USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 877 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 HIS : no HD1:sc= 0.0891 K(o=-0.91,f=-2.7) USER MOD Set 1.2: A 114 MET CE :methyl -169:sc= -0.996 (180deg=-1.51!) USER MOD Set 2.1: A 89 ASN : amide:sc= -1.43! K(o=-0.98!,f=-2) USER MOD Set 2.2: A 94 ASN : amide:sc= 0.456 K(o=-0.98,f=-1.9) USER MOD Set 3.1: A 59 ASN : amide:sc= 0.821 K(o=2.5,f=-5.6!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 147:sc= 1.66 (180deg=0.0457) USER MOD Set 4.1: A 54 THR OG1 : rot -65:sc= 1.06 USER MOD Set 4.2: A 56 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN :FLIP amide:sc= 0 F(o=-2.3!,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 170:sc=-0.00489 (180deg=-0.109) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 75:sc= 1.3 USER MOD Single : A 32 SER OG : rot 71:sc= 1.25 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 74:sc= 2.45 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 60:sc= 1.27 USER MOD Single : A 51 ASN : amide:sc= -0.818 X(o=-0.82,f=-1.1) USER MOD Single : A 60 THR OG1 : rot 97:sc= 1.25 USER MOD Single : A 67 SER OG : rot -19:sc= 0.765 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -1.92! X(o=-1.9!,f=-1.9) USER MOD Single : A 82 CYS SG : rot 96:sc= 0.261 USER MOD Single : A 85 THR OG1 : rot 100:sc= 1.18 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 1.2 K(o=1.2,f=-0.28) USER MOD Single : A 91 GLN :FLIP amide:sc= -1.17 F(o=-2,f=-1.2) USER MOD Single : A 100 MET CE :methyl 178:sc= -0.34 (180deg=-0.369) USER MOD Single : A 102 THR OG1 : rot -117:sc= 0.0984 USER MOD Single : A 113 GLN :FLIP amide:sc= -0.427 F(o=-1.6!,f=-0.43) USER MOD Single : A 115 GLN : amide:sc= -4.42! C(o=-4.4!,f=-8.2!) USER MOD Single : A 116 TYR OH : rot 17:sc= 0.299 USER MOD Single : A 123 GLN : amide:sc= 0.896 K(o=0.9,f=-0.52) USER MOD Single : A 125 GLN : amide:sc= -0.892 X(o=-0.89,f=-1.2) USER MOD Single : A 129 THR OG1 : rot -88:sc= 1.1 USER MOD Single : A 130 LYS NZ :NH3+ -162:sc= -0.0517 (180deg=-0.335) USER MOD Single : A 134 LYS NZ :NH3+ 166:sc= 1.59 (180deg=0.552) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.307 9.397 3.486 1.00 0.00 N ATOM 2 CA PRO A 1 4.032 8.880 2.329 1.00 0.00 C ATOM 3 C PRO A 1 5.468 9.357 2.373 1.00 0.00 C ATOM 4 O PRO A 1 5.853 10.069 3.285 1.00 0.00 O ATOM 5 CB PRO A 1 3.351 9.384 1.058 1.00 0.00 C ATOM 6 CG PRO A 1 2.074 9.948 1.544 1.00 0.00 C ATOM 7 CD PRO A 1 2.282 10.308 3.013 1.00 0.00 C ATOM 0 H2 PRO A 1 3.946 9.879 4.119 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.886 8.631 4.012 1.00 0.00 H new ATOM 0 HA PRO A 1 4.025 7.790 2.341 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.955 10.138 0.552 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.186 8.576 0.345 1.00 0.00 H new ATOM 0 HG2 PRO A 1 1.795 10.829 0.966 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.265 9.226 1.434 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.596 11.346 3.123 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.359 10.192 3.581 1.00 0.00 H new ATOM 17 N VAL A 2 6.243 8.965 1.398 1.00 0.00 N ATOM 18 CA VAL A 2 7.630 9.311 1.310 1.00 0.00 C ATOM 19 C VAL A 2 7.878 10.183 0.073 1.00 0.00 C ATOM 20 O VAL A 2 7.291 9.965 -0.983 1.00 0.00 O ATOM 21 CB VAL A 2 8.528 8.017 1.232 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.013 8.343 1.191 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.231 7.070 2.383 1.00 0.00 C ATOM 0 H VAL A 2 5.917 8.383 0.627 1.00 0.00 H new ATOM 0 HA VAL A 2 7.898 9.868 2.207 1.00 0.00 H new ATOM 0 HB VAL A 2 8.274 7.522 0.295 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.587 7.418 1.138 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.227 8.954 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.290 8.891 2.092 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.866 6.188 2.301 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.430 7.574 3.329 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.184 6.769 2.345 1.00 0.00 H new ATOM 33 N THR A 3 8.711 11.174 0.236 1.00 0.00 N ATOM 34 CA THR A 3 9.147 12.023 -0.842 1.00 0.00 C ATOM 35 C THR A 3 10.635 11.716 -1.007 1.00 0.00 C ATOM 36 O THR A 3 11.300 11.418 0.001 1.00 0.00 O ATOM 37 CB THR A 3 8.866 13.543 -0.532 1.00 0.00 C ATOM 38 OG1 THR A 3 9.413 14.410 -1.539 1.00 0.00 O ATOM 39 CG2 THR A 3 9.385 13.962 0.832 1.00 0.00 C ATOM 0 H THR A 3 9.115 11.420 1.140 1.00 0.00 H new ATOM 0 HA THR A 3 8.603 11.831 -1.767 1.00 0.00 H new ATOM 0 HB THR A 3 7.781 13.645 -0.533 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.216 15.342 -1.310 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.166 15.017 0.996 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.899 13.366 1.605 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.463 13.804 0.876 1.00 0.00 H new ATOM 228 N HIS A 16 10.065 11.929 5.180 1.00 0.00 N ATOM 229 CA HIS A 16 8.874 11.222 5.518 1.00 0.00 C ATOM 230 C HIS A 16 7.766 12.230 5.616 1.00 0.00 C ATOM 231 O HIS A 16 7.960 13.306 6.146 1.00 0.00 O ATOM 232 CB HIS A 16 9.009 10.533 6.904 1.00 0.00 C ATOM 233 CG HIS A 16 10.235 9.692 7.090 1.00 0.00 C ATOM 234 ND1 HIS A 16 10.962 9.688 8.241 1.00 0.00 N ATOM 235 CD2 HIS A 16 10.855 8.838 6.269 1.00 0.00 C ATOM 236 CE1 HIS A 16 11.971 8.882 8.124 1.00 0.00 C ATOM 237 NE2 HIS A 16 11.939 8.348 6.937 1.00 0.00 N ATOM 0 HA HIS A 16 8.681 10.462 4.761 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.997 11.303 7.676 1.00 0.00 H new ATOM 0 HB3 HIS A 16 8.132 9.906 7.066 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.554 8.583 5.264 1.00 0.00 H new ATOM 0 HE1 HIS A 16 12.713 8.686 8.884 1.00 0.00 H new ATOM 0 HE2 HIS A 16 12.612 7.676 6.568 1.00 0.00 H new ATOM 246 N ASN A 17 6.675 11.935 5.026 1.00 0.00 N ATOM 247 CA ASN A 17 5.465 12.733 5.185 1.00 0.00 C ATOM 248 C ASN A 17 4.517 11.894 5.947 1.00 0.00 C ATOM 249 O ASN A 17 4.449 10.697 5.679 1.00 0.00 O ATOM 250 CB ASN A 17 4.874 13.090 3.802 1.00 0.00 C ATOM 251 CG ASN A 17 5.639 14.192 3.047 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.896 14.402 3.359 1.00 0.00 O flip ATOM 253 ND2 ASN A 17 5.068 14.879 2.203 1.00 0.00 N flip ATOM 0 H ASN A 17 6.566 11.131 4.407 1.00 0.00 H new ATOM 0 HA ASN A 17 5.671 13.670 5.702 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.855 12.191 3.186 1.00 0.00 H new ATOM 0 HB3 ASN A 17 3.840 13.408 3.934 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.090 14.699 1.975 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.572 15.629 1.730 1.00 0.00 H new ATOM 260 N GLY A 18 3.834 12.479 6.906 1.00 0.00 N ATOM 261 CA GLY A 18 2.940 11.716 7.755 1.00 0.00 C ATOM 262 C GLY A 18 1.752 11.153 7.012 1.00 0.00 C ATOM 263 O GLY A 18 1.864 10.173 6.265 1.00 0.00 O ATOM 0 H GLY A 18 3.878 13.476 7.119 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.495 10.898 8.214 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.585 12.354 8.565 1.00 0.00 H new ATOM 267 N PHE A 19 0.623 11.755 7.209 1.00 0.00 N ATOM 268 CA PHE A 19 -0.580 11.323 6.542 1.00 0.00 C ATOM 269 C PHE A 19 -1.239 12.535 5.953 1.00 0.00 C ATOM 270 O PHE A 19 -1.707 13.429 6.688 1.00 0.00 O ATOM 271 CB PHE A 19 -1.549 10.595 7.510 1.00 0.00 C ATOM 272 CG PHE A 19 -0.929 9.443 8.263 1.00 0.00 C ATOM 273 CD1 PHE A 19 -0.664 8.243 7.628 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.617 9.562 9.620 1.00 0.00 C ATOM 275 CE1 PHE A 19 -0.100 7.193 8.319 1.00 0.00 C ATOM 276 CE2 PHE A 19 -0.055 8.511 10.308 1.00 0.00 C ATOM 277 CZ PHE A 19 0.199 7.323 9.657 1.00 0.00 C ATOM 0 H PHE A 19 0.501 12.555 7.830 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.322 10.606 5.762 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.936 11.317 8.229 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.401 10.224 6.941 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.901 8.128 6.581 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.819 10.490 10.135 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.109 6.264 7.809 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.186 8.617 11.355 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.633 6.494 10.196 1.00 0.00 H new ATOM 287 N ASP A 20 -1.273 12.617 4.649 1.00 0.00 N ATOM 288 CA ASP A 20 -1.807 13.768 3.994 1.00 0.00 C ATOM 289 C ASP A 20 -3.294 13.657 4.016 1.00 0.00 C ATOM 290 O ASP A 20 -3.862 12.705 3.457 1.00 0.00 O ATOM 291 CB ASP A 20 -1.274 13.857 2.553 1.00 0.00 C ATOM 292 CG ASP A 20 0.238 13.932 2.509 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.807 14.915 3.048 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.869 13.027 1.933 1.00 0.00 O ATOM 0 H ASP A 20 -0.932 11.890 4.020 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.500 14.680 4.507 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.610 12.987 1.988 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.695 14.736 2.065 1.00 0.00 H new ATOM 299 N PHE A 21 -3.922 14.604 4.664 1.00 0.00 N ATOM 300 CA PHE A 21 -5.334 14.530 4.924 1.00 0.00 C ATOM 301 C PHE A 21 -6.132 14.592 3.655 1.00 0.00 C ATOM 302 O PHE A 21 -7.100 13.918 3.546 1.00 0.00 O ATOM 303 CB PHE A 21 -5.779 15.602 5.883 1.00 0.00 C ATOM 304 CG PHE A 21 -7.164 15.372 6.419 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.406 14.332 7.300 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.213 16.178 6.038 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.669 14.099 7.788 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.484 15.953 6.526 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.714 14.913 7.407 1.00 0.00 C ATOM 0 H PHE A 21 -3.470 15.444 5.024 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.520 13.563 5.392 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.077 15.652 6.715 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.746 16.568 5.380 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.590 13.695 7.608 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.040 16.993 5.351 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.843 13.279 8.469 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.300 16.590 6.219 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.707 14.739 7.795 1.00 0.00 H new ATOM 319 N ALA A 22 -5.684 15.397 2.701 1.00 0.00 N ATOM 320 CA ALA A 22 -6.331 15.534 1.398 1.00 0.00 C ATOM 321 C ALA A 22 -6.584 14.174 0.750 1.00 0.00 C ATOM 322 O ALA A 22 -7.701 13.884 0.342 1.00 0.00 O ATOM 323 CB ALA A 22 -5.506 16.420 0.476 1.00 0.00 C ATOM 0 H ALA A 22 -4.854 15.980 2.808 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.299 16.009 1.561 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.007 16.508 -0.488 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.400 17.409 0.921 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.520 15.978 0.334 1.00 0.00 H new ATOM 329 N VAL A 23 -5.560 13.335 0.714 1.00 0.00 N ATOM 330 CA VAL A 23 -5.670 11.998 0.126 1.00 0.00 C ATOM 331 C VAL A 23 -6.707 11.173 0.889 1.00 0.00 C ATOM 332 O VAL A 23 -7.675 10.648 0.293 1.00 0.00 O ATOM 333 CB VAL A 23 -4.309 11.254 0.166 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.415 9.880 -0.487 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.222 12.072 -0.503 1.00 0.00 C ATOM 0 H VAL A 23 -4.636 13.553 1.086 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.977 12.117 -0.913 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.040 11.116 1.213 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.447 9.381 -0.445 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.155 9.281 0.044 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.719 9.994 -1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.279 11.527 -0.461 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.491 12.252 -1.544 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.114 13.025 0.014 1.00 0.00 H new ATOM 345 N ILE A 24 -6.483 11.068 2.199 1.00 0.00 N ATOM 346 CA ILE A 24 -7.394 10.342 3.110 1.00 0.00 C ATOM 347 C ILE A 24 -8.855 10.810 2.891 1.00 0.00 C ATOM 348 O ILE A 24 -9.775 10.006 2.726 1.00 0.00 O ATOM 349 CB ILE A 24 -7.013 10.608 4.605 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.578 10.164 4.936 1.00 0.00 C ATOM 351 CG2 ILE A 24 -8.007 9.976 5.571 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.287 8.695 4.703 1.00 0.00 C ATOM 0 H ILE A 24 -5.673 11.478 2.665 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.302 9.278 2.892 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.059 11.689 4.736 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.885 10.755 4.337 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.375 10.397 5.981 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.702 10.187 6.596 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.999 10.391 5.395 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -8.032 8.898 5.414 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.251 8.483 4.966 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.949 8.090 5.322 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.452 8.454 3.653 1.00 0.00 H new ATOM 364 N LYS A 25 -9.009 12.110 2.867 1.00 0.00 N ATOM 365 CA LYS A 25 -10.248 12.816 2.692 1.00 0.00 C ATOM 366 C LYS A 25 -10.927 12.384 1.401 1.00 0.00 C ATOM 367 O LYS A 25 -12.080 11.984 1.420 1.00 0.00 O ATOM 368 CB LYS A 25 -9.916 14.306 2.651 1.00 0.00 C ATOM 369 CG LYS A 25 -11.060 15.279 2.463 1.00 0.00 C ATOM 370 CD LYS A 25 -10.507 16.705 2.262 1.00 0.00 C ATOM 371 CE LYS A 25 -9.842 16.899 0.879 1.00 0.00 C ATOM 372 NZ LYS A 25 -10.802 16.757 -0.245 1.00 0.00 N ATOM 0 H LYS A 25 -8.217 12.743 2.977 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.935 12.599 3.510 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.408 14.562 3.581 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.202 14.468 1.843 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.660 14.987 1.601 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.718 15.253 3.332 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.319 17.424 2.374 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.779 16.921 3.044 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.383 17.887 0.837 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.040 16.170 0.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.348 17.061 -1.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.093 15.762 -0.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.638 17.349 -0.064 1.00 0.00 H new ATOM 386 N GLU A 26 -10.198 12.420 0.300 1.00 0.00 N ATOM 387 CA GLU A 26 -10.745 12.047 -0.995 1.00 0.00 C ATOM 388 C GLU A 26 -11.161 10.579 -1.043 1.00 0.00 C ATOM 389 O GLU A 26 -12.297 10.263 -1.431 1.00 0.00 O ATOM 390 CB GLU A 26 -9.760 12.324 -2.127 1.00 0.00 C ATOM 391 CG GLU A 26 -9.410 13.771 -2.335 1.00 0.00 C ATOM 392 CD GLU A 26 -8.475 13.938 -3.493 1.00 0.00 C ATOM 393 OE1 GLU A 26 -8.951 14.030 -4.649 1.00 0.00 O ATOM 394 OE2 GLU A 26 -7.258 13.977 -3.280 1.00 0.00 O ATOM 0 H GLU A 26 -9.219 12.706 0.276 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.631 12.666 -1.134 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -8.842 11.770 -1.931 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.178 11.932 -3.054 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.319 14.347 -2.511 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.950 14.171 -1.431 1.00 0.00 H new ATOM 401 N LEU A 27 -10.253 9.689 -0.660 1.00 0.00 N ATOM 402 CA LEU A 27 -10.527 8.267 -0.738 1.00 0.00 C ATOM 403 C LEU A 27 -11.666 7.893 0.229 1.00 0.00 C ATOM 404 O LEU A 27 -12.476 7.047 -0.073 1.00 0.00 O ATOM 405 CB LEU A 27 -9.254 7.416 -0.511 1.00 0.00 C ATOM 406 CG LEU A 27 -9.363 5.940 -0.895 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.832 5.801 -2.314 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.025 5.231 -0.710 1.00 0.00 C ATOM 0 H LEU A 27 -9.330 9.928 -0.296 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.859 8.037 -1.750 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.437 7.860 -1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.981 7.479 0.542 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.094 5.471 -0.236 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.904 4.744 -2.571 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.811 6.268 -2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.122 6.289 -2.981 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.127 4.182 -0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.273 5.703 -1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.718 5.300 0.334 1.00 0.00 H new ATOM 420 N LYS A 28 -11.755 8.589 1.361 1.00 0.00 N ATOM 421 CA LYS A 28 -12.856 8.389 2.316 1.00 0.00 C ATOM 422 C LYS A 28 -14.165 8.886 1.704 1.00 0.00 C ATOM 423 O LYS A 28 -15.243 8.319 1.947 1.00 0.00 O ATOM 424 CB LYS A 28 -12.619 9.139 3.637 1.00 0.00 C ATOM 425 CG LYS A 28 -13.694 8.852 4.677 1.00 0.00 C ATOM 426 CD LYS A 28 -13.539 9.668 5.948 1.00 0.00 C ATOM 427 CE LYS A 28 -12.256 9.366 6.699 1.00 0.00 C ATOM 428 NZ LYS A 28 -12.201 10.120 7.962 1.00 0.00 N ATOM 0 H LYS A 28 -11.079 9.299 1.644 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.908 7.322 2.530 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.646 8.859 4.040 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.586 10.211 3.441 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.673 9.054 4.242 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.670 7.792 4.930 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -13.564 10.728 5.697 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -14.389 9.475 6.602 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -12.192 8.297 6.905 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -11.397 9.623 6.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -11.315 9.899 8.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.239 11.139 7.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -13.010 9.855 8.560 1.00 0.00 H new ATOM 442 N THR A 29 -14.074 9.941 0.923 1.00 0.00 N ATOM 443 CA THR A 29 -15.228 10.499 0.269 1.00 0.00 C ATOM 444 C THR A 29 -15.774 9.490 -0.745 1.00 0.00 C ATOM 445 O THR A 29 -16.937 9.080 -0.652 1.00 0.00 O ATOM 446 CB THR A 29 -14.911 11.857 -0.406 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.443 12.785 0.594 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.145 12.429 -1.069 1.00 0.00 C ATOM 0 H THR A 29 -13.201 10.431 0.727 1.00 0.00 H new ATOM 0 HA THR A 29 -15.990 10.698 1.023 1.00 0.00 H new ATOM 0 HB THR A 29 -14.146 11.698 -1.166 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.524 12.557 0.847 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.898 13.382 -1.536 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.505 11.735 -1.829 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.922 12.582 -0.320 1.00 0.00 H new ATOM 456 N ALA A 30 -14.915 9.042 -1.673 1.00 0.00 N ATOM 457 CA ALA A 30 -15.277 8.051 -2.644 1.00 0.00 C ATOM 458 C ALA A 30 -15.741 6.781 -1.960 1.00 0.00 C ATOM 459 O ALA A 30 -16.638 6.144 -2.421 1.00 0.00 O ATOM 460 CB ALA A 30 -14.105 7.759 -3.552 1.00 0.00 C ATOM 0 H ALA A 30 -13.953 9.370 -1.754 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.099 8.439 -3.245 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.392 7.005 -4.285 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.808 8.672 -4.068 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.269 7.389 -2.959 1.00 0.00 H new ATOM 466 N ALA A 31 -15.115 6.433 -0.873 1.00 0.00 N ATOM 467 CA ALA A 31 -15.505 5.285 -0.089 1.00 0.00 C ATOM 468 C ALA A 31 -16.983 5.372 0.316 1.00 0.00 C ATOM 469 O ALA A 31 -17.720 4.434 0.146 1.00 0.00 O ATOM 470 CB ALA A 31 -14.698 5.266 1.157 1.00 0.00 C ATOM 0 H ALA A 31 -14.312 6.939 -0.498 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.346 4.388 -0.688 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.981 4.404 1.761 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.640 5.200 0.904 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.880 6.180 1.722 1.00 0.00 H new ATOM 476 N SER A 32 -17.397 6.537 0.772 1.00 0.00 N ATOM 477 CA SER A 32 -18.735 6.743 1.318 1.00 0.00 C ATOM 478 C SER A 32 -19.779 6.982 0.209 1.00 0.00 C ATOM 479 O SER A 32 -20.963 6.691 0.375 1.00 0.00 O ATOM 480 CB SER A 32 -18.678 7.950 2.264 1.00 0.00 C ATOM 481 OG SER A 32 -17.600 7.792 3.209 1.00 0.00 O ATOM 0 H SER A 32 -16.816 7.375 0.777 1.00 0.00 H new ATOM 0 HA SER A 32 -19.045 5.845 1.853 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.536 8.865 1.689 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.625 8.050 2.795 1.00 0.00 H new ATOM 0 HG SER A 32 -16.742 7.899 2.748 1.00 0.00 H new ATOM 487 N GLN A 33 -19.334 7.536 -0.892 1.00 0.00 N ATOM 488 CA GLN A 33 -20.212 7.873 -2.017 1.00 0.00 C ATOM 489 C GLN A 33 -20.281 6.752 -3.059 1.00 0.00 C ATOM 490 O GLN A 33 -21.344 6.253 -3.417 1.00 0.00 O ATOM 491 CB GLN A 33 -19.662 9.110 -2.711 1.00 0.00 C ATOM 492 CG GLN A 33 -19.686 10.374 -1.919 1.00 0.00 C ATOM 493 CD GLN A 33 -21.047 10.952 -1.870 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.841 10.671 -0.972 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.344 11.732 -2.858 1.00 0.00 N ATOM 0 H GLN A 33 -18.354 7.772 -1.047 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.212 8.035 -1.614 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.632 8.909 -3.004 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.229 9.269 -3.628 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.335 10.177 -0.906 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.998 11.095 -2.360 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.648 11.933 -3.576 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.274 12.147 -2.919 1.00 0.00 H new ATOM 504 N TYR A 34 -19.116 6.373 -3.495 1.00 0.00 N ATOM 505 CA TYR A 34 -18.890 5.530 -4.637 1.00 0.00 C ATOM 506 C TYR A 34 -18.788 4.069 -4.254 1.00 0.00 C ATOM 507 O TYR A 34 -19.385 3.206 -4.900 1.00 0.00 O ATOM 508 CB TYR A 34 -17.605 6.061 -5.330 1.00 0.00 C ATOM 509 CG TYR A 34 -17.867 7.295 -6.162 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.789 8.564 -5.608 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.208 7.183 -7.494 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.056 9.692 -6.366 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.472 8.297 -8.260 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.388 9.542 -7.698 1.00 0.00 C ATOM 515 OH TYR A 34 -18.655 10.640 -8.462 1.00 0.00 O ATOM 0 H TYR A 34 -18.249 6.658 -3.040 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.734 5.572 -5.325 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.855 6.289 -4.573 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.189 5.279 -5.965 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.516 8.674 -4.569 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -18.269 6.203 -7.945 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -18.005 10.675 -5.922 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.744 8.188 -9.300 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.870 10.358 -9.376 1.00 0.00 H new ATOM 525 N GLY A 35 -18.095 3.795 -3.168 1.00 0.00 N ATOM 526 CA GLY A 35 -17.875 2.431 -2.761 1.00 0.00 C ATOM 527 C GLY A 35 -16.704 1.854 -3.494 1.00 0.00 C ATOM 528 O GLY A 35 -16.378 2.308 -4.599 1.00 0.00 O ATOM 0 H GLY A 35 -17.678 4.497 -2.557 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.697 2.389 -1.686 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.767 1.836 -2.960 1.00 0.00 H new ATOM 532 N ALA A 36 -16.102 0.839 -2.955 1.00 0.00 N ATOM 533 CA ALA A 36 -14.947 0.289 -3.581 1.00 0.00 C ATOM 534 C ALA A 36 -15.390 -0.663 -4.685 1.00 0.00 C ATOM 535 O ALA A 36 -15.671 -1.807 -4.441 1.00 0.00 O ATOM 536 CB ALA A 36 -14.049 -0.366 -2.569 1.00 0.00 C ATOM 0 H ALA A 36 -16.390 0.380 -2.091 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.354 1.082 -4.037 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.174 -0.778 -3.072 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.730 0.372 -1.833 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.590 -1.168 -2.067 1.00 0.00 H new ATOM 542 N THR A 37 -15.417 -0.134 -5.897 1.00 0.00 N ATOM 543 CA THR A 37 -15.924 -0.765 -7.086 1.00 0.00 C ATOM 544 C THR A 37 -15.974 0.242 -8.193 1.00 0.00 C ATOM 545 O THR A 37 -15.625 -0.067 -9.312 1.00 0.00 O ATOM 546 CB THR A 37 -17.291 -1.520 -6.887 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.022 -2.885 -6.582 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.219 -1.452 -8.092 1.00 0.00 C ATOM 0 H THR A 37 -15.062 0.805 -6.079 1.00 0.00 H new ATOM 0 HA THR A 37 -15.231 -1.562 -7.356 1.00 0.00 H new ATOM 0 HB THR A 37 -17.810 -1.017 -6.071 1.00 0.00 H new ATOM 0 HG1 THR A 37 -16.697 -2.956 -5.660 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.138 -1.996 -7.875 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.456 -0.411 -8.310 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.728 -1.901 -8.955 1.00 0.00 H new ATOM 556 N ALA A 38 -16.333 1.461 -7.851 1.00 0.00 N ATOM 557 CA ALA A 38 -16.371 2.531 -8.814 1.00 0.00 C ATOM 558 C ALA A 38 -14.942 2.827 -9.259 1.00 0.00 C ATOM 559 O ALA A 38 -14.064 2.988 -8.401 1.00 0.00 O ATOM 560 CB ALA A 38 -16.996 3.757 -8.190 1.00 0.00 C ATOM 0 H ALA A 38 -16.604 1.733 -6.906 1.00 0.00 H new ATOM 0 HA ALA A 38 -16.971 2.244 -9.677 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.023 4.564 -8.922 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.011 3.524 -7.869 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.405 4.068 -7.328 1.00 0.00 H new ATOM 566 N PRO A 39 -14.682 2.886 -10.589 1.00 0.00 N ATOM 567 CA PRO A 39 -13.326 3.082 -11.162 1.00 0.00 C ATOM 568 C PRO A 39 -12.575 4.263 -10.549 1.00 0.00 C ATOM 569 O PRO A 39 -11.338 4.298 -10.547 1.00 0.00 O ATOM 570 CB PRO A 39 -13.610 3.358 -12.624 1.00 0.00 C ATOM 571 CG PRO A 39 -14.857 2.623 -12.905 1.00 0.00 C ATOM 572 CD PRO A 39 -15.688 2.740 -11.666 1.00 0.00 C ATOM 0 HA PRO A 39 -12.687 2.219 -10.975 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.728 4.425 -12.810 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.794 3.012 -13.259 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.375 3.047 -13.765 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.651 1.579 -13.140 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.356 3.600 -11.710 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.312 1.859 -11.516 1.00 0.00 H new ATOM 580 N TYR A 40 -13.336 5.220 -10.067 1.00 0.00 N ATOM 581 CA TYR A 40 -12.807 6.378 -9.399 1.00 0.00 C ATOM 582 C TYR A 40 -11.976 5.982 -8.157 1.00 0.00 C ATOM 583 O TYR A 40 -10.753 6.131 -8.153 1.00 0.00 O ATOM 584 CB TYR A 40 -13.947 7.339 -9.009 1.00 0.00 C ATOM 585 CG TYR A 40 -13.482 8.620 -8.335 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.806 9.586 -9.056 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.705 8.857 -6.985 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.368 10.744 -8.459 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.265 10.025 -6.380 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.603 10.961 -7.127 1.00 0.00 C ATOM 591 OH TYR A 40 -12.174 12.126 -6.548 1.00 0.00 O ATOM 0 H TYR A 40 -14.354 5.211 -10.131 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.140 6.891 -10.092 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.511 7.598 -9.905 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.633 6.818 -8.340 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -12.618 9.428 -10.108 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.230 8.119 -6.396 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -11.838 11.484 -9.041 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.443 10.194 -5.328 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.418 12.129 -5.599 1.00 0.00 H new ATOM 601 N THR A 41 -12.641 5.458 -7.102 1.00 0.00 N ATOM 602 CA THR A 41 -12.004 5.127 -5.827 1.00 0.00 C ATOM 603 C THR A 41 -10.822 4.157 -5.949 1.00 0.00 C ATOM 604 O THR A 41 -9.781 4.399 -5.354 1.00 0.00 O ATOM 605 CB THR A 41 -13.045 4.628 -4.781 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.478 4.538 -3.483 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.608 3.293 -5.148 1.00 0.00 C ATOM 0 H THR A 41 -13.640 5.255 -7.122 1.00 0.00 H new ATOM 0 HA THR A 41 -11.575 6.062 -5.467 1.00 0.00 H new ATOM 0 HB THR A 41 -13.847 5.366 -4.778 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.157 4.224 -2.850 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.329 2.982 -4.392 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.103 3.361 -6.117 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.802 2.561 -5.203 1.00 0.00 H new ATOM 615 N LEU A 42 -10.937 3.101 -6.753 1.00 0.00 N ATOM 616 CA LEU A 42 -9.828 2.180 -6.820 1.00 0.00 C ATOM 617 C LEU A 42 -8.661 2.708 -7.590 1.00 0.00 C ATOM 618 O LEU A 42 -7.541 2.333 -7.315 1.00 0.00 O ATOM 619 CB LEU A 42 -10.139 0.659 -7.031 1.00 0.00 C ATOM 620 CG LEU A 42 -11.242 0.209 -8.008 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.596 0.447 -7.408 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.119 0.886 -9.367 1.00 0.00 C ATOM 0 H LEU A 42 -11.745 2.877 -7.334 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.507 2.144 -5.779 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.212 0.184 -7.353 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.387 0.244 -6.054 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.115 -0.860 -8.178 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.366 0.125 -8.109 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.688 -0.120 -6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.719 1.509 -7.197 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.918 0.537 -10.021 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.197 1.966 -9.244 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.154 0.640 -9.810 1.00 0.00 H new ATOM 634 N ALA A 43 -8.916 3.659 -8.481 1.00 0.00 N ATOM 635 CA ALA A 43 -7.840 4.349 -9.172 1.00 0.00 C ATOM 636 C ALA A 43 -7.049 5.163 -8.184 1.00 0.00 C ATOM 637 O ALA A 43 -5.829 5.321 -8.301 1.00 0.00 O ATOM 638 CB ALA A 43 -8.348 5.238 -10.276 1.00 0.00 C ATOM 0 H ALA A 43 -9.854 3.967 -8.739 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.204 3.593 -9.632 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.506 5.732 -10.762 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.888 4.637 -11.008 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.018 5.990 -9.859 1.00 0.00 H new ATOM 644 N ILE A 44 -7.739 5.652 -7.189 1.00 0.00 N ATOM 645 CA ILE A 44 -7.105 6.404 -6.127 1.00 0.00 C ATOM 646 C ILE A 44 -6.280 5.445 -5.254 1.00 0.00 C ATOM 647 O ILE A 44 -5.138 5.744 -4.944 1.00 0.00 O ATOM 648 CB ILE A 44 -8.146 7.159 -5.295 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.998 8.011 -6.235 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.472 8.033 -4.224 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.239 8.573 -5.601 1.00 0.00 C ATOM 0 H ILE A 44 -8.748 5.545 -7.087 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.439 7.150 -6.560 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.780 6.443 -4.772 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.391 8.834 -6.612 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.285 7.407 -7.096 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.235 8.557 -3.649 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.884 7.402 -3.557 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.818 8.760 -4.706 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.787 9.165 -6.335 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.870 7.756 -5.250 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.962 9.206 -4.758 1.00 0.00 H new ATOM 663 N VAL A 45 -6.849 4.250 -4.944 1.00 0.00 N ATOM 664 CA VAL A 45 -6.140 3.194 -4.174 1.00 0.00 C ATOM 665 C VAL A 45 -4.794 2.894 -4.896 1.00 0.00 C ATOM 666 O VAL A 45 -3.712 2.844 -4.279 1.00 0.00 O ATOM 667 CB VAL A 45 -7.029 1.859 -4.048 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.301 0.724 -3.308 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.372 2.121 -3.342 1.00 0.00 C ATOM 0 H VAL A 45 -7.798 3.994 -5.216 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.955 3.545 -3.159 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.212 1.546 -5.076 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.950 -0.150 -3.254 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.388 0.466 -3.845 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.048 1.051 -2.299 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.938 1.191 -3.280 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.187 2.501 -2.337 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.943 2.856 -3.908 1.00 0.00 H new ATOM 679 N GLU A 46 -4.865 2.834 -6.223 1.00 0.00 N ATOM 680 CA GLU A 46 -3.709 2.551 -7.055 1.00 0.00 C ATOM 681 C GLU A 46 -2.733 3.723 -7.101 1.00 0.00 C ATOM 682 O GLU A 46 -1.530 3.515 -7.108 1.00 0.00 O ATOM 683 CB GLU A 46 -4.131 2.132 -8.462 1.00 0.00 C ATOM 684 CG GLU A 46 -5.114 0.983 -8.452 1.00 0.00 C ATOM 685 CD GLU A 46 -5.386 0.398 -9.799 1.00 0.00 C ATOM 686 OE1 GLU A 46 -4.544 -0.343 -10.320 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.463 0.652 -10.369 1.00 0.00 O ATOM 0 H GLU A 46 -5.727 2.981 -6.748 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.183 1.714 -6.595 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.578 2.985 -8.973 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.248 1.846 -9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.732 0.199 -7.798 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.054 1.328 -8.021 1.00 0.00 H new ATOM 694 N SER A 47 -3.261 4.939 -7.087 1.00 0.00 N ATOM 695 CA SER A 47 -2.441 6.147 -7.129 1.00 0.00 C ATOM 696 C SER A 47 -1.713 6.374 -5.794 1.00 0.00 C ATOM 697 O SER A 47 -0.583 6.888 -5.763 1.00 0.00 O ATOM 698 CB SER A 47 -3.291 7.366 -7.491 1.00 0.00 C ATOM 699 OG SER A 47 -3.948 7.170 -8.749 1.00 0.00 O ATOM 0 H SER A 47 -4.264 5.118 -7.046 1.00 0.00 H new ATOM 0 HA SER A 47 -1.686 6.009 -7.903 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.032 7.543 -6.712 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.661 8.254 -7.539 1.00 0.00 H new ATOM 0 HG SER A 47 -4.527 6.381 -8.696 1.00 0.00 H new ATOM 705 N VAL A 48 -2.339 5.971 -4.692 1.00 0.00 N ATOM 706 CA VAL A 48 -1.708 6.133 -3.395 1.00 0.00 C ATOM 707 C VAL A 48 -0.560 5.129 -3.270 1.00 0.00 C ATOM 708 O VAL A 48 0.451 5.396 -2.677 1.00 0.00 O ATOM 709 CB VAL A 48 -2.711 5.974 -2.211 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.036 6.257 -0.884 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.897 6.897 -2.375 1.00 0.00 C ATOM 0 H VAL A 48 -3.263 5.539 -4.673 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.324 7.151 -3.333 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.060 4.941 -2.220 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.758 6.139 -0.076 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.212 5.559 -0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.652 7.277 -0.881 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.580 6.765 -1.536 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.552 7.931 -2.403 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.415 6.662 -3.305 1.00 0.00 H new ATOM 721 N ALA A 49 -0.719 3.994 -3.887 1.00 0.00 N ATOM 722 CA ALA A 49 0.360 3.021 -3.904 1.00 0.00 C ATOM 723 C ALA A 49 1.293 3.279 -5.076 1.00 0.00 C ATOM 724 O ALA A 49 2.261 2.571 -5.276 1.00 0.00 O ATOM 725 CB ALA A 49 -0.186 1.600 -3.927 1.00 0.00 C ATOM 0 H ALA A 49 -1.566 3.713 -4.380 1.00 0.00 H new ATOM 0 HA ALA A 49 0.938 3.132 -2.986 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.643 0.892 -3.939 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.795 1.430 -3.039 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.797 1.459 -4.819 1.00 0.00 H new ATOM 731 N ASP A 50 0.997 4.314 -5.844 1.00 0.00 N ATOM 732 CA ASP A 50 1.804 4.651 -7.007 1.00 0.00 C ATOM 733 C ASP A 50 2.864 5.661 -6.592 1.00 0.00 C ATOM 734 O ASP A 50 3.668 6.159 -7.390 1.00 0.00 O ATOM 735 CB ASP A 50 0.913 5.205 -8.122 1.00 0.00 C ATOM 736 CG ASP A 50 1.592 5.271 -9.462 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.850 4.186 -10.080 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.818 6.389 -9.973 1.00 0.00 O ATOM 0 H ASP A 50 0.204 4.936 -5.684 1.00 0.00 H new ATOM 0 HA ASP A 50 2.298 3.759 -7.393 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.022 4.582 -8.206 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.578 6.205 -7.845 1.00 0.00 H new ATOM 743 N ASN A 51 2.845 5.968 -5.335 1.00 0.00 N ATOM 744 CA ASN A 51 3.825 6.821 -4.727 1.00 0.00 C ATOM 745 C ASN A 51 4.454 6.042 -3.609 1.00 0.00 C ATOM 746 O ASN A 51 4.019 4.937 -3.334 1.00 0.00 O ATOM 747 CB ASN A 51 3.240 8.171 -4.264 1.00 0.00 C ATOM 748 CG ASN A 51 2.276 8.115 -3.099 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.670 8.165 -1.948 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.007 8.090 -3.391 1.00 0.00 N ATOM 0 H ASN A 51 2.135 5.628 -4.686 1.00 0.00 H new ATOM 0 HA ASN A 51 4.583 7.102 -5.459 1.00 0.00 H new ATOM 0 HB2 ASN A 51 4.066 8.828 -3.994 1.00 0.00 H new ATOM 0 HB3 ASN A 51 2.730 8.632 -5.110 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.312 8.112 -2.645 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.709 8.048 -4.365 1.00 0.00 H new ATOM 757 N TRP A 52 5.460 6.564 -2.993 1.00 0.00 N ATOM 758 CA TRP A 52 6.198 5.811 -2.021 1.00 0.00 C ATOM 759 C TRP A 52 5.573 5.935 -0.662 1.00 0.00 C ATOM 760 O TRP A 52 5.327 7.038 -0.184 1.00 0.00 O ATOM 761 CB TRP A 52 7.619 6.295 -1.991 1.00 0.00 C ATOM 762 CG TRP A 52 8.257 6.320 -3.331 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.836 5.284 -4.009 1.00 0.00 C ATOM 764 CD2 TRP A 52 8.390 7.456 -4.144 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.328 5.735 -5.212 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.064 7.074 -5.308 1.00 0.00 C ATOM 767 CE3 TRP A 52 8.001 8.782 -3.984 1.00 0.00 C ATOM 768 CZ2 TRP A 52 9.354 7.983 -6.311 1.00 0.00 C ATOM 769 CZ3 TRP A 52 8.294 9.676 -4.964 1.00 0.00 C ATOM 770 CH2 TRP A 52 8.966 9.276 -6.112 1.00 0.00 C ATOM 0 H TRP A 52 5.796 7.515 -3.143 1.00 0.00 H new ATOM 0 HA TRP A 52 6.181 4.758 -2.301 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.645 7.298 -1.564 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.201 5.652 -1.331 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.898 4.266 -3.654 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.807 5.169 -5.912 1.00 0.00 H new ATOM 0 HE3 TRP A 52 7.474 9.096 -3.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.866 7.681 -7.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.001 10.709 -4.849 1.00 0.00 H new ATOM 0 HH2 TRP A 52 9.188 10.011 -6.871 1.00 0.00 H new ATOM 781 N LEU A 53 5.293 4.821 -0.063 1.00 0.00 N ATOM 782 CA LEU A 53 4.679 4.780 1.228 1.00 0.00 C ATOM 783 C LEU A 53 5.062 3.495 1.952 1.00 0.00 C ATOM 784 O LEU A 53 5.591 2.552 1.346 1.00 0.00 O ATOM 785 CB LEU A 53 3.134 4.938 1.126 1.00 0.00 C ATOM 786 CG LEU A 53 2.275 3.775 0.582 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.833 4.210 0.550 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.717 3.304 -0.798 1.00 0.00 C ATOM 0 H LEU A 53 5.487 3.902 -0.461 1.00 0.00 H new ATOM 0 HA LEU A 53 5.048 5.624 1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.765 5.175 2.124 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.937 5.808 0.499 1.00 0.00 H new ATOM 0 HG LEU A 53 2.404 2.924 1.250 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.216 3.397 0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.508 4.468 1.558 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.730 5.080 -0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.076 2.486 -1.126 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.642 4.130 -1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.750 2.959 -0.751 1.00 0.00 H new ATOM 800 N THR A 54 4.795 3.447 3.210 1.00 0.00 N ATOM 801 CA THR A 54 5.157 2.321 4.016 1.00 0.00 C ATOM 802 C THR A 54 3.885 1.552 4.395 1.00 0.00 C ATOM 803 O THR A 54 2.772 2.054 4.156 1.00 0.00 O ATOM 804 CB THR A 54 5.887 2.796 5.307 1.00 0.00 C ATOM 805 OG1 THR A 54 5.030 3.647 6.083 1.00 0.00 O ATOM 806 CG2 THR A 54 7.171 3.544 4.963 1.00 0.00 C ATOM 0 H THR A 54 4.316 4.191 3.718 1.00 0.00 H new ATOM 0 HA THR A 54 5.830 1.674 3.453 1.00 0.00 H new ATOM 0 HB THR A 54 6.141 1.912 5.891 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.846 4.470 5.583 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.662 3.865 5.882 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.838 2.885 4.406 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.932 4.417 4.355 1.00 0.00 H new ATOM 814 N PRO A 55 4.006 0.321 4.963 1.00 0.00 N ATOM 815 CA PRO A 55 2.857 -0.448 5.472 1.00 0.00 C ATOM 816 C PRO A 55 2.052 0.363 6.508 1.00 0.00 C ATOM 817 O PRO A 55 0.867 0.110 6.726 1.00 0.00 O ATOM 818 CB PRO A 55 3.519 -1.661 6.145 1.00 0.00 C ATOM 819 CG PRO A 55 4.777 -1.836 5.389 1.00 0.00 C ATOM 820 CD PRO A 55 5.250 -0.450 5.086 1.00 0.00 C ATOM 0 HA PRO A 55 2.149 -0.714 4.687 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.709 -1.478 7.203 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.888 -2.547 6.083 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.515 -2.384 5.974 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.610 -2.404 4.474 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.886 -0.061 5.881 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.834 -0.418 4.166 1.00 0.00 H new ATOM 828 N THR A 56 2.720 1.330 7.123 1.00 0.00 N ATOM 829 CA THR A 56 2.132 2.228 8.091 1.00 0.00 C ATOM 830 C THR A 56 1.090 3.130 7.392 1.00 0.00 C ATOM 831 O THR A 56 -0.059 3.270 7.853 1.00 0.00 O ATOM 832 CB THR A 56 3.247 3.104 8.676 1.00 0.00 C ATOM 833 OG1 THR A 56 4.389 2.268 8.985 1.00 0.00 O ATOM 834 CG2 THR A 56 2.786 3.812 9.937 1.00 0.00 C ATOM 0 H THR A 56 3.710 1.511 6.954 1.00 0.00 H new ATOM 0 HA THR A 56 1.642 1.659 8.881 1.00 0.00 H new ATOM 0 HB THR A 56 3.516 3.861 7.940 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.107 2.820 9.358 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.598 4.425 10.328 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.931 4.447 9.706 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.497 3.073 10.684 1.00 0.00 H new ATOM 842 N ASP A 57 1.501 3.706 6.263 1.00 0.00 N ATOM 843 CA ASP A 57 0.620 4.556 5.435 1.00 0.00 C ATOM 844 C ASP A 57 -0.525 3.711 4.931 1.00 0.00 C ATOM 845 O ASP A 57 -1.698 4.094 5.017 1.00 0.00 O ATOM 846 CB ASP A 57 1.370 5.109 4.219 1.00 0.00 C ATOM 847 CG ASP A 57 2.561 5.975 4.563 1.00 0.00 C ATOM 848 OD1 ASP A 57 3.662 5.423 4.787 1.00 0.00 O ATOM 849 OD2 ASP A 57 2.436 7.208 4.596 1.00 0.00 O ATOM 0 H ASP A 57 2.445 3.603 5.891 1.00 0.00 H new ATOM 0 HA ASP A 57 0.268 5.388 6.045 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.708 4.274 3.605 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.676 5.691 3.612 1.00 0.00 H new ATOM 854 N TRP A 58 -0.155 2.540 4.437 1.00 0.00 N ATOM 855 CA TRP A 58 -1.066 1.536 3.937 1.00 0.00 C ATOM 856 C TRP A 58 -2.199 1.233 4.920 1.00 0.00 C ATOM 857 O TRP A 58 -3.404 1.467 4.627 1.00 0.00 O ATOM 858 CB TRP A 58 -0.280 0.247 3.653 1.00 0.00 C ATOM 859 CG TRP A 58 0.262 0.113 2.276 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.080 0.959 1.215 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.022 -0.983 1.792 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.704 0.463 0.106 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.284 -0.735 0.433 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.513 -2.168 2.377 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.023 -1.603 -0.342 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.245 -3.034 1.584 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.482 -2.750 0.243 1.00 0.00 C ATOM 0 H TRP A 58 0.823 2.258 4.373 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.521 1.924 3.026 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.549 0.186 4.358 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.930 -0.605 3.852 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.476 1.884 1.250 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.733 0.909 -0.811 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.323 -2.394 3.416 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.233 -1.384 -1.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.638 -3.944 2.013 1.00 0.00 H new ATOM 0 HH2 TRP A 58 3.044 -3.455 -0.352 1.00 0.00 H new ATOM 878 N ASN A 59 -1.842 0.719 6.072 1.00 0.00 N ATOM 879 CA ASN A 59 -2.838 0.321 7.057 1.00 0.00 C ATOM 880 C ASN A 59 -3.694 1.463 7.469 1.00 0.00 C ATOM 881 O ASN A 59 -4.854 1.274 7.665 1.00 0.00 O ATOM 882 CB ASN A 59 -2.223 -0.378 8.268 1.00 0.00 C ATOM 883 CG ASN A 59 -1.704 -1.780 7.953 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.219 -2.471 7.044 1.00 0.00 O ATOM 885 ND2 ASN A 59 -0.727 -2.218 8.702 1.00 0.00 N ATOM 0 H ASN A 59 -0.875 0.564 6.357 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.477 -0.411 6.564 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.403 0.229 8.652 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.969 -0.443 9.060 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.355 -3.156 8.557 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.337 -1.621 9.431 1.00 0.00 H new ATOM 892 N THR A 60 -3.115 2.653 7.472 1.00 0.00 N ATOM 893 CA THR A 60 -3.845 3.842 7.848 1.00 0.00 C ATOM 894 C THR A 60 -4.886 4.222 6.768 1.00 0.00 C ATOM 895 O THR A 60 -5.924 4.819 7.068 1.00 0.00 O ATOM 896 CB THR A 60 -2.903 5.010 8.168 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.969 4.574 9.177 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.679 6.201 8.708 1.00 0.00 C ATOM 0 H THR A 60 -2.141 2.816 7.217 1.00 0.00 H new ATOM 0 HA THR A 60 -4.391 3.617 8.764 1.00 0.00 H new ATOM 0 HB THR A 60 -2.389 5.312 7.256 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.137 4.284 8.749 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.989 7.016 8.927 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.404 6.530 7.964 1.00 0.00 H new ATOM 0 HG23 THR A 60 -4.201 5.912 9.620 1.00 0.00 H new ATOM 906 N LEU A 61 -4.645 3.808 5.529 1.00 0.00 N ATOM 907 CA LEU A 61 -5.587 4.045 4.456 1.00 0.00 C ATOM 908 C LEU A 61 -6.820 3.276 4.689 1.00 0.00 C ATOM 909 O LEU A 61 -7.876 3.856 4.835 1.00 0.00 O ATOM 910 CB LEU A 61 -5.066 3.598 3.109 1.00 0.00 C ATOM 911 CG LEU A 61 -3.938 4.362 2.516 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.576 3.761 1.162 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.310 5.829 2.401 1.00 0.00 C ATOM 0 H LEU A 61 -3.802 3.306 5.249 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.760 5.121 4.446 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.756 2.557 3.198 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.896 3.624 2.403 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.062 4.295 3.161 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.749 4.320 0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.281 2.720 1.293 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.439 3.813 0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.478 6.382 1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.188 5.933 1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.531 6.227 3.391 1.00 0.00 H new ATOM 925 N VAL A 62 -6.667 1.946 4.793 1.00 0.00 N ATOM 926 CA VAL A 62 -7.859 1.046 4.897 1.00 0.00 C ATOM 927 C VAL A 62 -8.586 1.439 6.141 1.00 0.00 C ATOM 928 O VAL A 62 -9.814 1.516 6.205 1.00 0.00 O ATOM 929 CB VAL A 62 -7.460 -0.430 5.103 1.00 0.00 C ATOM 930 CG1 VAL A 62 -8.565 -1.362 4.705 1.00 0.00 C ATOM 931 CG2 VAL A 62 -6.183 -0.789 4.425 1.00 0.00 C ATOM 0 H VAL A 62 -5.766 1.468 4.808 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.440 1.141 3.980 1.00 0.00 H new ATOM 0 HB VAL A 62 -7.287 -0.548 6.173 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -8.247 -2.392 4.864 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -9.449 -1.158 5.309 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -8.804 -1.215 3.652 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.957 -1.840 4.607 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -6.280 -0.620 3.353 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.376 -0.171 4.818 1.00 0.00 H new ATOM 941 N ARG A 63 -7.750 1.748 7.089 1.00 0.00 N ATOM 942 CA ARG A 63 -8.119 2.134 8.439 1.00 0.00 C ATOM 943 C ARG A 63 -9.152 3.243 8.436 1.00 0.00 C ATOM 944 O ARG A 63 -10.203 3.121 9.031 1.00 0.00 O ATOM 945 CB ARG A 63 -6.890 2.660 9.149 1.00 0.00 C ATOM 946 CG ARG A 63 -7.026 2.911 10.618 1.00 0.00 C ATOM 947 CD ARG A 63 -7.212 1.629 11.380 1.00 0.00 C ATOM 948 NE ARG A 63 -7.197 1.885 12.819 1.00 0.00 N ATOM 949 CZ ARG A 63 -7.936 1.269 13.716 1.00 0.00 C ATOM 950 NH1 ARG A 63 -8.730 0.273 13.340 1.00 0.00 N ATOM 951 NH2 ARG A 63 -7.852 1.645 15.007 1.00 0.00 N ATOM 0 H ARG A 63 -6.740 1.740 6.944 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.533 1.258 8.938 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.078 1.949 8.998 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.591 3.592 8.669 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.139 3.428 10.984 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.875 3.570 10.799 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.156 1.164 11.097 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.420 0.926 11.121 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.558 2.604 13.157 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.764 -0.010 12.361 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.306 -0.209 14.031 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.221 2.399 15.279 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.419 1.176 15.713 1.00 0.00 H new ATOM 965 N ALA A 64 -8.832 4.311 7.762 1.00 0.00 N ATOM 966 CA ALA A 64 -9.636 5.498 7.766 1.00 0.00 C ATOM 967 C ALA A 64 -10.628 5.555 6.607 1.00 0.00 C ATOM 968 O ALA A 64 -11.832 5.670 6.820 1.00 0.00 O ATOM 969 CB ALA A 64 -8.702 6.703 7.714 1.00 0.00 C ATOM 0 H ALA A 64 -7.993 4.382 7.186 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.235 5.499 8.677 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.291 7.620 7.716 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.045 6.692 8.584 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.102 6.659 6.805 1.00 0.00 H new ATOM 975 N VAL A 65 -10.093 5.506 5.428 1.00 0.00 N ATOM 976 CA VAL A 65 -10.871 5.737 4.195 1.00 0.00 C ATOM 977 C VAL A 65 -12.164 4.886 4.080 1.00 0.00 C ATOM 978 O VAL A 65 -13.241 5.428 3.784 1.00 0.00 O ATOM 979 CB VAL A 65 -10.010 5.647 2.881 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.720 6.446 3.008 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.734 4.202 2.442 1.00 0.00 C ATOM 0 H VAL A 65 -9.106 5.307 5.265 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.199 6.772 4.295 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.610 6.096 2.090 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.148 6.363 2.084 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.958 7.493 3.195 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.129 6.054 3.836 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -9.136 4.207 1.531 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.191 3.680 3.230 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.679 3.692 2.254 1.00 0.00 H new ATOM 991 N LEU A 66 -12.091 3.605 4.406 1.00 0.00 N ATOM 992 CA LEU A 66 -13.239 2.726 4.242 1.00 0.00 C ATOM 993 C LEU A 66 -13.539 1.973 5.535 1.00 0.00 C ATOM 994 O LEU A 66 -12.738 1.990 6.476 1.00 0.00 O ATOM 995 CB LEU A 66 -13.083 1.767 3.012 1.00 0.00 C ATOM 996 CG LEU A 66 -13.931 2.129 1.755 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.553 1.316 0.541 1.00 0.00 C ATOM 998 CD2 LEU A 66 -15.417 1.949 2.049 1.00 0.00 C ATOM 0 H LEU A 66 -11.257 3.154 4.782 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.104 3.352 4.023 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.032 1.745 2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.348 0.758 3.327 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.720 3.174 1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.176 1.611 -0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.505 1.492 0.297 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.704 0.257 0.751 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.997 2.205 1.162 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.611 0.912 2.322 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.706 2.601 2.873 1.00 0.00 H new ATOM 1010 N SER A 67 -14.695 1.352 5.602 1.00 0.00 N ATOM 1011 CA SER A 67 -15.113 0.636 6.806 1.00 0.00 C ATOM 1012 C SER A 67 -16.180 -0.402 6.483 1.00 0.00 C ATOM 1013 O SER A 67 -17.199 -0.073 5.875 1.00 0.00 O ATOM 1014 CB SER A 67 -15.665 1.605 7.862 1.00 0.00 C ATOM 1015 OG SER A 67 -14.714 2.624 8.179 1.00 0.00 O ATOM 0 H SER A 67 -15.371 1.323 4.839 1.00 0.00 H new ATOM 0 HA SER A 67 -14.230 0.135 7.203 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.583 2.063 7.494 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.924 1.053 8.765 1.00 0.00 H new ATOM 0 HG SER A 67 -13.819 2.333 7.905 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.915 -1.632 6.821 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.877 -2.682 6.662 1.00 0.00 C ATOM 1023 C GLY A 68 -16.324 -3.801 5.814 1.00 0.00 C ATOM 1024 O GLY A 68 -15.627 -4.691 6.311 1.00 0.00 O ATOM 0 H GLY A 68 -15.024 -1.934 7.215 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.162 -3.069 7.640 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.781 -2.284 6.201 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.575 -3.704 4.536 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.143 -4.690 3.587 1.00 0.00 C ATOM 1030 C GLY A 69 -14.673 -4.625 3.335 1.00 0.00 C ATOM 1031 O GLY A 69 -14.070 -5.597 2.886 1.00 0.00 O ATOM 0 H GLY A 69 -17.091 -2.928 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.403 -5.683 3.953 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.677 -4.547 2.648 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.106 -3.471 3.617 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.675 -3.177 3.401 1.00 0.00 C ATOM 1037 C ASP A 70 -11.796 -4.316 3.887 1.00 0.00 C ATOM 1038 O ASP A 70 -11.029 -4.911 3.112 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.274 -1.848 4.108 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.296 -1.898 5.648 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.365 -2.130 6.230 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.248 -1.738 6.283 1.00 0.00 O ATOM 0 H ASP A 70 -14.623 -2.685 4.011 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.520 -3.065 2.328 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.272 -1.569 3.783 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.948 -1.059 3.775 1.00 0.00 H new ATOM 1047 N HIS A 71 -12.028 -4.688 5.114 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.273 -5.666 5.810 1.00 0.00 C ATOM 1049 C HIS A 71 -11.374 -7.006 5.083 1.00 0.00 C ATOM 1050 O HIS A 71 -10.359 -7.595 4.711 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.811 -5.763 7.247 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.880 -6.401 8.219 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -9.987 -5.677 8.962 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -10.729 -7.686 8.601 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.330 -6.475 9.757 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.756 -7.703 9.562 1.00 0.00 N ATOM 0 H HIS A 71 -12.785 -4.294 5.673 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.220 -5.388 5.846 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.050 -4.760 7.599 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.743 -6.327 7.234 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -11.272 -8.538 8.221 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -8.564 -6.177 10.458 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -9.416 -8.533 10.048 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.599 -7.436 4.803 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.823 -8.713 4.183 1.00 0.00 C ATOM 1067 C LEU A 72 -12.125 -8.878 2.832 1.00 0.00 C ATOM 1068 O LEU A 72 -11.340 -9.788 2.664 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.327 -9.134 4.199 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.401 -8.169 3.623 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.553 -8.268 2.096 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.741 -8.404 4.302 1.00 0.00 C ATOM 0 H LEU A 72 -13.449 -6.908 5.001 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.321 -9.445 4.815 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.408 -10.075 3.654 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.597 -9.341 5.235 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.053 -7.158 3.835 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.318 -7.568 1.760 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.604 -8.024 1.619 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.845 -9.282 1.824 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.483 -7.721 3.888 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.060 -9.432 4.132 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.642 -8.227 5.373 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.364 -8.019 1.900 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.735 -8.198 0.622 1.00 0.00 C ATOM 1086 C LEU A 73 -10.390 -7.561 0.377 1.00 0.00 C ATOM 1087 O LEU A 73 -9.446 -8.279 0.010 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.682 -8.280 -0.540 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.455 -9.638 -0.601 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -14.498 -9.673 -1.692 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -12.490 -10.801 -0.796 1.00 0.00 C ATOM 0 H LEU A 73 -12.972 -7.205 1.986 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.367 -9.220 0.718 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.400 -7.462 -0.476 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.125 -8.143 -1.467 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.970 -9.735 0.355 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -15.000 -10.640 -1.684 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -15.229 -8.883 -1.522 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.018 -9.521 -2.659 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.050 -11.735 -0.836 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -11.942 -10.667 -1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.787 -10.834 0.036 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.276 -6.231 0.586 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.990 -5.546 0.485 1.00 0.00 C ATOM 1105 C TRP A 74 -7.955 -6.296 1.374 1.00 0.00 C ATOM 1106 O TRP A 74 -6.847 -6.582 0.996 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.064 -4.074 1.033 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.737 -2.903 0.235 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.723 -2.904 -0.727 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.358 -1.524 0.390 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.008 -1.590 -1.122 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.181 -0.731 -0.418 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.406 -0.918 1.165 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.069 0.677 -0.449 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.268 0.486 1.148 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.110 1.272 0.351 1.00 0.00 C ATOM 0 H TRP A 74 -11.060 -5.623 0.824 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.710 -5.530 -0.568 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.573 -4.126 1.995 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.038 -3.765 1.231 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.205 -3.787 -1.119 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.707 -1.313 -1.812 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.760 -1.516 1.790 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.714 1.272 -1.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.508 0.958 1.753 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.010 2.347 0.361 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.357 -6.609 2.552 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.444 -7.134 3.522 1.00 0.00 C ATOM 1129 C LYS A 75 -7.217 -8.629 3.538 1.00 0.00 C ATOM 1130 O LYS A 75 -6.086 -9.044 3.740 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.604 -6.467 4.855 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.553 -4.951 4.671 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.152 -4.459 4.261 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.238 -4.416 5.505 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.886 -3.851 5.264 1.00 0.00 N ATOM 0 H LYS A 75 -9.319 -6.513 2.877 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.461 -6.841 3.154 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.551 -6.758 5.309 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.814 -6.789 5.533 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.276 -4.655 3.911 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.849 -4.464 5.600 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.728 -5.123 3.507 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.220 -3.468 3.812 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.730 -3.828 6.280 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.129 -5.428 5.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.562 -3.350 6.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.223 -4.621 5.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.925 -3.186 4.465 1.00 0.00 H new ATOM 1149 N SER A 76 -8.232 -9.446 3.295 1.00 0.00 N ATOM 1150 CA SER A 76 -7.969 -10.877 3.285 1.00 0.00 C ATOM 1151 C SER A 76 -7.051 -11.182 2.114 1.00 0.00 C ATOM 1152 O SER A 76 -6.087 -11.953 2.243 1.00 0.00 O ATOM 1153 CB SER A 76 -9.249 -11.708 3.206 1.00 0.00 C ATOM 1154 OG SER A 76 -9.025 -13.077 3.521 1.00 0.00 O ATOM 0 H SER A 76 -9.195 -9.164 3.111 1.00 0.00 H new ATOM 0 HA SER A 76 -7.492 -11.152 4.225 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.990 -11.296 3.892 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.667 -11.632 2.202 1.00 0.00 H new ATOM 0 HG SER A 76 -9.870 -13.569 3.459 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.276 -10.485 0.994 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.408 -10.654 -0.115 1.00 0.00 C ATOM 1162 C GLU A 77 -5.094 -9.946 0.096 1.00 0.00 C ATOM 1163 O GLU A 77 -4.162 -10.239 -0.600 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.016 -10.248 -1.449 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.170 -11.082 -1.892 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.522 -10.889 -3.354 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.602 -10.936 -4.227 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -9.729 -10.708 -3.687 1.00 0.00 O ATOM 0 H GLU A 77 -8.039 -9.821 0.858 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.232 -11.728 -0.171 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.341 -9.210 -1.383 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.240 -10.291 -2.214 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.939 -12.133 -1.717 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.040 -10.841 -1.281 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.003 -8.984 1.043 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.727 -8.356 1.334 1.00 0.00 C ATOM 1177 C PHE A 78 -2.779 -9.400 1.843 1.00 0.00 C ATOM 1178 O PHE A 78 -1.632 -9.453 1.444 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.896 -7.233 2.371 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.608 -6.605 2.860 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.850 -5.789 2.032 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.175 -6.810 4.164 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.685 -5.187 2.494 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.018 -6.220 4.627 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.269 -5.405 3.793 1.00 0.00 C ATOM 0 H PHE A 78 -5.788 -8.643 1.598 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.328 -7.910 0.423 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.520 -6.452 1.938 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.435 -7.632 3.230 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.170 -5.619 1.014 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.753 -7.440 4.824 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.107 -4.551 1.839 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.694 -6.393 5.643 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.636 -4.942 4.157 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.282 -10.257 2.685 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.482 -11.324 3.225 1.00 0.00 C ATOM 1197 C PHE A 79 -2.184 -12.372 2.167 1.00 0.00 C ATOM 1198 O PHE A 79 -1.017 -12.791 1.994 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.157 -11.928 4.452 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.215 -10.943 5.603 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.141 -10.803 6.464 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.304 -10.115 5.775 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.163 -9.872 7.487 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.333 -9.174 6.783 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.264 -9.046 7.636 1.00 0.00 C ATOM 0 H PHE A 79 -4.247 -10.239 3.015 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.524 -10.913 3.544 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.167 -12.244 4.193 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.614 -12.820 4.764 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.272 -11.431 6.335 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.149 -10.205 5.109 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.326 -9.790 8.165 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.197 -8.537 6.902 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.282 -8.304 8.420 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.210 -12.752 1.406 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.057 -13.773 0.374 1.00 0.00 C ATOM 1217 C GLU A 80 -2.079 -13.326 -0.714 1.00 0.00 C ATOM 1218 O GLU A 80 -1.066 -13.959 -0.947 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.384 -14.107 -0.322 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.491 -14.624 0.558 1.00 0.00 C ATOM 1221 CD GLU A 80 -6.638 -15.142 -0.264 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -7.497 -14.363 -0.691 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -6.687 -16.366 -0.519 1.00 0.00 O ATOM 0 H GLU A 80 -4.152 -12.369 1.485 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.682 -14.654 0.895 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.740 -13.209 -0.827 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.187 -14.850 -1.095 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.110 -15.420 1.198 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.841 -13.827 1.214 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.398 -12.224 -1.345 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.669 -11.701 -2.503 1.00 0.00 C ATOM 1232 C ASN A 81 -0.257 -11.289 -2.184 1.00 0.00 C ATOM 1233 O ASN A 81 0.642 -11.455 -3.025 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.452 -10.541 -3.180 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.745 -11.012 -3.832 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.842 -12.142 -4.317 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.748 -10.169 -3.840 1.00 0.00 N ATOM 0 H ASN A 81 -3.189 -11.642 -1.071 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.590 -12.527 -3.210 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.681 -9.779 -2.435 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.819 -10.071 -3.933 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.639 -10.441 -4.255 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.638 -9.241 -3.431 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.029 -10.766 -0.994 1.00 0.00 N ATOM 1245 CA CYS A 82 1.328 -10.390 -0.626 1.00 0.00 C ATOM 1246 C CYS A 82 2.184 -11.613 -0.485 1.00 0.00 C ATOM 1247 O CYS A 82 3.222 -11.721 -1.126 1.00 0.00 O ATOM 1248 CB CYS A 82 1.363 -9.562 0.644 1.00 0.00 C ATOM 1249 SG CYS A 82 0.617 -7.930 0.475 1.00 0.00 S ATOM 0 H CYS A 82 -0.740 -10.595 -0.283 1.00 0.00 H new ATOM 0 HA CYS A 82 1.727 -9.767 -1.427 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.847 -10.106 1.435 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.399 -9.446 0.961 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.615 -7.971 0.889 1.00 0.00 H new ATOM 1255 N ARG A 83 1.720 -12.577 0.284 1.00 0.00 N ATOM 1256 CA ARG A 83 2.485 -13.784 0.466 1.00 0.00 C ATOM 1257 C ARG A 83 2.539 -14.666 -0.771 1.00 0.00 C ATOM 1258 O ARG A 83 3.469 -15.398 -0.940 1.00 0.00 O ATOM 1259 CB ARG A 83 2.160 -14.553 1.745 1.00 0.00 C ATOM 1260 CG ARG A 83 3.050 -14.123 2.917 1.00 0.00 C ATOM 1261 CD ARG A 83 2.837 -12.670 3.339 1.00 0.00 C ATOM 1262 NE ARG A 83 3.946 -12.124 4.179 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.149 -12.352 5.487 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.417 -13.235 6.170 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.108 -11.691 6.097 1.00 0.00 N ATOM 0 H ARG A 83 0.831 -12.546 0.784 1.00 0.00 H new ATOM 0 HA ARG A 83 3.505 -13.430 0.614 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.114 -14.394 2.007 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.286 -15.621 1.567 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.855 -14.774 3.770 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.095 -14.264 2.641 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.730 -12.053 2.447 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.901 -12.594 3.893 1.00 0.00 H new ATOM 0 HE ARG A 83 4.618 -11.516 3.711 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.679 -13.759 5.699 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.595 -13.386 7.163 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.677 -11.023 5.577 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.282 -11.846 7.090 1.00 0.00 H new ATOM 1279 N ASP A 84 1.561 -14.539 -1.640 1.00 0.00 N ATOM 1280 CA ASP A 84 1.507 -15.280 -2.912 1.00 0.00 C ATOM 1281 C ASP A 84 2.685 -14.882 -3.750 1.00 0.00 C ATOM 1282 O ASP A 84 3.508 -15.712 -4.184 1.00 0.00 O ATOM 1283 CB ASP A 84 0.235 -14.900 -3.662 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.013 -15.763 -4.873 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.667 -16.822 -4.750 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.427 -15.396 -5.964 1.00 0.00 O ATOM 0 H ASP A 84 0.766 -13.916 -1.496 1.00 0.00 H new ATOM 0 HA ASP A 84 1.520 -16.352 -2.715 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.616 -14.978 -2.986 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.300 -13.857 -3.973 1.00 0.00 H new ATOM 1291 N THR A 85 2.778 -13.607 -3.918 1.00 0.00 N ATOM 1292 CA THR A 85 3.803 -12.968 -4.672 1.00 0.00 C ATOM 1293 C THR A 85 5.167 -13.201 -3.973 1.00 0.00 C ATOM 1294 O THR A 85 6.184 -13.473 -4.628 1.00 0.00 O ATOM 1295 CB THR A 85 3.428 -11.486 -4.730 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.112 -11.375 -5.326 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.432 -10.628 -5.478 1.00 0.00 C ATOM 0 H THR A 85 2.110 -12.950 -3.514 1.00 0.00 H new ATOM 0 HA THR A 85 3.894 -13.365 -5.683 1.00 0.00 H new ATOM 0 HB THR A 85 3.430 -11.101 -3.710 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.442 -11.261 -4.620 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.097 -9.591 -5.476 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.404 -10.696 -4.990 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.517 -10.980 -6.506 1.00 0.00 H new ATOM 1305 N ALA A 86 5.138 -13.164 -2.637 1.00 0.00 N ATOM 1306 CA ALA A 86 6.294 -13.453 -1.813 1.00 0.00 C ATOM 1307 C ALA A 86 6.822 -14.836 -2.107 1.00 0.00 C ATOM 1308 O ALA A 86 8.022 -14.998 -2.298 1.00 0.00 O ATOM 1309 CB ALA A 86 5.956 -13.336 -0.337 1.00 0.00 C ATOM 0 H ALA A 86 4.301 -12.930 -2.103 1.00 0.00 H new ATOM 0 HA ALA A 86 7.063 -12.719 -2.052 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.842 -13.558 0.258 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.618 -12.323 -0.120 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.165 -14.043 -0.088 1.00 0.00 H new ATOM 1315 N LYS A 87 5.920 -15.839 -2.164 1.00 0.00 N ATOM 1316 CA LYS A 87 6.309 -17.221 -2.471 1.00 0.00 C ATOM 1317 C LYS A 87 7.043 -17.278 -3.797 1.00 0.00 C ATOM 1318 O LYS A 87 8.052 -17.968 -3.929 1.00 0.00 O ATOM 1319 CB LYS A 87 5.097 -18.154 -2.532 1.00 0.00 C ATOM 1320 CG LYS A 87 4.288 -18.258 -1.243 1.00 0.00 C ATOM 1321 CD LYS A 87 3.223 -19.347 -1.308 1.00 0.00 C ATOM 1322 CE LYS A 87 2.161 -19.050 -2.347 1.00 0.00 C ATOM 1323 NZ LYS A 87 1.210 -20.177 -2.514 1.00 0.00 N ATOM 0 H LYS A 87 4.921 -15.712 -2.001 1.00 0.00 H new ATOM 0 HA LYS A 87 6.963 -17.557 -1.666 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.437 -17.813 -3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.440 -19.151 -2.807 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.962 -18.462 -0.411 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.811 -17.299 -1.039 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.696 -20.302 -1.538 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.753 -19.451 -0.330 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.612 -18.154 -2.058 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.640 -18.836 -3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.502 -19.930 -3.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.728 -21.027 -2.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.733 -20.366 -1.609 1.00 0.00 H new ATOM 1337 N ARG A 88 6.574 -16.491 -4.751 1.00 0.00 N ATOM 1338 CA ARG A 88 7.207 -16.435 -6.063 1.00 0.00 C ATOM 1339 C ARG A 88 8.615 -15.864 -5.993 1.00 0.00 C ATOM 1340 O ARG A 88 9.489 -16.261 -6.757 1.00 0.00 O ATOM 1341 CB ARG A 88 6.380 -15.636 -7.059 1.00 0.00 C ATOM 1342 CG ARG A 88 5.411 -16.458 -7.881 1.00 0.00 C ATOM 1343 CD ARG A 88 4.345 -17.182 -7.066 1.00 0.00 C ATOM 1344 NE ARG A 88 3.534 -18.048 -7.927 1.00 0.00 N ATOM 1345 CZ ARG A 88 2.286 -18.442 -7.709 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.542 -17.882 -6.759 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.767 -19.355 -8.499 1.00 0.00 N ATOM 0 H ARG A 88 5.761 -15.884 -4.645 1.00 0.00 H new ATOM 0 HA ARG A 88 7.269 -17.466 -6.411 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.820 -14.874 -6.517 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.056 -15.113 -7.735 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.918 -15.804 -8.600 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.974 -17.194 -8.454 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.819 -17.778 -6.286 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.705 -16.454 -6.567 1.00 0.00 H new ATOM 0 HE ARG A 88 3.975 -18.383 -8.783 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.929 -17.135 -6.182 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.585 -18.199 -6.608 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.322 -19.745 -9.261 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.809 -19.673 -8.350 1.00 0.00 H new ATOM 1361 N ASN A 89 8.845 -14.961 -5.074 1.00 0.00 N ATOM 1362 CA ASN A 89 10.147 -14.350 -4.968 1.00 0.00 C ATOM 1363 C ASN A 89 11.089 -15.218 -4.101 1.00 0.00 C ATOM 1364 O ASN A 89 12.305 -15.255 -4.333 1.00 0.00 O ATOM 1365 CB ASN A 89 10.033 -12.928 -4.422 1.00 0.00 C ATOM 1366 CG ASN A 89 11.007 -11.967 -5.079 1.00 0.00 C ATOM 1367 OD1 ASN A 89 12.110 -12.324 -5.436 1.00 0.00 O ATOM 1368 ND2 ASN A 89 10.575 -10.755 -5.269 1.00 0.00 N ATOM 0 H ASN A 89 8.157 -14.635 -4.395 1.00 0.00 H new ATOM 0 HA ASN A 89 10.582 -14.286 -5.965 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.016 -12.566 -4.572 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.212 -12.941 -3.347 1.00 0.00 H new ATOM 0 HD21 ASN A 89 11.170 -10.068 -5.732 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.641 -10.491 -4.955 1.00 0.00 H new ATOM 1375 N GLN A 90 10.529 -15.919 -3.097 1.00 0.00 N ATOM 1376 CA GLN A 90 11.332 -16.809 -2.236 1.00 0.00 C ATOM 1377 C GLN A 90 11.796 -17.989 -3.055 1.00 0.00 C ATOM 1378 O GLN A 90 12.946 -18.389 -2.962 1.00 0.00 O ATOM 1379 CB GLN A 90 10.533 -17.337 -1.013 1.00 0.00 C ATOM 1380 CG GLN A 90 9.727 -16.310 -0.220 1.00 0.00 C ATOM 1381 CD GLN A 90 10.492 -15.065 0.127 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.159 -14.989 1.143 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.340 -14.068 -0.691 1.00 0.00 N ATOM 0 H GLN A 90 9.537 -15.888 -2.864 1.00 0.00 H new ATOM 0 HA GLN A 90 12.173 -16.228 -1.857 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.848 -18.109 -1.363 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.234 -17.818 -0.331 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.845 -16.032 -0.797 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.373 -16.774 0.700 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.771 -14.179 -1.530 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.789 -13.174 -0.494 1.00 0.00 H new ATOM 1392 N GLN A 91 10.900 -18.525 -3.895 1.00 0.00 N ATOM 1393 CA GLN A 91 11.250 -19.662 -4.752 1.00 0.00 C ATOM 1394 C GLN A 91 12.335 -19.267 -5.772 1.00 0.00 C ATOM 1395 O GLN A 91 13.115 -20.099 -6.206 1.00 0.00 O ATOM 1396 CB GLN A 91 10.009 -20.235 -5.468 1.00 0.00 C ATOM 1397 CG GLN A 91 9.405 -19.292 -6.489 1.00 0.00 C ATOM 1398 CD GLN A 91 8.091 -19.750 -7.088 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.267 -20.394 -6.318 1.00 0.00 O flip ATOM 1400 NE2 GLN A 91 7.790 -19.445 -8.238 1.00 0.00 N flip ATOM 0 H GLN A 91 9.941 -18.194 -3.998 1.00 0.00 H new ATOM 0 HA GLN A 91 11.652 -20.446 -4.110 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.284 -21.166 -5.964 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.253 -20.483 -4.723 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.253 -18.321 -6.018 1.00 0.00 H new ATOM 0 HG3 GLN A 91 10.123 -19.146 -7.296 1.00 0.00 H new ATOM 0 HE21 GLN A 91 8.456 -18.939 -8.822 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.874 -19.697 -8.610 1.00 0.00 H new ATOM 1409 N ALA A 92 12.359 -17.994 -6.155 1.00 0.00 N ATOM 1410 CA ALA A 92 13.384 -17.488 -7.041 1.00 0.00 C ATOM 1411 C ALA A 92 14.678 -17.358 -6.268 1.00 0.00 C ATOM 1412 O ALA A 92 15.767 -17.628 -6.788 1.00 0.00 O ATOM 1413 CB ALA A 92 12.969 -16.152 -7.623 1.00 0.00 C ATOM 0 H ALA A 92 11.675 -17.297 -5.861 1.00 0.00 H new ATOM 0 HA ALA A 92 13.527 -18.181 -7.870 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.752 -15.786 -8.287 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.043 -16.272 -8.185 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.814 -15.436 -6.816 1.00 0.00 H new ATOM 1419 N GLY A 93 14.544 -16.971 -5.010 1.00 0.00 N ATOM 1420 CA GLY A 93 15.675 -16.885 -4.146 1.00 0.00 C ATOM 1421 C GLY A 93 16.312 -15.543 -4.153 1.00 0.00 C ATOM 1422 O GLY A 93 17.505 -15.421 -4.403 1.00 0.00 O ATOM 0 H GLY A 93 13.656 -16.714 -4.578 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.368 -17.130 -3.129 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.411 -17.632 -4.445 1.00 0.00 H new ATOM 1426 N ASN A 94 15.540 -14.509 -3.919 1.00 0.00 N ATOM 1427 CA ASN A 94 16.141 -13.175 -3.928 1.00 0.00 C ATOM 1428 C ASN A 94 16.293 -12.610 -2.534 1.00 0.00 C ATOM 1429 O ASN A 94 16.989 -11.607 -2.345 1.00 0.00 O ATOM 1430 CB ASN A 94 15.385 -12.180 -4.818 1.00 0.00 C ATOM 1431 CG ASN A 94 15.396 -12.553 -6.291 1.00 0.00 C ATOM 1432 OD1 ASN A 94 16.329 -12.229 -7.018 1.00 0.00 O ATOM 1433 ND2 ASN A 94 14.344 -13.152 -6.763 1.00 0.00 N ATOM 0 H ASN A 94 14.539 -14.546 -3.727 1.00 0.00 H new ATOM 0 HA ASN A 94 17.133 -13.312 -4.358 1.00 0.00 H new ATOM 0 HB2 ASN A 94 14.352 -12.112 -4.477 1.00 0.00 H new ATOM 0 HB3 ASN A 94 15.826 -11.190 -4.699 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.281 -13.363 -7.759 1.00 0.00 H new ATOM 0 HD22 ASN A 94 13.581 -13.411 -6.138 1.00 0.00 H new ATOM 1440 N GLY A 95 15.680 -13.277 -1.541 1.00 0.00 N ATOM 1441 CA GLY A 95 15.673 -12.736 -0.165 1.00 0.00 C ATOM 1442 C GLY A 95 15.007 -11.371 -0.164 1.00 0.00 C ATOM 1443 O GLY A 95 15.635 -10.357 0.134 1.00 0.00 O ATOM 0 H GLY A 95 15.195 -14.167 -1.656 1.00 0.00 H new ATOM 0 HA2 GLY A 95 15.140 -13.414 0.501 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.693 -12.656 0.211 1.00 0.00 H new ATOM 1447 N TRP A 96 13.753 -11.356 -0.507 1.00 0.00 N ATOM 1448 CA TRP A 96 13.055 -10.132 -0.800 1.00 0.00 C ATOM 1449 C TRP A 96 11.574 -10.436 -0.635 1.00 0.00 C ATOM 1450 O TRP A 96 11.228 -11.603 -0.427 1.00 0.00 O ATOM 1451 CB TRP A 96 13.376 -9.870 -2.279 1.00 0.00 C ATOM 1452 CG TRP A 96 13.421 -8.463 -2.762 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.561 -7.315 -2.032 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.408 -8.072 -4.130 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.639 -6.237 -2.879 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.545 -6.684 -4.169 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.298 -8.777 -5.338 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 13.568 -5.980 -5.360 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.317 -8.067 -6.525 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.457 -6.684 -6.524 1.00 0.00 C ATOM 0 H TRP A 96 13.179 -12.195 -0.593 1.00 0.00 H new ATOM 0 HA TRP A 96 13.325 -9.283 -0.172 1.00 0.00 H new ATOM 0 HB2 TRP A 96 14.344 -10.324 -2.493 1.00 0.00 H new ATOM 0 HB3 TRP A 96 12.636 -10.401 -2.877 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.604 -7.264 -0.954 1.00 0.00 H new ATOM 0 HE1 TRP A 96 13.749 -5.264 -2.594 1.00 0.00 H new ATOM 0 HE3 TRP A 96 13.200 -9.853 -5.341 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 13.671 -4.905 -5.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.222 -8.593 -7.463 1.00 0.00 H new ATOM 0 HH2 TRP A 96 13.478 -6.155 -7.465 1.00 0.00 H new ATOM 1471 N ASP A 97 10.715 -9.435 -0.668 1.00 0.00 N ATOM 1472 CA ASP A 97 9.251 -9.639 -0.682 1.00 0.00 C ATOM 1473 C ASP A 97 8.589 -10.016 0.628 1.00 0.00 C ATOM 1474 O ASP A 97 8.018 -9.166 1.248 1.00 0.00 O ATOM 1475 CB ASP A 97 8.757 -10.553 -1.813 1.00 0.00 C ATOM 1476 CG ASP A 97 8.695 -9.879 -3.165 1.00 0.00 C ATOM 1477 OD1 ASP A 97 9.367 -8.858 -3.389 1.00 0.00 O ATOM 1478 OD2 ASP A 97 8.020 -10.418 -4.058 1.00 0.00 O ATOM 0 H ASP A 97 10.996 -8.455 -0.686 1.00 0.00 H new ATOM 0 HA ASP A 97 8.917 -8.621 -0.880 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.415 -11.419 -1.880 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.765 -10.926 -1.558 1.00 0.00 H new ATOM 1483 N PHE A 98 8.696 -11.271 1.045 1.00 0.00 N ATOM 1484 CA PHE A 98 7.894 -11.863 2.163 1.00 0.00 C ATOM 1485 C PHE A 98 7.691 -10.956 3.400 1.00 0.00 C ATOM 1486 O PHE A 98 6.554 -10.719 3.817 1.00 0.00 O ATOM 1487 CB PHE A 98 8.418 -13.283 2.530 1.00 0.00 C ATOM 1488 CG PHE A 98 7.694 -13.927 3.691 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.556 -14.659 3.467 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.138 -13.776 4.999 1.00 0.00 C ATOM 1491 CE1 PHE A 98 5.876 -15.237 4.512 1.00 0.00 C ATOM 1492 CE2 PHE A 98 7.459 -14.347 6.040 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.327 -15.079 5.799 1.00 0.00 C ATOM 0 H PHE A 98 9.346 -11.935 0.624 1.00 0.00 H new ATOM 0 HA PHE A 98 6.882 -11.958 1.769 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.328 -13.929 1.656 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.479 -13.216 2.769 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.190 -14.783 2.458 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.030 -13.201 5.196 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.985 -15.817 4.320 1.00 0.00 H new ATOM 0 HE2 PHE A 98 7.815 -14.221 7.052 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.790 -15.531 6.620 1.00 0.00 H new ATOM 1503 N ASP A 99 8.772 -10.476 3.948 1.00 0.00 N ATOM 1504 CA ASP A 99 8.802 -9.578 5.127 1.00 0.00 C ATOM 1505 C ASP A 99 8.536 -8.128 4.717 1.00 0.00 C ATOM 1506 O ASP A 99 8.014 -7.325 5.498 1.00 0.00 O ATOM 1507 CB ASP A 99 10.209 -9.709 5.739 1.00 0.00 C ATOM 1508 CG ASP A 99 10.505 -8.751 6.835 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.677 -8.568 7.691 1.00 0.00 O ATOM 1510 OD2 ASP A 99 11.606 -8.154 6.853 1.00 0.00 O ATOM 0 H ASP A 99 9.703 -10.692 3.592 1.00 0.00 H new ATOM 0 HA ASP A 99 8.028 -9.854 5.843 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.331 -10.723 6.119 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.947 -9.574 4.949 1.00 0.00 H new ATOM 1515 N MET A 100 8.800 -7.854 3.456 1.00 0.00 N ATOM 1516 CA MET A 100 8.750 -6.507 2.889 1.00 0.00 C ATOM 1517 C MET A 100 7.305 -6.125 2.546 1.00 0.00 C ATOM 1518 O MET A 100 6.762 -5.198 3.126 1.00 0.00 O ATOM 1519 CB MET A 100 9.613 -6.403 1.611 1.00 0.00 C ATOM 1520 CG MET A 100 11.009 -7.034 1.687 1.00 0.00 C ATOM 1521 SD MET A 100 12.109 -6.318 2.915 1.00 0.00 S ATOM 1522 CE MET A 100 12.369 -4.677 2.236 1.00 0.00 C ATOM 0 H MET A 100 9.061 -8.569 2.777 1.00 0.00 H new ATOM 0 HA MET A 100 9.146 -5.822 3.639 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.069 -6.871 0.791 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.726 -5.349 1.358 1.00 0.00 H new ATOM 0 HG2 MET A 100 10.898 -8.098 1.899 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.481 -6.951 0.708 1.00 0.00 H new ATOM 0 HE1 MET A 100 13.005 -4.101 2.909 1.00 0.00 H new ATOM 0 HE2 MET A 100 12.852 -4.758 1.262 1.00 0.00 H new ATOM 0 HE3 MET A 100 11.409 -4.173 2.124 1.00 0.00 H new ATOM 1532 N LEU A 101 6.659 -6.863 1.622 1.00 0.00 N ATOM 1533 CA LEU A 101 5.283 -6.539 1.248 1.00 0.00 C ATOM 1534 C LEU A 101 4.322 -7.229 2.207 1.00 0.00 C ATOM 1535 O LEU A 101 3.999 -8.394 2.046 1.00 0.00 O ATOM 1536 CB LEU A 101 4.911 -6.802 -0.274 1.00 0.00 C ATOM 1537 CG LEU A 101 4.535 -8.217 -0.783 1.00 0.00 C ATOM 1538 CD1 LEU A 101 4.145 -8.166 -2.224 1.00 0.00 C ATOM 1539 CD2 LEU A 101 5.624 -9.206 -0.619 1.00 0.00 C ATOM 0 H LEU A 101 7.061 -7.665 1.136 1.00 0.00 H new ATOM 0 HA LEU A 101 5.185 -5.457 1.341 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.074 -6.146 -0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.759 -6.466 -0.870 1.00 0.00 H new ATOM 0 HG LEU A 101 3.696 -8.543 -0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.884 -9.168 -2.566 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.286 -7.506 -2.345 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.980 -7.787 -2.814 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.295 -10.175 -0.995 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.500 -8.878 -1.178 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.879 -9.294 0.437 1.00 0.00 H new ATOM 1551 N THR A 102 4.067 -6.535 3.299 1.00 0.00 N ATOM 1552 CA THR A 102 3.154 -6.888 4.398 1.00 0.00 C ATOM 1553 C THR A 102 3.527 -5.999 5.531 1.00 0.00 C ATOM 1554 O THR A 102 2.702 -5.323 6.120 1.00 0.00 O ATOM 1555 CB THR A 102 3.304 -8.351 4.932 1.00 0.00 C ATOM 1556 OG1 THR A 102 4.659 -8.819 4.807 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.326 -9.322 4.317 1.00 0.00 C ATOM 0 H THR A 102 4.522 -5.638 3.465 1.00 0.00 H new ATOM 0 HA THR A 102 2.136 -6.785 4.023 1.00 0.00 H new ATOM 0 HB THR A 102 3.053 -8.308 5.992 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.686 -9.584 4.195 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.489 -10.316 4.734 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.308 -8.999 4.534 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.474 -9.353 3.238 1.00 0.00 H new ATOM 1661 N ASP A 111 12.875 1.101 7.240 1.00 0.00 N ATOM 1662 CA ASP A 111 14.050 1.449 6.452 1.00 0.00 C ATOM 1663 C ASP A 111 14.218 0.708 5.147 1.00 0.00 C ATOM 1664 O ASP A 111 14.148 1.320 4.088 1.00 0.00 O ATOM 1665 CB ASP A 111 15.326 1.344 7.274 1.00 0.00 C ATOM 1666 CG ASP A 111 15.562 2.544 8.144 1.00 0.00 C ATOM 1667 OD1 ASP A 111 14.895 2.698 9.202 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.430 3.380 7.788 1.00 0.00 O ATOM 0 HA ASP A 111 13.864 2.485 6.170 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.277 0.453 7.899 1.00 0.00 H new ATOM 0 HB3 ASP A 111 16.175 1.216 6.603 1.00 0.00 H new ATOM 1673 N ALA A 112 14.368 -0.590 5.194 1.00 0.00 N ATOM 1674 CA ALA A 112 14.825 -1.336 4.004 1.00 0.00 C ATOM 1675 C ALA A 112 13.884 -1.225 2.785 1.00 0.00 C ATOM 1676 O ALA A 112 14.326 -1.354 1.643 1.00 0.00 O ATOM 1677 CB ALA A 112 15.097 -2.777 4.333 1.00 0.00 C ATOM 0 H ALA A 112 14.189 -1.163 6.019 1.00 0.00 H new ATOM 0 HA ALA A 112 15.757 -0.854 3.707 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.431 -3.298 3.436 1.00 0.00 H new ATOM 0 HB2 ALA A 112 15.872 -2.836 5.097 1.00 0.00 H new ATOM 0 HB3 ALA A 112 14.185 -3.244 4.705 1.00 0.00 H new ATOM 1683 N GLN A 113 12.600 -0.986 3.017 1.00 0.00 N ATOM 1684 CA GLN A 113 11.655 -0.831 1.902 1.00 0.00 C ATOM 1685 C GLN A 113 11.774 0.584 1.413 1.00 0.00 C ATOM 1686 O GLN A 113 11.684 0.861 0.231 1.00 0.00 O ATOM 1687 CB GLN A 113 10.223 -0.993 2.348 1.00 0.00 C ATOM 1688 CG GLN A 113 9.963 -2.129 3.287 1.00 0.00 C ATOM 1689 CD GLN A 113 9.156 -1.668 4.452 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.464 -0.475 4.935 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 8.338 -2.408 4.991 1.00 0.00 N flip ATOM 0 H GLN A 113 12.188 -0.895 3.946 1.00 0.00 H new ATOM 0 HA GLN A 113 11.889 -1.584 1.150 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.904 -0.068 2.828 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.599 -1.125 1.464 1.00 0.00 H new ATOM 0 HG2 GLN A 113 9.436 -2.927 2.765 1.00 0.00 H new ATOM 0 HG3 GLN A 113 10.909 -2.546 3.634 1.00 0.00 H new ATOM 0 HE21 GLN A 113 8.130 -3.320 4.585 1.00 0.00 H new ATOM 0 HE22 GLN A 113 7.866 -2.111 5.845 1.00 0.00 H new ATOM 1700 N MET A 114 11.989 1.486 2.372 1.00 0.00 N ATOM 1701 CA MET A 114 12.099 2.889 2.121 1.00 0.00 C ATOM 1702 C MET A 114 13.289 3.272 1.191 1.00 0.00 C ATOM 1703 O MET A 114 13.267 4.327 0.561 1.00 0.00 O ATOM 1704 CB MET A 114 12.158 3.633 3.445 1.00 0.00 C ATOM 1705 CG MET A 114 12.403 5.112 3.346 1.00 0.00 C ATOM 1706 SD MET A 114 12.159 5.931 4.921 1.00 0.00 S ATOM 1707 CE MET A 114 10.412 5.598 5.189 1.00 0.00 C ATOM 0 H MET A 114 12.091 1.238 3.356 1.00 0.00 H new ATOM 0 HA MET A 114 11.209 3.191 1.569 1.00 0.00 H new ATOM 0 HB2 MET A 114 11.219 3.473 3.974 1.00 0.00 H new ATOM 0 HB3 MET A 114 12.946 3.192 4.055 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.420 5.290 2.997 1.00 0.00 H new ATOM 0 HG3 MET A 114 11.731 5.543 2.604 1.00 0.00 H new ATOM 0 HE1 MET A 114 10.051 6.199 6.023 1.00 0.00 H new ATOM 0 HE2 MET A 114 9.851 5.852 4.289 1.00 0.00 H new ATOM 0 HE3 MET A 114 10.274 4.541 5.417 1.00 0.00 H new ATOM 1717 N GLN A 115 14.344 2.447 1.112 1.00 0.00 N ATOM 1718 CA GLN A 115 15.402 2.795 0.145 1.00 0.00 C ATOM 1719 C GLN A 115 14.969 2.514 -1.292 1.00 0.00 C ATOM 1720 O GLN A 115 15.645 2.940 -2.235 1.00 0.00 O ATOM 1721 CB GLN A 115 16.802 2.214 0.452 1.00 0.00 C ATOM 1722 CG GLN A 115 17.352 2.620 1.796 1.00 0.00 C ATOM 1723 CD GLN A 115 17.001 1.630 2.863 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.899 0.423 2.608 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.788 2.105 4.046 1.00 0.00 N ATOM 0 H GLN A 115 14.487 1.598 1.658 1.00 0.00 H new ATOM 0 HA GLN A 115 15.531 3.871 0.263 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.751 1.126 0.405 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.496 2.535 -0.325 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.436 2.716 1.731 1.00 0.00 H new ATOM 0 HG3 GLN A 115 16.961 3.601 2.067 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.882 3.106 4.218 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.526 1.479 4.807 1.00 0.00 H new ATOM 1734 N TYR A 116 13.837 1.787 -1.435 1.00 0.00 N ATOM 1735 CA TYR A 116 13.152 1.512 -2.685 1.00 0.00 C ATOM 1736 C TYR A 116 13.907 0.832 -3.789 1.00 0.00 C ATOM 1737 O TYR A 116 14.658 1.430 -4.542 1.00 0.00 O ATOM 1738 CB TYR A 116 12.303 2.675 -3.182 1.00 0.00 C ATOM 1739 CG TYR A 116 11.117 2.916 -2.298 1.00 0.00 C ATOM 1740 CD1 TYR A 116 10.026 2.059 -2.330 1.00 0.00 C ATOM 1741 CD2 TYR A 116 11.086 3.977 -1.419 1.00 0.00 C ATOM 1742 CE1 TYR A 116 8.945 2.260 -1.507 1.00 0.00 C ATOM 1743 CE2 TYR A 116 10.006 4.185 -0.590 1.00 0.00 C ATOM 1744 CZ TYR A 116 8.942 3.320 -0.640 1.00 0.00 C ATOM 1745 OH TYR A 116 7.872 3.523 0.171 1.00 0.00 O ATOM 0 H TYR A 116 13.367 1.364 -0.635 1.00 0.00 H new ATOM 0 HA TYR A 116 12.484 0.713 -2.364 1.00 0.00 H new ATOM 0 HB2 TYR A 116 12.913 3.577 -3.226 1.00 0.00 H new ATOM 0 HB3 TYR A 116 11.964 2.470 -4.197 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.027 1.222 -3.012 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.924 4.658 -1.380 1.00 0.00 H new ATOM 0 HE1 TYR A 116 8.102 1.586 -1.543 1.00 0.00 H new ATOM 0 HE2 TYR A 116 9.997 5.021 0.093 1.00 0.00 H new ATOM 0 HH TYR A 116 7.334 2.705 0.214 1.00 0.00 H new ATOM 1755 N ASP A 117 13.690 -0.439 -3.874 1.00 0.00 N ATOM 1756 CA ASP A 117 14.148 -1.207 -5.005 1.00 0.00 C ATOM 1757 C ASP A 117 13.039 -1.105 -6.010 1.00 0.00 C ATOM 1758 O ASP A 117 11.868 -1.248 -5.620 1.00 0.00 O ATOM 1759 CB ASP A 117 14.324 -2.701 -4.690 1.00 0.00 C ATOM 1760 CG ASP A 117 15.204 -3.008 -3.534 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.395 -2.685 -3.575 1.00 0.00 O ATOM 1762 OD2 ASP A 117 14.728 -3.624 -2.555 1.00 0.00 O ATOM 0 H ASP A 117 13.192 -0.982 -3.168 1.00 0.00 H new ATOM 0 HA ASP A 117 15.115 -0.826 -5.333 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.341 -3.134 -4.502 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.727 -3.196 -5.573 1.00 0.00 H new ATOM 1767 N PRO A 118 13.333 -0.885 -7.310 1.00 0.00 N ATOM 1768 CA PRO A 118 12.292 -0.739 -8.348 1.00 0.00 C ATOM 1769 C PRO A 118 11.422 -1.988 -8.459 1.00 0.00 C ATOM 1770 O PRO A 118 10.225 -1.905 -8.736 1.00 0.00 O ATOM 1771 CB PRO A 118 13.080 -0.537 -9.650 1.00 0.00 C ATOM 1772 CG PRO A 118 14.439 -0.099 -9.217 1.00 0.00 C ATOM 1773 CD PRO A 118 14.687 -0.746 -7.874 1.00 0.00 C ATOM 0 HA PRO A 118 11.614 0.083 -8.120 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.129 -1.459 -10.229 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.608 0.213 -10.285 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.195 -0.404 -9.941 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.491 0.987 -9.141 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.181 -1.712 -7.978 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.325 -0.129 -7.242 1.00 0.00 H new ATOM 1781 N GLY A 119 11.986 -3.124 -8.105 1.00 0.00 N ATOM 1782 CA GLY A 119 11.247 -4.352 -8.250 1.00 0.00 C ATOM 1783 C GLY A 119 10.375 -4.537 -7.035 1.00 0.00 C ATOM 1784 O GLY A 119 9.251 -4.937 -7.139 1.00 0.00 O ATOM 0 H GLY A 119 12.928 -3.219 -7.725 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.636 -4.321 -9.152 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.931 -5.194 -8.356 1.00 0.00 H new ATOM 1788 N LEU A 120 10.884 -4.107 -5.909 1.00 0.00 N ATOM 1789 CA LEU A 120 10.134 -4.245 -4.661 1.00 0.00 C ATOM 1790 C LEU A 120 8.916 -3.334 -4.717 1.00 0.00 C ATOM 1791 O LEU A 120 7.817 -3.744 -4.352 1.00 0.00 O ATOM 1792 CB LEU A 120 10.990 -3.899 -3.435 1.00 0.00 C ATOM 1793 CG LEU A 120 10.296 -4.075 -2.075 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.927 -5.518 -1.829 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.166 -3.571 -0.967 1.00 0.00 C ATOM 0 H LEU A 120 11.798 -3.664 -5.817 1.00 0.00 H new ATOM 0 HA LEU A 120 9.828 -5.286 -4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.885 -4.521 -3.450 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.320 -2.864 -3.524 1.00 0.00 H new ATOM 0 HG LEU A 120 9.378 -3.488 -2.097 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.438 -5.608 -0.859 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.248 -5.858 -2.611 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.828 -6.131 -1.839 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.655 -3.705 -0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.103 -4.128 -0.958 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.374 -2.512 -1.121 1.00 0.00 H new ATOM 1807 N PHE A 121 9.156 -2.092 -5.148 1.00 0.00 N ATOM 1808 CA PHE A 121 8.076 -1.126 -5.344 1.00 0.00 C ATOM 1809 C PHE A 121 6.986 -1.725 -6.267 1.00 0.00 C ATOM 1810 O PHE A 121 5.788 -1.563 -6.018 1.00 0.00 O ATOM 1811 CB PHE A 121 8.618 0.199 -5.915 1.00 0.00 C ATOM 1812 CG PHE A 121 7.581 1.281 -6.030 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.215 2.019 -4.931 1.00 0.00 C ATOM 1814 CD2 PHE A 121 6.962 1.547 -7.232 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.255 3.000 -5.022 1.00 0.00 C ATOM 1816 CE2 PHE A 121 5.999 2.526 -7.329 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.642 3.250 -6.226 1.00 0.00 C ATOM 0 H PHE A 121 10.086 -1.735 -5.367 1.00 0.00 H new ATOM 0 HA PHE A 121 7.626 -0.908 -4.375 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.429 0.553 -5.279 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.044 0.011 -6.900 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.689 1.826 -3.980 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.236 0.980 -8.109 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.983 3.573 -4.148 1.00 0.00 H new ATOM 0 HE2 PHE A 121 5.524 2.722 -8.279 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.882 4.014 -6.300 1.00 0.00 H new ATOM 1827 N ALA A 122 7.409 -2.458 -7.289 1.00 0.00 N ATOM 1828 CA ALA A 122 6.474 -3.101 -8.186 1.00 0.00 C ATOM 1829 C ALA A 122 5.669 -4.198 -7.462 1.00 0.00 C ATOM 1830 O ALA A 122 4.441 -4.235 -7.593 1.00 0.00 O ATOM 1831 CB ALA A 122 7.194 -3.660 -9.392 1.00 0.00 C ATOM 0 H ALA A 122 8.391 -2.618 -7.512 1.00 0.00 H new ATOM 0 HA ALA A 122 5.765 -2.349 -8.531 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.474 -4.140 -10.055 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.695 -2.851 -9.924 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.933 -4.393 -9.067 1.00 0.00 H new ATOM 1837 N GLN A 123 6.347 -5.113 -6.720 1.00 0.00 N ATOM 1838 CA GLN A 123 5.621 -6.120 -5.943 1.00 0.00 C ATOM 1839 C GLN A 123 4.653 -5.496 -4.940 1.00 0.00 C ATOM 1840 O GLN A 123 3.463 -5.829 -4.947 1.00 0.00 O ATOM 1841 CB GLN A 123 6.519 -7.113 -5.184 1.00 0.00 C ATOM 1842 CG GLN A 123 7.159 -8.213 -6.009 1.00 0.00 C ATOM 1843 CD GLN A 123 8.385 -7.806 -6.749 1.00 0.00 C ATOM 1844 OE1 GLN A 123 8.321 -7.390 -7.913 1.00 0.00 O ATOM 1845 NE2 GLN A 123 9.514 -7.915 -6.087 1.00 0.00 N ATOM 0 H GLN A 123 7.363 -5.165 -6.651 1.00 0.00 H new ATOM 0 HA GLN A 123 5.073 -6.675 -6.705 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.312 -6.549 -4.693 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.925 -7.578 -4.397 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.409 -9.044 -5.349 1.00 0.00 H new ATOM 0 HG3 GLN A 123 6.426 -8.584 -6.725 1.00 0.00 H new ATOM 0 HE21 GLN A 123 9.512 -8.264 -5.129 1.00 0.00 H new ATOM 0 HE22 GLN A 123 10.393 -7.651 -6.531 1.00 0.00 H new ATOM 1854 N ILE A 124 5.147 -4.569 -4.082 1.00 0.00 N ATOM 1855 CA ILE A 124 4.307 -3.977 -3.011 1.00 0.00 C ATOM 1856 C ILE A 124 3.074 -3.269 -3.567 1.00 0.00 C ATOM 1857 O ILE A 124 1.974 -3.430 -3.037 1.00 0.00 O ATOM 1858 CB ILE A 124 5.083 -3.005 -2.044 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.756 -1.878 -2.796 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.128 -3.756 -1.235 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.368 -0.805 -1.906 1.00 0.00 C ATOM 0 H ILE A 124 6.105 -4.220 -4.109 1.00 0.00 H new ATOM 0 HA ILE A 124 3.991 -4.835 -2.417 1.00 0.00 H new ATOM 0 HB ILE A 124 4.339 -2.579 -1.371 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.538 -2.296 -3.430 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.026 -1.411 -3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.648 -3.060 -0.577 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.641 -4.526 -0.637 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.846 -4.221 -1.911 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.829 -0.037 -2.527 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.589 -0.355 -1.290 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.125 -1.254 -1.263 1.00 0.00 H new ATOM 1873 N GLN A 125 3.239 -2.542 -4.666 1.00 0.00 N ATOM 1874 CA GLN A 125 2.136 -1.792 -5.237 1.00 0.00 C ATOM 1875 C GLN A 125 1.071 -2.737 -5.782 1.00 0.00 C ATOM 1876 O GLN A 125 -0.146 -2.530 -5.572 1.00 0.00 O ATOM 1877 CB GLN A 125 2.623 -0.894 -6.368 1.00 0.00 C ATOM 1878 CG GLN A 125 1.521 -0.037 -6.929 1.00 0.00 C ATOM 1879 CD GLN A 125 1.932 0.790 -8.122 1.00 0.00 C ATOM 1880 OE1 GLN A 125 2.824 0.413 -8.892 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.257 1.903 -8.316 1.00 0.00 N ATOM 0 H GLN A 125 4.120 -2.459 -5.173 1.00 0.00 H new ATOM 0 HA GLN A 125 1.708 -1.178 -4.445 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.427 -0.255 -6.002 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.043 -1.510 -7.163 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.686 -0.677 -7.214 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.159 0.629 -6.146 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.529 2.179 -7.657 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.462 2.489 -9.125 1.00 0.00 H new ATOM 1890 N ALA A 126 1.536 -3.778 -6.448 1.00 0.00 N ATOM 1891 CA ALA A 126 0.662 -4.734 -7.102 1.00 0.00 C ATOM 1892 C ALA A 126 -0.176 -5.496 -6.109 1.00 0.00 C ATOM 1893 O ALA A 126 -1.402 -5.489 -6.197 1.00 0.00 O ATOM 1894 CB ALA A 126 1.470 -5.702 -7.950 1.00 0.00 C ATOM 0 H ALA A 126 2.530 -3.984 -6.551 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.012 -4.169 -7.746 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.798 -6.411 -8.433 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.020 -5.148 -8.711 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.173 -6.242 -7.316 1.00 0.00 H new ATOM 1900 N ALA A 127 0.482 -6.110 -5.140 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.182 -6.968 -4.186 1.00 0.00 C ATOM 1902 C ALA A 127 -1.174 -6.207 -3.358 1.00 0.00 C ATOM 1903 O ALA A 127 -2.281 -6.704 -3.090 1.00 0.00 O ATOM 1904 CB ALA A 127 0.820 -7.660 -3.300 1.00 0.00 C ATOM 0 H ALA A 127 1.488 -6.025 -4.997 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.728 -7.724 -4.751 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.297 -8.300 -2.590 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.489 -8.266 -3.911 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.401 -6.915 -2.757 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.791 -4.991 -2.970 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.639 -4.153 -2.183 1.00 0.00 C ATOM 1912 C ALA A 128 -2.945 -3.866 -2.911 1.00 0.00 C ATOM 1913 O ALA A 128 -3.948 -4.307 -2.495 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.930 -2.850 -1.837 1.00 0.00 C ATOM 0 H ALA A 128 0.113 -4.578 -3.200 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.871 -4.681 -1.258 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.591 -2.224 -1.237 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.024 -3.068 -1.271 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.667 -2.324 -2.755 1.00 0.00 H new ATOM 1920 N THR A 129 -2.887 -3.235 -4.034 1.00 0.00 N ATOM 1921 CA THR A 129 -4.105 -2.862 -4.769 1.00 0.00 C ATOM 1922 C THR A 129 -5.023 -4.111 -5.119 1.00 0.00 C ATOM 1923 O THR A 129 -6.337 -4.087 -4.993 1.00 0.00 O ATOM 1924 CB THR A 129 -3.676 -2.109 -6.034 1.00 0.00 C ATOM 1925 OG1 THR A 129 -2.629 -2.844 -6.683 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.161 -0.710 -5.693 1.00 0.00 C ATOM 0 H THR A 129 -2.017 -2.954 -4.487 1.00 0.00 H new ATOM 0 HA THR A 129 -4.721 -2.224 -4.135 1.00 0.00 H new ATOM 0 HB THR A 129 -4.542 -2.011 -6.689 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.762 -2.567 -6.321 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.864 -0.199 -6.609 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.950 -0.142 -5.200 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.302 -0.791 -5.027 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.313 -5.228 -5.380 1.00 0.00 N ATOM 1935 CA LYS A 130 -4.856 -6.520 -5.828 1.00 0.00 C ATOM 1936 C LYS A 130 -5.780 -7.057 -4.760 1.00 0.00 C ATOM 1937 O LYS A 130 -6.672 -7.817 -5.020 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.681 -7.489 -6.041 1.00 0.00 C ATOM 1939 CG LYS A 130 -3.980 -8.769 -6.795 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.394 -8.476 -8.223 1.00 0.00 C ATOM 1941 CE LYS A 130 -4.524 -9.752 -9.029 1.00 0.00 C ATOM 1942 NZ LYS A 130 -3.223 -10.439 -9.187 1.00 0.00 N ATOM 0 H LYS A 130 -3.298 -5.251 -5.278 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.412 -6.405 -6.759 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -2.894 -6.956 -6.574 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.279 -7.756 -5.064 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.099 -9.411 -6.793 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.774 -9.317 -6.288 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -5.344 -7.942 -8.227 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.659 -7.821 -8.690 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -5.231 -10.421 -8.538 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.934 -9.520 -10.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -3.282 -11.117 -9.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.482 -9.738 -9.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.989 -10.946 -8.310 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.452 -6.728 -3.563 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.220 -6.913 -2.411 1.00 0.00 C ATOM 1958 C ALA A 131 -7.205 -5.760 -2.256 1.00 0.00 C ATOM 1959 O ALA A 131 -8.415 -5.956 -2.378 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.221 -6.913 -1.314 1.00 0.00 C ATOM 0 H ALA A 131 -4.557 -6.284 -3.360 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.813 -7.827 -2.428 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.729 -7.053 -0.360 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.510 -7.724 -1.469 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.689 -5.961 -1.306 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.665 -4.554 -2.126 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.357 -3.318 -1.730 1.00 0.00 C ATOM 1968 C TRP A 132 -8.407 -2.773 -2.744 1.00 0.00 C ATOM 1969 O TRP A 132 -8.571 -1.570 -2.898 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.381 -2.198 -1.336 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.445 -2.553 -0.227 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.022 -3.769 0.041 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.818 -1.713 0.758 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.125 -3.788 0.989 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -3.978 -2.562 1.498 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.845 -0.351 1.101 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.173 -2.119 2.513 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.055 0.050 2.111 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.237 -0.830 2.794 1.00 0.00 C ATOM 0 H TRP A 132 -5.673 -4.396 -2.303 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.926 -3.632 -0.855 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.796 -1.918 -2.212 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.956 -1.319 -1.042 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.377 -4.653 -0.467 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.613 -4.615 1.295 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.477 0.347 0.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.521 -2.788 3.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.059 1.091 2.398 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.622 -0.446 3.594 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.007 -3.616 -3.494 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.187 -3.203 -4.293 1.00 0.00 C ATOM 1992 C ARG A 133 -11.553 -3.867 -3.928 1.00 0.00 C ATOM 1993 O ARG A 133 -12.584 -3.185 -3.880 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.913 -3.266 -5.821 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.131 -2.908 -6.722 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.101 -4.062 -6.870 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.463 -3.650 -7.261 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.995 -3.775 -8.489 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.241 -4.125 -9.535 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.283 -3.561 -8.662 1.00 0.00 N ATOM 0 H ARG A 133 -8.736 -4.594 -3.599 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.323 -2.163 -3.998 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.094 -2.587 -6.056 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.576 -4.271 -6.074 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.653 -2.051 -6.298 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.774 -2.608 -7.707 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.714 -4.756 -7.616 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.153 -4.604 -5.926 1.00 0.00 H new ATOM 0 HE ARG A 133 -14.051 -3.235 -6.538 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.244 -4.302 -9.409 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.662 -4.215 -10.460 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.868 -3.303 -7.868 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.695 -3.654 -9.590 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.519 -5.149 -3.677 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.701 -6.093 -3.804 1.00 0.00 C ATOM 2016 C LYS A 134 -14.011 -5.898 -3.038 1.00 0.00 C ATOM 2017 O LYS A 134 -14.601 -6.844 -2.594 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.298 -7.550 -3.882 1.00 0.00 C ATOM 2019 CG LYS A 134 -12.001 -8.012 -5.286 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.901 -7.208 -5.910 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.592 -7.459 -5.236 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.095 -8.816 -5.485 1.00 0.00 N ATOM 0 H LYS A 134 -10.669 -5.620 -3.368 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.041 -5.708 -4.765 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.417 -7.710 -3.260 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.097 -8.164 -3.466 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.720 -9.065 -5.271 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.902 -7.931 -5.894 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.821 -7.458 -6.968 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.145 -6.147 -5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.858 -6.734 -5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.702 -7.305 -4.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.094 -8.875 -5.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.650 -9.497 -4.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.188 -9.040 -6.496 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.470 -4.743 -2.912 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.744 -4.525 -2.246 1.00 0.00 C ATOM 2038 C LEU A 135 -16.848 -4.333 -3.294 1.00 0.00 C ATOM 2039 O LEU A 135 -16.557 -4.443 -4.485 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.597 -3.315 -1.372 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.963 -3.504 0.016 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.710 -4.389 -0.020 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.568 -2.154 0.517 1.00 0.00 C ATOM 0 H LEU A 135 -14.010 -3.898 -3.250 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.023 -5.382 -1.634 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.002 -2.581 -1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.587 -2.882 -1.231 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.692 -3.995 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.305 -4.487 0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.972 -5.375 -0.404 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.962 -3.934 -0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.113 -2.251 1.503 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.851 -1.706 -0.171 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.451 -1.519 0.585 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.134 -4.145 -2.897 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.182 -3.794 -3.836 1.00 0.00 C ATOM 2057 C PRO A 136 -19.400 -2.265 -3.875 1.00 0.00 C ATOM 2058 O PRO A 136 -18.668 -1.508 -3.226 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.411 -4.507 -3.264 1.00 0.00 C ATOM 2060 CG PRO A 136 -20.189 -4.537 -1.780 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.685 -4.342 -1.543 1.00 0.00 C ATOM 0 HA PRO A 136 -18.954 -4.085 -4.862 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.328 -3.974 -3.515 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.507 -5.514 -3.669 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.761 -3.750 -1.289 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.525 -5.485 -1.360 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.490 -3.481 -0.903 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -18.242 -5.210 -1.054 1.00 0.00 H new