0.00 C ATOM 0 HA PRO A 51 18.310 -28.678 -8.116 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.902 -28.959 -10.375 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.156 -28.886 -10.513 1.00 0.00 H new ATOM 0 HG2 PRO A 51 20.180 -26.695 -10.927 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.763 -27.078 -11.883 1.00 0.00 H new ATOM 0 HD2 PRO A 51 18.753 -25.048 -10.068 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.306 -25.974 -10.415 1.00 0.00 H new ATOM 775 N GLY A 52 20.457 -28.957 -7.072 1.00 0.00 N ATOM 776 CA GLY A 52 21.725 -29.099 -6.381 1.00 0.00 C ATOM 777 C GLY A 52 21.973 -27.983 -5.386 1.00 0.00 C ATOM 778 O GLY A 52 23.107 -27.758 -4.962 1.00 0.00 O ATOM 0 H GLY A 52 19.726 -29.598 -6.763 1.00 0.00 H new ATOM 0 HA2 GLY A 52 21.746 -30.056 -5.861 1.00 0.00 H new ATOM 0 HA3 GLY A 52 22.533 -29.116 -7.112 1.00 0.00 H new ATOM 782 N LYS A 53 20.909 -27.279 -5.013 1.00 0.00 N ATOM 783 CA LYS A 53 21.015 -26.178 -4.062 1.00 0.00 C ATOM 784 C LYS A 53 20.016 -26.347 -2.922 1.00 0.00 C ATOM 785 O LYS A 53 18.872 -26.747 -3.138 1.00 0.00 O ATOM 786 CB LYS A 53 20.777 -24.842 -4.769 1.00 0.00 C ATOM 787 CG LYS A 53 21.218 -23.637 -3.956 1.00 0.00 C ATOM 788 CD LYS A 53 22.707 -23.377 -4.107 1.00 0.00 C ATOM 789 CE LYS A 53 23.188 -22.310 -3.136 1.00 0.00 C ATOM 790 NZ LYS A 53 24.670 -22.320 -2.990 1.00 0.00 N ATOM 0 H LYS A 53 19.964 -27.451 -5.355 1.00 0.00 H new ATOM 0 HA LYS A 53 22.022 -26.187 -3.644 1.00 0.00 H new ATOM 0 HB2 LYS A 53 21.310 -24.843 -5.720 1.00 0.00 H new ATOM 0 HB3 LYS A 53 19.716 -24.746 -4.999 1.00 0.00 H new ATOM 0 HG2 LYS A 53 20.660 -22.757 -4.276 1.00 0.00 H new ATOM 0 HG3 LYS A 53 20.981 -23.800 -2.905 1.00 0.00 H new ATOM 0 HD2 LYS A 53 23.258 -24.302 -3.935 1.00 0.00 H new ATOM 0 HD3 LYS A 53 22.921 -23.064 -5.129 1.00 0.00 H new ATOM 0 HE2 LYS A 53 22.864 -21.329 -3.485 1.00 0.00 H new ATOM 0 HE3 LYS A 53 22.726 -22.471 -2.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 24.958 -21.578 -2.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 24.977 -23.247 -2.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 25.111 -22.141 -3.915 1.00 0.00 H new ATOM 804 N LYS A 54 20.456 -26.039 -1.706 1.00 0.00 N ATOM 805 CA LYS A 54 19.600 -26.153 -0.531 1.00 0.00 C ATOM 806 C LYS A 54 18.884 -24.836 -0.249 1.00 0.00 C ATOM 807 O LYS A 54 19.511 -23.778 -0.184 1.00 0.00 O ATOM 808 CB LYS A 54 20.427 -26.568 0.689 1.00 0.00 C ATOM 809 CG LYS A 54 20.929 -28.000 0.625 1.00 0.00 C ATOM 810 CD LYS A 54 21.730 -28.366 1.863 1.00 0.00 C ATOM 811 CE LYS A 54 22.152 -29.827 1.842 1.00 0.00 C ATOM 812 NZ LYS A 54 22.868 -30.215 3.089 1.00 0.00 N ATOM 0 H LYS A 54 21.401 -25.708 -1.509 1.00 0.00 H new ATOM 0 HA LYS A 54 18.850 -26.918 -0.732 1.00 0.00 H new ATOM 0 HB2 LYS A 54 21.280 -25.897 0.784 1.00 0.00 H new ATOM 0 HB3 LYS A 54 19.822 -26.444 1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 54 20.082 -28.679 0.524 1.00 0.00 H new ATOM 0 HG3 LYS A 54 21.549 -28.130 -0.262 1.00 0.00 H new ATOM 0 HD2 LYS A 54 22.614 -27.732 1.926 1.00 0.00 H new ATOM 0 HD3 LYS A 54 21.134 -28.171 2.754 1.00 0.00 H new ATOM 0 HE2 LYS A 54 21.272 -30.458 1.717 1.00 0.00 H new ATOM 0 HE3 LYS A 54 22.797 -30.006 0.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 23.139 -31.218 3.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 23.722 -29.631 3.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 22.244 -30.068 3.908 1.00 0.00 H new ATOM 826 N LEU A 55 17.568 -24.908 -0.081 1.00 0.00 N ATOM 827 CA LEU A 55 16.766 -23.721 0.196 1.00 0.00 C ATOM 828 C LEU A 55 17.051 -23.186 1.596 1.00 0.00 C ATOM 829 O LEU A 55 17.285 -23.954 2.529 1.00 0.00 O ATOM 830 CB LEU A 55 15.278 -24.043 0.053 1.00 0.00 C ATOM 831 CG LEU A 55 14.692 -23.903 -1.353 1.00 0.00 C ATOM 832 CD1 LEU A 55 13.225 -24.300 -1.362 1.00 0.00 C ATOM 833 CD2 LEU A 55 14.864 -22.479 -1.863 1.00 0.00 C ATOM 0 H LEU A 55 17.034 -25.775 -0.132 1.00 0.00 H new ATOM 0 HA LEU A 55 17.036 -22.952 -0.528 1.00 0.00 H new ATOM 0 HB2 LEU A 55 15.114 -25.066 0.393 1.00 0.00 H new ATOM 0 HB3 LEU A 55 14.720 -23.390 0.724 1.00 0.00 H new ATOM 0 HG LEU A 55 15.233 -24.575 -2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.826 -24.194 -2.371 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.127 -25.337 -1.040 1.00 0.00 H new ATOM 0 HD13 LEU A 55 12.669 -23.655 -0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.441 -22.398 -2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.349 -21.789 -1.195 1.00 0.00 H new ATOM 0 HD23 LEU A 55 15.925 -22.230 -1.895 1.00 0.00 H new ATOM 845 N SER A 56 17.026 -21.865 1.735 1.00 0.00 N ATOM 846 CA SER A 56 17.283 -21.226 3.021 1.00 0.00 C ATOM 847 C SER A 56 16.023 -20.552 3.554 1.00 0.00 C ATOM 848 O SER A 56 15.092 -20.265 2.800 1.00 0.00 O ATOM 849 CB SER A 56 18.408 -20.198 2.888 1.00 0.00 C ATOM 850 OG SER A 56 19.669 -20.784 3.163 1.00 0.00 O ATOM 0 H SER A 56 16.830 -21.216 0.973 1.00 0.00 H new ATOM 0 HA SER A 56 17.588 -21.998 3.728 1.00 0.00 H new ATOM 0 HB2 SER A 56 18.408 -19.783 1.880 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.231 -19.370 3.574 1.00 0.00 H new ATOM 0 HG SER A 56 20.372 -20.107 3.070 1.00 0.00 H new ATOM 856 N ASP A 57 16.000 -20.302 4.858 1.00 0.00 N ATOM 857 CA ASP A 57 14.855 -19.660 5.494 1.00 0.00 C ATOM 858 C ASP A 57 14.577 -18.298 4.866 1.00 0.00 C ATOM 859 O ASP A 57 13.437 -17.833 4.844 1.00 0.00 O ATOM 860 CB ASP A 57 15.100 -19.503 6.996 1.00 0.00 C ATOM 861 CG ASP A 57 15.517 -20.804 7.653 1.00 0.00 C ATOM 862 OD1 ASP A 57 15.046 -21.871 7.209 1.00 0.00 O ATOM 863 OD2 ASP A 57 16.315 -20.754 8.613 1.00 0.00 O ATOM 0 H ASP A 57 16.761 -20.534 5.496 1.00 0.00 H new ATOM 0 HA ASP A 57 13.983 -20.295 5.341 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.874 -18.753 7.159 1.00 0.00 H new ATOM 0 HB3 ASP A 57 14.192 -19.133 7.473 1.00 0.00 H new ATOM 868 N LEU A 58 15.627 -17.662 4.357 1.00 0.00 N ATOM 869 CA LEU A 58 15.497 -16.352 3.729 1.00 0.00 C ATOM 870 C LEU A 58 14.627 -16.432 2.478 1.00 0.00 C ATOM 871 O LEU A 58 13.840 -15.528 2.200 1.00 0.00 O ATOM 872 CB LEU A 58 16.877 -15.798 3.370 1.00 0.00 C ATOM 873 CG LEU A 58 17.687 -15.214 4.528 1.00 0.00 C ATOM 874 CD1 LEU A 58 16.854 -14.211 5.310 1.00 0.00 C ATOM 875 CD2 LEU A 58 18.186 -16.324 5.442 1.00 0.00 C ATOM 0 H LEU A 58 16.577 -18.032 4.367 1.00 0.00 H new ATOM 0 HA LEU A 58 15.017 -15.681 4.441 1.00 0.00 H new ATOM 0 HB2 LEU A 58 17.460 -16.597 2.912 1.00 0.00 H new ATOM 0 HB3 LEU A 58 16.750 -15.023 2.614 1.00 0.00 H new ATOM 0 HG LEU A 58 18.551 -14.693 4.116 1.00 0.00 H new ATOM 0 HD11 LEU A 58 17.447 -13.806 6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.546 -13.400 4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.970 -14.707 5.712 1.00 0.00 H new ATOM 0 HD21 LEU A 58 18.760 -15.891 6.261 1.00 0.00 H new ATOM 0 HD22 LEU A 58 17.335 -16.872 5.846 1.00 0.00 H new ATOM 0 HD23 LEU A 58 18.820 -17.005 4.875 1.00 0.00 H new ATOM 887 N GLU A 59 14.775 -17.520 1.729 1.00 0.00 N ATOM 888 CA GLU A 59 14.002 -17.717 0.508 1.00 0.00 C ATOM 889 C GLU A 59 12.819 -18.647 0.759 1.00 0.00 C ATOM 890 O GLU A 59 11.909 -18.747 -0.065 1.00 0.00 O ATOM 891 CB GLU A 59 14.890 -18.290 -0.598 1.00 0.00 C ATOM 892 CG GLU A 59 16.201 -17.542 -0.775 1.00 0.00 C ATOM 893 CD GLU A 59 16.718 -17.600 -2.200 1.00 0.00 C ATOM 894 OE1 GLU A 59 17.004 -18.716 -2.681 1.00 0.00 O ATOM 895 OE2 GLU A 59 16.836 -16.530 -2.833 1.00 0.00 O ATOM 0 H GLU A 59 15.422 -18.278 1.946 1.00 0.00 H new ATOM 0 HA GLU A 59 13.619 -16.747 0.190 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.105 -19.335 -0.375 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.341 -18.271 -1.539 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.063 -16.500 -0.485 1.00 0.00 H new ATOM 0 HG3 GLU A 59 16.949 -17.964 -0.104 1.00 0.00 H new ATOM 902 N ARG A 60 12.839 -19.327 1.901 1.00 0.00 N ATOM 903 CA ARG A 60 11.769 -20.250 2.259 1.00 0.00 C ATOM 904 C ARG A 60 10.450 -19.508 2.446 1.00 0.00 C ATOM 905 O ARG A 60 10.251 -18.814 3.444 1.00 0.00 O ATOM 906 CB ARG A 60 12.127 -21.007 3.540 1.00 0.00 C ATOM 907 CG ARG A 60 11.422 -22.346 3.674 1.00 0.00 C ATOM 908 CD ARG A 60 12.226 -23.317 4.525 1.00 0.00 C ATOM 909 NE ARG A 60 11.369 -24.264 5.232 1.00 0.00 N ATOM 910 CZ ARG A 60 10.730 -23.977 6.360 1.00 0.00 C ATOM 911 NH1 ARG A 60 10.849 -22.774 6.906 1.00 0.00 N ATOM 912 NH2 ARG A 60 9.968 -24.893 6.944 1.00 0.00 N ATOM 0 H ARG A 60 13.584 -19.256 2.594 1.00 0.00 H new ATOM 0 HA ARG A 60 11.651 -20.964 1.444 1.00 0.00 H new ATOM 0 HB2 ARG A 60 13.205 -21.169 3.567 1.00 0.00 H new ATOM 0 HB3 ARG A 60 11.877 -20.387 4.400 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.439 -22.198 4.120 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.262 -22.774 2.685 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.924 -23.863 3.890 1.00 0.00 H new ATOM 0 HD3 ARG A 60 12.822 -22.759 5.247 1.00 0.00 H new ATOM 0 HE ARG A 60 11.255 -25.198 4.838 1.00 0.00 H new ATOM 0 HH11 ARG A 60 11.433 -22.067 6.459 1.00 0.00 H new ATOM 0 HH12 ARG A 60 10.357 -22.556 7.773 1.00 0.00 H new ATOM 0 HH21 ARG A 60 9.873 -25.819 6.526 1.00 0.00 H new ATOM 0 HH22 ARG A 60 9.478 -24.671 7.811 1.00 0.00 H new ATOM 926 N VAL A 61 9.550 -19.658 1.480 1.00 0.00 N ATOM 927 CA VAL A 61 8.249 -19.002 1.538 1.00 0.00 C ATOM 928 C VAL A 61 7.255 -19.824 2.351 1.00 0.00 C ATOM 929 O VAL A 61 6.679 -20.793 1.854 1.00 0.00 O ATOM 930 CB VAL A 61 7.674 -18.769 0.128 1.00 0.00 C ATOM 931 CG1 VAL A 61 6.294 -18.135 0.212 1.00 0.00 C ATOM 932 CG2 VAL A 61 8.617 -17.906 -0.696 1.00 0.00 C ATOM 0 H VAL A 61 9.698 -20.228 0.647 1.00 0.00 H new ATOM 0 HA VAL A 61 8.402 -18.038 2.023 1.00 0.00 H new ATOM 0 HB VAL A 61 7.574 -19.734 -0.369 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.904 -17.978 -0.794 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.623 -18.795 0.762 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.364 -17.177 0.727 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.195 -17.752 -1.689 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.751 -16.942 -0.205 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.582 -18.405 -0.786 1.00 0.00 H new ATOM 942 N THR A 62 7.056 -19.431 3.605 1.00 0.00 N ATOM 943 CA THR A 62 6.132 -20.131 4.488 1.00 0.00 C ATOM 944 C THR A 62 4.706 -19.623 4.307 1.00 0.00 C ATOM 945 O THR A 62 4.480 -18.596 3.668 1.00 0.00 O ATOM 946 CB THR A 62 6.538 -19.972 5.966 1.00 0.00 C ATOM 947 OG1 THR A 62 6.538 -18.587 6.327 1.00 0.00 O ATOM 948 CG2 THR A 62 7.915 -20.568 6.216 1.00 0.00 C ATOM 0 H THR A 62 7.523 -18.631 4.032 1.00 0.00 H new ATOM 0 HA THR A 62 6.175 -21.186 4.218 1.00 0.00 H new ATOM 0 HB THR A 62 5.812 -20.506 6.579 1.00 0.00 H new ATOM 0 HG1 THR A 62 6.795 -18.494 7.268 1.00 0.00 H new ATOM 0 HG21 THR A 62 8.180 -20.444 7.266 1.00 0.00 H new ATOM 0 HG22 THR A 62 7.903 -21.629 5.968 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.650 -20.058 5.593 1.00 0.00 H new ATOM 956 N SER A 63 3.748 -20.348 4.874 1.00 0.00 N ATOM 957 CA SER A 63 2.343 -19.972 4.772 1.00 0.00 C ATOM 958 C SER A 63 2.108 -18.583 5.359 1.00 0.00 C ATOM 959 O SER A 63 1.373 -17.774 4.793 1.00 0.00 O ATOM 960 CB SER A 63 1.465 -20.997 5.492 1.00 0.00 C ATOM 961 OG SER A 63 1.420 -20.741 6.885 1.00 0.00 O ATOM 0 H SER A 63 3.919 -21.199 5.409 1.00 0.00 H new ATOM 0 HA SER A 63 2.074 -19.952 3.716 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.456 -20.969 5.081 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.853 -22.000 5.316 1.00 0.00 H new ATOM 0 HG SER A 63 0.851 -21.409 7.322 1.00 0.00 H new ATOM 967 N LEU A 64 2.739 -18.315 6.497 1.00 0.00 N ATOM 968 CA LEU A 64 2.600 -17.024 7.162 1.00 0.00 C ATOM 969 C LEU A 64 3.122 -15.897 6.277 1.00 0.00 C ATOM 970 O LEU A 64 2.539 -14.813 6.225 1.00 0.00 O ATOM 971 CB LEU A 64 3.352 -17.032 8.494 1.00 0.00 C ATOM 972 CG LEU A 64 3.570 -15.667 9.150 1.00 0.00 C ATOM 973 CD1 LEU A 64 2.237 -15.028 9.508 1.00 0.00 C ATOM 974 CD2 LEU A 64 4.448 -15.803 10.385 1.00 0.00 C ATOM 0 H LEU A 64 3.351 -18.974 6.978 1.00 0.00 H new ATOM 0 HA LEU A 64 1.540 -16.852 7.351 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.806 -17.666 9.193 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.325 -17.497 8.336 1.00 0.00 H new ATOM 0 HG LEU A 64 4.080 -15.019 8.437 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.412 -14.058 9.973 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.643 -14.895 8.604 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.700 -15.673 10.204 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.592 -14.822 10.839 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.966 -16.467 11.102 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.415 -16.217 10.100 1.00 0.00 H new ATOM 986 N LYS A 65 4.222 -16.159 5.580 1.00 0.00 N ATOM 987 CA LYS A 65 4.822 -15.169 4.694 1.00 0.00 C ATOM 988 C LYS A 65 3.840 -14.748 3.605 1.00 0.00 C ATOM 989 O LYS A 65 3.740 -13.568 3.267 1.00 0.00 O ATOM 990 CB LYS A 65 6.096 -15.729 4.057 1.00 0.00 C ATOM 991 CG LYS A 65 7.351 -15.460 4.870 1.00 0.00 C ATOM 992 CD LYS A 65 8.607 -15.784 4.080 1.00 0.00 C ATOM 993 CE LYS A 65 9.740 -16.230 4.992 1.00 0.00 C ATOM 994 NZ LYS A 65 9.460 -17.552 5.618 1.00 0.00 N ATOM 0 H LYS A 65 4.717 -17.050 5.612 1.00 0.00 H new ATOM 0 HA LYS A 65 5.076 -14.292 5.289 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.983 -16.805 3.924 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.217 -15.296 3.064 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.371 -14.413 5.174 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.330 -16.057 5.782 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.390 -16.570 3.356 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.918 -14.906 3.514 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.666 -16.288 4.419 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.894 -15.484 5.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.965 -17.621 6.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.438 -17.648 5.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.781 -18.311 4.984 1.00 0.00 H new ATOM 1008 N VAL A 66 3.115 -15.720 3.060 1.00 0.00 N ATOM 1009 CA VAL A 66 2.139 -15.449 2.011 1.00 0.00 C ATOM 1010 C VAL A 66 1.054 -14.497 2.502 1.00 0.00 C ATOM 1011 O VAL A 66 0.594 -13.629 1.761 1.00 0.00 O ATOM 1012 CB VAL A 66 1.478 -16.748 1.511 1.00 0.00 C ATOM 1013 CG1 VAL A 66 0.417 -16.439 0.466 1.00 0.00 C ATOM 1014 CG2 VAL A 66 2.527 -17.698 0.953 1.00 0.00 C ATOM 0 H VAL A 66 3.185 -16.702 3.327 1.00 0.00 H new ATOM 0 HA VAL A 66 2.681 -14.984 1.187 1.00 0.00 H new ATOM 0 HB VAL A 66 0.991 -17.236 2.355 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.039 -17.368 0.125 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.349 -15.798 0.903 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.877 -15.928 -0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.043 -18.610 0.604 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.044 -17.221 0.121 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.247 -17.945 1.734 1.00 0.00 H new ATOM 1024 N TYR A 67 0.651 -14.665 3.757 1.00 0.00 N ATOM 1025 CA TYR A 67 -0.381 -13.821 4.347 1.00 0.00 C ATOM 1026 C TYR A 67 0.104 -12.380 4.482 1.00 0.00 C ATOM 1027 O TYR A 67 -0.664 -11.436 4.305 1.00 0.00 O ATOM 1028 CB TYR A 67 -0.790 -14.363 5.718 1.00 0.00 C ATOM 1029 CG TYR A 67 -2.026 -13.703 6.285 1.00 0.00 C ATOM 1030 CD1 TYR A 67 -3.234 -13.739 5.601 1.00 0.00 C ATOM 1031 CD2 TYR A 67 -1.986 -13.043 7.508 1.00 0.00 C ATOM 1032 CE1 TYR A 67 -4.366 -13.137 6.115 1.00 0.00 C ATOM 1033 CE2 TYR A 67 -3.113 -12.439 8.031 1.00 0.00 C ATOM 1034 CZ TYR A 67 -4.300 -12.488 7.331 1.00 0.00 C ATOM 1035 OH TYR A 67 -5.426 -11.888 7.847 1.00 0.00 O ATOM 0 H TYR A 67 1.023 -15.378 4.385 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.247 -13.833 3.685 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.965 -15.436 5.638 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.037 -14.226 6.415 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -3.289 -14.247 4.650 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.058 -13.002 8.059 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -5.297 -13.174 5.569 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.065 -11.931 8.983 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.211 -11.476 8.710 1.00 0.00 H new ATOM 1045 N ASN A 68 1.386 -12.221 4.795 1.00 0.00 N ATOM 1046 CA ASN A 68 1.975 -10.897 4.954 1.00 0.00 C ATOM 1047 C ASN A 68 1.976 -10.140 3.629 1.00 0.00 C ATOM 1048 O ASN A 68 1.643 -8.955 3.579 1.00 0.00 O ATOM 1049 CB ASN A 68 3.404 -11.012 5.489 1.00 0.00 C ATOM 1050 CG ASN A 68 3.457 -10.995 7.004 1.00 0.00 C ATOM 1051 OD1 ASN A 68 3.131 -9.991 7.637 1.00 0.00 O ATOM 1052 ND2 ASN A 68 3.869 -12.112 7.594 1.00 0.00 N ATOM 0 H ASN A 68 2.036 -12.993 4.943 1.00 0.00 H new ATOM 0 HA ASN A 68 1.370 -10.341 5.670 1.00 0.00 H new ATOM 0 HB2 ASN A 68 3.853 -11.935 5.123 1.00 0.00 H new ATOM 0 HB3 ASN A 68 4.003 -10.189 5.098 1.00 0.00 H new ATOM 0 HD21 ASN A 68 3.925 -12.161 8.611 1.00 0.00 H new ATOM 0 HD22 ASN A 68 4.129 -12.921 7.030 1.00 0.00 H new ATOM 1059 N TRP A 69 2.350 -10.831 2.559 1.00 0.00 N ATOM 1060 CA TRP A 69 2.393 -10.225 1.233 1.00 0.00 C ATOM 1061 C TRP A 69 0.986 -9.942 0.718 1.00 0.00 C ATOM 1062 O TRP A 69 0.718 -8.873 0.169 1.00 0.00 O ATOM 1063 CB TRP A 69 3.134 -11.138 0.256 1.00 0.00 C ATOM 1064 CG TRP A 69 3.210 -10.583 -1.135 1.00 0.00 C ATOM 1065 CD1 TRP A 69 4.286 -9.979 -1.718 1.00 0.00 C ATOM 1066 CD2 TRP A 69 2.165 -10.580 -2.114 1.00 0.00 C ATOM 1067 NE1 TRP A 69 3.974 -9.600 -3.002 1.00 0.00 N ATOM 1068 CE2 TRP A 69 2.679 -9.959 -3.269 1.00 0.00 C ATOM 1069 CE3 TRP A 69 0.847 -11.044 -2.129 1.00 0.00 C ATOM 1070 CZ2 TRP A 69 1.920 -9.789 -4.423 1.00 0.00 C ATOM 1071 CZ3 TRP A 69 0.094 -10.875 -3.275 1.00 0.00 C ATOM 1072 CH2 TRP A 69 0.632 -10.253 -4.410 1.00 0.00 C ATOM 0 H TRP A 69 2.628 -11.812 2.583 1.00 0.00 H new ATOM 0 HA TRP A 69 2.928 -9.279 1.310 1.00 0.00 H new ATOM 0 HB2 TRP A 69 4.145 -11.311 0.626 1.00 0.00 H new ATOM 0 HB3 TRP A 69 2.636 -12.107 0.226 1.00 0.00 H new ATOM 0 HD1 TRP A 69 5.242 -9.822 -1.241 1.00 0.00 H new ATOM 0 HE1 TRP A 69 4.604 -9.128 -3.651 1.00 0.00 H new ATOM 0 HE3 TRP A 69 0.424 -11.526 -1.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 2.332 -9.308 -5.298 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -0.926 -11.228 -3.297 1.00 0.00 H new ATOM 0 HH2 TRP A 69 0.019 -10.138 -5.291 1.00 0.00 H new ATOM 1083 N PHE A 70 0.090 -10.907 0.898 1.00 0.00 N ATOM 1084 CA PHE A 70 -1.290 -10.762 0.450 1.00 0.00 C ATOM 1085 C PHE A 70 -1.978 -9.607 1.172 1.00 0.00 C ATOM 1086 O PHE A 70 -2.692 -8.814 0.559 1.00 0.00 O ATOM 1087 CB PHE A 70 -2.065 -12.060 0.686 1.00 0.00 C ATOM 1088 CG PHE A 70 -2.012 -13.010 -0.476 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -0.806 -13.552 -0.890 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -3.168 -13.360 -1.155 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -0.754 -14.427 -1.959 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -3.122 -14.235 -2.224 1.00 0.00 C ATOM 1093 CZ PHE A 70 -1.913 -14.768 -2.627 1.00 0.00 C ATOM 0 H PHE A 70 0.295 -11.798 1.351 1.00 0.00 H new ATOM 0 HA PHE A 70 -1.277 -10.544 -0.618 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -1.665 -12.557 1.570 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -3.106 -11.818 0.900 1.00 0.00 H new ATOM 0 HD1 PHE A 70 0.104 -13.288 -0.372 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.116 -12.944 -0.846 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.192 -14.843 -2.271 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.030 -14.502 -2.744 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.875 -15.450 -3.463 1.00 0.00 H new ATOM 1103 N ALA A 71 -1.758 -9.520 2.480 1.00 0.00 N ATOM 1104 CA ALA A 71 -2.354 -8.463 3.286 1.00 0.00 C ATOM 1105 C ALA A 71 -1.917 -7.086 2.797 1.00 0.00 C ATOM 1106 O ALA A 71 -2.674 -6.120 2.877 1.00 0.00 O ATOM 1107 CB ALA A 71 -1.986 -8.645 4.752 1.00 0.00 C ATOM 0 H ALA A 71 -1.171 -10.169 3.004 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.437 -8.530 3.183 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.438 -7.848 5.342 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.354 -9.609 5.102 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.902 -8.608 4.862 1.00 0.00 H new ATOM 1113 N ASN A 72 -0.691 -7.005 2.290 1.00 0.00 N ATOM 1114 CA ASN A 72 -0.153 -5.745 1.789 1.00 0.00 C ATOM 1115 C ASN A 72 -0.942 -5.262 0.576 1.00 0.00 C ATOM 1116 O ASN A 72 -1.175 -4.064 0.412 1.00 0.00 O ATOM 1117 CB ASN A 72 1.322 -5.908 1.419 1.00 0.00 C ATOM 1118 CG ASN A 72 2.040 -4.577 1.305 1.00 0.00 C ATOM 1119 OD1 ASN A 72 2.921 -4.264 2.106 1.00 0.00 O ATOM 1120 ND2 ASN A 72 1.665 -3.787 0.306 1.00 0.00 N ATOM 0 H ASN A 72 -0.052 -7.796 2.215 1.00 0.00 H new ATOM 0 HA ASN A 72 -0.242 -5.000 2.580 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.817 -6.521 2.172 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.399 -6.442 0.472 1.00 0.00 H new ATOM 0 HD21 ASN A 72 2.112 -2.879 0.178 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.930 -4.088 -0.334 1.00 0.00 H new ATOM 1127 N ARG A 73 -1.352 -6.201 -0.270 1.00 0.00 N ATOM 1128 CA ARG A 73 -2.114 -5.871 -1.468 1.00 0.00 C ATOM 1129 C ARG A 73 -3.542 -5.468 -1.110 1.00 0.00 C ATOM 1130 O ARG A 73 -4.069 -4.484 -1.631 1.00 0.00 O ATOM 1131 CB ARG A 73 -2.135 -7.061 -2.429 1.00 0.00 C ATOM 1132 CG ARG A 73 -3.129 -6.906 -3.569 1.00 0.00 C ATOM 1133 CD ARG A 73 -2.578 -6.016 -4.672 1.00 0.00 C ATOM 1134 NE ARG A 73 -3.642 -5.396 -5.457 1.00 0.00 N ATOM 1135 CZ ARG A 73 -3.472 -4.941 -6.694 1.00 0.00 C ATOM 1136 NH1 ARG A 73 -2.288 -5.037 -7.283 1.00 0.00 N ATOM 1137 NH2 ARG A 73 -4.489 -4.390 -7.344 1.00 0.00 N ATOM 0 H ARG A 73 -1.169 -7.197 -0.148 1.00 0.00 H new ATOM 0 HA ARG A 73 -1.628 -5.027 -1.956 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.137 -7.199 -2.845 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -2.375 -7.965 -1.869 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.371 -7.887 -3.978 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -4.058 -6.482 -3.188 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -1.952 -5.239 -4.233 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.939 -6.606 -5.329 1.00 0.00 H new ATOM 0 HE ARG A 73 -4.565 -5.307 -5.033 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -1.504 -5.461 -6.787 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -2.161 -4.687 -8.233 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.401 -4.316 -6.894 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -4.358 -4.041 -8.293 1.00 0.00 H new ATOM 1151 N ARG A 74 -4.161 -6.234 -0.218 1.00 0.00 N ATOM 1152 CA ARG A 74 -5.528 -5.957 0.208 1.00 0.00 C ATOM 1153 C ARG A 74 -5.626 -4.582 0.861 1.00 0.00 C ATOM 1154 O ARG A 74 -6.517 -3.793 0.543 1.00 0.00 O ATOM 1155 CB ARG A 74 -6.008 -7.033 1.185 1.00 0.00 C ATOM 1156 CG ARG A 74 -6.078 -8.423 0.574 1.00 0.00 C ATOM 1157 CD ARG A 74 -7.167 -9.262 1.223 1.00 0.00 C ATOM 1158 NE ARG A 74 -6.858 -9.576 2.616 1.00 0.00 N ATOM 1159 CZ ARG A 74 -6.051 -10.564 2.985 1.00 0.00 C ATOM 1160 NH1 ARG A 74 -5.472 -11.329 2.070 1.00 0.00 N ATOM 1161 NH2 ARG A 74 -5.819 -10.787 4.272 1.00 0.00 N ATOM 0 H ARG A 74 -3.738 -7.051 0.224 1.00 0.00 H new ATOM 0 HA ARG A 74 -6.166 -5.967 -0.675 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.338 -7.056 2.044 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -6.995 -6.759 1.558 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.269 -8.342 -0.496 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.116 -8.921 0.690 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -8.115 -8.727 1.174 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.294 -10.188 0.662 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.286 -9.005 3.345 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -5.646 -11.159 1.079 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.853 -12.087 2.357 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.261 -10.199 4.979 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.199 -11.546 4.554 1.00 0.00 H new ATOM 1175 N LYS A 75 -4.706 -4.300 1.776 1.00 0.00 N ATOM 1176 CA LYS A 75 -4.687 -3.020 2.475 1.00 0.00 C ATOM 1177 C LYS A 75 -4.383 -1.879 1.510 1.00 0.00 C ATOM 1178 O LYS A 75 -4.873 -0.763 1.682 1.00 0.00 O ATOM 1179 CB LYS A 75 -3.647 -3.044 3.597 1.00 0.00 C ATOM 1180 CG LYS A 75 -2.225 -2.812 3.114 1.00 0.00 C ATOM 1181 CD LYS A 75 -1.243 -2.768 4.272 1.00 0.00 C ATOM 1182 CE LYS A 75 -1.238 -4.076 5.049 1.00 0.00 C ATOM 1183 NZ LYS A 75 -0.084 -4.160 5.986 1.00 0.00 N ATOM 0 H LYS A 75 -3.962 -4.941 2.052 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.674 -2.855 2.907 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.901 -2.281 4.333 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.696 -4.007 4.106 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.940 -3.606 2.424 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.177 -1.875 2.559 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.241 -2.565 3.893 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.504 -1.947 4.941 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.168 -4.169 5.609 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.201 -4.913 4.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.116 -5.066 6.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.804 -4.097 5.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.133 -3.376 6.668 1.00 0.00 H new