USER MOD reduce.3.24.130724 H: found=0, std=0, add=391, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 393 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 THR OG1 : rot -170:sc= 0.0903 USER MOD Single : A 22 ASN : amide:sc= -0.615 X(o=-0.62,f=-0.87) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0372 X(o=-0.037,f=-0.5) USER MOD Single : A 36 LYS NZ :NH3+ -140:sc= 0.481 (180deg=-0.0143) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -163:sc= -1.08 (180deg=-1.76) USER MOD Single : A 61 SER OG : rot 180:sc= -0.0285 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -106:sc= 0.318 (180deg=-0.78) USER MOD ----------------------------------------------------------------- ATOM 168 N PHE A 14 9.316 0.391 -21.570 1.00 0.00 N ATOM 169 CA PHE A 14 9.783 0.072 -20.226 1.00 0.00 C ATOM 170 C PHE A 14 8.765 -0.790 -19.486 1.00 0.00 C ATOM 171 O PHE A 14 7.556 -0.623 -19.653 1.00 0.00 O ATOM 172 CB PHE A 14 10.049 1.357 -19.438 1.00 0.00 C ATOM 173 CG PHE A 14 11.215 2.148 -19.959 1.00 0.00 C ATOM 174 CD1 PHE A 14 11.035 3.101 -20.948 1.00 0.00 C ATOM 175 CD2 PHE A 14 12.490 1.939 -19.459 1.00 0.00 C ATOM 176 CE1 PHE A 14 12.105 3.832 -21.429 1.00 0.00 C ATOM 177 CE2 PHE A 14 13.564 2.667 -19.936 1.00 0.00 C ATOM 178 CZ PHE A 14 13.372 3.614 -20.923 1.00 0.00 C ATOM 0 HA PHE A 14 10.712 -0.491 -20.315 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.156 1.981 -19.464 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.230 1.103 -18.394 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.047 3.275 -21.348 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.647 1.199 -18.688 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.951 4.573 -22.200 1.00 0.00 H new ATOM 0 HE2 PHE A 14 14.553 2.495 -19.537 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.210 4.183 -21.298 1.00 0.00 H new ATOM 188 N ILE A 15 9.262 -1.712 -18.669 1.00 0.00 N ATOM 189 CA ILE A 15 8.397 -2.600 -17.903 1.00 0.00 C ATOM 190 C ILE A 15 8.916 -2.783 -16.481 1.00 0.00 C ATOM 191 O ILE A 15 10.125 -2.827 -16.250 1.00 0.00 O ATOM 192 CB ILE A 15 8.273 -3.982 -18.573 1.00 0.00 C ATOM 193 CG1 ILE A 15 7.311 -4.871 -17.783 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.640 -4.640 -18.686 1.00 0.00 C ATOM 195 CD1 ILE A 15 7.027 -6.198 -18.453 1.00 0.00 C ATOM 0 H ILE A 15 10.260 -1.864 -18.520 1.00 0.00 H new ATOM 0 HA ILE A 15 7.414 -2.131 -17.871 1.00 0.00 H new ATOM 0 HB ILE A 15 7.872 -3.848 -19.578 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.729 -5.055 -16.793 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.372 -4.338 -17.639 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.536 -5.615 -19.161 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.298 -4.012 -19.287 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.067 -4.765 -17.691 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.338 -6.776 -17.837 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.580 -6.023 -19.432 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.958 -6.752 -18.573 1.00 0.00 H new ATOM 207 N THR A 16 7.995 -2.890 -15.529 1.00 0.00 N ATOM 208 CA THR A 16 8.359 -3.069 -14.129 1.00 0.00 C ATOM 209 C THR A 16 9.052 -4.408 -13.908 1.00 0.00 C ATOM 210 O THR A 16 9.018 -5.286 -14.769 1.00 0.00 O ATOM 211 CB THR A 16 7.124 -2.985 -13.212 1.00 0.00 C ATOM 212 OG1 THR A 16 5.958 -2.681 -13.987 1.00 0.00 O ATOM 213 CG2 THR A 16 7.317 -1.923 -12.140 1.00 0.00 C ATOM 0 H THR A 16 6.990 -2.856 -15.702 1.00 0.00 H new ATOM 0 HA THR A 16 9.046 -2.262 -13.875 1.00 0.00 H new ATOM 0 HB THR A 16 6.994 -3.951 -12.725 1.00 0.00 H new ATOM 0 HG1 THR A 16 5.211 -2.474 -13.387 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.432 -1.882 -11.505 1.00 0.00 H new ATOM 0 HG22 THR A 16 8.188 -2.172 -11.534 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.470 -0.953 -12.612 1.00 0.00 H new ATOM 221 N GLY A 17 9.680 -4.560 -12.746 1.00 0.00 N ATOM 222 CA GLY A 17 10.371 -5.796 -12.432 1.00 0.00 C ATOM 223 C GLY A 17 9.417 -6.941 -12.158 1.00 0.00 C ATOM 224 O GLY A 17 9.351 -7.902 -12.925 1.00 0.00 O ATOM 0 H GLY A 17 9.722 -3.848 -12.016 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.026 -6.063 -13.262 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.008 -5.641 -11.561 1.00 0.00 H new ATOM 228 N VAL A 18 8.675 -6.841 -11.059 1.00 0.00 N ATOM 229 CA VAL A 18 7.719 -7.877 -10.685 1.00 0.00 C ATOM 230 C VAL A 18 6.765 -8.185 -11.834 1.00 0.00 C ATOM 231 O VAL A 18 6.267 -9.304 -11.957 1.00 0.00 O ATOM 232 CB VAL A 18 6.900 -7.464 -9.448 1.00 0.00 C ATOM 233 CG1 VAL A 18 6.029 -6.257 -9.763 1.00 0.00 C ATOM 234 CG2 VAL A 18 6.053 -8.629 -8.957 1.00 0.00 C ATOM 0 H VAL A 18 8.718 -6.053 -10.412 1.00 0.00 H new ATOM 0 HA VAL A 18 8.296 -8.770 -10.447 1.00 0.00 H new ATOM 0 HB VAL A 18 7.591 -7.186 -8.652 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.458 -5.980 -8.877 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.661 -5.421 -10.064 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.344 -6.504 -10.574 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.481 -8.320 -8.082 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.369 -8.940 -9.747 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.702 -9.463 -8.690 1.00 0.00 H new ATOM 244 N ARG A 19 6.514 -7.185 -12.672 1.00 0.00 N ATOM 245 CA ARG A 19 5.619 -7.348 -13.811 1.00 0.00 C ATOM 246 C ARG A 19 6.219 -8.299 -14.842 1.00 0.00 C ATOM 247 O ARG A 19 5.511 -9.109 -15.441 1.00 0.00 O ATOM 248 CB ARG A 19 5.330 -5.993 -14.459 1.00 0.00 C ATOM 249 CG ARG A 19 3.988 -5.401 -14.060 1.00 0.00 C ATOM 250 CD ARG A 19 2.885 -5.827 -15.016 1.00 0.00 C ATOM 251 NE ARG A 19 1.656 -6.180 -14.311 1.00 0.00 N ATOM 252 CZ ARG A 19 0.477 -6.309 -14.909 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.368 -6.114 -16.216 1.00 0.00 N ATOM 254 NH2 ARG A 19 -0.597 -6.633 -14.200 1.00 0.00 N ATOM 0 H ARG A 19 6.918 -6.253 -12.584 1.00 0.00 H new ATOM 0 HA ARG A 19 4.684 -7.776 -13.448 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.121 -5.294 -14.188 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.361 -6.104 -15.543 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.736 -5.717 -13.048 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.059 -4.313 -14.046 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.681 -5.018 -15.718 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.224 -6.680 -15.603 1.00 0.00 H new ATOM 0 HE ARG A 19 1.706 -6.336 -13.304 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.191 -5.864 -16.765 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.539 -6.214 -16.673 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -0.518 -6.783 -13.194 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -1.502 -6.732 -14.661 1.00 0.00 H new ATOM 268 N ALA A 20 7.528 -8.195 -15.044 1.00 0.00 N ATOM 269 CA ALA A 20 8.224 -9.046 -16.001 1.00 0.00 C ATOM 270 C ALA A 20 8.430 -10.449 -15.440 1.00 0.00 C ATOM 271 O ALA A 20 8.456 -11.429 -16.185 1.00 0.00 O ATOM 272 CB ALA A 20 9.560 -8.427 -16.385 1.00 0.00 C ATOM 0 H ALA A 20 8.128 -7.529 -14.557 1.00 0.00 H new ATOM 0 HA ALA A 20 7.605 -9.128 -16.894 1.00 0.00 H new ATOM 0 HB1 ALA A 20 10.068 -9.074 -17.100 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.392 -7.449 -16.836 1.00 0.00 H new ATOM 0 HB3 ALA A 20 10.178 -8.314 -15.494 1.00 0.00 H new ATOM 278 N ILE A 21 8.578 -10.538 -14.122 1.00 0.00 N ATOM 279 CA ILE A 21 8.782 -11.821 -13.462 1.00 0.00 C ATOM 280 C ILE A 21 7.507 -12.658 -13.481 1.00 0.00 C ATOM 281 O ILE A 21 7.557 -13.885 -13.415 1.00 0.00 O ATOM 282 CB ILE A 21 9.239 -11.637 -12.003 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.535 -10.825 -11.950 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.428 -12.990 -11.332 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.863 -10.299 -10.570 1.00 0.00 C ATOM 0 H ILE A 21 8.560 -9.737 -13.491 1.00 0.00 H new ATOM 0 HA ILE A 21 9.564 -12.340 -14.017 1.00 0.00 H new ATOM 0 HB ILE A 21 8.467 -11.090 -11.462 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.359 -11.448 -12.298 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.457 -9.985 -12.641 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.751 -12.843 -10.301 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.485 -13.536 -11.342 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.184 -13.561 -11.871 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.794 -9.734 -10.608 1.00 0.00 H new ATOM 0 HD12 ILE A 21 10.058 -9.649 -10.227 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.974 -11.135 -9.879 1.00 0.00 H new ATOM 297 N ASN A 22 6.365 -11.985 -13.574 1.00 0.00 N ATOM 298 CA ASN A 22 5.076 -12.667 -13.604 1.00 0.00 C ATOM 299 C ASN A 22 4.659 -12.980 -15.038 1.00 0.00 C ATOM 300 O ASN A 22 3.946 -13.951 -15.289 1.00 0.00 O ATOM 301 CB ASN A 22 4.006 -11.809 -12.926 1.00 0.00 C ATOM 302 CG ASN A 22 4.153 -11.787 -11.416 1.00 0.00 C ATOM 303 OD1 ASN A 22 4.464 -12.805 -10.797 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.930 -10.623 -10.817 1.00 0.00 N ATOM 0 H ASN A 22 6.306 -10.968 -13.630 1.00 0.00 H new ATOM 0 HA ASN A 22 5.178 -13.606 -13.061 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.065 -10.790 -13.309 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.019 -12.191 -13.187 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.014 -10.547 -9.803 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.674 -9.805 -11.371 1.00 0.00 H new ATOM 311 N GLU A 23 5.110 -12.150 -15.974 1.00 0.00 N ATOM 312 CA GLU A 23 4.783 -12.339 -17.383 1.00 0.00 C ATOM 313 C GLU A 23 5.780 -13.281 -18.051 1.00 0.00 C ATOM 314 O GLU A 23 5.407 -14.337 -18.563 1.00 0.00 O ATOM 315 CB GLU A 23 4.770 -10.993 -18.111 1.00 0.00 C ATOM 316 CG GLU A 23 3.627 -10.085 -17.690 1.00 0.00 C ATOM 317 CD GLU A 23 3.708 -8.711 -18.327 1.00 0.00 C ATOM 318 OE1 GLU A 23 4.825 -8.294 -18.699 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.654 -8.054 -18.454 1.00 0.00 O ATOM 0 H GLU A 23 5.702 -11.342 -15.782 1.00 0.00 H new ATOM 0 HA GLU A 23 3.791 -12.786 -17.443 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.715 -10.482 -17.929 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.705 -11.171 -19.184 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.679 -10.551 -17.960 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.633 -9.979 -16.605 1.00 0.00 H new ATOM 326 N PHE A 24 7.051 -12.892 -18.042 1.00 0.00 N ATOM 327 CA PHE A 24 8.102 -13.700 -18.648 1.00 0.00 C ATOM 328 C PHE A 24 8.375 -14.950 -17.817 1.00 0.00 C ATOM 329 O PHE A 24 8.999 -15.900 -18.291 1.00 0.00 O ATOM 330 CB PHE A 24 9.386 -12.880 -18.792 1.00 0.00 C ATOM 331 CG PHE A 24 9.249 -11.711 -19.726 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.720 -10.510 -19.282 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.650 -11.814 -21.049 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.593 -9.434 -20.139 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.525 -10.741 -21.911 1.00 0.00 C ATOM 336 CZ PHE A 24 8.997 -9.549 -21.455 1.00 0.00 C ATOM 0 H PHE A 24 7.378 -12.022 -17.622 1.00 0.00 H new ATOM 0 HA PHE A 24 7.763 -14.009 -19.637 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.688 -12.517 -17.810 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.184 -13.530 -19.151 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.403 -10.414 -18.254 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.065 -12.743 -21.410 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.178 -8.504 -19.780 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.840 -10.834 -22.940 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.900 -8.708 -22.126 1.00 0.00 H new ATOM 346 N CYS A 25 7.903 -14.942 -16.575 1.00 0.00 N ATOM 347 CA CYS A 25 8.097 -16.074 -15.676 1.00 0.00 C ATOM 348 C CYS A 25 9.581 -16.365 -15.480 1.00 0.00 C ATOM 349 O CYS A 25 10.051 -17.469 -15.759 1.00 0.00 O ATOM 350 CB CYS A 25 7.390 -17.314 -16.225 1.00 0.00 C ATOM 351 SG CYS A 25 5.629 -17.399 -15.821 1.00 0.00 S ATOM 0 H CYS A 25 7.383 -14.164 -16.168 1.00 0.00 H new ATOM 0 HA CYS A 25 7.665 -15.816 -14.709 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.505 -17.335 -17.309 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.885 -18.204 -15.835 1.00 0.00 H new ATOM 0 HG CYS A 25 5.119 -18.481 -16.330 1.00 0.00 H new ATOM 357 N LEU A 26 10.316 -15.368 -15.000 1.00 0.00 N ATOM 358 CA LEU A 26 11.748 -15.516 -14.767 1.00 0.00 C ATOM 359 C LEU A 26 12.045 -15.675 -13.280 1.00 0.00 C ATOM 360 O LEU A 26 11.132 -15.726 -12.455 1.00 0.00 O ATOM 361 CB LEU A 26 12.502 -14.306 -15.323 1.00 0.00 C ATOM 362 CG LEU A 26 12.162 -13.904 -16.758 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.395 -12.415 -16.965 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.982 -14.717 -17.749 1.00 0.00 C ATOM 0 H LEU A 26 9.944 -14.448 -14.765 1.00 0.00 H new ATOM 0 HA LEU A 26 12.084 -16.415 -15.283 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.309 -13.453 -14.673 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.571 -14.513 -15.269 1.00 0.00 H new ATOM 0 HG LEU A 26 11.107 -14.113 -16.933 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.148 -12.147 -17.992 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.763 -11.849 -16.280 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.442 -12.180 -16.771 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.726 -14.417 -18.765 1.00 0.00 H new ATOM 0 HD22 LEU A 26 14.043 -14.540 -17.575 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.764 -15.777 -17.618 1.00 0.00 H new ATOM 376 N LYS A 27 13.328 -15.752 -12.943 1.00 0.00 N ATOM 377 CA LYS A 27 13.747 -15.902 -11.554 1.00 0.00 C ATOM 378 C LYS A 27 14.015 -14.542 -10.917 1.00 0.00 C ATOM 379 O LYS A 27 14.063 -13.522 -11.604 1.00 0.00 O ATOM 380 CB LYS A 27 15.003 -16.773 -11.470 1.00 0.00 C ATOM 381 CG LYS A 27 14.742 -18.164 -10.920 1.00 0.00 C ATOM 382 CD LYS A 27 14.806 -19.217 -12.013 1.00 0.00 C ATOM 383 CE LYS A 27 16.242 -19.617 -12.318 1.00 0.00 C ATOM 384 NZ LYS A 27 16.391 -21.093 -12.444 1.00 0.00 N ATOM 0 H LYS A 27 14.096 -15.713 -13.613 1.00 0.00 H new ATOM 0 HA LYS A 27 12.939 -16.387 -11.007 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.441 -16.861 -12.464 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.739 -16.274 -10.840 1.00 0.00 H new ATOM 0 HG2 LYS A 27 15.476 -18.395 -10.148 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.761 -18.190 -10.445 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.240 -20.096 -11.706 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.334 -18.833 -12.918 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.563 -19.139 -13.243 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.897 -19.252 -11.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.383 -21.325 -12.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.108 -21.548 -11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.786 -21.438 -13.216 1.00 0.00 H new ATOM 398 N SER A 28 14.190 -14.535 -9.599 1.00 0.00 N ATOM 399 CA SER A 28 14.451 -13.300 -8.869 1.00 0.00 C ATOM 400 C SER A 28 15.827 -12.743 -9.219 1.00 0.00 C ATOM 401 O SER A 28 15.998 -11.534 -9.375 1.00 0.00 O ATOM 402 CB SER A 28 14.356 -13.544 -7.362 1.00 0.00 C ATOM 403 OG SER A 28 13.324 -12.764 -6.783 1.00 0.00 O ATOM 0 H SER A 28 14.156 -15.371 -9.015 1.00 0.00 H new ATOM 0 HA SER A 28 13.697 -12.569 -9.160 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.167 -14.601 -7.173 1.00 0.00 H new ATOM 0 HB3 SER A 28 15.308 -13.301 -6.890 1.00 0.00 H new ATOM 0 HG SER A 28 13.283 -12.939 -5.820 1.00 0.00 H new ATOM 409 N SER A 29 16.806 -13.634 -9.341 1.00 0.00 N ATOM 410 CA SER A 29 18.169 -13.232 -9.669 1.00 0.00 C ATOM 411 C SER A 29 18.289 -12.874 -11.148 1.00 0.00 C ATOM 412 O SER A 29 19.144 -12.079 -11.538 1.00 0.00 O ATOM 413 CB SER A 29 19.151 -14.352 -9.322 1.00 0.00 C ATOM 414 OG SER A 29 19.374 -14.420 -7.925 1.00 0.00 O ATOM 0 H SER A 29 16.681 -14.639 -9.218 1.00 0.00 H new ATOM 0 HA SER A 29 18.413 -12.349 -9.079 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.761 -15.305 -9.678 1.00 0.00 H new ATOM 0 HB3 SER A 29 20.097 -14.183 -9.837 1.00 0.00 H new ATOM 0 HG SER A 29 20.004 -15.145 -7.729 1.00 0.00 H new ATOM 420 N ASP A 30 17.427 -13.468 -11.965 1.00 0.00 N ATOM 421 CA ASP A 30 17.434 -13.213 -13.401 1.00 0.00 C ATOM 422 C ASP A 30 17.368 -11.716 -13.687 1.00 0.00 C ATOM 423 O ASP A 30 18.267 -11.152 -14.312 1.00 0.00 O ATOM 424 CB ASP A 30 16.259 -13.925 -14.073 1.00 0.00 C ATOM 425 CG ASP A 30 16.484 -15.419 -14.200 1.00 0.00 C ATOM 426 OD1 ASP A 30 17.518 -15.907 -13.699 1.00 0.00 O ATOM 427 OD2 ASP A 30 15.626 -16.100 -14.801 1.00 0.00 O ATOM 0 H ASP A 30 16.714 -14.130 -11.658 1.00 0.00 H new ATOM 0 HA ASP A 30 18.366 -13.602 -13.810 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.351 -13.745 -13.497 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.098 -13.499 -15.063 1.00 0.00 H new ATOM 432 N LEU A 31 16.298 -11.077 -13.226 1.00 0.00 N ATOM 433 CA LEU A 31 16.114 -9.645 -13.433 1.00 0.00 C ATOM 434 C LEU A 31 17.336 -8.865 -12.961 1.00 0.00 C ATOM 435 O LEU A 31 17.724 -7.870 -13.573 1.00 0.00 O ATOM 436 CB LEU A 31 14.867 -9.159 -12.692 1.00 0.00 C ATOM 437 CG LEU A 31 13.542 -9.304 -13.441 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.493 -8.357 -14.629 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.341 -10.743 -13.895 1.00 0.00 C ATOM 0 H LEU A 31 15.545 -11.528 -12.707 1.00 0.00 H new ATOM 0 HA LEU A 31 15.986 -9.471 -14.501 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.792 -9.705 -11.752 1.00 0.00 H new ATOM 0 HB3 LEU A 31 15.005 -8.108 -12.440 1.00 0.00 H new ATOM 0 HG LEU A 31 12.732 -9.042 -12.761 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.543 -8.475 -15.149 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.590 -7.329 -14.279 1.00 0.00 H new ATOM 0 HD13 LEU A 31 14.311 -8.587 -15.311 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.393 -10.828 -14.426 1.00 0.00 H new ATOM 0 HD22 LEU A 31 14.156 -11.032 -14.558 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.330 -11.401 -13.026 1.00 0.00 H new ATOM 451 N GLU A 32 17.941 -9.325 -11.870 1.00 0.00 N ATOM 452 CA GLU A 32 19.121 -8.670 -11.318 1.00 0.00 C ATOM 453 C GLU A 32 20.293 -8.749 -12.292 1.00 0.00 C ATOM 454 O GLU A 32 21.140 -7.857 -12.332 1.00 0.00 O ATOM 455 CB GLU A 32 19.508 -9.310 -9.983 1.00 0.00 C ATOM 456 CG GLU A 32 18.907 -8.610 -8.775 1.00 0.00 C ATOM 457 CD GLU A 32 19.865 -7.624 -8.136 1.00 0.00 C ATOM 458 OE1 GLU A 32 20.655 -7.001 -8.876 1.00 0.00 O ATOM 459 OE2 GLU A 32 19.825 -7.474 -6.897 1.00 0.00 O ATOM 0 H GLU A 32 17.634 -10.148 -11.352 1.00 0.00 H new ATOM 0 HA GLU A 32 18.879 -7.620 -11.153 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.190 -10.353 -9.984 1.00 0.00 H new ATOM 0 HB3 GLU A 32 20.594 -9.308 -9.890 1.00 0.00 H new ATOM 0 HG2 GLU A 32 18.000 -8.086 -9.077 1.00 0.00 H new ATOM 0 HG3 GLU A 32 18.613 -9.356 -8.037 1.00 0.00 H new ATOM 466 N GLN A 33 20.334 -9.823 -13.073 1.00 0.00 N ATOM 467 CA GLN A 33 21.402 -10.019 -14.046 1.00 0.00 C ATOM 468 C GLN A 33 21.367 -8.937 -15.120 1.00 0.00 C ATOM 469 O GLN A 33 22.396 -8.591 -15.701 1.00 0.00 O ATOM 470 CB GLN A 33 21.284 -11.400 -14.693 1.00 0.00 C ATOM 471 CG GLN A 33 22.572 -11.879 -15.343 1.00 0.00 C ATOM 472 CD GLN A 33 23.249 -12.983 -14.554 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.144 -13.040 -13.329 1.00 0.00 O ATOM 474 NE2 GLN A 33 23.949 -13.868 -15.254 1.00 0.00 N ATOM 0 H GLN A 33 19.640 -10.571 -13.051 1.00 0.00 H new ATOM 0 HA GLN A 33 22.354 -9.952 -13.520 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.979 -12.122 -13.936 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.495 -11.374 -15.445 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.355 -12.237 -16.349 1.00 0.00 H new ATOM 0 HG3 GLN A 33 23.258 -11.038 -15.445 1.00 0.00 H new ATOM 0 HE21 GLN A 33 24.009 -13.783 -16.269 1.00 0.00 H new ATOM 0 HE22 GLN A 33 24.426 -14.633 -14.777 1.00 0.00 H new ATOM 483 N LEU A 34 20.177 -8.406 -15.378 1.00 0.00 N ATOM 484 CA LEU A 34 20.007 -7.362 -16.383 1.00 0.00 C ATOM 485 C LEU A 34 20.565 -6.032 -15.886 1.00 0.00 C ATOM 486 O LEU A 34 21.099 -5.946 -14.780 1.00 0.00 O ATOM 487 CB LEU A 34 18.527 -7.206 -16.740 1.00 0.00 C ATOM 488 CG LEU A 34 17.841 -8.447 -17.313 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.329 -8.309 -17.226 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.275 -8.678 -18.754 1.00 0.00 C ATOM 0 H LEU A 34 19.316 -8.681 -14.906 1.00 0.00 H new ATOM 0 HA LEU A 34 20.560 -7.657 -17.275 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.988 -6.898 -15.844 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.432 -6.396 -17.463 1.00 0.00 H new ATOM 0 HG LEU A 34 18.141 -9.311 -16.720 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.858 -9.201 -17.638 1.00 0.00 H new ATOM 0 HD12 LEU A 34 16.034 -8.192 -16.183 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.010 -7.435 -17.794 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.777 -9.565 -19.146 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.004 -7.813 -19.359 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.355 -8.822 -18.790 1.00 0.00 H new ATOM 502 N ARG A 35 20.435 -4.997 -16.710 1.00 0.00 N ATOM 503 CA ARG A 35 20.925 -3.671 -16.354 1.00 0.00 C ATOM 504 C ARG A 35 19.842 -2.864 -15.644 1.00 0.00 C ATOM 505 O ARG A 35 18.657 -2.988 -15.953 1.00 0.00 O ATOM 506 CB ARG A 35 21.395 -2.926 -17.604 1.00 0.00 C ATOM 507 CG ARG A 35 22.760 -2.275 -17.448 1.00 0.00 C ATOM 508 CD ARG A 35 23.220 -1.626 -18.744 1.00 0.00 C ATOM 509 NE ARG A 35 24.674 -1.515 -18.815 1.00 0.00 N ATOM 510 CZ ARG A 35 25.375 -0.603 -18.150 1.00 0.00 C ATOM 511 NH1 ARG A 35 24.757 0.273 -17.369 1.00 0.00 N ATOM 512 NH2 ARG A 35 26.696 -0.565 -18.266 1.00 0.00 N ATOM 0 H ARG A 35 19.995 -5.051 -17.628 1.00 0.00 H new ATOM 0 HA ARG A 35 21.768 -3.792 -15.674 1.00 0.00 H new ATOM 0 HB2 ARG A 35 21.428 -3.623 -18.441 1.00 0.00 H new ATOM 0 HB3 ARG A 35 20.663 -2.159 -17.856 1.00 0.00 H new ATOM 0 HG2 ARG A 35 22.718 -1.524 -16.659 1.00 0.00 H new ATOM 0 HG3 ARG A 35 23.488 -3.024 -17.137 1.00 0.00 H new ATOM 0 HD2 ARG A 35 22.859 -2.211 -19.590 1.00 0.00 H new ATOM 0 HD3 ARG A 35 22.776 -0.634 -18.830 1.00 0.00 H new ATOM 0 HE ARG A 35 25.179 -2.174 -19.408 1.00 0.00 H new ATOM 0 HH11 ARG A 35 23.741 0.247 -17.278 1.00 0.00 H new ATOM 0 HH12 ARG A 35 25.297 0.972 -16.859 1.00 0.00 H new ATOM 0 HH21 ARG A 35 27.175 -1.236 -18.866 1.00 0.00 H new ATOM 0 HH22 ARG A 35 27.233 0.136 -17.755 1.00 0.00 H new ATOM 526 N LYS A 36 20.257 -2.037 -14.691 1.00 0.00 N ATOM 527 CA LYS A 36 19.324 -1.208 -13.937 1.00 0.00 C ATOM 528 C LYS A 36 19.176 0.167 -14.581 1.00 0.00 C ATOM 529 O LYS A 36 20.078 1.001 -14.499 1.00 0.00 O ATOM 530 CB LYS A 36 19.799 -1.057 -12.490 1.00 0.00 C ATOM 531 CG LYS A 36 20.253 -2.362 -11.859 1.00 0.00 C ATOM 532 CD LYS A 36 19.106 -3.352 -11.741 1.00 0.00 C ATOM 533 CE LYS A 36 19.490 -4.549 -10.883 1.00 0.00 C ATOM 534 NZ LYS A 36 20.761 -5.174 -11.341 1.00 0.00 N ATOM 0 H LYS A 36 21.234 -1.923 -14.422 1.00 0.00 H new ATOM 0 HA LYS A 36 18.351 -1.700 -13.944 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.622 -0.343 -12.459 1.00 0.00 H new ATOM 0 HB3 LYS A 36 18.990 -0.637 -11.893 1.00 0.00 H new ATOM 0 HG2 LYS A 36 21.052 -2.799 -12.458 1.00 0.00 H new ATOM 0 HG3 LYS A 36 20.668 -2.165 -10.871 1.00 0.00 H new ATOM 0 HD2 LYS A 36 18.238 -2.855 -11.307 1.00 0.00 H new ATOM 0 HD3 LYS A 36 18.815 -3.693 -12.734 1.00 0.00 H new ATOM 0 HE2 LYS A 36 19.594 -4.233 -9.845 1.00 0.00 H new ATOM 0 HE3 LYS A 36 18.690 -5.289 -10.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 20.679 -6.209 -11.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 20.950 -4.896 -12.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 21.543 -4.854 -10.735 1.00 0.00 H new ATOM 782 N VAL A 51 13.779 0.322 -13.424 1.00 0.00 N ATOM 783 CA VAL A 51 12.936 -0.339 -14.413 1.00 0.00 C ATOM 784 C VAL A 51 13.775 -1.142 -15.401 1.00 0.00 C ATOM 785 O VAL A 51 14.995 -0.989 -15.463 1.00 0.00 O ATOM 786 CB VAL A 51 12.080 0.678 -15.191 1.00 0.00 C ATOM 787 CG1 VAL A 51 11.091 1.365 -14.262 1.00 0.00 C ATOM 788 CG2 VAL A 51 12.967 1.699 -15.888 1.00 0.00 C ATOM 0 HA VAL A 51 12.277 -1.014 -13.867 1.00 0.00 H new ATOM 0 HB VAL A 51 11.514 0.142 -15.953 1.00 0.00 H new ATOM 0 HG11 VAL A 51 10.495 2.080 -14.829 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.434 0.619 -13.814 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.634 1.889 -13.475 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.345 2.410 -16.433 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.561 2.232 -15.146 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.631 1.188 -16.586 1.00 0.00 H new ATOM 798 N TYR A 52 13.113 -1.997 -16.173 1.00 0.00 N ATOM 799 CA TYR A 52 13.798 -2.825 -17.158 1.00 0.00 C ATOM 800 C TYR A 52 13.255 -2.566 -18.560 1.00 0.00 C ATOM 801 O TYR A 52 12.130 -2.092 -18.726 1.00 0.00 O ATOM 802 CB TYR A 52 13.644 -4.306 -16.805 1.00 0.00 C ATOM 803 CG TYR A 52 14.164 -4.657 -15.429 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.504 -4.485 -15.107 1.00 0.00 C ATOM 805 CD2 TYR A 52 13.315 -5.163 -14.453 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.984 -4.805 -13.852 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.786 -5.485 -13.194 1.00 0.00 C ATOM 808 CZ TYR A 52 15.121 -5.305 -12.899 1.00 0.00 C ATOM 809 OH TYR A 52 15.594 -5.625 -11.647 1.00 0.00 O ATOM 0 H TYR A 52 12.103 -2.135 -16.135 1.00 0.00 H new ATOM 0 HA TYR A 52 14.856 -2.562 -17.144 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.590 -4.578 -16.866 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.172 -4.905 -17.547 1.00 0.00 H new ATOM 0 HD1 TYR A 52 16.183 -4.094 -15.851 1.00 0.00 H new ATOM 0 HD2 TYR A 52 12.269 -5.307 -14.682 1.00 0.00 H new ATOM 0 HE1 TYR A 52 17.029 -4.665 -13.618 1.00 0.00 H new ATOM 0 HE2 TYR A 52 13.112 -5.875 -12.446 1.00 0.00 H new ATOM 0 HH TYR A 52 14.858 -5.963 -11.096 1.00 0.00 H new ATOM 819 N LEU A 53 14.062 -2.882 -19.567 1.00 0.00 N ATOM 820 CA LEU A 53 13.664 -2.684 -20.957 1.00 0.00 C ATOM 821 C LEU A 53 12.983 -3.932 -21.510 1.00 0.00 C ATOM 822 O LEU A 53 13.493 -5.044 -21.370 1.00 0.00 O ATOM 823 CB LEU A 53 14.883 -2.333 -21.812 1.00 0.00 C ATOM 824 CG LEU A 53 14.890 -0.934 -22.428 1.00 0.00 C ATOM 825 CD1 LEU A 53 15.898 -0.043 -21.719 1.00 0.00 C ATOM 826 CD2 LEU A 53 15.195 -1.008 -23.917 1.00 0.00 C ATOM 0 H LEU A 53 14.995 -3.276 -19.447 1.00 0.00 H new ATOM 0 HA LEU A 53 12.954 -1.858 -20.992 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.776 -2.442 -21.197 1.00 0.00 H new ATOM 0 HB3 LEU A 53 14.959 -3.063 -22.618 1.00 0.00 H new ATOM 0 HG LEU A 53 13.899 -0.498 -22.302 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.889 0.949 -22.171 1.00 0.00 H new ATOM 0 HD12 LEU A 53 15.635 0.037 -20.664 1.00 0.00 H new ATOM 0 HD13 LEU A 53 16.894 -0.475 -21.812 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.196 -0.003 -24.339 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.173 -1.465 -24.066 1.00 0.00 H new ATOM 0 HD23 LEU A 53 14.434 -1.610 -24.415 1.00 0.00 H new ATOM 838 N ARG A 54 11.830 -3.739 -22.142 1.00 0.00 N ATOM 839 CA ARG A 54 11.079 -4.848 -22.718 1.00 0.00 C ATOM 840 C ARG A 54 11.928 -5.611 -23.731 1.00 0.00 C ATOM 841 O ARG A 54 11.786 -6.823 -23.887 1.00 0.00 O ATOM 842 CB ARG A 54 9.803 -4.335 -23.388 1.00 0.00 C ATOM 843 CG ARG A 54 8.646 -5.319 -23.330 1.00 0.00 C ATOM 844 CD ARG A 54 7.306 -4.610 -23.445 1.00 0.00 C ATOM 845 NE ARG A 54 6.185 -5.543 -23.367 1.00 0.00 N ATOM 846 CZ ARG A 54 5.856 -6.380 -24.344 1.00 0.00 C ATOM 847 NH1 ARG A 54 6.558 -6.401 -25.469 1.00 0.00 N ATOM 848 NH2 ARG A 54 4.822 -7.199 -24.198 1.00 0.00 N ATOM 0 H ARG A 54 11.395 -2.825 -22.268 1.00 0.00 H new ATOM 0 HA ARG A 54 10.808 -5.529 -21.911 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.501 -3.404 -22.909 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.019 -4.102 -24.431 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.745 -6.046 -24.136 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.686 -5.874 -22.393 1.00 0.00 H new ATOM 0 HD2 ARG A 54 7.218 -3.870 -22.649 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.262 -4.069 -24.390 1.00 0.00 H new ATOM 0 HE ARG A 54 5.624 -5.552 -22.515 1.00 0.00 H new ATOM 0 HH11 ARG A 54 7.353 -5.773 -25.586 1.00 0.00 H new ATOM 0 HH12 ARG A 54 6.303 -7.045 -26.218 1.00 0.00 H new ATOM 0 HH21 ARG A 54 4.279 -7.186 -23.335 1.00 0.00 H new ATOM 0 HH22 ARG A 54 4.570 -7.841 -24.949 1.00 0.00 H new ATOM 862 N SER A 55 12.810 -4.891 -24.418 1.00 0.00 N ATOM 863 CA SER A 55 13.678 -5.499 -25.419 1.00 0.00 C ATOM 864 C SER A 55 14.723 -6.394 -24.761 1.00 0.00 C ATOM 865 O SER A 55 15.006 -7.492 -25.240 1.00 0.00 O ATOM 866 CB SER A 55 14.369 -4.416 -26.250 1.00 0.00 C ATOM 867 OG SER A 55 15.362 -4.975 -27.092 1.00 0.00 O ATOM 0 H SER A 55 12.942 -3.887 -24.299 1.00 0.00 H new ATOM 0 HA SER A 55 13.060 -6.113 -26.075 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.630 -3.890 -26.854 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.823 -3.679 -25.587 1.00 0.00 H new ATOM 0 HG SER A 55 15.788 -4.263 -27.613 1.00 0.00 H new ATOM 873 N ASP A 56 15.292 -5.918 -23.659 1.00 0.00 N ATOM 874 CA ASP A 56 16.305 -6.675 -22.932 1.00 0.00 C ATOM 875 C ASP A 56 15.685 -7.881 -22.235 1.00 0.00 C ATOM 876 O ASP A 56 16.324 -8.923 -22.087 1.00 0.00 O ATOM 877 CB ASP A 56 17.003 -5.780 -21.907 1.00 0.00 C ATOM 878 CG ASP A 56 18.239 -5.108 -22.472 1.00 0.00 C ATOM 879 OD1 ASP A 56 18.967 -5.761 -23.248 1.00 0.00 O ATOM 880 OD2 ASP A 56 18.478 -3.928 -22.137 1.00 0.00 O ATOM 0 H ASP A 56 15.069 -5.011 -23.249 1.00 0.00 H new ATOM 0 HA ASP A 56 17.042 -7.033 -23.651 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.305 -5.018 -21.560 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.282 -6.376 -21.038 1.00 0.00 H new ATOM 885 N VAL A 57 14.435 -7.733 -21.806 1.00 0.00 N ATOM 886 CA VAL A 57 13.728 -8.810 -21.123 1.00 0.00 C ATOM 887 C VAL A 57 13.272 -9.879 -22.109 1.00 0.00 C ATOM 888 O VAL A 57 13.199 -11.060 -21.770 1.00 0.00 O ATOM 889 CB VAL A 57 12.504 -8.280 -20.355 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.831 -9.403 -19.581 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.909 -7.148 -19.423 1.00 0.00 C ATOM 0 H VAL A 57 13.891 -6.877 -21.920 1.00 0.00 H new ATOM 0 HA VAL A 57 14.430 -9.249 -20.414 1.00 0.00 H new ATOM 0 HB VAL A 57 11.787 -7.888 -21.076 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.968 -9.009 -19.045 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.504 -10.178 -20.274 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.538 -9.828 -18.868 1.00 0.00 H new ATOM 0 HG21 VAL A 57 12.031 -6.785 -18.888 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.646 -7.512 -18.707 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.341 -6.334 -20.005 1.00 0.00 H new ATOM 901 N GLU A 58 12.966 -9.457 -23.332 1.00 0.00 N ATOM 902 CA GLU A 58 12.515 -10.379 -24.368 1.00 0.00 C ATOM 903 C GLU A 58 13.512 -11.521 -24.551 1.00 0.00 C ATOM 904 O GLU A 58 13.124 -12.672 -24.747 1.00 0.00 O ATOM 905 CB GLU A 58 12.323 -9.639 -25.693 1.00 0.00 C ATOM 906 CG GLU A 58 11.685 -10.489 -26.779 1.00 0.00 C ATOM 907 CD GLU A 58 11.176 -9.662 -27.944 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.522 -8.464 -28.016 1.00 0.00 O ATOM 909 OE2 GLU A 58 10.433 -10.213 -28.782 1.00 0.00 O ATOM 0 H GLU A 58 13.022 -8.483 -23.629 1.00 0.00 H new ATOM 0 HA GLU A 58 11.560 -10.799 -24.053 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.703 -8.759 -25.521 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.292 -9.283 -26.044 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.414 -11.213 -27.143 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.858 -11.056 -26.352 1.00 0.00 H new ATOM 916 N ALA A 59 14.798 -11.192 -24.485 1.00 0.00 N ATOM 917 CA ALA A 59 15.850 -12.188 -24.641 1.00 0.00 C ATOM 918 C ALA A 59 16.089 -12.944 -23.339 1.00 0.00 C ATOM 919 O ALA A 59 16.427 -14.128 -23.348 1.00 0.00 O ATOM 920 CB ALA A 59 17.137 -11.527 -25.114 1.00 0.00 C ATOM 0 H ALA A 59 15.136 -10.243 -24.325 1.00 0.00 H new ATOM 0 HA ALA A 59 15.526 -12.907 -25.393 1.00 0.00 H new ATOM 0 HB1 ALA A 59 17.914 -12.283 -25.226 1.00 0.00 H new ATOM 0 HB2 ALA A 59 16.964 -11.039 -26.073 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.455 -10.785 -24.382 1.00 0.00 H new ATOM 926 N LYS A 60 15.912 -12.252 -22.218 1.00 0.00 N ATOM 927 CA LYS A 60 16.107 -12.857 -20.906 1.00 0.00 C ATOM 928 C LYS A 60 15.248 -14.108 -20.750 1.00 0.00 C ATOM 929 O LYS A 60 15.586 -15.013 -19.987 1.00 0.00 O ATOM 930 CB LYS A 60 15.769 -11.852 -19.803 1.00 0.00 C ATOM 931 CG LYS A 60 16.785 -11.822 -18.674 1.00 0.00 C ATOM 932 CD LYS A 60 16.969 -13.197 -18.053 1.00 0.00 C ATOM 933 CE LYS A 60 18.030 -13.178 -16.963 1.00 0.00 C ATOM 934 NZ LYS A 60 18.445 -14.553 -16.570 1.00 0.00 N ATOM 0 H LYS A 60 15.634 -11.271 -22.192 1.00 0.00 H new ATOM 0 HA LYS A 60 17.155 -13.144 -20.818 1.00 0.00 H new ATOM 0 HB2 LYS A 60 15.695 -10.856 -20.241 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.789 -12.093 -19.392 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.741 -11.462 -19.053 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.460 -11.117 -17.909 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.022 -13.538 -17.635 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.252 -13.912 -18.826 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.900 -12.622 -17.312 1.00 0.00 H new ATOM 0 HE3 LYS A 60 17.645 -12.651 -16.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.936 -14.519 -15.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.604 -15.160 -16.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.085 -14.942 -17.292 1.00 0.00 H new ATOM 948 N SER A 61 14.138 -14.152 -21.479 1.00 0.00 N ATOM 949 CA SER A 61 13.229 -15.291 -21.420 1.00 0.00 C ATOM 950 C SER A 61 13.718 -16.423 -22.319 1.00 0.00 C ATOM 951 O SER A 61 13.420 -17.594 -22.079 1.00 0.00 O ATOM 952 CB SER A 61 11.819 -14.868 -21.835 1.00 0.00 C ATOM 953 OG SER A 61 11.542 -15.257 -23.169 1.00 0.00 O ATOM 0 H SER A 61 13.846 -13.412 -22.118 1.00 0.00 H new ATOM 0 HA SER A 61 13.204 -15.651 -20.392 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.088 -15.318 -21.163 1.00 0.00 H new ATOM 0 HB3 SER A 61 11.717 -13.787 -21.739 1.00 0.00 H new ATOM 0 HG SER A 61 10.634 -14.977 -23.410 1.00 0.00 H new ATOM 959 N LEU A 62 14.470 -16.065 -23.354 1.00 0.00 N ATOM 960 CA LEU A 62 15.001 -17.050 -24.290 1.00 0.00 C ATOM 961 C LEU A 62 16.324 -17.619 -23.789 1.00 0.00 C ATOM 962 O LEU A 62 16.646 -18.780 -24.041 1.00 0.00 O ATOM 963 CB LEU A 62 15.194 -16.418 -25.670 1.00 0.00 C ATOM 964 CG LEU A 62 14.048 -15.540 -26.172 1.00 0.00 C ATOM 965 CD1 LEU A 62 14.319 -15.070 -27.593 1.00 0.00 C ATOM 966 CD2 LEU A 62 12.728 -16.293 -26.100 1.00 0.00 C ATOM 0 H LEU A 62 14.726 -15.101 -23.566 1.00 0.00 H new ATOM 0 HA LEU A 62 14.282 -17.866 -24.368 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.103 -15.817 -25.648 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.357 -17.217 -26.394 1.00 0.00 H new ATOM 0 HG LEU A 62 13.978 -14.663 -25.528 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.493 -14.446 -27.934 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.243 -14.492 -27.615 1.00 0.00 H new ATOM 0 HD13 LEU A 62 14.416 -15.934 -28.250 1.00 0.00 H new ATOM 0 HD21 LEU A 62 11.924 -15.652 -26.461 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.785 -17.188 -26.720 1.00 0.00 H new ATOM 0 HD23 LEU A 62 12.528 -16.579 -25.067 1.00 0.00 H new ATOM 978 N GLU A 63 17.085 -16.795 -23.076 1.00 0.00 N ATOM 979 CA GLU A 63 18.373 -17.218 -22.538 1.00 0.00 C ATOM 980 C GLU A 63 18.184 -18.146 -21.342 1.00 0.00 C ATOM 981 O GLU A 63 19.055 -18.958 -21.028 1.00 0.00 O ATOM 982 CB GLU A 63 19.204 -16.001 -22.127 1.00 0.00 C ATOM 983 CG GLU A 63 18.724 -15.341 -20.846 1.00 0.00 C ATOM 984 CD GLU A 63 19.544 -15.748 -19.637 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.338 -16.871 -19.132 1.00 0.00 O ATOM 986 OE2 GLU A 63 20.392 -14.943 -19.197 1.00 0.00 O ATOM 0 H GLU A 63 16.832 -15.831 -22.857 1.00 0.00 H new ATOM 0 HA GLU A 63 18.903 -17.763 -23.319 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.243 -16.307 -22.001 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.183 -15.268 -22.933 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.767 -14.258 -20.962 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.679 -15.602 -20.676 1.00 0.00 H new ATOM 993 N VAL A 64 17.040 -18.020 -20.677 1.00 0.00 N ATOM 994 CA VAL A 64 16.735 -18.847 -19.515 1.00 0.00 C ATOM 995 C VAL A 64 15.972 -20.103 -19.920 1.00 0.00 C ATOM 996 O VAL A 64 16.522 -21.204 -19.917 1.00 0.00 O ATOM 997 CB VAL A 64 15.908 -18.070 -18.474 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.554 -18.965 -17.297 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.665 -16.836 -18.007 1.00 0.00 C ATOM 0 H VAL A 64 16.309 -17.353 -20.923 1.00 0.00 H new ATOM 0 HA VAL A 64 17.688 -19.132 -19.070 1.00 0.00 H new ATOM 0 HB VAL A 64 14.980 -17.744 -18.943 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.970 -18.398 -16.572 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.970 -19.815 -17.649 1.00 0.00 H new ATOM 0 HG13 VAL A 64 16.469 -19.324 -16.825 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.066 -16.298 -17.272 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.610 -17.138 -17.555 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.862 -16.186 -18.859 1.00 0.00 H new ATOM 1009 N TRP A 65 14.702 -19.930 -20.268 1.00 0.00 N ATOM 1010 CA TRP A 65 13.862 -21.050 -20.676 1.00 0.00 C ATOM 1011 C TRP A 65 14.435 -21.739 -21.910 1.00 0.00 C ATOM 1012 O TRP A 65 14.193 -22.924 -22.139 1.00 0.00 O ATOM 1013 CB TRP A 65 12.438 -20.570 -20.960 1.00 0.00 C ATOM 1014 CG TRP A 65 11.610 -20.402 -19.722 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.428 -19.253 -19.007 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.853 -21.417 -19.053 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.604 -19.492 -17.933 1.00 0.00 N ATOM 1018 CE2 TRP A 65 10.237 -20.812 -17.940 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.634 -22.777 -19.287 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 9.419 -21.521 -17.065 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.822 -23.480 -18.417 1.00 0.00 C ATOM 1022 CH2 TRP A 65 9.222 -22.852 -17.318 1.00 0.00 C ATOM 0 H TRP A 65 14.231 -19.025 -20.276 1.00 0.00 H new ATOM 0 HA TRP A 65 13.838 -21.770 -19.858 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.482 -19.619 -21.491 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.947 -21.283 -21.623 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.867 -18.297 -19.250 1.00 0.00 H new ATOM 0 HE1 TRP A 65 10.313 -18.799 -17.243 1.00 0.00 H new ATOM 0 HE3 TRP A 65 11.091 -23.270 -20.132 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.956 -21.038 -16.217 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.647 -24.532 -18.588 1.00 0.00 H new ATOM 0 HH2 TRP A 65 8.592 -23.429 -16.657 1.00 0.00 H new ATOM 1033 N GLY A 66 15.195 -20.989 -22.701 1.00 0.00 N ATOM 1034 CA GLY A 66 15.790 -21.546 -23.902 1.00 0.00 C ATOM 1035 C GLY A 66 15.151 -21.011 -25.168 1.00 0.00 C ATOM 1036 O GLY A 66 15.845 -20.661 -26.123 1.00 0.00 O ATOM 0 H GLY A 66 15.409 -20.006 -22.532 1.00 0.00 H new ATOM 0 HA2 GLY A 66 16.856 -21.320 -23.914 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.694 -22.632 -23.881 1.00 0.00 H new ATOM 1040 N SER A 67 13.823 -20.948 -25.177 1.00 0.00 N ATOM 1041 CA SER A 67 13.089 -20.458 -26.338 1.00 0.00 C ATOM 1042 C SER A 67 11.779 -19.800 -25.913 1.00 0.00 C ATOM 1043 O SER A 67 11.271 -20.022 -24.814 1.00 0.00 O ATOM 1044 CB SER A 67 12.805 -21.604 -27.311 1.00 0.00 C ATOM 1045 OG SER A 67 12.896 -22.859 -26.660 1.00 0.00 O ATOM 0 H SER A 67 13.234 -21.230 -24.394 1.00 0.00 H new ATOM 0 HA SER A 67 13.706 -19.712 -26.839 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.810 -21.484 -27.739 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.514 -21.567 -28.138 1.00 0.00 H new ATOM 0 HG SER A 67 12.709 -23.575 -27.302 1.00 0.00 H new ATOM 1051 N PRO A 68 11.219 -18.970 -26.806 1.00 0.00 N ATOM 1052 CA PRO A 68 9.961 -18.263 -26.548 1.00 0.00 C ATOM 1053 C PRO A 68 8.761 -19.204 -26.523 1.00 0.00 C ATOM 1054 O PRO A 68 7.701 -18.858 -26.003 1.00 0.00 O ATOM 1055 CB PRO A 68 9.853 -17.290 -27.725 1.00 0.00 C ATOM 1056 CG PRO A 68 10.647 -17.924 -28.814 1.00 0.00 C ATOM 1057 CD PRO A 68 11.770 -18.658 -28.135 1.00 0.00 C ATOM 0 HA PRO A 68 9.960 -17.776 -25.573 1.00 0.00 H new ATOM 0 HB2 PRO A 68 8.815 -17.145 -28.025 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.250 -16.309 -27.465 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.031 -18.608 -29.399 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.032 -17.173 -29.504 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.046 -19.562 -28.678 1.00 0.00 H new ATOM 0 HD3 PRO A 68 12.667 -18.043 -28.064 1.00 0.00 H new ATOM 1065 N GLU A 69 8.937 -20.394 -27.088 1.00 0.00 N ATOM 1066 CA GLU A 69 7.867 -21.384 -27.131 1.00 0.00 C ATOM 1067 C GLU A 69 7.640 -21.999 -25.752 1.00 0.00 C ATOM 1068 O GLU A 69 6.508 -22.302 -25.375 1.00 0.00 O ATOM 1069 CB GLU A 69 8.199 -22.483 -28.143 1.00 0.00 C ATOM 1070 CG GLU A 69 8.142 -22.016 -29.588 1.00 0.00 C ATOM 1071 CD GLU A 69 9.488 -22.102 -30.281 1.00 0.00 C ATOM 1072 OE1 GLU A 69 10.127 -23.172 -30.204 1.00 0.00 O ATOM 1073 OE2 GLU A 69 9.902 -21.100 -30.901 1.00 0.00 O ATOM 0 H GLU A 69 9.809 -20.696 -27.522 1.00 0.00 H new ATOM 0 HA GLU A 69 6.952 -20.880 -27.441 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.197 -22.869 -27.934 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.503 -23.311 -28.010 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.417 -22.621 -30.133 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.786 -20.986 -29.620 1.00 0.00 H new ATOM 1080 N ALA A 70 8.724 -22.180 -25.006 1.00 0.00 N ATOM 1081 CA ALA A 70 8.644 -22.757 -23.669 1.00 0.00 C ATOM 1082 C ALA A 70 7.837 -21.863 -22.734 1.00 0.00 C ATOM 1083 O ALA A 70 7.107 -22.351 -21.869 1.00 0.00 O ATOM 1084 CB ALA A 70 10.040 -22.987 -23.109 1.00 0.00 C ATOM 0 H ALA A 70 9.668 -21.936 -25.304 1.00 0.00 H new ATOM 0 HA ALA A 70 8.132 -23.717 -23.743 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.965 -23.418 -22.111 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.585 -23.671 -23.760 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.571 -22.037 -23.055 1.00 0.00 H new ATOM 1090 N LEU A 71 7.973 -20.554 -22.910 1.00 0.00 N ATOM 1091 CA LEU A 71 7.256 -19.591 -22.080 1.00 0.00 C ATOM 1092 C LEU A 71 5.808 -19.451 -22.536 1.00 0.00 C ATOM 1093 O LEU A 71 4.898 -19.330 -21.717 1.00 0.00 O ATOM 1094 CB LEU A 71 7.952 -18.230 -22.128 1.00 0.00 C ATOM 1095 CG LEU A 71 7.181 -17.060 -21.515 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.066 -17.228 -20.008 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.854 -15.739 -21.857 1.00 0.00 C ATOM 0 H LEU A 71 8.573 -20.134 -23.620 1.00 0.00 H new ATOM 0 HA LEU A 71 7.260 -19.958 -21.054 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.910 -18.316 -21.616 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.168 -17.991 -23.169 1.00 0.00 H new ATOM 0 HG LEU A 71 6.176 -17.052 -21.937 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.514 -16.386 -19.589 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.538 -18.155 -19.784 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.063 -17.263 -19.569 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.291 -14.918 -21.412 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.871 -15.736 -21.465 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.883 -15.615 -22.940 1.00 0.00 H new ATOM 1109 N ALA A 72 5.601 -19.471 -23.849 1.00 0.00 N ATOM 1110 CA ALA A 72 4.263 -19.350 -24.414 1.00 0.00 C ATOM 1111 C ALA A 72 3.341 -20.439 -23.877 1.00 0.00 C ATOM 1112 O ALA A 72 2.123 -20.265 -23.827 1.00 0.00 O ATOM 1113 CB ALA A 72 4.324 -19.409 -25.933 1.00 0.00 C ATOM 0 H ALA A 72 6.344 -19.570 -24.541 1.00 0.00 H new ATOM 0 HA ALA A 72 3.855 -18.384 -24.115 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.318 -19.317 -26.341 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.942 -18.592 -26.304 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.756 -20.360 -26.243 1.00 0.00 H new ATOM 1119 N ARG A 73 3.928 -21.562 -23.477 1.00 0.00 N ATOM 1120 CA ARG A 73 3.158 -22.680 -22.946 1.00 0.00 C ATOM 1121 C ARG A 73 2.266 -22.227 -21.794 1.00 0.00 C ATOM 1122 O ARG A 73 1.146 -22.711 -21.637 1.00 0.00 O ATOM 1123 CB ARG A 73 4.095 -23.793 -22.473 1.00 0.00 C ATOM 1124 CG ARG A 73 5.024 -24.311 -23.559 1.00 0.00 C ATOM 1125 CD ARG A 73 4.788 -25.787 -23.837 1.00 0.00 C ATOM 1126 NE ARG A 73 5.768 -26.634 -23.163 1.00 0.00 N ATOM 1127 CZ ARG A 73 5.703 -27.961 -23.144 1.00 0.00 C ATOM 1128 NH1 ARG A 73 4.709 -28.588 -23.759 1.00 0.00 N ATOM 1129 NH2 ARG A 73 6.633 -28.663 -22.509 1.00 0.00 N ATOM 0 H ARG A 73 4.935 -21.722 -23.511 1.00 0.00 H new ATOM 0 HA ARG A 73 2.523 -23.064 -23.745 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.694 -23.423 -21.641 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.498 -24.622 -22.092 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.871 -23.738 -24.474 1.00 0.00 H new ATOM 0 HG3 ARG A 73 6.060 -24.158 -23.257 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.785 -26.062 -23.510 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.833 -25.965 -24.911 1.00 0.00 H new ATOM 0 HE ARG A 73 6.545 -26.182 -22.680 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.992 -28.051 -24.248 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.661 -29.607 -23.743 1.00 0.00 H new ATOM 0 HH21 ARG A 73 7.399 -28.184 -22.035 1.00 0.00 H new ATOM 0 HH22 ARG A 73 6.582 -29.682 -22.495 1.00 0.00 H new ATOM 1143 N GLU A 74 2.772 -21.296 -20.991 1.00 0.00 N ATOM 1144 CA GLU A 74 2.021 -20.779 -19.853 1.00 0.00 C ATOM 1145 C GLU A 74 1.237 -19.529 -20.241 1.00 0.00 C ATOM 1146 O GLU A 74 0.201 -19.223 -19.651 1.00 0.00 O ATOM 1147 CB GLU A 74 2.966 -20.462 -18.692 1.00 0.00 C ATOM 1148 CG GLU A 74 3.427 -21.693 -17.930 1.00 0.00 C ATOM 1149 CD GLU A 74 2.671 -21.892 -16.630 1.00 0.00 C ATOM 1150 OE1 GLU A 74 1.436 -22.073 -16.685 1.00 0.00 O ATOM 1151 OE2 GLU A 74 3.313 -21.865 -15.560 1.00 0.00 O ATOM 0 H GLU A 74 3.698 -20.885 -21.107 1.00 0.00 H new ATOM 0 HA GLU A 74 1.314 -21.547 -19.538 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.839 -19.936 -19.078 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.465 -19.784 -18.001 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.299 -22.574 -18.559 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.492 -21.606 -17.717 1.00 0.00 H new ATOM 1158 N LYS A 75 1.739 -18.808 -21.238 1.00 0.00 N ATOM 1159 CA LYS A 75 1.087 -17.591 -21.708 1.00 0.00 C ATOM 1160 C LYS A 75 -0.228 -17.914 -22.410 1.00 0.00 C ATOM 1161 O LYS A 75 -1.210 -17.184 -22.277 1.00 0.00 O ATOM 1162 CB LYS A 75 2.012 -16.828 -22.659 1.00 0.00 C ATOM 1163 CG LYS A 75 3.376 -16.522 -22.066 1.00 0.00 C ATOM 1164 CD LYS A 75 3.876 -15.152 -22.494 1.00 0.00 C ATOM 1165 CE LYS A 75 4.579 -14.434 -21.352 1.00 0.00 C ATOM 1166 NZ LYS A 75 3.649 -13.549 -20.597 1.00 0.00 N ATOM 0 H LYS A 75 2.596 -19.046 -21.737 1.00 0.00 H new ATOM 0 HA LYS A 75 0.871 -16.966 -20.841 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.144 -17.412 -23.570 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.532 -15.893 -22.946 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.319 -16.566 -20.978 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.089 -17.285 -22.379 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.562 -15.260 -23.334 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.037 -14.550 -22.842 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.013 -15.169 -20.673 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.403 -13.841 -21.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.844 -12.556 -20.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.667 -13.779 -20.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.785 -13.693 -19.576 1.00 0.00 H new