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 Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= -1.74 USER MOD Single : A 22 MET CE :methyl -167:sc= -7.35 (180deg=-8.71!) 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= 1.08 K(o=1.1,f=-0.041) USER MOD Single : A 29 ASN : amide:sc= -1.08 X(o=-1.1,f=-1.4!) USER MOD Single : A 30 GLN : amide:sc= 0.432 X(o=0.43,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 139:sc= -0.546! (180deg=-1.65!) USER MOD Single : A 42 ASN : amide:sc= 1.21 K(o=1.2,f=-0.095) USER MOD Single : A 44 CYS SG : rot 180:sc= -1.27 USER MOD Single : A 45 ASN : amide:sc= 0.117 K(o=0.12,f=-11!) USER MOD Single : A 49 GLN : amide:sc= -0.287 K(o=-0.29,f=-7.1!) USER MOD Single : A 50 LYS NZ :NH3+ -170:sc= 0.00578 (180deg=0) 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 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= -0.107 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.136 K(o=-0.14,f=-1.2!) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 166 N TRP A 14 11.303 -10.342 -2.115 1.00 0.00 N ATOM 167 CA TRP A 14 10.391 -11.196 -2.867 1.00 0.00 C ATOM 168 C TRP A 14 10.899 -11.416 -4.288 1.00 0.00 C ATOM 169 O TRP A 14 11.314 -10.473 -4.962 1.00 0.00 O ATOM 170 CB TRP A 14 8.993 -10.578 -2.902 1.00 0.00 C ATOM 171 CG TRP A 14 8.163 -10.917 -1.701 1.00 0.00 C ATOM 172 CD1 TRP A 14 7.788 -10.068 -0.699 1.00 0.00 C ATOM 173 CD2 TRP A 14 7.609 -12.196 -1.375 1.00 0.00 C ATOM 174 NE1 TRP A 14 7.033 -10.743 0.230 1.00 0.00 N ATOM 175 CE2 TRP A 14 6.908 -12.050 -0.162 1.00 0.00 C ATOM 176 CE3 TRP A 14 7.634 -13.450 -1.991 1.00 0.00 C ATOM 177 CZ2 TRP A 14 6.242 -13.111 0.445 1.00 0.00 C ATOM 178 CZ3 TRP A 14 6.973 -14.502 -1.388 1.00 0.00 C ATOM 179 CH2 TRP A 14 6.283 -14.328 -0.180 1.00 0.00 C ATOM 0 HA TRP A 14 10.341 -12.162 -2.365 1.00 0.00 H new ATOM 0 HB2 TRP A 14 9.084 -9.494 -2.977 1.00 0.00 H new ATOM 0 HB3 TRP A 14 8.476 -10.917 -3.800 1.00 0.00 H new ATOM 0 HD1 TRP A 14 8.047 -9.021 -0.645 1.00 0.00 H new ATOM 0 HE1 TRP A 14 6.631 -10.337 1.075 1.00 0.00 H new ATOM 0 HE3 TRP A 14 8.161 -13.594 -2.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 5.712 -12.979 1.376 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 6.988 -15.476 -1.855 1.00 0.00 H new ATOM 0 HH2 TRP A 14 5.774 -15.170 0.266 1.00 0.00 H new ATOM 190 N ARG A 15 10.863 -12.666 -4.738 1.00 0.00 N ATOM 191 CA ARG A 15 11.321 -13.009 -6.079 1.00 0.00 C ATOM 192 C ARG A 15 10.172 -12.937 -7.080 1.00 0.00 C ATOM 193 O ARG A 15 9.017 -13.186 -6.736 1.00 0.00 O ATOM 194 CB ARG A 15 11.933 -14.411 -6.089 1.00 0.00 C ATOM 195 CG ARG A 15 13.116 -14.565 -5.147 1.00 0.00 C ATOM 196 CD ARG A 15 14.342 -13.831 -5.667 1.00 0.00 C ATOM 197 NE ARG A 15 14.358 -12.431 -5.253 1.00 0.00 N ATOM 198 CZ ARG A 15 15.377 -11.609 -5.479 1.00 0.00 C ATOM 199 NH1 ARG A 15 16.457 -12.046 -6.112 1.00 0.00 N ATOM 200 NH2 ARG A 15 15.317 -10.348 -5.072 1.00 0.00 N ATOM 0 H ARG A 15 10.521 -13.458 -4.194 1.00 0.00 H new ATOM 0 HA ARG A 15 12.082 -12.286 -6.372 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.165 -15.135 -5.816 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.253 -14.652 -7.103 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.851 -14.180 -4.162 1.00 0.00 H new ATOM 0 HG3 ARG A 15 13.349 -15.623 -5.024 1.00 0.00 H new ATOM 0 HD2 ARG A 15 15.242 -14.327 -5.304 1.00 0.00 H new ATOM 0 HD3 ARG A 15 14.364 -13.887 -6.755 1.00 0.00 H new ATOM 0 HE ARG A 15 13.542 -12.064 -4.763 1.00 0.00 H new ATOM 0 HH11 ARG A 15 16.507 -13.015 -6.427 1.00 0.00 H new ATOM 0 HH12 ARG A 15 17.238 -11.413 -6.284 1.00 0.00 H new ATOM 0 HH21 ARG A 15 14.488 -10.008 -4.585 1.00 0.00 H new ATOM 0 HH22 ARG A 15 16.100 -9.718 -5.246 1.00 0.00 H new ATOM 214 N LYS A 16 10.497 -12.594 -8.322 1.00 0.00 N ATOM 215 CA LYS A 16 9.494 -12.489 -9.375 1.00 0.00 C ATOM 216 C LYS A 16 8.719 -13.795 -9.520 1.00 0.00 C ATOM 217 O LYS A 16 7.542 -13.791 -9.879 1.00 0.00 O ATOM 218 CB LYS A 16 10.158 -12.128 -10.706 1.00 0.00 C ATOM 219 CG LYS A 16 9.189 -12.075 -11.875 1.00 0.00 C ATOM 220 CD LYS A 16 8.600 -10.685 -12.049 1.00 0.00 C ATOM 221 CE LYS A 16 7.317 -10.519 -11.248 1.00 0.00 C ATOM 222 NZ LYS A 16 7.116 -9.110 -10.810 1.00 0.00 N ATOM 0 H LYS A 16 11.448 -12.384 -8.624 1.00 0.00 H new ATOM 0 HA LYS A 16 8.795 -11.700 -9.099 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.648 -11.159 -10.607 1.00 0.00 H new ATOM 0 HB3 LYS A 16 10.937 -12.859 -10.924 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.704 -12.370 -12.789 1.00 0.00 H new ATOM 0 HG3 LYS A 16 8.386 -12.794 -11.716 1.00 0.00 H new ATOM 0 HD2 LYS A 16 9.328 -9.938 -11.732 1.00 0.00 H new ATOM 0 HD3 LYS A 16 8.397 -10.504 -13.105 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.467 -10.836 -11.853 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.347 -11.170 -10.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 6.232 -9.038 -10.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 7.914 -8.815 -10.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 7.062 -8.491 -11.644 1.00 0.00 H new ATOM 236 N GLU A 17 9.386 -14.909 -9.236 1.00 0.00 N ATOM 237 CA GLU A 17 8.757 -16.221 -9.334 1.00 0.00 C ATOM 238 C GLU A 17 7.706 -16.403 -8.243 1.00 0.00 C ATOM 239 O GLU A 17 6.597 -16.871 -8.507 1.00 0.00 O ATOM 240 CB GLU A 17 9.812 -17.325 -9.230 1.00 0.00 C ATOM 241 CG GLU A 17 11.015 -17.104 -10.132 1.00 0.00 C ATOM 242 CD GLU A 17 10.661 -17.175 -11.604 1.00 0.00 C ATOM 243 OE1 GLU A 17 10.160 -18.231 -12.044 1.00 0.00 O ATOM 244 OE2 GLU A 17 10.885 -16.175 -12.318 1.00 0.00 O ATOM 0 H GLU A 17 10.361 -14.929 -8.936 1.00 0.00 H new ATOM 0 HA GLU A 17 8.264 -16.288 -10.304 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.151 -17.395 -8.197 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.352 -18.281 -9.480 1.00 0.00 H new ATOM 0 HG2 GLU A 17 11.454 -16.130 -9.914 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.775 -17.853 -9.908 1.00 0.00 H new ATOM 251 N CYS A 18 8.061 -16.032 -7.019 1.00 0.00 N ATOM 252 CA CYS A 18 7.149 -16.155 -5.887 1.00 0.00 C ATOM 253 C CYS A 18 6.048 -15.103 -5.959 1.00 0.00 C ATOM 254 O CYS A 18 4.949 -15.302 -5.440 1.00 0.00 O ATOM 255 CB CYS A 18 7.916 -16.020 -4.570 1.00 0.00 C ATOM 256 SG CYS A 18 9.342 -17.122 -4.429 1.00 0.00 S ATOM 0 H CYS A 18 8.974 -15.643 -6.784 1.00 0.00 H new ATOM 0 HA CYS A 18 6.687 -17.141 -5.930 1.00 0.00 H new ATOM 0 HB2 CYS A 18 8.255 -14.990 -4.464 1.00 0.00 H new ATOM 0 HB3 CYS A 18 7.234 -16.218 -3.743 1.00 0.00 H new ATOM 0 HG CYS A 18 9.926 -16.932 -3.283 1.00 0.00 H new ATOM 262 N LEU A 19 6.350 -13.982 -6.604 1.00 0.00 N ATOM 263 CA LEU A 19 5.385 -12.896 -6.743 1.00 0.00 C ATOM 264 C LEU A 19 4.333 -13.233 -7.795 1.00 0.00 C ATOM 265 O LEU A 19 3.145 -12.981 -7.601 1.00 0.00 O ATOM 266 CB LEU A 19 6.101 -11.597 -7.119 1.00 0.00 C ATOM 267 CG LEU A 19 6.960 -10.963 -6.025 1.00 0.00 C ATOM 268 CD1 LEU A 19 7.558 -9.651 -6.508 1.00 0.00 C ATOM 269 CD2 LEU A 19 6.139 -10.744 -4.762 1.00 0.00 C ATOM 0 H LEU A 19 7.255 -13.801 -7.039 1.00 0.00 H new ATOM 0 HA LEU A 19 4.883 -12.763 -5.784 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.735 -11.793 -7.984 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.351 -10.870 -7.432 1.00 0.00 H new ATOM 0 HG LEU A 19 7.777 -11.646 -5.790 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.166 -9.215 -5.716 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.181 -9.835 -7.383 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.756 -8.961 -6.772 1.00 0.00 H new ATOM 0 HD21 LEU A 19 6.767 -10.292 -3.994 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.302 -10.082 -4.983 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.760 -11.701 -4.404 1.00 0.00 H new ATOM 281 N ALA A 20 4.779 -13.806 -8.908 1.00 0.00 N ATOM 282 CA ALA A 20 3.876 -14.182 -9.988 1.00 0.00 C ATOM 283 C ALA A 20 2.859 -15.217 -9.519 1.00 0.00 C ATOM 284 O ALA A 20 1.720 -15.238 -9.984 1.00 0.00 O ATOM 285 CB ALA A 20 4.665 -14.715 -11.175 1.00 0.00 C ATOM 0 H ALA A 20 5.760 -14.020 -9.085 1.00 0.00 H new ATOM 0 HA ALA A 20 3.331 -13.291 -10.299 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.977 -14.992 -11.974 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.347 -13.944 -11.534 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.236 -15.591 -10.868 1.00 0.00 H new ATOM 291 N VAL A 21 3.279 -16.075 -8.594 1.00 0.00 N ATOM 292 CA VAL A 21 2.404 -17.113 -8.062 1.00 0.00 C ATOM 293 C VAL A 21 1.417 -16.536 -7.053 1.00 0.00 C ATOM 294 O VAL A 21 0.245 -16.910 -7.033 1.00 0.00 O ATOM 295 CB VAL A 21 3.213 -18.236 -7.386 1.00 0.00 C ATOM 296 CG1 VAL A 21 2.306 -19.399 -7.016 1.00 0.00 C ATOM 297 CG2 VAL A 21 4.343 -18.699 -8.294 1.00 0.00 C ATOM 0 H VAL A 21 4.219 -16.072 -8.198 1.00 0.00 H new ATOM 0 HA VAL A 21 1.855 -17.528 -8.907 1.00 0.00 H new ATOM 0 HB VAL A 21 3.652 -17.842 -6.469 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.895 -20.183 -6.540 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.535 -19.054 -6.326 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.836 -19.795 -7.916 1.00 0.00 H new ATOM 0 HG21 VAL A 21 4.904 -19.493 -7.801 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.928 -19.075 -9.229 1.00 0.00 H new ATOM 0 HG23 VAL A 21 5.008 -17.861 -8.504 1.00 0.00 H new ATOM 307 N MET A 22 1.899 -15.621 -6.218 1.00 0.00 N ATOM 308 CA MET A 22 1.058 -14.990 -5.208 1.00 0.00 C ATOM 309 C MET A 22 -0.055 -14.175 -5.859 1.00 0.00 C ATOM 310 O MET A 22 -1.186 -14.156 -5.375 1.00 0.00 O ATOM 311 CB MET A 22 1.901 -14.091 -4.301 1.00 0.00 C ATOM 312 CG MET A 22 2.553 -14.834 -3.146 1.00 0.00 C ATOM 313 SD MET A 22 3.036 -13.736 -1.799 1.00 0.00 S ATOM 314 CE MET A 22 4.411 -12.867 -2.549 1.00 0.00 C ATOM 0 H MET A 22 2.867 -15.300 -6.221 1.00 0.00 H new ATOM 0 HA MET A 22 0.603 -15.777 -4.606 1.00 0.00 H new ATOM 0 HB2 MET A 22 2.677 -13.611 -4.898 1.00 0.00 H new ATOM 0 HB3 MET A 22 1.270 -13.297 -3.902 1.00 0.00 H new ATOM 0 HG2 MET A 22 1.862 -15.586 -2.766 1.00 0.00 H new ATOM 0 HG3 MET A 22 3.433 -15.365 -3.511 1.00 0.00 H new ATOM 0 HE1 MET A 22 4.961 -12.324 -1.780 1.00 0.00 H new ATOM 0 HE2 MET A 22 5.074 -13.584 -3.032 1.00 0.00 H new ATOM 0 HE3 MET A 22 4.035 -12.163 -3.291 1.00 0.00 H new ATOM 324 N GLU A 23 0.275 -13.504 -6.958 1.00 0.00 N ATOM 325 CA GLU A 23 -0.698 -12.686 -7.673 1.00 0.00 C ATOM 326 C GLU A 23 -1.827 -13.548 -8.232 1.00 0.00 C ATOM 327 O GLU A 23 -2.990 -13.144 -8.229 1.00 0.00 O ATOM 328 CB GLU A 23 -0.017 -11.920 -8.809 1.00 0.00 C ATOM 329 CG GLU A 23 0.535 -10.569 -8.386 1.00 0.00 C ATOM 330 CD GLU A 23 1.464 -9.969 -9.423 1.00 0.00 C ATOM 331 OE1 GLU A 23 2.396 -10.674 -9.864 1.00 0.00 O ATOM 332 OE2 GLU A 23 1.261 -8.794 -9.794 1.00 0.00 O ATOM 0 H GLU A 23 1.207 -13.511 -7.372 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.123 -11.973 -6.967 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.796 -12.526 -9.209 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.733 -11.774 -9.618 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.292 -9.883 -8.204 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.071 -10.679 -7.443 1.00 0.00 H new ATOM 339 N SER A 24 -1.475 -14.737 -8.710 1.00 0.00 N ATOM 340 CA SER A 24 -2.457 -15.655 -9.276 1.00 0.00 C ATOM 341 C SER A 24 -3.470 -16.086 -8.219 1.00 0.00 C ATOM 342 O SER A 24 -4.679 -16.035 -8.446 1.00 0.00 O ATOM 343 CB SER A 24 -1.759 -16.884 -9.861 1.00 0.00 C ATOM 344 OG SER A 24 -2.604 -17.564 -10.773 1.00 0.00 O ATOM 0 H SER A 24 -0.517 -15.088 -8.717 1.00 0.00 H new ATOM 0 HA SER A 24 -2.988 -15.134 -10.073 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.843 -16.579 -10.367 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.469 -17.559 -9.056 1.00 0.00 H new ATOM 0 HG SER A 24 -2.134 -18.345 -11.134 1.00 0.00 H new ATOM 350 N TYR A 25 -2.967 -16.509 -7.065 1.00 0.00 N ATOM 351 CA TYR A 25 -3.826 -16.952 -5.974 1.00 0.00 C ATOM 352 C TYR A 25 -4.702 -15.808 -5.472 1.00 0.00 C ATOM 353 O TYR A 25 -5.837 -16.020 -5.045 1.00 0.00 O ATOM 354 CB TYR A 25 -2.983 -17.505 -4.824 1.00 0.00 C ATOM 355 CG TYR A 25 -2.665 -18.977 -4.960 1.00 0.00 C ATOM 356 CD1 TYR A 25 -1.819 -19.435 -5.963 1.00 0.00 C ATOM 357 CD2 TYR A 25 -3.211 -19.909 -4.087 1.00 0.00 C ATOM 358 CE1 TYR A 25 -1.527 -20.779 -6.092 1.00 0.00 C ATOM 359 CE2 TYR A 25 -2.922 -21.255 -4.207 1.00 0.00 C ATOM 360 CZ TYR A 25 -2.080 -21.685 -5.211 1.00 0.00 C ATOM 361 OH TYR A 25 -1.792 -23.025 -5.335 1.00 0.00 O ATOM 0 H TYR A 25 -1.969 -16.554 -6.861 1.00 0.00 H new ATOM 0 HA TYR A 25 -4.473 -17.743 -6.354 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -2.050 -16.944 -4.766 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -3.512 -17.341 -3.885 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -1.383 -18.728 -6.653 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -3.873 -19.576 -3.301 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -0.869 -21.119 -6.878 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -3.353 -21.966 -3.518 1.00 0.00 H new ATOM 0 HH TYR A 25 -0.895 -23.133 -5.715 1.00 0.00 H new ATOM 371 N PHE A 26 -4.166 -14.593 -5.527 1.00 0.00 N ATOM 372 CA PHE A 26 -4.897 -13.413 -5.078 1.00 0.00 C ATOM 373 C PHE A 26 -6.074 -13.118 -6.004 1.00 0.00 C ATOM 374 O PHE A 26 -7.141 -12.703 -5.555 1.00 0.00 O ATOM 375 CB PHE A 26 -3.965 -12.202 -5.018 1.00 0.00 C ATOM 376 CG PHE A 26 -4.541 -11.040 -4.260 1.00 0.00 C ATOM 377 CD1 PHE A 26 -5.578 -10.293 -4.795 1.00 0.00 C ATOM 378 CD2 PHE A 26 -4.045 -10.694 -3.014 1.00 0.00 C ATOM 379 CE1 PHE A 26 -6.110 -9.223 -4.101 1.00 0.00 C ATOM 380 CE2 PHE A 26 -4.573 -9.625 -2.315 1.00 0.00 C ATOM 381 CZ PHE A 26 -5.607 -8.888 -2.860 1.00 0.00 C ATOM 0 H PHE A 26 -3.228 -14.400 -5.878 1.00 0.00 H new ATOM 0 HA PHE A 26 -5.284 -13.614 -4.079 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.025 -12.499 -4.553 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.731 -11.883 -6.034 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -5.975 -10.550 -5.766 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.236 -11.266 -2.584 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.919 -8.649 -4.529 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.178 -9.366 -1.344 1.00 0.00 H new ATOM 0 HZ PHE A 26 -6.021 -8.052 -2.316 1.00 0.00 H new ATOM 391 N ASN A 27 -5.869 -13.335 -7.299 1.00 0.00 N ATOM 392 CA ASN A 27 -6.912 -13.092 -8.289 1.00 0.00 C ATOM 393 C ASN A 27 -8.106 -14.014 -8.060 1.00 0.00 C ATOM 394 O ASN A 27 -9.255 -13.615 -8.246 1.00 0.00 O ATOM 395 CB ASN A 27 -6.361 -13.293 -9.702 1.00 0.00 C ATOM 396 CG ASN A 27 -5.788 -12.016 -10.287 1.00 0.00 C ATOM 397 OD1 ASN A 27 -6.500 -11.238 -10.922 1.00 0.00 O ATOM 398 ND2 ASN A 27 -4.496 -11.796 -10.074 1.00 0.00 N ATOM 0 H ASN A 27 -4.991 -13.679 -7.687 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.247 -12.060 -8.181 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.586 -14.059 -9.681 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -7.156 -13.661 -10.350 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -4.055 -10.954 -10.443 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -3.945 -12.469 -9.542 1.00 0.00 H new ATOM 405 N GLU A 28 -7.823 -15.249 -7.656 1.00 0.00 N ATOM 406 CA GLU A 28 -8.874 -16.228 -7.403 1.00 0.00 C ATOM 407 C GLU A 28 -9.485 -16.024 -6.020 1.00 0.00 C ATOM 408 O GLU A 28 -10.677 -16.251 -5.817 1.00 0.00 O ATOM 409 CB GLU A 28 -8.317 -17.648 -7.522 1.00 0.00 C ATOM 410 CG GLU A 28 -7.431 -18.055 -6.356 1.00 0.00 C ATOM 411 CD GLU A 28 -7.287 -19.559 -6.230 1.00 0.00 C ATOM 412 OE1 GLU A 28 -8.211 -20.281 -6.661 1.00 0.00 O ATOM 413 OE2 GLU A 28 -6.252 -20.014 -5.701 1.00 0.00 O ATOM 0 H GLU A 28 -6.877 -15.595 -7.497 1.00 0.00 H new ATOM 0 HA GLU A 28 -9.655 -16.087 -8.151 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.148 -18.350 -7.598 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.746 -17.729 -8.447 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -6.445 -17.609 -6.481 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.847 -17.655 -5.431 1.00 0.00 H new ATOM 420 N ASN A 29 -8.659 -15.594 -5.072 1.00 0.00 N ATOM 421 CA ASN A 29 -9.118 -15.360 -3.707 1.00 0.00 C ATOM 422 C ASN A 29 -8.231 -14.338 -3.003 1.00 0.00 C ATOM 423 O ASN A 29 -7.007 -14.467 -2.990 1.00 0.00 O ATOM 424 CB ASN A 29 -9.128 -16.672 -2.918 1.00 0.00 C ATOM 425 CG ASN A 29 -9.994 -16.592 -1.676 1.00 0.00 C ATOM 426 OD1 ASN A 29 -10.995 -15.877 -1.648 1.00 0.00 O ATOM 427 ND2 ASN A 29 -9.611 -17.329 -0.640 1.00 0.00 N ATOM 0 H ASN A 29 -7.669 -15.401 -5.223 1.00 0.00 H new ATOM 0 HA ASN A 29 -10.132 -14.964 -3.754 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -9.490 -17.476 -3.559 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.108 -16.928 -2.631 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -10.154 -17.317 0.223 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.774 -17.908 -0.707 1.00 0.00 H new ATOM 434 N GLN A 30 -8.858 -13.322 -2.418 1.00 0.00 N ATOM 435 CA GLN A 30 -8.126 -12.277 -1.712 1.00 0.00 C ATOM 436 C GLN A 30 -7.533 -12.811 -0.412 1.00 0.00 C ATOM 437 O GLN A 30 -6.399 -12.490 -0.058 1.00 0.00 O ATOM 438 CB GLN A 30 -9.045 -11.091 -1.418 1.00 0.00 C ATOM 439 CG GLN A 30 -9.712 -10.515 -2.657 1.00 0.00 C ATOM 440 CD GLN A 30 -10.057 -9.047 -2.506 1.00 0.00 C ATOM 441 OE1 GLN A 30 -11.156 -8.697 -2.073 1.00 0.00 O ATOM 442 NE2 GLN A 30 -9.118 -8.178 -2.861 1.00 0.00 N ATOM 0 H GLN A 30 -9.871 -13.201 -2.419 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.309 -11.944 -2.353 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.815 -11.405 -0.714 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -8.467 -10.307 -0.929 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -9.050 -10.642 -3.514 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -10.621 -11.078 -2.870 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -8.222 -8.512 -3.215 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -9.293 -7.176 -2.780 1.00 0.00 H new ATOM 451 N TYR A 31 -8.308 -13.627 0.294 1.00 0.00 N ATOM 452 CA TYR A 31 -7.860 -14.203 1.556 1.00 0.00 C ATOM 453 C TYR A 31 -7.782 -15.724 1.463 1.00 0.00 C ATOM 454 O TYR A 31 -8.749 -16.439 1.728 1.00 0.00 O ATOM 455 CB TYR A 31 -8.805 -13.798 2.689 1.00 0.00 C ATOM 456 CG TYR A 31 -9.273 -12.363 2.603 1.00 0.00 C ATOM 457 CD1 TYR A 31 -10.111 -11.946 1.576 1.00 0.00 C ATOM 458 CD2 TYR A 31 -8.879 -11.425 3.549 1.00 0.00 C ATOM 459 CE1 TYR A 31 -10.540 -10.635 1.493 1.00 0.00 C ATOM 460 CE2 TYR A 31 -9.305 -10.113 3.475 1.00 0.00 C ATOM 461 CZ TYR A 31 -10.135 -9.723 2.445 1.00 0.00 C ATOM 462 OH TYR A 31 -10.562 -8.417 2.367 1.00 0.00 O ATOM 0 H TYR A 31 -9.249 -13.904 0.014 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.863 -13.818 1.768 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.674 -14.456 2.679 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.301 -13.950 3.643 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -10.432 -12.658 0.830 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -8.228 -11.727 4.356 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -11.189 -10.326 0.687 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -8.990 -9.397 4.219 1.00 0.00 H new ATOM 0 HH TYR A 31 -10.187 -7.905 3.114 1.00 0.00 H new ATOM 472 N PRO A 32 -6.602 -16.233 1.078 1.00 0.00 N ATOM 473 CA PRO A 32 -6.367 -17.673 0.942 1.00 0.00 C ATOM 474 C PRO A 32 -6.346 -18.387 2.290 1.00 0.00 C ATOM 475 O PRO A 32 -5.534 -18.068 3.159 1.00 0.00 O ATOM 476 CB PRO A 32 -4.991 -17.747 0.276 1.00 0.00 C ATOM 477 CG PRO A 32 -4.317 -16.474 0.656 1.00 0.00 C ATOM 478 CD PRO A 32 -5.406 -15.440 0.747 1.00 0.00 C ATOM 0 HA PRO A 32 -7.157 -18.163 0.373 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -4.428 -18.613 0.625 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -5.080 -17.840 -0.806 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.796 -16.577 1.608 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.571 -16.191 -0.086 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.191 -14.697 1.515 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -5.528 -14.901 -0.193 1.00 0.00 H new ATOM 486 N ASP A 33 -7.242 -19.353 2.456 1.00 0.00 N ATOM 487 CA ASP A 33 -7.325 -20.113 3.698 1.00 0.00 C ATOM 488 C ASP A 33 -5.951 -20.634 4.109 1.00 0.00 C ATOM 489 O ASP A 33 -4.976 -20.488 3.373 1.00 0.00 O ATOM 490 CB ASP A 33 -8.301 -21.281 3.542 1.00 0.00 C ATOM 491 CG ASP A 33 -9.749 -20.832 3.569 1.00 0.00 C ATOM 492 OD1 ASP A 33 -10.021 -19.737 4.104 1.00 0.00 O ATOM 493 OD2 ASP A 33 -10.609 -21.577 3.055 1.00 0.00 O ATOM 0 H ASP A 33 -7.921 -19.629 1.747 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.690 -19.446 4.479 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -8.100 -21.795 2.602 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -8.132 -22.002 4.342 1.00 0.00 H new ATOM 498 N GLU A 34 -5.883 -21.240 5.291 1.00 0.00 N ATOM 499 CA GLU A 34 -4.627 -21.780 5.800 1.00 0.00 C ATOM 500 C GLU A 34 -4.030 -22.784 4.819 1.00 0.00 C ATOM 501 O GLU A 34 -2.830 -22.763 4.546 1.00 0.00 O ATOM 502 CB GLU A 34 -4.848 -22.446 7.159 1.00 0.00 C ATOM 503 CG GLU A 34 -3.595 -23.089 7.732 1.00 0.00 C ATOM 504 CD GLU A 34 -3.877 -23.909 8.976 1.00 0.00 C ATOM 505 OE1 GLU A 34 -4.226 -23.310 10.014 1.00 0.00 O ATOM 506 OE2 GLU A 34 -3.749 -25.149 8.911 1.00 0.00 O ATOM 0 H GLU A 34 -6.681 -21.369 5.913 1.00 0.00 H new ATOM 0 HA GLU A 34 -3.926 -20.954 5.918 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.219 -21.701 7.863 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -5.624 -23.206 7.060 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.141 -23.728 6.975 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.869 -22.312 7.970 1.00 0.00 H new ATOM 513 N ALA A 35 -4.876 -23.664 4.293 1.00 0.00 N ATOM 514 CA ALA A 35 -4.433 -24.676 3.342 1.00 0.00 C ATOM 515 C ALA A 35 -4.010 -24.041 2.022 1.00 0.00 C ATOM 516 O ALA A 35 -3.061 -24.491 1.380 1.00 0.00 O ATOM 517 CB ALA A 35 -5.534 -25.699 3.109 1.00 0.00 C ATOM 0 H ALA A 35 -5.872 -23.696 4.510 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.566 -25.182 3.766 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.189 -26.449 2.397 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.786 -26.184 4.052 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.417 -25.199 2.711 1.00 0.00 H new ATOM 523 N LYS A 36 -4.721 -22.992 1.621 1.00 0.00 N ATOM 524 CA LYS A 36 -4.420 -22.294 0.377 1.00 0.00 C ATOM 525 C LYS A 36 -3.060 -21.607 0.454 1.00 0.00 C ATOM 526 O LYS A 36 -2.290 -21.625 -0.506 1.00 0.00 O ATOM 527 CB LYS A 36 -5.508 -21.262 0.071 1.00 0.00 C ATOM 528 CG LYS A 36 -5.342 -20.585 -1.279 1.00 0.00 C ATOM 529 CD LYS A 36 -5.645 -21.540 -2.422 1.00 0.00 C ATOM 530 CE LYS A 36 -7.142 -21.676 -2.653 1.00 0.00 C ATOM 531 NZ LYS A 36 -7.665 -20.606 -3.547 1.00 0.00 N ATOM 0 H LYS A 36 -5.510 -22.607 2.140 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.390 -23.031 -0.426 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.481 -21.752 0.105 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -5.506 -20.502 0.852 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -6.006 -19.722 -1.339 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.323 -20.211 -1.377 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.166 -21.182 -3.333 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.219 -22.519 -2.202 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -7.355 -22.651 -3.091 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -7.662 -21.636 -1.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -8.355 -21.014 -4.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.128 -19.871 -2.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -6.878 -20.185 -4.081 1.00 0.00 H new ATOM 545 N ARG A 37 -2.771 -21.003 1.602 1.00 0.00 N ATOM 546 CA ARG A 37 -1.505 -20.311 1.804 1.00 0.00 C ATOM 547 C ARG A 37 -0.330 -21.276 1.669 1.00 0.00 C ATOM 548 O ARG A 37 0.683 -20.952 1.051 1.00 0.00 O ATOM 549 CB ARG A 37 -1.476 -19.646 3.181 1.00 0.00 C ATOM 550 CG ARG A 37 -2.338 -18.397 3.272 1.00 0.00 C ATOM 551 CD ARG A 37 -2.019 -17.590 4.521 1.00 0.00 C ATOM 552 NE ARG A 37 -2.728 -18.094 5.694 1.00 0.00 N ATOM 553 CZ ARG A 37 -2.293 -19.106 6.437 1.00 0.00 C ATOM 554 NH1 ARG A 37 -1.157 -19.717 6.131 1.00 0.00 N ATOM 555 NH2 ARG A 37 -2.994 -19.507 7.489 1.00 0.00 N ATOM 0 H ARG A 37 -3.397 -20.979 2.407 1.00 0.00 H new ATOM 0 HA ARG A 37 -1.413 -19.543 1.035 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.812 -20.364 3.929 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.447 -19.386 3.428 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.180 -17.779 2.388 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.391 -18.680 3.279 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.945 -17.618 4.707 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -2.287 -16.546 4.356 1.00 0.00 H new ATOM 0 HE ARG A 37 -3.605 -17.645 5.957 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -0.615 -19.410 5.323 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -0.825 -20.494 6.703 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.868 -19.038 7.728 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -2.659 -20.284 8.059 1.00 0.00 H new ATOM 569 N GLU A 38 -0.475 -22.461 2.253 1.00 0.00 N ATOM 570 CA GLU A 38 0.575 -23.472 2.199 1.00 0.00 C ATOM 571 C GLU A 38 0.747 -24.002 0.778 1.00 0.00 C ATOM 572 O GLU A 38 1.859 -24.314 0.352 1.00 0.00 O ATOM 573 CB GLU A 38 0.251 -24.627 3.149 1.00 0.00 C ATOM 574 CG GLU A 38 0.578 -24.329 4.603 1.00 0.00 C ATOM 575 CD GLU A 38 1.971 -24.783 4.993 1.00 0.00 C ATOM 576 OE1 GLU A 38 2.244 -25.998 4.911 1.00 0.00 O ATOM 577 OE2 GLU A 38 2.789 -23.921 5.379 1.00 0.00 O ATOM 0 H GLU A 38 -1.308 -22.745 2.768 1.00 0.00 H new ATOM 0 HA GLU A 38 1.509 -23.005 2.511 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.809 -24.868 3.066 1.00 0.00 H new ATOM 0 HB3 GLU A 38 0.805 -25.511 2.835 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.487 -23.257 4.780 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.153 -24.821 5.244 1.00 0.00 H new ATOM 584 N GLU A 39 -0.361 -24.100 0.050 1.00 0.00 N ATOM 585 CA GLU A 39 -0.332 -24.592 -1.322 1.00 0.00 C ATOM 586 C GLU A 39 0.408 -23.619 -2.234 1.00 0.00 C ATOM 587 O GLU A 39 1.264 -24.020 -3.024 1.00 0.00 O ATOM 588 CB GLU A 39 -1.756 -24.811 -1.839 1.00 0.00 C ATOM 589 CG GLU A 39 -1.823 -25.668 -3.091 1.00 0.00 C ATOM 590 CD GLU A 39 -1.920 -27.149 -2.781 1.00 0.00 C ATOM 591 OE1 GLU A 39 -1.468 -27.556 -1.690 1.00 0.00 O ATOM 592 OE2 GLU A 39 -2.446 -27.900 -3.628 1.00 0.00 O ATOM 0 H GLU A 39 -1.289 -23.845 0.387 1.00 0.00 H new ATOM 0 HA GLU A 39 0.200 -25.544 -1.328 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.350 -25.281 -1.055 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -2.211 -23.843 -2.047 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.686 -25.368 -3.686 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.937 -25.485 -3.699 1.00 0.00 H new ATOM 599 N ILE A 40 0.072 -22.338 -2.120 1.00 0.00 N ATOM 600 CA ILE A 40 0.705 -21.307 -2.933 1.00 0.00 C ATOM 601 C ILE A 40 2.139 -21.053 -2.481 1.00 0.00 C ATOM 602 O ILE A 40 2.991 -20.661 -3.277 1.00 0.00 O ATOM 603 CB ILE A 40 -0.082 -19.984 -2.877 1.00 0.00 C ATOM 604 CG1 ILE A 40 0.414 -19.025 -3.961 1.00 0.00 C ATOM 605 CG2 ILE A 40 0.047 -19.349 -1.501 1.00 0.00 C ATOM 606 CD1 ILE A 40 1.760 -18.409 -3.654 1.00 0.00 C ATOM 0 H ILE A 40 -0.635 -21.990 -1.472 1.00 0.00 H new ATOM 0 HA ILE A 40 0.710 -21.674 -3.959 1.00 0.00 H new ATOM 0 HB ILE A 40 -1.135 -20.196 -3.060 1.00 0.00 H new ATOM 0 HG12 ILE A 40 0.477 -19.561 -4.908 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.319 -18.229 -4.093 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.514 -18.415 -1.477 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.349 -20.030 -0.748 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.097 -19.146 -1.291 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.048 -17.741 -4.466 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.698 -17.844 -2.724 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.506 -19.197 -3.551 1.00 0.00 H new ATOM 618 N ALA A 41 2.397 -21.280 -1.197 1.00 0.00 N ATOM 619 CA ALA A 41 3.729 -21.079 -0.639 1.00 0.00 C ATOM 620 C ALA A 41 4.685 -22.178 -1.090 1.00 0.00 C ATOM 621 O ALA A 41 5.804 -21.902 -1.519 1.00 0.00 O ATOM 622 CB ALA A 41 3.662 -21.027 0.880 1.00 0.00 C ATOM 0 H ALA A 41 1.702 -21.603 -0.524 1.00 0.00 H new ATOM 0 HA ALA A 41 4.111 -20.127 -1.008 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.663 -20.877 1.283 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.019 -20.202 1.188 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.255 -21.965 1.259 1.00 0.00 H new ATOM 628 N ASN A 42 4.236 -23.425 -0.991 1.00 0.00 N ATOM 629 CA ASN A 42 5.053 -24.566 -1.388 1.00 0.00 C ATOM 630 C ASN A 42 5.462 -24.457 -2.854 1.00 0.00 C ATOM 631 O ASN A 42 6.547 -24.892 -3.239 1.00 0.00 O ATOM 632 CB ASN A 42 4.290 -25.871 -1.156 1.00 0.00 C ATOM 633 CG ASN A 42 4.529 -26.442 0.229 1.00 0.00 C ATOM 634 OD1 ASN A 42 5.259 -27.420 0.392 1.00 0.00 O ATOM 635 ND2 ASN A 42 3.914 -25.831 1.235 1.00 0.00 N ATOM 0 H ASN A 42 3.311 -23.671 -0.639 1.00 0.00 H new ATOM 0 HA ASN A 42 5.955 -24.567 -0.776 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.223 -25.695 -1.294 1.00 0.00 H new ATOM 0 HB3 ASN A 42 4.592 -26.603 -1.905 1.00 0.00 H new ATOM 0 HD21 ASN A 42 4.038 -26.169 2.189 1.00 0.00 H new ATOM 0 HD22 ASN A 42 3.318 -25.023 1.053 1.00 0.00 H new ATOM 642 N ALA A 43 4.587 -23.873 -3.666 1.00 0.00 N ATOM 643 CA ALA A 43 4.858 -23.705 -5.088 1.00 0.00 C ATOM 644 C ALA A 43 5.962 -22.678 -5.318 1.00 0.00 C ATOM 645 O ALA A 43 6.807 -22.848 -6.198 1.00 0.00 O ATOM 646 CB ALA A 43 3.591 -23.293 -5.822 1.00 0.00 C ATOM 0 H ALA A 43 3.684 -23.508 -3.363 1.00 0.00 H new ATOM 0 HA ALA A 43 5.199 -24.662 -5.483 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.809 -23.171 -6.883 1.00 0.00 H new ATOM 0 HB2 ALA A 43 2.830 -24.062 -5.694 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.226 -22.350 -5.416 1.00 0.00 H new ATOM 652 N CYS A 44 5.949 -21.614 -4.523 1.00 0.00 N ATOM 653 CA CYS A 44 6.949 -20.559 -4.642 1.00 0.00 C ATOM 654 C CYS A 44 8.348 -21.101 -4.363 1.00 0.00 C ATOM 655 O CYS A 44 9.316 -20.714 -5.015 1.00 0.00 O ATOM 656 CB CYS A 44 6.631 -19.415 -3.679 1.00 0.00 C ATOM 657 SG CYS A 44 5.191 -18.429 -4.153 1.00 0.00 S ATOM 0 H CYS A 44 5.257 -21.459 -3.789 1.00 0.00 H new ATOM 0 HA CYS A 44 6.923 -20.182 -5.664 1.00 0.00 H new ATOM 0 HB2 CYS A 44 6.464 -19.828 -2.684 1.00 0.00 H new ATOM 0 HB3 CYS A 44 7.500 -18.760 -3.610 1.00 0.00 H new ATOM 0 HG CYS A 44 5.002 -17.488 -3.276 1.00 0.00 H new ATOM 663 N ASN A 45 8.445 -21.998 -3.387 1.00 0.00 N ATOM 664 CA ASN A 45 9.725 -22.592 -3.020 1.00 0.00 C ATOM 665 C ASN A 45 10.252 -23.486 -4.138 1.00 0.00 C ATOM 666 O ASN A 45 11.460 -23.594 -4.343 1.00 0.00 O ATOM 667 CB ASN A 45 9.583 -23.402 -1.729 1.00 0.00 C ATOM 668 CG ASN A 45 9.628 -22.528 -0.490 1.00 0.00 C ATOM 669 OD1 ASN A 45 10.454 -21.620 -0.387 1.00 0.00 O ATOM 670 ND2 ASN A 45 8.738 -22.799 0.457 1.00 0.00 N ATOM 0 H ASN A 45 7.653 -22.329 -2.836 1.00 0.00 H new ATOM 0 HA ASN A 45 10.439 -21.784 -2.859 1.00 0.00 H new ATOM 0 HB2 ASN A 45 8.641 -23.951 -1.749 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.382 -24.142 -1.678 1.00 0.00 H new ATOM 0 HD21 ASN A 45 8.720 -22.245 1.313 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.072 -23.561 0.328 1.00 0.00 H new ATOM 677 N ALA A 46 9.335 -24.123 -4.860 1.00 0.00 N ATOM 678 CA ALA A 46 9.707 -25.005 -5.959 1.00 0.00 C ATOM 679 C ALA A 46 10.262 -24.211 -7.136 1.00 0.00 C ATOM 680 O ALA A 46 11.309 -24.550 -7.689 1.00 0.00 O ATOM 681 CB ALA A 46 8.509 -25.835 -6.398 1.00 0.00 C ATOM 0 H ALA A 46 8.330 -24.044 -4.703 1.00 0.00 H new ATOM 0 HA ALA A 46 10.490 -25.676 -5.605 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.801 -26.489 -7.219 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.158 -26.438 -5.561 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.709 -25.173 -6.729 1.00 0.00 H new ATOM 687 N VAL A 47 9.554 -23.152 -7.517 1.00 0.00 N ATOM 688 CA VAL A 47 9.977 -22.309 -8.628 1.00 0.00 C ATOM 689 C VAL A 47 11.368 -21.735 -8.385 1.00 0.00 C ATOM 690 O VAL A 47 12.115 -21.470 -9.327 1.00 0.00 O ATOM 691 CB VAL A 47 8.989 -21.150 -8.861 1.00 0.00 C ATOM 692 CG1 VAL A 47 7.708 -21.661 -9.503 1.00 0.00 C ATOM 693 CG2 VAL A 47 8.691 -20.434 -7.553 1.00 0.00 C ATOM 0 H VAL A 47 8.685 -22.858 -7.072 1.00 0.00 H new ATOM 0 HA VAL A 47 9.999 -22.942 -9.515 1.00 0.00 H new ATOM 0 HB VAL A 47 9.448 -20.435 -9.544 1.00 0.00 H new ATOM 0 HG11 VAL A 47 7.022 -20.828 -9.660 1.00 0.00 H new ATOM 0 HG12 VAL A 47 7.941 -22.125 -10.462 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.241 -22.397 -8.848 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.992 -19.618 -7.736 1.00 0.00 H new ATOM 0 HG22 VAL A 47 8.252 -21.137 -6.845 1.00 0.00 H new ATOM 0 HG23 VAL A 47 9.616 -20.033 -7.139 1.00 0.00 H new ATOM 703 N ILE A 48 11.710 -21.545 -7.115 1.00 0.00 N ATOM 704 CA ILE A 48 13.013 -21.004 -6.748 1.00 0.00 C ATOM 705 C ILE A 48 13.992 -22.119 -6.397 1.00 0.00 C ATOM 706 O ILE A 48 15.201 -21.974 -6.573 1.00 0.00 O ATOM 707 CB ILE A 48 12.904 -20.038 -5.553 1.00 0.00 C ATOM 708 CG1 ILE A 48 12.403 -20.780 -4.313 1.00 0.00 C ATOM 709 CG2 ILE A 48 11.981 -18.878 -5.893 1.00 0.00 C ATOM 710 CD1 ILE A 48 12.344 -19.914 -3.074 1.00 0.00 C ATOM 0 H ILE A 48 11.103 -21.758 -6.323 1.00 0.00 H new ATOM 0 HA ILE A 48 13.384 -20.458 -7.615 1.00 0.00 H new ATOM 0 HB ILE A 48 13.894 -19.637 -5.337 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.409 -21.179 -4.515 1.00 0.00 H new ATOM 0 HG13 ILE A 48 13.056 -21.632 -4.121 1.00 0.00 H new ATOM 0 HG21 ILE A 48 11.914 -18.204 -5.039 1.00 0.00 H new ATOM 0 HG22 ILE A 48 12.378 -18.337 -6.752 1.00 0.00 H new ATOM 0 HG23 ILE A 48 10.989 -19.261 -6.132 1.00 0.00 H new ATOM 0 HD11 ILE A 48 11.980 -20.505 -2.234 1.00 0.00 H new ATOM 0 HD12 ILE A 48 13.341 -19.536 -2.847 1.00 0.00 H new ATOM 0 HD13 ILE A 48 11.669 -19.076 -3.247 1.00 0.00 H new ATOM 722 N GLN A 49 13.461 -23.233 -5.903 1.00 0.00 N ATOM 723 CA GLN A 49 14.289 -24.374 -5.530 1.00 0.00 C ATOM 724 C GLN A 49 15.113 -24.860 -6.717 1.00 0.00 C ATOM 725 O GLN A 49 14.602 -24.992 -7.829 1.00 0.00 O ATOM 726 CB GLN A 49 13.416 -25.512 -4.999 1.00 0.00 C ATOM 727 CG GLN A 49 14.187 -26.793 -4.725 1.00 0.00 C ATOM 728 CD GLN A 49 15.185 -26.642 -3.594 1.00 0.00 C ATOM 729 OE1 GLN A 49 16.203 -25.963 -3.735 1.00 0.00 O ATOM 730 NE2 GLN A 49 14.899 -27.276 -2.463 1.00 0.00 N ATOM 0 H GLN A 49 12.462 -23.370 -5.752 1.00 0.00 H new ATOM 0 HA GLN A 49 14.973 -24.053 -4.744 1.00 0.00 H new ATOM 0 HB2 GLN A 49 12.929 -25.187 -4.079 1.00 0.00 H new ATOM 0 HB3 GLN A 49 12.626 -25.720 -5.721 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.485 -27.590 -4.481 1.00 0.00 H new ATOM 0 HG3 GLN A 49 14.713 -27.097 -5.630 1.00 0.00 H new ATOM 0 HE21 GLN A 49 14.044 -27.828 -2.390 1.00 0.00 H new ATOM 0 HE22 GLN A 49 15.534 -27.211 -1.667 1.00 0.00 H new ATOM 739 N LYS A 50 16.393 -25.124 -6.474 1.00 0.00 N ATOM 740 CA LYS A 50 17.289 -25.596 -7.522 1.00 0.00 C ATOM 741 C LYS A 50 17.837 -26.980 -7.187 1.00 0.00 C ATOM 742 O LYS A 50 17.956 -27.362 -6.022 1.00 0.00 O ATOM 743 CB LYS A 50 18.445 -24.612 -7.715 1.00 0.00 C ATOM 744 CG LYS A 50 17.993 -23.183 -7.957 1.00 0.00 C ATOM 745 CD LYS A 50 19.122 -22.193 -7.721 1.00 0.00 C ATOM 746 CE LYS A 50 18.798 -20.828 -8.309 1.00 0.00 C ATOM 747 NZ LYS A 50 17.872 -20.054 -7.437 1.00 0.00 N ATOM 0 H LYS A 50 16.833 -25.019 -5.560 1.00 0.00 H new ATOM 0 HA LYS A 50 16.719 -25.664 -8.449 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.084 -24.638 -6.832 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.053 -24.940 -8.558 1.00 0.00 H new ATOM 0 HG2 LYS A 50 17.629 -23.084 -8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.158 -22.948 -7.297 1.00 0.00 H new ATOM 0 HD2 LYS A 50 19.304 -22.095 -6.651 1.00 0.00 H new ATOM 0 HD3 LYS A 50 20.041 -22.574 -8.167 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.721 -20.265 -8.449 1.00 0.00 H new ATOM 0 HE3 LYS A 50 18.349 -20.954 -9.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 17.542 -19.209 -7.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 17.056 -20.647 -7.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 18.371 -19.765 -6.571 1.00 0.00 H new ATOM 761 N PRO A 51 18.179 -27.751 -8.230 1.00 0.00 N ATOM 762 CA PRO A 51 18.722 -29.103 -8.071 1.00 0.00 C ATOM 763 C PRO A 51 20.130 -29.098 -7.486 1.00 0.00 C ATOM 764 O PRO A 51 21.016 -28.404 -7.983 1.00 0.00 O ATOM 765 CB PRO A 51 18.738 -29.649 -9.500 1.00 0.00 C ATOM 766 CG PRO A 51 18.821 -28.441 -10.367 1.00 0.00 C ATOM 767 CD PRO A 51 18.064 -27.360 -9.645 1.00 0.00 C ATOM 0 HA PRO A 51 18.130 -29.701 -7.378 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.589 -30.311 -9.661 1.00 0.00 H new ATOM 0 HB3 PRO A 51 17.839 -30.228 -9.713 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.858 -28.149 -10.530 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.386 -28.634 -11.348 1.00 0.00 H new ATOM 0 HD2 PRO A 51 18.497 -26.376 -9.827 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.023 -27.315 -9.966 1.00 0.00 H new ATOM 775 N GLY A 52 20.330 -29.877 -6.428 1.00 0.00 N ATOM 776 CA GLY A 52 21.633 -29.947 -5.794 1.00 0.00 C ATOM 777 C GLY A 52 21.930 -28.729 -4.942 1.00 0.00 C ATOM 778 O GLY A 52 23.053 -28.550 -4.471 1.00 0.00 O ATOM 0 H GLY A 52 19.613 -30.461 -5.998 1.00 0.00 H new ATOM 0 HA2 GLY A 52 21.684 -30.842 -5.173 1.00 0.00 H new ATOM 0 HA3 GLY A 52 22.402 -30.046 -6.560 1.00 0.00 H new ATOM 782 N LYS A 53 20.922 -27.887 -4.745 1.00 0.00 N ATOM 783 CA LYS A 53 21.078 -26.679 -3.945 1.00 0.00 C ATOM 784 C LYS A 53 20.113 -26.679 -2.764 1.00 0.00 C ATOM 785 O LYS A 53 18.998 -27.192 -2.860 1.00 0.00 O ATOM 786 CB LYS A 53 20.845 -25.437 -4.808 1.00 0.00 C ATOM 787 CG LYS A 53 21.523 -24.188 -4.273 1.00 0.00 C ATOM 788 CD LYS A 53 22.935 -24.043 -4.816 1.00 0.00 C ATOM 789 CE LYS A 53 23.931 -24.855 -4.002 1.00 0.00 C ATOM 790 NZ LYS A 53 25.318 -24.330 -4.139 1.00 0.00 N ATOM 0 H LYS A 53 19.987 -28.019 -5.129 1.00 0.00 H new ATOM 0 HA LYS A 53 22.097 -26.659 -3.558 1.00 0.00 H new ATOM 0 HB2 LYS A 53 21.208 -25.633 -5.817 1.00 0.00 H new ATOM 0 HB3 LYS A 53 19.773 -25.254 -4.884 1.00 0.00 H new ATOM 0 HG2 LYS A 53 20.936 -23.310 -4.544 1.00 0.00 H new ATOM 0 HG3 LYS A 53 21.553 -24.228 -3.184 1.00 0.00 H new ATOM 0 HD2 LYS A 53 22.961 -24.369 -5.856 1.00 0.00 H new ATOM 0 HD3 LYS A 53 23.225 -22.992 -4.804 1.00 0.00 H new ATOM 0 HE2 LYS A 53 23.639 -24.840 -2.952 1.00 0.00 H new ATOM 0 HE3 LYS A 53 23.903 -25.895 -4.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 25.967 -24.910 -3.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 25.606 -24.367 -5.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 25.351 -23.345 -3.806 1.00 0.00 H new ATOM 804 N LYS A 54 20.548 -26.098 -1.650 1.00 0.00 N ATOM 805 CA LYS A 54 19.721 -26.028 -0.451 1.00 0.00 C ATOM 806 C LYS A 54 19.016 -24.680 -0.354 1.00 0.00 C ATOM 807 O LYS A 54 19.621 -23.633 -0.587 1.00 0.00 O ATOM 808 CB LYS A 54 20.577 -26.259 0.797 1.00 0.00 C ATOM 809 CG LYS A 54 21.124 -27.671 0.907 1.00 0.00 C ATOM 810 CD LYS A 54 21.836 -27.892 2.231 1.00 0.00 C ATOM 811 CE LYS A 54 22.584 -29.216 2.248 1.00 0.00 C ATOM 812 NZ LYS A 54 23.670 -29.227 3.267 1.00 0.00 N ATOM 0 H LYS A 54 21.468 -25.669 -1.553 1.00 0.00 H new ATOM 0 HA LYS A 54 18.964 -26.810 -0.516 1.00 0.00 H new ATOM 0 HB2 LYS A 54 21.409 -25.555 0.792 1.00 0.00 H new ATOM 0 HB3 LYS A 54 19.980 -26.040 1.682 1.00 0.00 H new ATOM 0 HG2 LYS A 54 20.308 -28.387 0.808 1.00 0.00 H new ATOM 0 HG3 LYS A 54 21.815 -27.859 0.085 1.00 0.00 H new ATOM 0 HD2 LYS A 54 22.536 -27.075 2.410 1.00 0.00 H new ATOM 0 HD3 LYS A 54 21.110 -27.873 3.043 1.00 0.00 H new ATOM 0 HE2 LYS A 54 21.884 -30.026 2.454 1.00 0.00 H new ATOM 0 HE3 LYS A 54 23.009 -29.406 1.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 24.156 -30.146 3.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 24.352 -28.471 3.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 23.262 -29.072 4.211 1.00 0.00 H new ATOM 826 N LEU A 55 17.734 -24.712 -0.008 1.00 0.00 N ATOM 827 CA LEU A 55 16.945 -23.491 0.122 1.00 0.00 C ATOM 828 C LEU A 55 17.304 -22.744 1.402 1.00 0.00 C ATOM 829 O LEU A 55 17.589 -23.357 2.431 1.00 0.00 O ATOM 830 CB LEU A 55 15.452 -23.821 0.112 1.00 0.00 C ATOM 831 CG LEU A 55 14.784 -23.871 -1.263 1.00 0.00 C ATOM 832 CD1 LEU A 55 13.361 -24.394 -1.147 1.00 0.00 C ATOM 833 CD2 LEU A 55 14.797 -22.494 -1.912 1.00 0.00 C ATOM 0 H LEU A 55 17.218 -25.570 0.188 1.00 0.00 H new ATOM 0 HA LEU A 55 17.174 -22.848 -0.728 1.00 0.00 H new ATOM 0 HB2 LEU A 55 15.311 -24.787 0.598 1.00 0.00 H new ATOM 0 HB3 LEU A 55 14.933 -23.080 0.719 1.00 0.00 H new ATOM 0 HG LEU A 55 15.350 -24.555 -1.896 1.00 0.00 H new ATOM 0 HD11 LEU A 55 12.902 -24.422 -2.135 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.376 -25.399 -0.725 1.00 0.00 H new ATOM 0 HD13 LEU A 55 12.783 -23.736 -0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.318 -22.548 -2.890 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.256 -21.789 -1.281 1.00 0.00 H new ATOM 0 HD23 LEU A 55 15.827 -22.158 -2.031 1.00 0.00 H new ATOM 845 N SER A 56 17.286 -21.417 1.332 1.00 0.00 N ATOM 846 CA SER A 56 17.611 -20.586 2.486 1.00 0.00 C ATOM 847 C SER A 56 16.342 -20.070 3.158 1.00 0.00 C ATOM 848 O SER A 56 15.330 -19.832 2.499 1.00 0.00 O ATOM 849 CB SER A 56 18.492 -19.410 2.062 1.00 0.00 C ATOM 850 OG SER A 56 19.334 -18.994 3.123 1.00 0.00 O ATOM 0 H SER A 56 17.050 -20.894 0.489 1.00 0.00 H new ATOM 0 HA SER A 56 18.157 -21.199 3.203 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.099 -19.697 1.203 1.00 0.00 H new ATOM 0 HB3 SER A 56 17.864 -18.578 1.744 1.00 0.00 H new ATOM 0 HG SER A 56 19.888 -18.242 2.826 1.00 0.00 H new ATOM 856 N ASP A 57 16.405 -19.899 4.474 1.00 0.00 N ATOM 857 CA ASP A 57 15.263 -19.410 5.237 1.00 0.00 C ATOM 858 C ASP A 57 14.779 -18.070 4.692 1.00 0.00 C ATOM 859 O ASP A 57 13.586 -17.765 4.734 1.00 0.00 O ATOM 860 CB ASP A 57 15.631 -19.271 6.715 1.00 0.00 C ATOM 861 CG ASP A 57 14.411 -19.206 7.612 1.00 0.00 C ATOM 862 OD1 ASP A 57 13.734 -20.244 7.770 1.00 0.00 O ATOM 863 OD2 ASP A 57 14.134 -18.118 8.158 1.00 0.00 O ATOM 0 H ASP A 57 17.235 -20.092 5.034 1.00 0.00 H new ATOM 0 HA ASP A 57 14.455 -20.135 5.139 1.00 0.00 H new ATOM 0 HB2 ASP A 57 16.252 -20.116 7.013 1.00 0.00 H new ATOM 0 HB3 ASP A 57 16.229 -18.370 6.854 1.00 0.00 H new ATOM 868 N LEU A 58 15.711 -17.273 4.182 1.00 0.00 N ATOM 869 CA LEU A 58 15.380 -15.964 3.630 1.00 0.00 C ATOM 870 C LEU A 58 14.567 -16.104 2.347 1.00 0.00 C ATOM 871 O LEU A 58 13.705 -15.276 2.054 1.00 0.00 O ATOM 872 CB LEU A 58 16.657 -15.168 3.353 1.00 0.00 C ATOM 873 CG LEU A 58 17.367 -14.592 4.579 1.00 0.00 C ATOM 874 CD1 LEU A 58 18.043 -15.698 5.373 1.00 0.00 C ATOM 875 CD2 LEU A 58 18.382 -13.537 4.160 1.00 0.00 C ATOM 0 H LEU A 58 16.702 -17.510 4.139 1.00 0.00 H new ATOM 0 HA LEU A 58 14.777 -15.429 4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 58 17.357 -15.814 2.823 1.00 0.00 H new ATOM 0 HB3 LEU A 58 16.411 -14.346 2.681 1.00 0.00 H new ATOM 0 HG LEU A 58 16.622 -14.118 5.218 1.00 0.00 H new ATOM 0 HD11 LEU A 58 18.543 -15.269 6.241 1.00 0.00 H new ATOM 0 HD12 LEU A 58 17.295 -16.418 5.704 1.00 0.00 H new ATOM 0 HD13 LEU A 58 18.777 -16.201 4.744 1.00 0.00 H new ATOM 0 HD21 LEU A 58 18.878 -13.138 5.045 1.00 0.00 H new ATOM 0 HD22 LEU A 58 19.124 -13.987 3.500 1.00 0.00 H new ATOM 0 HD23 LEU A 58 17.872 -12.730 3.635 1.00 0.00 H new ATOM 887 N GLU A 59 14.846 -17.159 1.588 1.00 0.00 N ATOM 888 CA GLU A 59 14.138 -17.408 0.337 1.00 0.00 C ATOM 889 C GLU A 59 12.977 -18.374 0.552 1.00 0.00 C ATOM 890 O GLU A 59 12.079 -18.477 -0.283 1.00 0.00 O ATOM 891 CB GLU A 59 15.097 -17.971 -0.714 1.00 0.00 C ATOM 892 CG GLU A 59 16.334 -17.116 -0.930 1.00 0.00 C ATOM 893 CD GLU A 59 16.898 -17.249 -2.331 1.00 0.00 C ATOM 894 OE1 GLU A 59 17.158 -18.393 -2.759 1.00 0.00 O ATOM 895 OE2 GLU A 59 17.080 -16.210 -3.000 1.00 0.00 O ATOM 0 H GLU A 59 15.556 -17.854 1.817 1.00 0.00 H new ATOM 0 HA GLU A 59 13.737 -16.459 -0.019 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.406 -18.972 -0.413 1.00 0.00 H new ATOM 0 HB3 GLU A 59 14.566 -18.073 -1.661 1.00 0.00 H new ATOM 0 HG2 GLU A 59 16.087 -16.072 -0.740 1.00 0.00 H new ATOM 0 HG3 GLU A 59 17.098 -17.400 -0.206 1.00 0.00 H new ATOM 902 N ARG A 60 13.003 -19.081 1.677 1.00 0.00 N ATOM 903 CA ARG A 60 11.955 -20.040 2.002 1.00 0.00 C ATOM 904 C ARG A 60 10.616 -19.336 2.202 1.00 0.00 C ATOM 905 O ARG A 60 10.412 -18.639 3.196 1.00 0.00 O ATOM 906 CB ARG A 60 12.324 -20.825 3.262 1.00 0.00 C ATOM 907 CG ARG A 60 11.766 -22.238 3.285 1.00 0.00 C ATOM 908 CD ARG A 60 12.582 -23.144 4.193 1.00 0.00 C ATOM 909 NE ARG A 60 13.742 -23.706 3.507 1.00 0.00 N ATOM 910 CZ ARG A 60 14.469 -24.708 3.990 1.00 0.00 C ATOM 911 NH1 ARG A 60 14.157 -25.254 5.157 1.00 0.00 N ATOM 912 NH2 ARG A 60 15.510 -25.164 3.306 1.00 0.00 N ATOM 0 H ARG A 60 13.739 -19.007 2.379 1.00 0.00 H new ATOM 0 HA ARG A 60 11.860 -20.733 1.166 1.00 0.00 H new ATOM 0 HB2 ARG A 60 13.410 -20.871 3.346 1.00 0.00 H new ATOM 0 HB3 ARG A 60 11.959 -20.285 4.136 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.731 -22.216 3.626 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.760 -22.645 2.274 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.915 -22.579 5.064 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.951 -23.953 4.560 1.00 0.00 H new ATOM 0 HE ARG A 60 14.009 -23.307 2.607 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.358 -24.905 5.686 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.716 -26.023 5.526 1.00 0.00 H new ATOM 0 HH21 ARG A 60 15.753 -24.745 2.408 1.00 0.00 H new ATOM 0 HH22 ARG A 60 16.067 -25.933 3.678 1.00 0.00 H new ATOM 926 N VAL A 61 9.707 -19.522 1.250 1.00 0.00 N ATOM 927 CA VAL A 61 8.388 -18.905 1.321 1.00 0.00 C ATOM 928 C VAL A 61 7.442 -19.729 2.187 1.00 0.00 C ATOM 929 O VAL A 61 6.918 -20.756 1.752 1.00 0.00 O ATOM 930 CB VAL A 61 7.770 -18.739 -0.080 1.00 0.00 C ATOM 931 CG1 VAL A 61 6.377 -18.134 0.019 1.00 0.00 C ATOM 932 CG2 VAL A 61 8.669 -17.885 -0.961 1.00 0.00 C ATOM 0 H VAL A 61 9.860 -20.095 0.420 1.00 0.00 H new ATOM 0 HA VAL A 61 8.523 -17.921 1.770 1.00 0.00 H new ATOM 0 HB VAL A 61 7.681 -19.724 -0.538 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.956 -18.024 -0.980 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.738 -18.788 0.612 1.00 0.00 H new ATOM 0 HG13 VAL A 61 6.438 -17.156 0.496 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.217 -17.778 -1.947 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.792 -16.901 -0.510 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.643 -18.363 -1.059 1.00 0.00 H new ATOM 942 N THR A 62 7.226 -19.273 3.417 1.00 0.00 N ATOM 943 CA THR A 62 6.343 -19.968 4.346 1.00 0.00 C ATOM 944 C THR A 62 4.903 -19.493 4.195 1.00 0.00 C ATOM 945 O THR A 62 4.630 -18.519 3.493 1.00 0.00 O ATOM 946 CB THR A 62 6.790 -19.762 5.806 1.00 0.00 C ATOM 947 OG1 THR A 62 6.687 -18.378 6.159 1.00 0.00 O ATOM 948 CG2 THR A 62 8.221 -20.237 6.006 1.00 0.00 C ATOM 0 H THR A 62 7.651 -18.425 3.793 1.00 0.00 H new ATOM 0 HA THR A 62 6.400 -21.029 4.103 1.00 0.00 H new ATOM 0 HB THR A 62 6.136 -20.350 6.450 1.00 0.00 H new ATOM 0 HG1 THR A 62 6.971 -18.256 7.089 1.00 0.00 H new ATOM 0 HG21 THR A 62 8.514 -20.081 7.044 1.00 0.00 H new ATOM 0 HG22 THR A 62 8.289 -21.298 5.765 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.886 -19.673 5.353 1.00 0.00 H new ATOM 956 N SER A 63 3.983 -20.186 4.859 1.00 0.00 N ATOM 957 CA SER A 63 2.569 -19.837 4.796 1.00 0.00 C ATOM 958 C SER A 63 2.336 -18.421 5.314 1.00 0.00 C ATOM 959 O SER A 63 1.560 -17.656 4.738 1.00 0.00 O ATOM 960 CB SER A 63 1.739 -20.832 5.609 1.00 0.00 C ATOM 961 OG SER A 63 1.813 -20.546 6.995 1.00 0.00 O ATOM 0 H SER A 63 4.192 -20.993 5.447 1.00 0.00 H new ATOM 0 HA SER A 63 2.256 -19.881 3.753 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.700 -20.796 5.282 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.096 -21.845 5.424 1.00 0.00 H new ATOM 0 HG SER A 63 1.273 -21.195 7.492 1.00 0.00 H new ATOM 967 N LEU A 64 3.013 -18.077 6.404 1.00 0.00 N ATOM 968 CA LEU A 64 2.882 -16.753 7.001 1.00 0.00 C ATOM 969 C LEU A 64 3.351 -15.670 6.034 1.00 0.00 C ATOM 970 O LEU A 64 2.742 -14.605 5.934 1.00 0.00 O ATOM 971 CB LEU A 64 3.685 -16.675 8.300 1.00 0.00 C ATOM 972 CG LEU A 64 3.827 -15.285 8.919 1.00 0.00 C ATOM 973 CD1 LEU A 64 2.472 -14.756 9.363 1.00 0.00 C ATOM 974 CD2 LEU A 64 4.798 -15.319 10.091 1.00 0.00 C ATOM 0 H LEU A 64 3.659 -18.697 6.893 1.00 0.00 H new ATOM 0 HA LEU A 64 1.828 -16.585 7.222 1.00 0.00 H new ATOM 0 HB2 LEU A 64 3.216 -17.331 9.033 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.683 -17.070 8.111 1.00 0.00 H new ATOM 0 HG LEU A 64 4.226 -14.611 8.161 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.594 -13.765 9.801 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.806 -14.693 8.502 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.043 -15.430 10.104 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.887 -14.321 10.519 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.428 -16.008 10.850 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.776 -15.653 9.744 1.00 0.00 H new ATOM 986 N LYS A 65 4.436 -15.951 5.321 1.00 0.00 N ATOM 987 CA LYS A 65 4.987 -15.004 4.359 1.00 0.00 C ATOM 988 C LYS A 65 3.953 -14.646 3.296 1.00 0.00 C ATOM 989 O LYS A 65 3.825 -13.486 2.906 1.00 0.00 O ATOM 990 CB LYS A 65 6.236 -15.587 3.695 1.00 0.00 C ATOM 991 CG LYS A 65 7.514 -15.334 4.476 1.00 0.00 C ATOM 992 CD LYS A 65 8.744 -15.490 3.597 1.00 0.00 C ATOM 993 CE LYS A 65 9.958 -15.917 4.409 1.00 0.00 C ATOM 994 NZ LYS A 65 10.517 -14.789 5.205 1.00 0.00 N ATOM 0 H LYS A 65 4.952 -16.828 5.391 1.00 0.00 H new ATOM 0 HA LYS A 65 5.260 -14.096 4.896 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.103 -16.662 3.570 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.339 -15.161 2.697 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.491 -14.329 4.897 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.573 -16.029 5.314 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.546 -16.229 2.820 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.955 -14.547 3.094 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.679 -16.731 5.078 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.726 -16.304 3.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 11.342 -15.120 5.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.806 -14.022 4.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.793 -14.436 5.863 1.00 0.00 H new ATOM 1008 N VAL A 66 3.216 -15.651 2.831 1.00 0.00 N ATOM 1009 CA VAL A 66 2.192 -15.441 1.815 1.00 0.00 C ATOM 1010 C VAL A 66 1.090 -14.521 2.328 1.00 0.00 C ATOM 1011 O VAL A 66 0.625 -13.634 1.612 1.00 0.00 O ATOM 1012 CB VAL A 66 1.565 -16.775 1.367 1.00 0.00 C ATOM 1013 CG1 VAL A 66 0.491 -16.534 0.318 1.00 0.00 C ATOM 1014 CG2 VAL A 66 2.637 -17.716 0.839 1.00 0.00 C ATOM 0 H VAL A 66 3.310 -16.618 3.142 1.00 0.00 H new ATOM 0 HA VAL A 66 2.683 -14.974 0.961 1.00 0.00 H new ATOM 0 HB VAL A 66 1.095 -17.245 2.231 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.059 -17.487 0.013 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.290 -15.899 0.736 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.933 -16.042 -0.549 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.177 -18.653 0.527 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.137 -17.256 -0.013 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.366 -17.914 1.624 1.00 0.00 H new ATOM 1024 N TYR A 67 0.676 -14.738 3.571 1.00 0.00 N ATOM 1025 CA TYR A 67 -0.373 -13.929 4.179 1.00 0.00 C ATOM 1026 C TYR A 67 0.080 -12.481 4.342 1.00 0.00 C ATOM 1027 O TYR A 67 -0.706 -11.550 4.170 1.00 0.00 O ATOM 1028 CB TYR A 67 -0.768 -14.507 5.539 1.00 0.00 C ATOM 1029 CG TYR A 67 -2.014 -13.881 6.125 1.00 0.00 C ATOM 1030 CD1 TYR A 67 -3.229 -13.943 5.453 1.00 0.00 C ATOM 1031 CD2 TYR A 67 -1.976 -13.228 7.351 1.00 0.00 C ATOM 1032 CE1 TYR A 67 -4.369 -13.372 5.984 1.00 0.00 C ATOM 1033 CE2 TYR A 67 -3.112 -12.655 7.890 1.00 0.00 C ATOM 1034 CZ TYR A 67 -4.305 -12.729 7.203 1.00 0.00 C ATOM 1035 OH TYR A 67 -5.439 -12.160 7.736 1.00 0.00 O ATOM 0 H TYR A 67 1.051 -15.468 4.177 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.239 -13.947 3.518 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.925 -15.581 5.436 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.059 -14.371 6.236 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -3.283 -14.446 4.499 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.043 -13.167 7.892 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -5.305 -13.429 5.448 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.066 -12.152 8.844 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.224 -11.748 8.599 1.00 0.00 H new ATOM 1045 N ASN A 68 1.354 -12.300 4.675 1.00 0.00 N ATOM 1046 CA ASN A 68 1.914 -10.967 4.862 1.00 0.00 C ATOM 1047 C ASN A 68 1.874 -10.173 3.559 1.00 0.00 C ATOM 1048 O ASN A 68 1.515 -8.996 3.549 1.00 0.00 O ATOM 1049 CB ASN A 68 3.353 -11.062 5.370 1.00 0.00 C ATOM 1050 CG ASN A 68 3.429 -11.128 6.884 1.00 0.00 C ATOM 1051 OD1 ASN A 68 2.638 -10.496 7.584 1.00 0.00 O ATOM 1052 ND2 ASN A 68 4.384 -11.897 7.395 1.00 0.00 N ATOM 0 H ASN A 68 2.018 -13.060 4.821 1.00 0.00 H new ATOM 0 HA ASN A 68 1.308 -10.446 5.604 1.00 0.00 H new ATOM 0 HB2 ASN A 68 3.827 -11.947 4.946 1.00 0.00 H new ATOM 0 HB3 ASN A 68 3.917 -10.199 5.018 1.00 0.00 H new ATOM 0 HD21 ASN A 68 4.484 -11.982 8.407 1.00 0.00 H new ATOM 0 HD22 ASN A 68 5.017 -12.403 6.776 1.00 0.00 H new ATOM 1059 N TRP A 69 2.245 -10.826 2.464 1.00 0.00 N ATOM 1060 CA TRP A 69 2.251 -10.182 1.155 1.00 0.00 C ATOM 1061 C TRP A 69 0.830 -9.904 0.679 1.00 0.00 C ATOM 1062 O TRP A 69 0.541 -8.831 0.150 1.00 0.00 O ATOM 1063 CB TRP A 69 2.982 -11.058 0.136 1.00 0.00 C ATOM 1064 CG TRP A 69 3.037 -10.454 -1.234 1.00 0.00 C ATOM 1065 CD1 TRP A 69 4.096 -9.806 -1.803 1.00 0.00 C ATOM 1066 CD2 TRP A 69 1.987 -10.442 -2.208 1.00 0.00 C ATOM 1067 NE1 TRP A 69 3.768 -9.391 -3.071 1.00 0.00 N ATOM 1068 CE2 TRP A 69 2.480 -9.770 -3.344 1.00 0.00 C ATOM 1069 CE3 TRP A 69 0.680 -10.935 -2.232 1.00 0.00 C ATOM 1070 CZ2 TRP A 69 1.710 -9.579 -4.488 1.00 0.00 C ATOM 1071 CZ3 TRP A 69 -0.083 -10.745 -3.368 1.00 0.00 C ATOM 1072 CH2 TRP A 69 0.434 -10.072 -4.484 1.00 0.00 C ATOM 0 H TRP A 69 2.546 -11.801 2.456 1.00 0.00 H new ATOM 0 HA TRP A 69 2.775 -9.231 1.248 1.00 0.00 H new ATOM 0 HB2 TRP A 69 3.998 -11.240 0.486 1.00 0.00 H new ATOM 0 HB3 TRP A 69 2.486 -12.027 0.079 1.00 0.00 H new ATOM 0 HD1 TRP A 69 5.051 -9.644 -1.326 1.00 0.00 H new ATOM 0 HE1 TRP A 69 4.384 -8.883 -3.706 1.00 0.00 H new ATOM 0 HE3 TRP A 69 0.273 -11.455 -1.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 2.106 -9.060 -5.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -1.095 -11.121 -3.397 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -0.187 -9.940 -5.358 1.00 0.00 H new ATOM 1083 N PHE A 70 -0.055 -10.878 0.869 1.00 0.00 N ATOM 1084 CA PHE A 70 -1.447 -10.738 0.457 1.00 0.00 C ATOM 1085 C PHE A 70 -2.123 -9.595 1.208 1.00 0.00 C ATOM 1086 O PHE A 70 -2.835 -8.784 0.615 1.00 0.00 O ATOM 1087 CB PHE A 70 -2.207 -12.043 0.700 1.00 0.00 C ATOM 1088 CG PHE A 70 -2.165 -12.988 -0.467 1.00 0.00 C ATOM 1089 CD1 PHE A 70 -0.958 -13.488 -0.928 1.00 0.00 C ATOM 1090 CD2 PHE A 70 -3.334 -13.374 -1.104 1.00 0.00 C ATOM 1091 CE1 PHE A 70 -0.917 -14.357 -2.002 1.00 0.00 C ATOM 1092 CE2 PHE A 70 -3.298 -14.244 -2.177 1.00 0.00 C ATOM 1093 CZ PHE A 70 -2.089 -14.735 -2.628 1.00 0.00 C ATOM 0 H PHE A 70 0.167 -11.773 1.306 1.00 0.00 H new ATOM 0 HA PHE A 70 -1.464 -10.510 -0.609 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -1.788 -12.540 1.575 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -3.246 -11.811 0.932 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.039 -13.195 -0.443 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.283 -12.991 -0.758 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.030 -14.740 -2.351 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.216 -14.540 -2.663 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.060 -15.413 -3.468 1.00 0.00 H new ATOM 1103 N ALA A 71 -1.896 -9.538 2.516 1.00 0.00 N ATOM 1104 CA ALA A 71 -2.482 -8.494 3.348 1.00 0.00 C ATOM 1105 C ALA A 71 -2.038 -7.110 2.887 1.00 0.00 C ATOM 1106 O ALA A 71 -2.802 -6.148 2.953 1.00 0.00 O ATOM 1107 CB ALA A 71 -2.110 -8.711 4.807 1.00 0.00 C ATOM 0 H ALA A 71 -1.311 -10.202 3.022 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.566 -8.551 3.248 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.554 -7.924 5.417 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.483 -9.680 5.137 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.026 -8.684 4.914 1.00 0.00 H new ATOM 1113 N ASN A 72 -0.797 -7.017 2.420 1.00 0.00 N ATOM 1114 CA ASN A 72 -0.251 -5.750 1.949 1.00 0.00 C ATOM 1115 C ASN A 72 -1.008 -5.253 0.721 1.00 0.00 C ATOM 1116 O ASN A 72 -1.191 -4.050 0.536 1.00 0.00 O ATOM 1117 CB ASN A 72 1.235 -5.903 1.617 1.00 0.00 C ATOM 1118 CG ASN A 72 1.964 -4.573 1.602 1.00 0.00 C ATOM 1119 OD1 ASN A 72 2.503 -4.136 2.619 1.00 0.00 O ATOM 1120 ND2 ASN A 72 1.984 -3.922 0.445 1.00 0.00 N ATOM 0 H ASN A 72 -0.151 -7.804 2.358 1.00 0.00 H new ATOM 0 HA ASN A 72 -0.366 -5.016 2.746 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.702 -6.562 2.349 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.340 -6.383 0.644 1.00 0.00 H new ATOM 0 HD21 ASN A 72 2.459 -3.022 0.374 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.524 -4.322 -0.373 1.00 0.00 H new ATOM 1127 N ARG A 73 -1.447 -6.189 -0.115 1.00 0.00 N ATOM 1128 CA ARG A 73 -2.185 -5.847 -1.325 1.00 0.00 C ATOM 1129 C ARG A 73 -3.603 -5.396 -0.988 1.00 0.00 C ATOM 1130 O ARG A 73 -4.090 -4.397 -1.517 1.00 0.00 O ATOM 1131 CB ARG A 73 -2.231 -7.045 -2.276 1.00 0.00 C ATOM 1132 CG ARG A 73 -3.199 -6.867 -3.433 1.00 0.00 C ATOM 1133 CD ARG A 73 -2.677 -5.860 -4.447 1.00 0.00 C ATOM 1134 NE ARG A 73 -3.730 -5.389 -5.343 1.00 0.00 N ATOM 1135 CZ ARG A 73 -3.493 -4.833 -6.526 1.00 0.00 C ATOM 1136 NH1 ARG A 73 -2.248 -4.679 -6.952 1.00 0.00 N ATOM 1137 NH2 ARG A 73 -4.505 -4.429 -7.284 1.00 0.00 N ATOM 0 H ARG A 73 -1.304 -7.189 0.024 1.00 0.00 H new ATOM 0 HA ARG A 73 -1.667 -5.023 -1.815 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.231 -7.221 -2.673 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -2.511 -7.935 -1.712 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.362 -7.827 -3.923 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -4.165 -6.535 -3.053 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -2.241 -5.010 -3.922 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.879 -6.316 -5.033 1.00 0.00 H new ATOM 0 HE ARG A 73 -4.700 -5.493 -5.044 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -1.468 -4.988 -6.371 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -2.069 -4.252 -7.861 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.465 -4.545 -6.958 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -4.323 -4.002 -8.192 1.00 0.00 H new ATOM 1151 N ARG A 74 -4.261 -6.141 -0.106 1.00 0.00 N ATOM 1152 CA ARG A 74 -5.624 -5.819 0.300 1.00 0.00 C ATOM 1153 C ARG A 74 -5.690 -4.431 0.932 1.00 0.00 C ATOM 1154 O ARG A 74 -6.607 -3.657 0.661 1.00 0.00 O ATOM 1155 CB ARG A 74 -6.146 -6.865 1.286 1.00 0.00 C ATOM 1156 CG ARG A 74 -6.081 -8.288 0.755 1.00 0.00 C ATOM 1157 CD ARG A 74 -7.188 -9.152 1.341 1.00 0.00 C ATOM 1158 NE ARG A 74 -6.875 -9.598 2.695 1.00 0.00 N ATOM 1159 CZ ARG A 74 -6.085 -10.631 2.965 1.00 0.00 C ATOM 1160 NH1 ARG A 74 -5.530 -11.320 1.977 1.00 0.00 N ATOM 1161 NH2 ARG A 74 -5.848 -10.976 4.224 1.00 0.00 N ATOM 0 H ARG A 74 -3.873 -6.971 0.341 1.00 0.00 H new ATOM 0 HA ARG A 74 -6.252 -5.824 -0.591 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.568 -6.803 2.208 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.179 -6.628 1.541 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -6.164 -8.276 -0.332 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.111 -8.724 0.996 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -8.121 -8.588 1.352 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.348 -10.020 0.701 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.286 -9.088 3.477 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -5.710 -11.057 1.008 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.924 -12.113 2.186 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.273 -10.448 4.986 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.241 -11.770 4.430 1.00 0.00 H new ATOM 1175 N LYS A 75 -4.711 -4.125 1.776 1.00 0.00 N ATOM 1176 CA LYS A 75 -4.656 -2.831 2.447 1.00 0.00 C ATOM 1177 C LYS A 75 -4.295 -1.723 1.463 1.00 0.00 C ATOM 1178 O LYS A 75 -4.748 -0.587 1.601 1.00 0.00 O ATOM 1179 CB LYS A 75 -3.635 -2.868 3.587 1.00 0.00 C ATOM 1180 CG LYS A 75 -2.193 -2.851 3.113 1.00 0.00 C ATOM 1181 CD LYS A 75 -1.223 -2.757 4.279 1.00 0.00 C ATOM 1182 CE LYS A 75 -1.220 -4.034 5.105 1.00 0.00 C ATOM 1183 NZ LYS A 75 0.087 -4.250 5.787 1.00 0.00 N ATOM 0 H LYS A 75 -3.944 -4.755 2.012 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.643 -2.620 2.858 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.803 -2.013 4.242 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.802 -3.765 4.184 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.987 -3.755 2.539 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.040 -2.006 2.442 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.218 -2.563 3.903 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.495 -1.913 4.913 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.015 -3.987 5.849 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.438 -4.885 4.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.049 -5.130 6.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.842 -4.320 5.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.283 -3.450 6.422 1.00 0.00 H new