USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=22 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 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 115 GLN : amide:sc= -4.66! K(o=-4.7!,f=-0.77) USER MOD Set 2.1: A 81 ASN : amide:sc= -0.828 K(o=-1.5,f=-8.8!) USER MOD Set 2.2: A 82 CYS SG : rot 34:sc= -0.688 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.036 K(o=-0.036,f=-4.7!) USER MOD Single : A 17 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.46) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0936) USER MOD Single : A 28 LYS NZ :NH3+ -167:sc= -0.0162 (180deg=-0.19) USER MOD Single : A 29 THR OG1 : rot 76:sc= 1.23 USER MOD Single : A 32 SER OG : rot 85:sc= 1.19 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 -17:sc= 1.23 USER MOD Single : A 40 TYR OH : rot -119:sc= 0.651 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 70:sc= 1.2 USER MOD Single : A 51 ASN : amide:sc= 0.36 X(o=0.36,f=0) USER MOD Single : A 54 THR OG1 : rot 72:sc= 1.38 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0292 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 THR OG1 : rot 168:sc= 1.34 USER MOD Single : A 67 SER OG : rot 180:sc= -0.0356 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 169:sc= 0.621! (180deg=0.465!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 81:sc= 1.24 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -6.35! C(o=-6.4!,f=-11!) USER MOD Single : A 90 GLN : amide:sc= 0.649 K(o=0.65,f=-0.09) USER MOD Single : A 91 GLN : amide:sc= 0.0571 X(o=0.057,f=0) USER MOD Single : A 94 ASN : amide:sc=-0.00255 K(o=-0.0026,f=-0.71) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 37:sc= 0.429 USER MOD Single : A 113 GLN : amide:sc= -3.67! C(o=-3.7!,f=-3.6!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0.622 K(o=0.62,f=-0.29) USER MOD Single : A 125 GLN : amide:sc= -0.0267 X(o=-0.027,f=-0.16) USER MOD Single : A 129 THR OG1 : rot -95:sc= 1.28 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -163:sc= -1.66! (180deg=-2.66!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.388 9.112 2.150 1.00 0.00 N ATOM 2 CA PRO A 1 3.949 9.391 0.856 1.00 0.00 C ATOM 3 C PRO A 1 5.460 9.328 0.959 1.00 0.00 C ATOM 4 O PRO A 1 6.013 9.525 2.038 1.00 0.00 O ATOM 5 CB PRO A 1 3.484 10.765 0.410 1.00 0.00 C ATOM 6 CG PRO A 1 2.427 11.114 1.407 1.00 0.00 C ATOM 7 CD PRO A 1 2.728 10.304 2.652 1.00 0.00 C ATOM 0 H2 PRO A 1 4.122 8.818 2.795 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.722 8.342 2.086 1.00 0.00 H new ATOM 0 HA PRO A 1 3.621 8.658 0.119 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.300 11.488 0.420 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.088 10.745 -0.605 1.00 0.00 H new ATOM 0 HG2 PRO A 1 2.438 12.182 1.626 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.436 10.878 1.020 1.00 0.00 H new ATOM 0 HD2 PRO A 1 3.369 10.855 3.340 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.816 10.056 3.196 1.00 0.00 H new ATOM 17 N VAL A 2 6.110 9.008 -0.131 1.00 0.00 N ATOM 18 CA VAL A 2 7.566 8.905 -0.163 1.00 0.00 C ATOM 19 C VAL A 2 8.154 9.732 -1.294 1.00 0.00 C ATOM 20 O VAL A 2 7.639 9.740 -2.403 1.00 0.00 O ATOM 21 CB VAL A 2 8.038 7.417 -0.271 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.549 7.307 -0.461 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.646 6.662 0.970 1.00 0.00 C ATOM 0 H VAL A 2 5.657 8.810 -1.023 1.00 0.00 H new ATOM 0 HA VAL A 2 7.934 9.306 0.781 1.00 0.00 H new ATOM 0 HB VAL A 2 7.551 6.988 -1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.831 6.257 -0.531 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.839 7.822 -1.377 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.057 7.763 0.389 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.978 5.627 0.887 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.113 7.124 1.840 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.562 6.687 1.084 1.00 0.00 H new ATOM 33 N THR A 3 9.227 10.414 -0.991 1.00 0.00 N ATOM 34 CA THR A 3 9.962 11.209 -1.924 1.00 0.00 C ATOM 35 C THR A 3 11.450 10.935 -1.654 1.00 0.00 C ATOM 36 O THR A 3 11.818 10.460 -0.543 1.00 0.00 O ATOM 37 CB THR A 3 9.636 12.731 -1.729 1.00 0.00 C ATOM 38 OG1 THR A 3 10.329 13.544 -2.689 1.00 0.00 O ATOM 39 CG2 THR A 3 9.971 13.203 -0.316 1.00 0.00 C ATOM 0 H THR A 3 9.623 10.428 -0.051 1.00 0.00 H new ATOM 0 HA THR A 3 9.697 10.955 -2.950 1.00 0.00 H new ATOM 0 HB THR A 3 8.563 12.843 -1.885 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.104 14.487 -2.543 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.731 14.262 -0.220 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.388 12.632 0.406 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.033 13.052 -0.124 1.00 0.00 H new ATOM 228 N HIS A 16 10.132 10.068 4.273 1.00 0.00 N ATOM 229 CA HIS A 16 8.771 9.643 4.426 1.00 0.00 C ATOM 230 C HIS A 16 8.007 10.888 4.689 1.00 0.00 C ATOM 231 O HIS A 16 8.483 11.751 5.444 1.00 0.00 O ATOM 232 CB HIS A 16 8.577 8.713 5.643 1.00 0.00 C ATOM 233 CG HIS A 16 9.361 7.430 5.682 1.00 0.00 C ATOM 234 ND1 HIS A 16 9.087 6.435 6.584 1.00 0.00 N ATOM 235 CD2 HIS A 16 10.437 7.006 4.988 1.00 0.00 C ATOM 236 CE1 HIS A 16 9.954 5.467 6.454 1.00 0.00 C ATOM 237 NE2 HIS A 16 10.790 5.782 5.492 1.00 0.00 N ATOM 0 HA HIS A 16 8.453 9.093 3.540 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.822 9.281 6.540 1.00 0.00 H new ATOM 0 HB3 HIS A 16 7.519 8.460 5.705 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.929 7.533 4.184 1.00 0.00 H new ATOM 0 HE1 HIS A 16 9.979 4.560 7.039 1.00 0.00 H new ATOM 0 HE2 HIS A 16 11.572 5.210 5.173 1.00 0.00 H new ATOM 246 N ASN A 17 6.868 11.007 4.165 1.00 0.00 N ATOM 247 CA ASN A 17 6.082 12.180 4.366 1.00 0.00 C ATOM 248 C ASN A 17 4.890 11.888 5.229 1.00 0.00 C ATOM 249 O ASN A 17 4.491 10.723 5.371 1.00 0.00 O ATOM 250 CB ASN A 17 5.637 12.762 3.020 1.00 0.00 C ATOM 251 CG ASN A 17 6.782 13.238 2.140 1.00 0.00 C ATOM 252 OD1 ASN A 17 7.834 13.637 2.618 1.00 0.00 O ATOM 253 ND2 ASN A 17 6.574 13.233 0.852 1.00 0.00 N ATOM 0 H ASN A 17 6.431 10.298 3.575 1.00 0.00 H new ATOM 0 HA ASN A 17 6.699 12.917 4.880 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.068 12.005 2.480 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.962 13.598 3.203 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.299 13.568 0.217 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.687 12.894 0.480 1.00 0.00 H new ATOM 260 N GLY A 18 4.311 12.934 5.788 1.00 0.00 N ATOM 261 CA GLY A 18 3.155 12.789 6.627 1.00 0.00 C ATOM 262 C GLY A 18 1.937 12.428 5.819 1.00 0.00 C ATOM 263 O GLY A 18 1.923 12.612 4.586 1.00 0.00 O ATOM 0 H GLY A 18 4.631 13.895 5.670 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.340 12.018 7.375 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.975 13.719 7.166 1.00 0.00 H new ATOM 267 N PHE A 19 0.929 11.907 6.484 1.00 0.00 N ATOM 268 CA PHE A 19 -0.294 11.476 5.822 1.00 0.00 C ATOM 269 C PHE A 19 -0.980 12.687 5.227 1.00 0.00 C ATOM 270 O PHE A 19 -1.377 13.599 5.973 1.00 0.00 O ATOM 271 CB PHE A 19 -1.232 10.785 6.836 1.00 0.00 C ATOM 272 CG PHE A 19 -0.533 9.751 7.679 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.019 8.629 7.100 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.389 9.934 9.041 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.695 7.699 7.859 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.290 9.013 9.810 1.00 0.00 C ATOM 277 CZ PHE A 19 0.832 7.889 9.217 1.00 0.00 C ATOM 0 H PHE A 19 0.929 11.768 7.495 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.052 10.764 5.033 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.671 11.540 7.488 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.053 10.312 6.298 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.080 8.476 6.035 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.814 10.810 9.509 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.117 6.822 7.390 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.398 9.170 10.873 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.361 7.162 9.815 1.00 0.00 H new ATOM 287 N ASP A 20 -1.098 12.737 3.896 1.00 0.00 N ATOM 288 CA ASP A 20 -1.731 13.871 3.245 1.00 0.00 C ATOM 289 C ASP A 20 -3.188 13.758 3.487 1.00 0.00 C ATOM 290 O ASP A 20 -3.800 12.747 3.105 1.00 0.00 O ATOM 291 CB ASP A 20 -1.477 13.852 1.735 1.00 0.00 C ATOM 292 CG ASP A 20 -2.033 15.086 1.048 1.00 0.00 C ATOM 293 OD1 ASP A 20 -1.323 16.101 0.965 1.00 0.00 O ATOM 294 OD2 ASP A 20 -3.180 15.074 0.598 1.00 0.00 O ATOM 0 H ASP A 20 -0.765 12.011 3.261 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.323 14.799 3.645 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.405 13.786 1.549 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.931 12.961 1.302 1.00 0.00 H new ATOM 299 N PHE A 21 -3.758 14.751 4.111 1.00 0.00 N ATOM 300 CA PHE A 21 -5.120 14.649 4.509 1.00 0.00 C ATOM 301 C PHE A 21 -6.045 14.666 3.319 1.00 0.00 C ATOM 302 O PHE A 21 -6.942 13.905 3.281 1.00 0.00 O ATOM 303 CB PHE A 21 -5.510 15.698 5.526 1.00 0.00 C ATOM 304 CG PHE A 21 -6.815 15.374 6.180 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.895 14.329 7.080 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.956 16.095 5.890 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.086 14.003 7.676 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.153 15.776 6.485 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.216 14.726 7.380 1.00 0.00 C ATOM 0 H PHE A 21 -3.299 15.630 4.350 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.227 13.683 5.002 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.732 15.776 6.285 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.579 16.670 5.038 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.007 13.761 7.317 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.908 16.916 5.190 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.136 13.181 8.375 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.042 16.345 6.253 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.156 14.473 7.848 1.00 0.00 H new ATOM 319 N ALA A 22 -5.788 15.528 2.359 1.00 0.00 N ATOM 320 CA ALA A 22 -6.573 15.610 1.116 1.00 0.00 C ATOM 321 C ALA A 22 -6.670 14.250 0.418 1.00 0.00 C ATOM 322 O ALA A 22 -7.747 13.864 -0.033 1.00 0.00 O ATOM 323 CB ALA A 22 -5.988 16.644 0.174 1.00 0.00 C ATOM 0 H ALA A 22 -5.025 16.203 2.406 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.582 15.918 1.390 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.585 16.686 -0.737 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.994 17.621 0.657 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.963 16.370 -0.077 1.00 0.00 H new ATOM 329 N VAL A 23 -5.549 13.544 0.332 1.00 0.00 N ATOM 330 CA VAL A 23 -5.514 12.179 -0.213 1.00 0.00 C ATOM 331 C VAL A 23 -6.455 11.260 0.588 1.00 0.00 C ATOM 332 O VAL A 23 -7.407 10.686 0.030 1.00 0.00 O ATOM 333 CB VAL A 23 -4.053 11.616 -0.195 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.006 10.128 -0.495 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.197 12.355 -1.201 1.00 0.00 C ATOM 0 H VAL A 23 -4.640 13.893 0.634 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.856 12.211 -1.247 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.665 11.768 0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.972 9.784 -0.471 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.585 9.587 0.253 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.427 9.943 -1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.183 11.955 -1.180 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.616 12.228 -2.199 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.174 13.415 -0.950 1.00 0.00 H new ATOM 345 N ILE A 24 -6.173 11.147 1.870 1.00 0.00 N ATOM 346 CA ILE A 24 -6.996 10.327 2.800 1.00 0.00 C ATOM 347 C ILE A 24 -8.488 10.685 2.653 1.00 0.00 C ATOM 348 O ILE A 24 -9.344 9.824 2.466 1.00 0.00 O ATOM 349 CB ILE A 24 -6.599 10.573 4.298 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.109 10.290 4.551 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.471 9.736 5.246 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.672 8.882 4.213 1.00 0.00 C ATOM 0 H ILE A 24 -5.379 11.608 2.315 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.816 9.284 2.540 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.776 11.629 4.504 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.514 10.992 3.966 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.889 10.483 5.601 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.174 9.927 6.277 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.518 10.009 5.114 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.341 8.678 5.021 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.608 8.771 4.422 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.236 8.171 4.817 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.856 8.688 3.156 1.00 0.00 H new ATOM 364 N LYS A 25 -8.732 11.959 2.680 1.00 0.00 N ATOM 365 CA LYS A 25 -10.034 12.567 2.648 1.00 0.00 C ATOM 366 C LYS A 25 -10.781 12.226 1.369 1.00 0.00 C ATOM 367 O LYS A 25 -11.954 11.889 1.419 1.00 0.00 O ATOM 368 CB LYS A 25 -9.844 14.074 2.788 1.00 0.00 C ATOM 369 CG LYS A 25 -11.081 14.902 3.006 1.00 0.00 C ATOM 370 CD LYS A 25 -10.687 16.352 3.233 1.00 0.00 C ATOM 371 CE LYS A 25 -10.257 17.054 1.953 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.379 17.264 1.015 1.00 0.00 N ATOM 0 H LYS A 25 -7.982 12.649 2.728 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.641 12.183 3.468 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.165 14.254 3.622 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.347 14.438 1.888 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.740 14.824 2.142 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.636 14.526 3.865 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.529 16.888 3.671 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.872 16.393 3.956 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.812 18.017 2.203 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.483 16.464 1.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.078 17.903 0.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.667 16.351 0.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.182 17.686 1.523 1.00 0.00 H new ATOM 386 N GLU A 26 -10.105 12.302 0.237 1.00 0.00 N ATOM 387 CA GLU A 26 -10.729 12.008 -1.038 1.00 0.00 C ATOM 388 C GLU A 26 -11.137 10.539 -1.128 1.00 0.00 C ATOM 389 O GLU A 26 -12.290 10.227 -1.476 1.00 0.00 O ATOM 390 CB GLU A 26 -9.825 12.410 -2.205 1.00 0.00 C ATOM 391 CG GLU A 26 -10.363 11.991 -3.562 1.00 0.00 C ATOM 392 CD GLU A 26 -9.560 12.518 -4.711 1.00 0.00 C ATOM 393 OE1 GLU A 26 -8.330 12.318 -4.749 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.160 13.130 -5.613 1.00 0.00 O ATOM 0 H GLU A 26 -9.122 12.566 0.176 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.638 12.606 -1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.691 13.492 -2.194 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.840 11.966 -2.061 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.387 10.903 -3.614 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.392 12.337 -3.659 1.00 0.00 H new ATOM 401 N LEU A 27 -10.215 9.647 -0.803 1.00 0.00 N ATOM 402 CA LEU A 27 -10.514 8.221 -0.872 1.00 0.00 C ATOM 403 C LEU A 27 -11.597 7.881 0.151 1.00 0.00 C ATOM 404 O LEU A 27 -12.463 7.062 -0.107 1.00 0.00 O ATOM 405 CB LEU A 27 -9.249 7.351 -0.672 1.00 0.00 C ATOM 406 CG LEU A 27 -9.376 5.875 -1.061 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.892 5.755 -2.472 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.021 5.190 -0.936 1.00 0.00 C ATOM 0 H LEU A 27 -9.270 9.876 -0.494 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.884 7.993 -1.871 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.436 7.789 -1.251 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.958 7.405 0.377 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.082 5.388 -0.388 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.979 4.702 -2.739 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.871 6.229 -2.543 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.200 6.247 -3.156 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.117 4.140 -1.214 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.305 5.677 -1.598 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.670 5.262 0.094 1.00 0.00 H new ATOM 420 N LYS A 28 -11.564 8.575 1.281 1.00 0.00 N ATOM 421 CA LYS A 28 -12.557 8.416 2.330 1.00 0.00 C ATOM 422 C LYS A 28 -13.928 8.892 1.843 1.00 0.00 C ATOM 423 O LYS A 28 -14.954 8.270 2.139 1.00 0.00 O ATOM 424 CB LYS A 28 -12.113 9.167 3.591 1.00 0.00 C ATOM 425 CG LYS A 28 -12.991 8.962 4.804 1.00 0.00 C ATOM 426 CD LYS A 28 -12.343 9.557 6.037 1.00 0.00 C ATOM 427 CE LYS A 28 -13.231 9.417 7.254 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.468 10.213 7.132 1.00 0.00 N ATOM 0 H LYS A 28 -10.845 9.266 1.495 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.647 7.359 2.583 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.098 8.858 3.840 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.075 10.233 3.366 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -13.964 9.425 4.638 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.167 7.897 4.957 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.390 9.062 6.222 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.127 10.611 5.863 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.488 8.367 7.396 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.682 9.734 8.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.938 10.268 8.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -14.233 11.172 6.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -15.106 9.760 6.446 1.00 0.00 H new ATOM 442 N THR A 29 -13.928 9.955 1.041 1.00 0.00 N ATOM 443 CA THR A 29 -15.138 10.495 0.480 1.00 0.00 C ATOM 444 C THR A 29 -15.723 9.498 -0.528 1.00 0.00 C ATOM 445 O THR A 29 -16.899 9.151 -0.446 1.00 0.00 O ATOM 446 CB THR A 29 -14.876 11.871 -0.209 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.339 12.799 0.748 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.156 12.454 -0.804 1.00 0.00 C ATOM 0 H THR A 29 -13.083 10.457 0.769 1.00 0.00 H new ATOM 0 HA THR A 29 -15.852 10.659 1.287 1.00 0.00 H new ATOM 0 HB THR A 29 -14.164 11.707 -1.017 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.395 12.593 0.910 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.935 13.412 -1.275 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.557 11.767 -1.549 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.891 12.600 -0.013 1.00 0.00 H new ATOM 456 N ALA A 30 -14.885 9.003 -1.441 1.00 0.00 N ATOM 457 CA ALA A 30 -15.303 8.040 -2.412 1.00 0.00 C ATOM 458 C ALA A 30 -15.782 6.776 -1.740 1.00 0.00 C ATOM 459 O ALA A 30 -16.779 6.248 -2.100 1.00 0.00 O ATOM 460 CB ALA A 30 -14.186 7.744 -3.384 1.00 0.00 C ATOM 0 H ALA A 30 -13.903 9.270 -1.512 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.138 8.460 -2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.524 7.009 -4.114 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.899 8.661 -3.898 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.327 7.348 -2.842 1.00 0.00 H new ATOM 466 N ALA A 31 -15.109 6.348 -0.726 1.00 0.00 N ATOM 467 CA ALA A 31 -15.480 5.160 -0.006 1.00 0.00 C ATOM 468 C ALA A 31 -16.805 5.318 0.711 1.00 0.00 C ATOM 469 O ALA A 31 -17.528 4.336 0.904 1.00 0.00 O ATOM 470 CB ALA A 31 -14.405 4.839 0.969 1.00 0.00 C ATOM 0 H ALA A 31 -14.276 6.812 -0.364 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.601 4.347 -0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.673 3.939 1.523 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.469 4.672 0.436 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.284 5.670 1.664 1.00 0.00 H new ATOM 476 N SER A 32 -17.130 6.519 1.131 1.00 0.00 N ATOM 477 CA SER A 32 -18.378 6.763 1.814 1.00 0.00 C ATOM 478 C SER A 32 -19.537 6.963 0.833 1.00 0.00 C ATOM 479 O SER A 32 -20.620 6.465 1.049 1.00 0.00 O ATOM 480 CB SER A 32 -18.242 7.987 2.715 1.00 0.00 C ATOM 481 OG SER A 32 -17.180 7.812 3.647 1.00 0.00 O ATOM 0 H SER A 32 -16.544 7.345 1.011 1.00 0.00 H new ATOM 0 HA SER A 32 -18.605 5.884 2.417 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.057 8.873 2.107 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.177 8.157 3.249 1.00 0.00 H new ATOM 0 HG SER A 32 -16.333 8.079 3.232 1.00 0.00 H new ATOM 487 N GLN A 33 -19.273 7.645 -0.262 1.00 0.00 N ATOM 488 CA GLN A 33 -20.305 8.040 -1.229 1.00 0.00 C ATOM 489 C GLN A 33 -20.469 6.987 -2.334 1.00 0.00 C ATOM 490 O GLN A 33 -21.562 6.503 -2.614 1.00 0.00 O ATOM 491 CB GLN A 33 -19.858 9.334 -1.896 1.00 0.00 C ATOM 492 CG GLN A 33 -19.738 10.534 -1.007 1.00 0.00 C ATOM 493 CD GLN A 33 -21.055 11.143 -0.741 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.725 10.835 0.240 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.461 11.966 -1.644 1.00 0.00 N ATOM 0 H GLN A 33 -18.333 7.948 -0.518 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.251 8.152 -0.698 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.891 9.159 -2.367 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.563 9.569 -2.694 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.272 10.245 -0.065 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.083 11.270 -1.474 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.862 12.186 -2.440 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.382 12.398 -1.564 1.00 0.00 H new ATOM 504 N TYR A 34 -19.354 6.631 -2.897 1.00 0.00 N ATOM 505 CA TYR A 34 -19.225 5.800 -4.086 1.00 0.00 C ATOM 506 C TYR A 34 -19.119 4.358 -3.689 1.00 0.00 C ATOM 507 O TYR A 34 -19.724 3.468 -4.303 1.00 0.00 O ATOM 508 CB TYR A 34 -17.975 6.302 -4.871 1.00 0.00 C ATOM 509 CG TYR A 34 -18.231 7.580 -5.631 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.224 8.805 -4.986 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.514 7.554 -6.988 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.485 9.975 -5.655 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.773 8.722 -7.674 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.758 9.928 -7.004 1.00 0.00 C ATOM 515 OH TYR A 34 -19.019 11.089 -7.689 1.00 0.00 O ATOM 0 H TYR A 34 -18.449 6.923 -2.527 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.100 5.877 -4.731 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.153 6.459 -4.173 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.656 5.528 -5.569 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.007 8.841 -3.929 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -18.532 6.610 -7.513 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -18.476 10.919 -5.131 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.987 8.693 -8.732 1.00 0.00 H new ATOM 0 HH TYR A 34 -19.191 10.881 -8.631 1.00 0.00 H new ATOM 525 N GLY A 35 -18.411 4.137 -2.621 1.00 0.00 N ATOM 526 CA GLY A 35 -18.257 2.850 -2.093 1.00 0.00 C ATOM 527 C GLY A 35 -17.472 1.908 -2.944 1.00 0.00 C ATOM 528 O GLY A 35 -16.880 2.276 -3.959 1.00 0.00 O ATOM 0 H GLY A 35 -17.926 4.867 -2.099 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.771 2.928 -1.121 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -19.245 2.423 -1.922 1.00 0.00 H new ATOM 532 N ALA A 36 -17.514 0.691 -2.538 1.00 0.00 N ATOM 533 CA ALA A 36 -16.820 -0.388 -3.145 1.00 0.00 C ATOM 534 C ALA A 36 -17.296 -0.647 -4.549 1.00 0.00 C ATOM 535 O ALA A 36 -18.489 -0.585 -4.847 1.00 0.00 O ATOM 536 CB ALA A 36 -17.058 -1.580 -2.321 1.00 0.00 C ATOM 0 H ALA A 36 -18.064 0.404 -1.728 1.00 0.00 H new ATOM 0 HA ALA A 36 -15.760 -0.143 -3.206 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -16.539 -2.433 -2.757 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -16.685 -1.405 -1.312 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -18.127 -1.787 -2.282 1.00 0.00 H new ATOM 542 N THR A 37 -16.322 -0.907 -5.404 1.00 0.00 N ATOM 543 CA THR A 37 -16.458 -1.267 -6.808 1.00 0.00 C ATOM 544 C THR A 37 -16.781 -0.082 -7.722 1.00 0.00 C ATOM 545 O THR A 37 -16.670 -0.210 -8.953 1.00 0.00 O ATOM 546 CB THR A 37 -17.372 -2.484 -7.113 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.749 -2.191 -6.913 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.013 -3.628 -6.249 1.00 0.00 C ATOM 0 H THR A 37 -15.344 -0.870 -5.116 1.00 0.00 H new ATOM 0 HA THR A 37 -15.451 -1.605 -7.052 1.00 0.00 H new ATOM 0 HB THR A 37 -17.216 -2.730 -8.163 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.835 -1.376 -6.376 1.00 0.00 H new ATOM 0 HG21 THR A 37 -17.663 -4.473 -6.475 1.00 0.00 H new ATOM 0 HG22 THR A 37 -15.976 -3.909 -6.430 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.135 -3.346 -5.203 1.00 0.00 H new ATOM 556 N ALA A 38 -17.176 1.071 -7.143 1.00 0.00 N ATOM 557 CA ALA A 38 -17.360 2.256 -7.929 1.00 0.00 C ATOM 558 C ALA A 38 -16.006 2.638 -8.510 1.00 0.00 C ATOM 559 O ALA A 38 -15.032 2.824 -7.752 1.00 0.00 O ATOM 560 CB ALA A 38 -17.914 3.379 -7.086 1.00 0.00 C ATOM 0 H ALA A 38 -17.365 1.182 -6.147 1.00 0.00 H new ATOM 0 HA ALA A 38 -18.078 2.070 -8.728 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -18.045 4.267 -7.704 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.876 3.081 -6.670 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.221 3.601 -6.274 1.00 0.00 H new ATOM 566 N PRO A 39 -15.919 2.721 -9.856 1.00 0.00 N ATOM 567 CA PRO A 39 -14.667 2.974 -10.592 1.00 0.00 C ATOM 568 C PRO A 39 -13.819 4.095 -10.018 1.00 0.00 C ATOM 569 O PRO A 39 -12.586 4.020 -10.050 1.00 0.00 O ATOM 570 CB PRO A 39 -15.153 3.340 -11.978 1.00 0.00 C ATOM 571 CG PRO A 39 -16.410 2.571 -12.139 1.00 0.00 C ATOM 572 CD PRO A 39 -17.063 2.564 -10.790 1.00 0.00 C ATOM 0 HA PRO A 39 -14.010 2.105 -10.551 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -15.328 4.412 -12.068 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.422 3.071 -12.740 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -17.058 3.033 -12.884 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.206 1.556 -12.479 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.781 3.377 -10.687 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -17.605 1.635 -10.610 1.00 0.00 H new ATOM 580 N TYR A 40 -14.475 5.113 -9.479 1.00 0.00 N ATOM 581 CA TYR A 40 -13.797 6.247 -8.895 1.00 0.00 C ATOM 582 C TYR A 40 -12.869 5.831 -7.739 1.00 0.00 C ATOM 583 O TYR A 40 -11.653 5.992 -7.846 1.00 0.00 O ATOM 584 CB TYR A 40 -14.805 7.312 -8.419 1.00 0.00 C ATOM 585 CG TYR A 40 -14.167 8.630 -8.020 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.691 9.494 -8.985 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.033 9.000 -6.692 1.00 0.00 C ATOM 588 CE1 TYR A 40 -13.101 10.689 -8.649 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.440 10.203 -6.340 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.973 11.043 -7.328 1.00 0.00 C ATOM 591 OH TYR A 40 -12.395 12.259 -7.004 1.00 0.00 O ATOM 0 H TYR A 40 -15.493 5.170 -9.437 1.00 0.00 H new ATOM 0 HA TYR A 40 -13.175 6.682 -9.678 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.527 7.496 -9.215 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.361 6.917 -7.569 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.784 9.225 -10.027 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.396 8.341 -5.918 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.738 11.349 -9.423 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.345 10.479 -5.300 1.00 0.00 H new ATOM 0 HH TYR A 40 -11.590 12.106 -6.466 1.00 0.00 H new ATOM 601 N THR A 41 -13.433 5.278 -6.637 1.00 0.00 N ATOM 602 CA THR A 41 -12.660 4.937 -5.443 1.00 0.00 C ATOM 603 C THR A 41 -11.466 4.000 -5.736 1.00 0.00 C ATOM 604 O THR A 41 -10.360 4.258 -5.274 1.00 0.00 O ATOM 605 CB THR A 41 -13.560 4.376 -4.276 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.851 4.412 -3.036 1.00 0.00 O ATOM 607 CG2 THR A 41 -14.011 2.949 -4.526 1.00 0.00 C ATOM 0 H THR A 41 -14.427 5.062 -6.562 1.00 0.00 H new ATOM 0 HA THR A 41 -12.237 5.881 -5.099 1.00 0.00 H new ATOM 0 HB THR A 41 -14.441 5.016 -4.234 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.423 4.062 -2.322 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.627 2.611 -3.693 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.592 2.907 -5.448 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.138 2.302 -4.617 1.00 0.00 H new ATOM 615 N LEU A 42 -11.655 2.955 -6.535 1.00 0.00 N ATOM 616 CA LEU A 42 -10.538 2.076 -6.793 1.00 0.00 C ATOM 617 C LEU A 42 -9.531 2.638 -7.755 1.00 0.00 C ATOM 618 O LEU A 42 -8.384 2.272 -7.702 1.00 0.00 O ATOM 619 CB LEU A 42 -10.825 0.551 -6.961 1.00 0.00 C ATOM 620 CG LEU A 42 -11.985 0.063 -7.838 1.00 0.00 C ATOM 621 CD1 LEU A 42 -13.296 0.252 -7.122 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.992 0.738 -9.203 1.00 0.00 C ATOM 0 H LEU A 42 -12.532 2.709 -6.994 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.048 2.066 -5.819 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.915 0.095 -7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.984 0.143 -5.963 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.842 -1.002 -8.019 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -14.111 -0.098 -7.756 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.288 -0.318 -6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.439 1.309 -6.898 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.830 0.362 -9.790 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -12.092 1.816 -9.075 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.059 0.520 -9.722 1.00 0.00 H new ATOM 634 N ALA A 43 -9.953 3.599 -8.594 1.00 0.00 N ATOM 635 CA ALA A 43 -9.014 4.301 -9.474 1.00 0.00 C ATOM 636 C ALA A 43 -8.026 5.050 -8.620 1.00 0.00 C ATOM 637 O ALA A 43 -6.852 5.163 -8.943 1.00 0.00 O ATOM 638 CB ALA A 43 -9.730 5.268 -10.409 1.00 0.00 C ATOM 0 H ALA A 43 -10.923 3.901 -8.679 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.503 3.567 -10.097 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.999 5.768 -11.044 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -10.435 4.717 -11.031 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.268 6.011 -9.821 1.00 0.00 H new ATOM 644 N ILE A 44 -8.516 5.515 -7.507 1.00 0.00 N ATOM 645 CA ILE A 44 -7.713 6.220 -6.546 1.00 0.00 C ATOM 646 C ILE A 44 -6.786 5.229 -5.811 1.00 0.00 C ATOM 647 O ILE A 44 -5.639 5.546 -5.587 1.00 0.00 O ATOM 648 CB ILE A 44 -8.589 6.984 -5.549 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.495 7.954 -6.298 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.717 7.751 -4.546 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.625 8.469 -5.468 1.00 0.00 C ATOM 0 H ILE A 44 -9.495 5.415 -7.237 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.102 6.951 -7.075 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.202 6.269 -5.000 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.900 8.796 -6.652 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.899 7.456 -7.180 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.356 8.288 -3.845 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.088 7.049 -3.999 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.087 8.462 -5.081 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.230 9.154 -6.062 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.242 7.634 -5.136 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.228 8.995 -4.600 1.00 0.00 H new ATOM 663 N VAL A 45 -7.289 4.016 -5.481 1.00 0.00 N ATOM 664 CA VAL A 45 -6.434 2.953 -4.865 1.00 0.00 C ATOM 665 C VAL A 45 -5.242 2.658 -5.825 1.00 0.00 C ATOM 666 O VAL A 45 -4.078 2.530 -5.403 1.00 0.00 O ATOM 667 CB VAL A 45 -7.231 1.607 -4.565 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.338 0.565 -3.879 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.455 1.852 -3.690 1.00 0.00 C ATOM 0 H VAL A 45 -8.262 3.744 -5.624 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.082 3.325 -3.903 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.556 1.227 -5.534 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.915 -0.340 -3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.493 0.328 -4.525 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.971 0.966 -2.934 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.969 0.908 -3.510 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.142 2.281 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.131 2.542 -4.195 1.00 0.00 H new ATOM 679 N GLU A 46 -5.548 2.632 -7.116 1.00 0.00 N ATOM 680 CA GLU A 46 -4.554 2.427 -8.161 1.00 0.00 C ATOM 681 C GLU A 46 -3.576 3.621 -8.202 1.00 0.00 C ATOM 682 O GLU A 46 -2.360 3.450 -8.195 1.00 0.00 O ATOM 683 CB GLU A 46 -5.264 2.309 -9.510 1.00 0.00 C ATOM 684 CG GLU A 46 -6.328 1.219 -9.572 1.00 0.00 C ATOM 685 CD GLU A 46 -5.797 -0.182 -9.652 1.00 0.00 C ATOM 686 OE1 GLU A 46 -5.046 -0.609 -8.751 1.00 0.00 O ATOM 687 OE2 GLU A 46 -6.188 -0.924 -10.603 1.00 0.00 O ATOM 0 H GLU A 46 -6.497 2.753 -7.469 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.995 1.515 -7.952 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.729 3.266 -9.747 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.519 2.116 -10.282 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.963 1.301 -8.690 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.963 1.401 -10.439 1.00 0.00 H new ATOM 694 N SER A 47 -4.146 4.830 -8.206 1.00 0.00 N ATOM 695 CA SER A 47 -3.390 6.075 -8.287 1.00 0.00 C ATOM 696 C SER A 47 -2.441 6.257 -7.101 1.00 0.00 C ATOM 697 O SER A 47 -1.273 6.605 -7.290 1.00 0.00 O ATOM 698 CB SER A 47 -4.340 7.271 -8.383 1.00 0.00 C ATOM 699 OG SER A 47 -5.201 7.149 -9.510 1.00 0.00 O ATOM 0 H SER A 47 -5.155 4.969 -8.152 1.00 0.00 H new ATOM 0 HA SER A 47 -2.781 6.020 -9.189 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.935 7.342 -7.472 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.763 8.193 -8.459 1.00 0.00 H new ATOM 0 HG SER A 47 -5.839 6.421 -9.357 1.00 0.00 H new ATOM 705 N VAL A 48 -2.931 6.005 -5.886 1.00 0.00 N ATOM 706 CA VAL A 48 -2.105 6.149 -4.703 1.00 0.00 C ATOM 707 C VAL A 48 -0.935 5.195 -4.756 1.00 0.00 C ATOM 708 O VAL A 48 0.191 5.584 -4.507 1.00 0.00 O ATOM 709 CB VAL A 48 -2.887 6.018 -3.347 1.00 0.00 C ATOM 710 CG1 VAL A 48 -3.848 7.172 -3.164 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.643 4.707 -3.236 1.00 0.00 C ATOM 0 H VAL A 48 -3.888 5.703 -5.704 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.736 7.175 -4.718 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.136 6.039 -2.557 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.377 7.058 -2.218 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.293 8.110 -3.159 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.567 7.180 -3.983 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.166 4.668 -2.280 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.366 4.634 -4.048 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.941 3.876 -3.300 1.00 0.00 H new ATOM 721 N ALA A 49 -1.193 3.985 -5.209 1.00 0.00 N ATOM 722 CA ALA A 49 -0.179 2.957 -5.285 1.00 0.00 C ATOM 723 C ALA A 49 0.882 3.237 -6.335 1.00 0.00 C ATOM 724 O ALA A 49 1.950 2.680 -6.277 1.00 0.00 O ATOM 725 CB ALA A 49 -0.811 1.625 -5.536 1.00 0.00 C ATOM 0 H ALA A 49 -2.113 3.688 -5.535 1.00 0.00 H new ATOM 0 HA ALA A 49 0.329 2.951 -4.321 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.037 0.860 -5.591 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.497 1.389 -4.723 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.360 1.654 -6.477 1.00 0.00 H new ATOM 731 N ASP A 50 0.609 4.155 -7.262 1.00 0.00 N ATOM 732 CA ASP A 50 1.566 4.475 -8.342 1.00 0.00 C ATOM 733 C ASP A 50 2.727 5.332 -7.795 1.00 0.00 C ATOM 734 O ASP A 50 3.674 5.699 -8.503 1.00 0.00 O ATOM 735 CB ASP A 50 0.835 5.176 -9.512 1.00 0.00 C ATOM 736 CG ASP A 50 1.732 5.555 -10.677 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.262 4.664 -11.363 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.918 6.765 -10.927 1.00 0.00 O ATOM 0 H ASP A 50 -0.258 4.691 -7.295 1.00 0.00 H new ATOM 0 HA ASP A 50 1.995 3.550 -8.726 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.045 4.519 -9.876 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.351 6.077 -9.134 1.00 0.00 H new ATOM 743 N ASN A 51 2.653 5.592 -6.519 1.00 0.00 N ATOM 744 CA ASN A 51 3.629 6.365 -5.784 1.00 0.00 C ATOM 745 C ASN A 51 4.468 5.404 -4.968 1.00 0.00 C ATOM 746 O ASN A 51 4.081 4.278 -4.791 1.00 0.00 O ATOM 747 CB ASN A 51 2.912 7.329 -4.820 1.00 0.00 C ATOM 748 CG ASN A 51 2.140 8.429 -5.512 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.647 9.523 -5.706 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.921 8.157 -5.887 1.00 0.00 N ATOM 0 H ASN A 51 1.884 5.261 -5.936 1.00 0.00 H new ATOM 0 HA ASN A 51 4.247 6.938 -6.476 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.227 6.757 -4.193 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.651 7.779 -4.157 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.361 8.868 -6.357 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.527 7.233 -5.710 1.00 0.00 H new ATOM 757 N TRP A 52 5.592 5.855 -4.441 1.00 0.00 N ATOM 758 CA TRP A 52 6.450 4.979 -3.610 1.00 0.00 C ATOM 759 C TRP A 52 6.015 4.984 -2.149 1.00 0.00 C ATOM 760 O TRP A 52 6.732 4.471 -1.300 1.00 0.00 O ATOM 761 CB TRP A 52 7.920 5.409 -3.662 1.00 0.00 C ATOM 762 CG TRP A 52 8.608 5.258 -4.984 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.192 4.547 -6.071 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.881 5.807 -5.326 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.120 4.647 -7.073 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.166 5.415 -6.641 1.00 0.00 C ATOM 767 CE3 TRP A 52 10.807 6.608 -4.645 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.335 5.790 -7.291 1.00 0.00 C ATOM 769 CZ3 TRP A 52 11.965 6.978 -5.292 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.220 6.570 -6.602 1.00 0.00 C ATOM 0 H TRP A 52 5.942 6.805 -4.561 1.00 0.00 H new ATOM 0 HA TRP A 52 6.342 3.977 -4.026 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.982 6.455 -3.361 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.472 4.831 -2.921 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.269 3.989 -6.132 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.043 4.217 -7.995 1.00 0.00 H new ATOM 0 HE3 TRP A 52 10.616 6.929 -3.632 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.537 5.476 -8.304 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 12.688 7.594 -4.777 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.137 6.878 -7.082 1.00 0.00 H new ATOM 781 N LEU A 53 4.897 5.657 -1.893 1.00 0.00 N ATOM 782 CA LEU A 53 4.280 5.808 -0.549 1.00 0.00 C ATOM 783 C LEU A 53 4.472 4.557 0.352 1.00 0.00 C ATOM 784 O LEU A 53 4.306 3.406 -0.077 1.00 0.00 O ATOM 785 CB LEU A 53 2.768 6.149 -0.676 1.00 0.00 C ATOM 786 CG LEU A 53 1.780 5.001 -0.993 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.352 5.501 -0.945 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.056 4.369 -2.338 1.00 0.00 C ATOM 0 H LEU A 53 4.369 6.131 -2.625 1.00 0.00 H new ATOM 0 HA LEU A 53 4.800 6.633 -0.062 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.452 6.611 0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.662 6.903 -1.456 1.00 0.00 H new ATOM 0 HG LEU A 53 1.923 4.236 -0.229 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.329 4.680 -1.170 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.136 5.889 0.050 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.219 6.295 -1.680 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.338 3.569 -2.518 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.963 5.123 -3.120 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.066 3.960 -2.347 1.00 0.00 H new ATOM 800 N THR A 54 4.813 4.804 1.586 1.00 0.00 N ATOM 801 CA THR A 54 5.156 3.782 2.514 1.00 0.00 C ATOM 802 C THR A 54 3.943 2.973 2.989 1.00 0.00 C ATOM 803 O THR A 54 2.810 3.476 3.010 1.00 0.00 O ATOM 804 CB THR A 54 5.901 4.408 3.708 1.00 0.00 C ATOM 805 OG1 THR A 54 5.587 5.814 3.790 1.00 0.00 O ATOM 806 CG2 THR A 54 7.411 4.213 3.585 1.00 0.00 C ATOM 0 H THR A 54 4.859 5.745 1.976 1.00 0.00 H new ATOM 0 HA THR A 54 5.806 3.074 2.001 1.00 0.00 H new ATOM 0 HB THR A 54 5.574 3.906 4.619 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.662 5.925 4.094 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.907 4.666 4.443 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.639 3.148 3.555 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.766 4.686 2.669 1.00 0.00 H new ATOM 814 N PRO A 55 4.164 1.693 3.386 1.00 0.00 N ATOM 815 CA PRO A 55 3.102 0.822 3.911 1.00 0.00 C ATOM 816 C PRO A 55 2.377 1.438 5.113 1.00 0.00 C ATOM 817 O PRO A 55 1.254 1.054 5.427 1.00 0.00 O ATOM 818 CB PRO A 55 3.852 -0.445 4.329 1.00 0.00 C ATOM 819 CG PRO A 55 5.058 -0.465 3.462 1.00 0.00 C ATOM 820 CD PRO A 55 5.453 0.973 3.289 1.00 0.00 C ATOM 0 HA PRO A 55 2.321 0.646 3.171 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.122 -0.416 5.385 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.241 -1.335 4.180 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.862 -1.040 3.922 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.842 -0.931 2.501 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.152 1.294 4.061 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.938 1.144 2.328 1.00 0.00 H new ATOM 828 N THR A 56 3.031 2.396 5.757 1.00 0.00 N ATOM 829 CA THR A 56 2.490 3.127 6.873 1.00 0.00 C ATOM 830 C THR A 56 1.263 3.934 6.403 1.00 0.00 C ATOM 831 O THR A 56 0.176 3.849 6.998 1.00 0.00 O ATOM 832 CB THR A 56 3.553 4.091 7.386 1.00 0.00 C ATOM 833 OG1 THR A 56 4.818 3.404 7.408 1.00 0.00 O ATOM 834 CG2 THR A 56 3.210 4.546 8.793 1.00 0.00 C ATOM 0 H THR A 56 3.976 2.686 5.504 1.00 0.00 H new ATOM 0 HA THR A 56 2.195 2.437 7.664 1.00 0.00 H new ATOM 0 HB THR A 56 3.601 4.963 6.734 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.514 4.011 7.734 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.976 5.234 9.150 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.244 5.050 8.787 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.164 3.681 9.454 1.00 0.00 H new ATOM 842 N ASP A 57 1.440 4.685 5.336 1.00 0.00 N ATOM 843 CA ASP A 57 0.356 5.447 4.783 1.00 0.00 C ATOM 844 C ASP A 57 -0.618 4.620 3.992 1.00 0.00 C ATOM 845 O ASP A 57 -1.804 4.966 3.935 1.00 0.00 O ATOM 846 CB ASP A 57 0.793 6.762 4.109 1.00 0.00 C ATOM 847 CG ASP A 57 1.928 6.659 3.140 1.00 0.00 C ATOM 848 OD1 ASP A 57 3.061 6.349 3.568 1.00 0.00 O ATOM 849 OD2 ASP A 57 1.767 7.053 1.996 1.00 0.00 O ATOM 0 H ASP A 57 2.326 4.780 4.840 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.224 5.785 5.642 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.067 7.182 3.587 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.071 7.471 4.889 1.00 0.00 H new ATOM 854 N TRP A 58 -0.151 3.497 3.418 1.00 0.00 N ATOM 855 CA TRP A 58 -1.085 2.507 2.860 1.00 0.00 C ATOM 856 C TRP A 58 -2.045 2.090 3.990 1.00 0.00 C ATOM 857 O TRP A 58 -3.264 2.214 3.879 1.00 0.00 O ATOM 858 CB TRP A 58 -0.367 1.228 2.359 1.00 0.00 C ATOM 859 CG TRP A 58 0.304 1.235 0.991 1.00 0.00 C ATOM 860 CD1 TRP A 58 1.504 1.775 0.645 1.00 0.00 C ATOM 861 CD2 TRP A 58 -0.180 0.576 -0.202 1.00 0.00 C ATOM 862 NE1 TRP A 58 1.791 1.494 -0.679 1.00 0.00 N ATOM 863 CE2 TRP A 58 0.780 0.768 -1.213 1.00 0.00 C ATOM 864 CE3 TRP A 58 -1.333 -0.152 -0.511 1.00 0.00 C ATOM 865 CZ2 TRP A 58 0.631 0.255 -2.501 1.00 0.00 C ATOM 866 CZ3 TRP A 58 -1.479 -0.661 -1.790 1.00 0.00 C ATOM 867 CH2 TRP A 58 -0.501 -0.458 -2.771 1.00 0.00 C ATOM 0 H TRP A 58 0.837 3.258 3.330 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.596 2.962 2.011 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.394 0.970 3.095 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.099 0.420 2.361 1.00 0.00 H new ATOM 0 HD1 TRP A 58 2.141 2.341 1.308 1.00 0.00 H new ATOM 0 HE1 TRP A 58 2.632 1.788 -1.175 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -2.097 -0.314 0.235 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.384 0.416 -3.258 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -2.366 -1.226 -2.036 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -0.645 -0.873 -3.758 1.00 0.00 H new ATOM 878 N ASN A 59 -1.464 1.641 5.101 1.00 0.00 N ATOM 879 CA ASN A 59 -2.208 1.201 6.305 1.00 0.00 C ATOM 880 C ASN A 59 -3.223 2.255 6.744 1.00 0.00 C ATOM 881 O ASN A 59 -4.383 1.951 7.064 1.00 0.00 O ATOM 882 CB ASN A 59 -1.201 0.910 7.442 1.00 0.00 C ATOM 883 CG ASN A 59 -1.840 0.695 8.796 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.273 -0.411 9.120 1.00 0.00 O ATOM 885 ND2 ASN A 59 -1.838 1.717 9.631 1.00 0.00 N ATOM 0 H ASN A 59 -0.452 1.567 5.203 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.763 0.294 6.066 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.622 0.024 7.181 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.499 1.741 7.512 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.203 1.604 10.577 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.472 2.620 9.331 1.00 0.00 H new ATOM 892 N THR A 60 -2.789 3.480 6.651 1.00 0.00 N ATOM 893 CA THR A 60 -3.607 4.598 7.035 1.00 0.00 C ATOM 894 C THR A 60 -4.833 4.743 6.102 1.00 0.00 C ATOM 895 O THR A 60 -5.926 5.128 6.553 1.00 0.00 O ATOM 896 CB THR A 60 -2.754 5.879 7.062 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.644 5.656 7.951 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.565 7.071 7.569 1.00 0.00 C ATOM 0 H THR A 60 -1.862 3.733 6.308 1.00 0.00 H new ATOM 0 HA THR A 60 -3.996 4.424 8.038 1.00 0.00 H new ATOM 0 HB THR A 60 -2.414 6.104 6.051 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.989 6.377 7.844 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.937 7.962 7.577 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.419 7.236 6.912 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.918 6.867 8.580 1.00 0.00 H new ATOM 906 N LEU A 61 -4.673 4.345 4.831 1.00 0.00 N ATOM 907 CA LEU A 61 -5.760 4.434 3.871 1.00 0.00 C ATOM 908 C LEU A 61 -6.838 3.491 4.268 1.00 0.00 C ATOM 909 O LEU A 61 -7.905 3.911 4.637 1.00 0.00 O ATOM 910 CB LEU A 61 -5.333 4.044 2.450 1.00 0.00 C ATOM 911 CG LEU A 61 -4.241 4.848 1.801 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.901 4.252 0.446 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.648 6.298 1.657 1.00 0.00 C ATOM 0 H LEU A 61 -3.805 3.963 4.456 1.00 0.00 H new ATOM 0 HA LEU A 61 -6.089 5.473 3.869 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.015 3.002 2.470 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.213 4.096 1.809 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.357 4.812 2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.109 4.838 -0.021 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.564 3.224 0.575 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.786 4.266 -0.190 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.840 6.857 1.185 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.544 6.365 1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.853 6.718 2.642 1.00 0.00 H new ATOM 925 N VAL A 62 -6.499 2.211 4.305 1.00 0.00 N ATOM 926 CA VAL A 62 -7.511 1.158 4.469 1.00 0.00 C ATOM 927 C VAL A 62 -8.296 1.321 5.752 1.00 0.00 C ATOM 928 O VAL A 62 -9.516 1.178 5.778 1.00 0.00 O ATOM 929 CB VAL A 62 -6.902 -0.282 4.372 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.798 -0.517 5.398 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.987 -1.331 4.511 1.00 0.00 C ATOM 0 H VAL A 62 -5.541 1.870 4.225 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.202 1.276 3.634 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.447 -0.369 3.385 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.409 -1.529 5.289 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.993 0.200 5.237 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.202 -0.390 6.402 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.544 -2.324 4.441 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.478 -1.220 5.478 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.720 -1.204 3.715 1.00 0.00 H new ATOM 941 N ARG A 63 -7.600 1.696 6.772 1.00 0.00 N ATOM 942 CA ARG A 63 -8.229 1.819 8.066 1.00 0.00 C ATOM 943 C ARG A 63 -9.108 3.079 8.208 1.00 0.00 C ATOM 944 O ARG A 63 -10.033 3.099 9.014 1.00 0.00 O ATOM 945 CB ARG A 63 -7.217 1.750 9.184 1.00 0.00 C ATOM 946 CG ARG A 63 -6.286 2.923 9.262 1.00 0.00 C ATOM 947 CD ARG A 63 -5.314 2.745 10.389 1.00 0.00 C ATOM 948 NE ARG A 63 -6.008 2.575 11.681 1.00 0.00 N ATOM 949 CZ ARG A 63 -5.427 2.544 12.886 1.00 0.00 C ATOM 950 NH1 ARG A 63 -4.134 2.787 13.015 1.00 0.00 N ATOM 951 NH2 ARG A 63 -6.159 2.285 13.960 1.00 0.00 N ATOM 0 H ARG A 63 -6.606 1.923 6.748 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.899 0.963 8.145 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.749 1.662 10.132 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.626 0.842 9.065 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.746 3.030 8.321 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.857 3.840 9.408 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.686 1.875 10.195 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.653 3.610 10.441 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.022 2.472 11.652 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.571 3.000 12.192 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.700 2.761 13.938 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.160 2.111 13.865 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.722 2.260 14.881 1.00 0.00 H new ATOM 965 N ALA A 64 -8.803 4.136 7.488 1.00 0.00 N ATOM 966 CA ALA A 64 -9.590 5.356 7.624 1.00 0.00 C ATOM 967 C ALA A 64 -10.567 5.570 6.473 1.00 0.00 C ATOM 968 O ALA A 64 -11.770 5.775 6.689 1.00 0.00 O ATOM 969 CB ALA A 64 -8.662 6.559 7.745 1.00 0.00 C ATOM 0 H ALA A 64 -8.037 4.184 6.817 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.188 5.247 8.529 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.256 7.468 7.846 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.026 6.441 8.622 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.040 6.630 6.853 1.00 0.00 H new ATOM 975 N VAL A 65 -10.019 5.580 5.290 1.00 0.00 N ATOM 976 CA VAL A 65 -10.777 5.902 4.079 1.00 0.00 C ATOM 977 C VAL A 65 -12.084 5.105 3.928 1.00 0.00 C ATOM 978 O VAL A 65 -13.146 5.690 3.684 1.00 0.00 O ATOM 979 CB VAL A 65 -9.931 5.859 2.762 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.642 6.648 2.918 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.664 4.446 2.253 1.00 0.00 C ATOM 0 H VAL A 65 -9.036 5.367 5.122 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.060 6.943 4.232 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.539 6.337 1.994 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.073 6.602 1.990 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.877 7.687 3.149 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.050 6.221 3.728 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -9.073 4.494 1.338 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.116 3.884 3.010 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.612 3.948 2.047 1.00 0.00 H new ATOM 991 N LEU A 66 -12.038 3.821 4.143 1.00 0.00 N ATOM 992 CA LEU A 66 -13.208 3.035 3.947 1.00 0.00 C ATOM 993 C LEU A 66 -13.567 2.342 5.264 1.00 0.00 C ATOM 994 O LEU A 66 -12.728 2.256 6.175 1.00 0.00 O ATOM 995 CB LEU A 66 -12.999 2.076 2.726 1.00 0.00 C ATOM 996 CG LEU A 66 -14.265 1.549 1.998 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.959 1.218 0.547 1.00 0.00 C ATOM 998 CD2 LEU A 66 -14.818 0.332 2.678 1.00 0.00 C ATOM 0 H LEU A 66 -11.212 3.308 4.450 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.071 3.648 3.686 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.382 2.596 1.993 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -12.427 1.214 3.070 1.00 0.00 H new ATOM 0 HG LEU A 66 -15.011 2.343 2.036 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.862 0.851 0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.609 2.115 0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.186 0.451 0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.704 -0.012 2.144 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -14.066 -0.457 2.680 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.087 0.580 3.705 1.00 0.00 H new ATOM 1010 N SER A 67 -14.783 1.938 5.387 1.00 0.00 N ATOM 1011 CA SER A 67 -15.244 1.302 6.608 1.00 0.00 C ATOM 1012 C SER A 67 -16.331 0.264 6.340 1.00 0.00 C ATOM 1013 O SER A 67 -17.397 0.586 5.826 1.00 0.00 O ATOM 1014 CB SER A 67 -15.719 2.365 7.612 1.00 0.00 C ATOM 1015 OG SER A 67 -14.629 3.229 7.969 1.00 0.00 O ATOM 0 H SER A 67 -15.494 2.030 4.661 1.00 0.00 H new ATOM 0 HA SER A 67 -14.402 0.764 7.043 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.530 2.950 7.178 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.117 1.882 8.504 1.00 0.00 H new ATOM 0 HG SER A 67 -14.942 3.904 8.607 1.00 0.00 H new ATOM 1021 N GLY A 68 -16.022 -0.976 6.636 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.964 -2.055 6.536 1.00 0.00 C ATOM 1023 C GLY A 68 -16.340 -3.243 5.865 1.00 0.00 C ATOM 1024 O GLY A 68 -15.794 -4.136 6.527 1.00 0.00 O ATOM 0 H GLY A 68 -15.097 -1.263 6.956 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.312 -2.334 7.531 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.838 -1.730 5.972 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.382 -3.235 4.558 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.840 -4.313 3.764 1.00 0.00 C ATOM 1030 C GLY A 69 -14.324 -4.286 3.672 1.00 0.00 C ATOM 1031 O GLY A 69 -13.698 -5.313 3.372 1.00 0.00 O ATOM 0 H GLY A 69 -16.794 -2.480 4.010 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.154 -5.265 4.192 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.259 -4.262 2.759 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.754 -3.111 3.939 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.317 -2.797 3.750 1.00 0.00 C ATOM 1037 C ASP A 70 -11.391 -3.902 4.234 1.00 0.00 C ATOM 1038 O ASP A 70 -10.705 -4.549 3.416 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.944 -1.439 4.439 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.226 -1.393 5.950 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.411 -1.419 6.346 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.279 -1.395 6.761 1.00 0.00 O ATOM 0 H ASP A 70 -14.286 -2.321 4.304 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.168 -2.709 2.674 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.885 -1.241 4.273 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.498 -0.636 3.954 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.445 -4.176 5.521 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.556 -5.107 6.158 1.00 0.00 C ATOM 1049 C HIS A 71 -10.713 -6.503 5.587 1.00 0.00 C ATOM 1050 O HIS A 71 -9.743 -7.115 5.188 1.00 0.00 O ATOM 1051 CB HIS A 71 -10.797 -5.117 7.666 1.00 0.00 C ATOM 1052 CG HIS A 71 -9.715 -5.785 8.460 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -9.888 -6.975 9.118 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -8.449 -5.396 8.727 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -8.785 -7.290 9.753 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -7.899 -6.352 9.533 1.00 0.00 N ATOM 0 H HIS A 71 -12.119 -3.749 6.157 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.534 -4.783 5.964 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -10.903 -4.089 8.012 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.743 -5.620 7.868 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -7.964 -4.499 8.371 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -8.633 -8.173 10.355 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -6.949 -6.337 9.904 1.00 0.00 H new ATOM 1065 N LEU A 72 -11.933 -6.980 5.488 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.126 -8.338 5.048 1.00 0.00 C ATOM 1067 C LEU A 72 -11.692 -8.622 3.605 1.00 0.00 C ATOM 1068 O LEU A 72 -10.931 -9.544 3.380 1.00 0.00 O ATOM 1069 CB LEU A 72 -13.465 -8.989 5.507 1.00 0.00 C ATOM 1070 CG LEU A 72 -14.778 -8.181 5.409 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.209 -7.946 3.984 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -15.879 -8.889 6.173 1.00 0.00 C ATOM 0 H LEU A 72 -12.785 -6.462 5.701 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.388 -8.904 5.617 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.600 -9.902 4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.343 -9.288 6.548 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.588 -7.203 5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.137 -7.374 3.974 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.434 -7.390 3.456 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.368 -8.904 3.489 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.801 -8.313 6.099 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.036 -9.881 5.750 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -15.593 -8.983 7.221 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.057 -7.799 2.648 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.609 -8.100 1.290 1.00 0.00 C ATOM 1086 C LEU A 73 -10.219 -7.576 0.983 1.00 0.00 C ATOM 1087 O LEU A 73 -9.323 -8.388 0.727 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.591 -7.672 0.218 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.641 -8.705 -0.255 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.009 -10.044 -0.617 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.739 -8.900 0.753 1.00 0.00 C ATOM 0 H LEU A 73 -12.628 -6.962 2.761 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.559 -9.189 1.264 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.125 -6.796 0.585 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.018 -7.355 -0.653 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.085 -8.288 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.785 -10.736 -0.943 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.289 -9.901 -1.423 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.500 -10.454 0.256 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.452 -9.634 0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.313 -9.256 1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.249 -7.952 0.923 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.018 -6.235 1.049 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.721 -5.635 0.807 1.00 0.00 C ATOM 1105 C TRP A 74 -7.661 -6.306 1.673 1.00 0.00 C ATOM 1106 O TRP A 74 -6.615 -6.680 1.239 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.689 -4.112 1.156 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.486 -3.059 0.326 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.440 -3.208 -0.654 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.242 -1.649 0.404 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.918 -1.942 -1.056 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.174 -0.973 -0.405 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.346 -0.934 1.128 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.221 0.442 -0.483 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.348 0.476 1.068 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.299 1.156 0.275 1.00 0.00 C ATOM 0 H TRP A 74 -10.753 -5.564 1.270 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.522 -5.769 -0.256 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.025 -4.019 2.189 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.643 -3.806 1.132 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -10.774 -4.153 -1.056 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.680 -1.771 -1.712 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.628 -1.445 1.753 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.945 0.946 -1.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.618 1.038 1.632 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.310 2.236 0.257 1.00 0.00 H new ATOM 1127 N LYS A 75 -7.958 -6.430 2.886 1.00 0.00 N ATOM 1128 CA LYS A 75 -6.978 -6.857 3.845 1.00 0.00 C ATOM 1129 C LYS A 75 -6.774 -8.326 4.069 1.00 0.00 C ATOM 1130 O LYS A 75 -5.619 -8.741 4.194 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.017 -6.022 5.070 1.00 0.00 C ATOM 1132 CG LYS A 75 -6.888 -4.570 4.713 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.518 -4.228 4.136 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.482 -4.238 5.260 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.132 -3.883 4.823 1.00 0.00 N ATOM 0 H LYS A 75 -8.883 -6.245 3.274 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.033 -6.661 3.338 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.952 -6.191 5.604 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.209 -6.312 5.742 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.659 -4.308 3.989 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.066 -3.964 5.601 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.244 -4.950 3.366 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.545 -3.248 3.659 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.797 -3.542 6.038 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.459 -5.230 5.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.527 -3.729 5.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.739 -4.655 4.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.169 -3.012 4.255 1.00 0.00 H new ATOM 1149 N SER A 76 -7.834 -9.134 4.132 1.00 0.00 N ATOM 1150 CA SER A 76 -7.611 -10.553 4.330 1.00 0.00 C ATOM 1151 C SER A 76 -6.885 -11.086 3.109 1.00 0.00 C ATOM 1152 O SER A 76 -5.983 -11.944 3.213 1.00 0.00 O ATOM 1153 CB SER A 76 -8.919 -11.318 4.583 1.00 0.00 C ATOM 1154 OG SER A 76 -8.675 -12.681 4.908 1.00 0.00 O ATOM 0 H SER A 76 -8.808 -8.842 4.052 1.00 0.00 H new ATOM 0 HA SER A 76 -7.005 -10.702 5.224 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.468 -10.842 5.396 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.551 -11.262 3.697 1.00 0.00 H new ATOM 0 HG SER A 76 -9.528 -13.138 5.064 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.203 -10.501 1.962 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.560 -10.882 0.752 1.00 0.00 C ATOM 1162 C GLU A 77 -5.151 -10.380 0.736 1.00 0.00 C ATOM 1163 O GLU A 77 -4.289 -11.038 0.194 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.271 -10.327 -0.441 1.00 0.00 C ATOM 1165 CG GLU A 77 -6.801 -10.884 -1.756 1.00 0.00 C ATOM 1166 CD GLU A 77 -7.166 -12.329 -1.971 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -6.554 -13.225 -1.377 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.089 -12.588 -2.765 1.00 0.00 O ATOM 0 H GLU A 77 -7.902 -9.765 1.863 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.576 -11.971 0.705 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.338 -10.523 -0.337 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.146 -9.244 -0.453 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.225 -10.288 -2.564 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -5.718 -10.780 -1.817 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.918 -9.208 1.325 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.592 -8.631 1.324 1.00 0.00 C ATOM 1177 C PHE A 78 -2.595 -9.597 1.947 1.00 0.00 C ATOM 1178 O PHE A 78 -1.506 -9.819 1.429 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.590 -7.285 2.056 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.234 -6.674 2.287 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.556 -6.035 1.275 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.658 -6.732 3.538 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.323 -5.463 1.506 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.432 -6.171 3.776 1.00 0.00 C ATOM 1185 CZ PHE A 78 0.238 -5.534 2.756 1.00 0.00 C ATOM 0 H PHE A 78 -5.627 -8.651 1.802 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.289 -8.451 0.293 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.194 -6.580 1.485 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.079 -7.416 3.021 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.994 -5.981 0.289 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.182 -7.227 4.342 1.00 0.00 H new ATOM 0 HE1 PHE A 78 0.200 -4.961 0.705 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.008 -6.228 4.761 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.205 -5.090 2.940 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.000 -10.189 3.027 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.183 -11.150 3.701 1.00 0.00 C ATOM 1197 C PHE A 79 -1.965 -12.391 2.858 1.00 0.00 C ATOM 1198 O PHE A 79 -0.827 -12.816 2.654 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.788 -11.489 5.040 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.626 -10.378 6.038 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.387 -10.106 6.583 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -3.699 -9.593 6.413 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.215 -9.072 7.481 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -3.537 -8.561 7.315 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.291 -8.299 7.850 1.00 0.00 C ATOM 0 H PHE A 79 -3.905 -10.020 3.466 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.200 -10.709 3.866 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.848 -11.707 4.912 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.321 -12.394 5.428 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.538 -10.712 6.302 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.676 -9.789 5.996 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.237 -8.870 7.893 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.385 -7.958 7.603 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.162 -7.491 8.555 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.043 -12.912 2.308 1.00 0.00 N ATOM 1216 CA GLU A 80 -2.988 -14.141 1.536 1.00 0.00 C ATOM 1217 C GLU A 80 -2.178 -13.982 0.237 1.00 0.00 C ATOM 1218 O GLU A 80 -1.174 -14.670 0.035 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.394 -14.645 1.215 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.265 -14.922 2.431 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.645 -15.890 3.414 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.538 -17.105 3.107 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.293 -15.467 4.534 1.00 0.00 O ATOM 0 H GLU A 80 -3.974 -12.502 2.381 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.475 -14.876 2.156 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.895 -13.908 0.587 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.312 -15.560 0.628 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.471 -13.981 2.942 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.223 -15.320 2.098 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.577 -13.037 -0.612 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.964 -12.875 -1.936 1.00 0.00 C ATOM 1232 C ASN A 81 -0.521 -12.441 -1.858 1.00 0.00 C ATOM 1233 O ASN A 81 0.295 -12.834 -2.691 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.778 -11.963 -2.926 1.00 0.00 C ATOM 1235 CG ASN A 81 -2.842 -10.451 -2.612 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -1.962 -9.867 -1.992 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -3.869 -9.805 -3.091 1.00 0.00 N ATOM 0 H ASN A 81 -3.322 -12.370 -0.410 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.992 -13.877 -2.365 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.351 -12.082 -3.922 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.799 -12.341 -2.970 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -3.948 -8.798 -2.952 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.593 -10.307 -3.605 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.185 -11.670 -0.863 1.00 0.00 N ATOM 1245 CA CYS A 82 1.165 -11.234 -0.732 1.00 0.00 C ATOM 1246 C CYS A 82 2.075 -12.372 -0.279 1.00 0.00 C ATOM 1247 O CYS A 82 3.183 -12.493 -0.752 1.00 0.00 O ATOM 1248 CB CYS A 82 1.256 -10.033 0.158 1.00 0.00 C ATOM 1249 SG CYS A 82 0.432 -8.569 -0.521 1.00 0.00 S ATOM 0 H CYS A 82 -0.823 -11.336 -0.141 1.00 0.00 H new ATOM 0 HA CYS A 82 1.522 -10.927 -1.715 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.815 -10.273 1.125 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.306 -9.800 0.335 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.609 -8.936 -1.207 1.00 0.00 H new ATOM 1255 N ARG A 83 1.577 -13.243 0.584 1.00 0.00 N ATOM 1256 CA ARG A 83 2.358 -14.410 1.003 1.00 0.00 C ATOM 1257 C ARG A 83 2.419 -15.443 -0.117 1.00 0.00 C ATOM 1258 O ARG A 83 3.384 -16.196 -0.234 1.00 0.00 O ATOM 1259 CB ARG A 83 1.793 -15.037 2.264 1.00 0.00 C ATOM 1260 CG ARG A 83 1.944 -14.180 3.495 1.00 0.00 C ATOM 1261 CD ARG A 83 3.396 -13.960 3.828 1.00 0.00 C ATOM 1262 NE ARG A 83 3.549 -13.220 5.074 1.00 0.00 N ATOM 1263 CZ ARG A 83 3.907 -13.787 6.235 1.00 0.00 C ATOM 1264 NH1 ARG A 83 4.033 -15.108 6.330 1.00 0.00 N ATOM 1265 NH2 ARG A 83 4.087 -13.051 7.295 1.00 0.00 N ATOM 0 H ARG A 83 0.651 -13.172 1.006 1.00 0.00 H new ATOM 0 HA ARG A 83 3.368 -14.066 1.224 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.735 -15.250 2.109 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.288 -15.993 2.436 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.455 -13.219 3.335 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.443 -14.657 4.337 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.902 -14.922 3.910 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.878 -13.414 3.017 1.00 0.00 H new ATOM 0 HE ARG A 83 3.374 -12.215 5.062 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.857 -15.697 5.516 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.306 -15.532 7.217 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.956 -12.041 7.243 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.359 -13.485 8.177 1.00 0.00 H new ATOM 1279 N ASP A 84 1.385 -15.458 -0.936 1.00 0.00 N ATOM 1280 CA ASP A 84 1.307 -16.308 -2.135 1.00 0.00 C ATOM 1281 C ASP A 84 2.456 -15.941 -3.057 1.00 0.00 C ATOM 1282 O ASP A 84 3.258 -16.779 -3.499 1.00 0.00 O ATOM 1283 CB ASP A 84 0.005 -15.989 -2.860 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.280 -16.874 -4.046 1.00 0.00 C ATOM 1285 OD1 ASP A 84 0.245 -16.610 -5.145 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -1.076 -17.828 -3.918 1.00 0.00 O ATOM 0 H ASP A 84 0.559 -14.877 -0.796 1.00 0.00 H new ATOM 0 HA ASP A 84 1.353 -17.362 -1.860 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.820 -16.073 -2.153 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.034 -14.952 -3.195 1.00 0.00 H new ATOM 1291 N THR A 85 2.523 -14.676 -3.307 1.00 0.00 N ATOM 1292 CA THR A 85 3.525 -14.058 -4.100 1.00 0.00 C ATOM 1293 C THR A 85 4.922 -14.244 -3.437 1.00 0.00 C ATOM 1294 O THR A 85 5.900 -14.527 -4.113 1.00 0.00 O ATOM 1295 CB THR A 85 3.129 -12.580 -4.222 1.00 0.00 C ATOM 1296 OG1 THR A 85 1.846 -12.498 -4.877 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.151 -11.738 -4.951 1.00 0.00 C ATOM 0 H THR A 85 1.841 -14.012 -2.942 1.00 0.00 H new ATOM 0 HA THR A 85 3.598 -14.505 -5.091 1.00 0.00 H new ATOM 0 HB THR A 85 3.076 -12.169 -3.214 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.134 -12.668 -4.225 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.804 -10.706 -4.999 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.101 -11.777 -4.418 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.285 -12.123 -5.962 1.00 0.00 H new ATOM 1305 N ALA A 86 4.935 -14.168 -2.117 1.00 0.00 N ATOM 1306 CA ALA A 86 6.135 -14.344 -1.310 1.00 0.00 C ATOM 1307 C ALA A 86 6.785 -15.688 -1.547 1.00 0.00 C ATOM 1308 O ALA A 86 7.979 -15.758 -1.861 1.00 0.00 O ATOM 1309 CB ALA A 86 5.821 -14.188 0.153 1.00 0.00 C ATOM 0 H ALA A 86 4.099 -13.979 -1.565 1.00 0.00 H new ATOM 0 HA ALA A 86 6.838 -13.569 -1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.731 -14.323 0.737 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.418 -13.191 0.334 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.085 -14.936 0.449 1.00 0.00 H new ATOM 1315 N LYS A 87 6.008 -16.759 -1.425 1.00 0.00 N ATOM 1316 CA LYS A 87 6.545 -18.091 -1.609 1.00 0.00 C ATOM 1317 C LYS A 87 6.982 -18.315 -3.053 1.00 0.00 C ATOM 1318 O LYS A 87 7.943 -19.028 -3.316 1.00 0.00 O ATOM 1319 CB LYS A 87 5.575 -19.171 -1.096 1.00 0.00 C ATOM 1320 CG LYS A 87 4.163 -19.068 -1.651 1.00 0.00 C ATOM 1321 CD LYS A 87 3.212 -20.077 -1.026 1.00 0.00 C ATOM 1322 CE LYS A 87 3.607 -21.500 -1.361 1.00 0.00 C ATOM 1323 NZ LYS A 87 2.665 -22.484 -0.785 1.00 0.00 N ATOM 0 H LYS A 87 5.013 -16.726 -1.201 1.00 0.00 H new ATOM 0 HA LYS A 87 7.443 -18.181 -0.998 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.979 -20.152 -1.346 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.529 -19.113 -0.009 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.782 -18.061 -1.480 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.189 -19.219 -2.730 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.203 -19.947 0.056 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.198 -19.888 -1.378 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.642 -21.622 -2.444 1.00 0.00 H new ATOM 0 HE3 LYS A 87 4.611 -21.696 -0.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.970 -23.446 -1.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 2.650 -22.386 0.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.711 -22.314 -1.163 1.00 0.00 H new ATOM 1337 N ARG A 88 6.319 -17.656 -3.989 1.00 0.00 N ATOM 1338 CA ARG A 88 6.750 -17.743 -5.373 1.00 0.00 C ATOM 1339 C ARG A 88 8.053 -16.971 -5.592 1.00 0.00 C ATOM 1340 O ARG A 88 8.915 -17.402 -6.351 1.00 0.00 O ATOM 1341 CB ARG A 88 5.664 -17.333 -6.378 1.00 0.00 C ATOM 1342 CG ARG A 88 4.713 -18.461 -6.770 1.00 0.00 C ATOM 1343 CD ARG A 88 3.923 -18.991 -5.601 1.00 0.00 C ATOM 1344 NE ARG A 88 3.160 -20.178 -5.961 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.848 -20.331 -5.775 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.094 -19.304 -5.412 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.285 -21.501 -6.007 1.00 0.00 N ATOM 0 H ARG A 88 5.501 -17.070 -3.823 1.00 0.00 H new ATOM 0 HA ARG A 88 6.944 -18.797 -5.570 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.083 -16.515 -5.953 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.144 -16.949 -7.278 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.025 -18.101 -7.534 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.286 -19.275 -7.215 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.601 -19.229 -4.781 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.245 -18.218 -5.240 1.00 0.00 H new ATOM 0 HE ARG A 88 3.668 -20.952 -6.388 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.516 -18.386 -5.272 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.092 -19.431 -5.272 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.853 -22.285 -6.328 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.282 -21.621 -5.866 1.00 0.00 H new ATOM 1361 N ASN A 89 8.220 -15.880 -4.866 1.00 0.00 N ATOM 1362 CA ASN A 89 9.416 -15.065 -4.962 1.00 0.00 C ATOM 1363 C ASN A 89 10.608 -15.787 -4.323 1.00 0.00 C ATOM 1364 O ASN A 89 11.748 -15.653 -4.787 1.00 0.00 O ATOM 1365 CB ASN A 89 9.164 -13.668 -4.349 1.00 0.00 C ATOM 1366 CG ASN A 89 10.285 -12.651 -4.577 1.00 0.00 C ATOM 1367 OD1 ASN A 89 11.474 -12.946 -4.477 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.892 -11.448 -4.900 1.00 0.00 N ATOM 0 H ASN A 89 7.533 -15.536 -4.196 1.00 0.00 H new ATOM 0 HA ASN A 89 9.667 -14.911 -6.011 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.240 -13.267 -4.764 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.009 -13.781 -3.276 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.581 -10.717 -5.079 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.896 -11.239 -4.974 1.00 0.00 H new ATOM 1375 N GLN A 90 10.342 -16.597 -3.304 1.00 0.00 N ATOM 1376 CA GLN A 90 11.410 -17.356 -2.657 1.00 0.00 C ATOM 1377 C GLN A 90 11.921 -18.446 -3.592 1.00 0.00 C ATOM 1378 O GLN A 90 13.135 -18.637 -3.726 1.00 0.00 O ATOM 1379 CB GLN A 90 10.981 -17.988 -1.326 1.00 0.00 C ATOM 1380 CG GLN A 90 10.394 -17.031 -0.290 1.00 0.00 C ATOM 1381 CD GLN A 90 11.136 -15.706 -0.202 1.00 0.00 C ATOM 1382 OE1 GLN A 90 12.129 -15.563 0.527 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.616 -14.713 -0.894 1.00 0.00 N ATOM 0 H GLN A 90 9.412 -16.745 -2.912 1.00 0.00 H new ATOM 0 HA GLN A 90 12.203 -16.642 -2.435 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.243 -18.763 -1.535 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.847 -18.483 -0.886 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.350 -16.838 -0.535 1.00 0.00 H new ATOM 0 HG3 GLN A 90 10.408 -17.513 0.688 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.798 -14.874 -1.482 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.031 -13.783 -0.842 1.00 0.00 H new ATOM 1392 N GLN A 91 11.001 -19.144 -4.250 1.00 0.00 N ATOM 1393 CA GLN A 91 11.379 -20.196 -5.185 1.00 0.00 C ATOM 1394 C GLN A 91 11.926 -19.618 -6.492 1.00 0.00 C ATOM 1395 O GLN A 91 12.703 -20.274 -7.186 1.00 0.00 O ATOM 1396 CB GLN A 91 10.240 -21.210 -5.408 1.00 0.00 C ATOM 1397 CG GLN A 91 8.947 -20.608 -5.905 1.00 0.00 C ATOM 1398 CD GLN A 91 7.804 -21.602 -5.913 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.559 -22.297 -6.906 1.00 0.00 O ATOM 1400 NE2 GLN A 91 7.112 -21.703 -4.798 1.00 0.00 N ATOM 0 H GLN A 91 9.996 -19.001 -4.154 1.00 0.00 H new ATOM 0 HA GLN A 91 12.195 -20.758 -4.730 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.575 -21.960 -6.125 1.00 0.00 H new ATOM 0 HB3 GLN A 91 10.046 -21.730 -4.470 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.680 -19.759 -5.275 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.095 -20.222 -6.914 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.343 -21.113 -3.999 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.344 -22.372 -4.733 1.00 0.00 H new ATOM 1409 N ALA A 92 11.528 -18.404 -6.825 1.00 0.00 N ATOM 1410 CA ALA A 92 12.106 -17.707 -7.974 1.00 0.00 C ATOM 1411 C ALA A 92 13.496 -17.216 -7.595 1.00 0.00 C ATOM 1412 O ALA A 92 14.396 -17.114 -8.432 1.00 0.00 O ATOM 1413 CB ALA A 92 11.233 -16.529 -8.383 1.00 0.00 C ATOM 0 H ALA A 92 10.812 -17.878 -6.324 1.00 0.00 H new ATOM 0 HA ALA A 92 12.167 -18.392 -8.820 1.00 0.00 H new ATOM 0 HB1 ALA A 92 11.681 -16.024 -9.239 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.240 -16.888 -8.652 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.153 -15.830 -7.551 1.00 0.00 H new ATOM 1419 N GLY A 93 13.644 -16.901 -6.327 1.00 0.00 N ATOM 1420 CA GLY A 93 14.901 -16.482 -5.775 1.00 0.00 C ATOM 1421 C GLY A 93 15.236 -15.040 -6.082 1.00 0.00 C ATOM 1422 O GLY A 93 16.359 -14.730 -6.485 1.00 0.00 O ATOM 0 H GLY A 93 12.883 -16.931 -5.648 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.880 -16.621 -4.694 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.693 -17.123 -6.164 1.00 0.00 H new ATOM 1426 N ASN A 94 14.273 -14.160 -5.873 1.00 0.00 N ATOM 1427 CA ASN A 94 14.486 -12.726 -6.100 1.00 0.00 C ATOM 1428 C ASN A 94 14.900 -12.073 -4.804 1.00 0.00 C ATOM 1429 O ASN A 94 15.718 -11.144 -4.791 1.00 0.00 O ATOM 1430 CB ASN A 94 13.232 -12.042 -6.645 1.00 0.00 C ATOM 1431 CG ASN A 94 12.883 -12.425 -8.065 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.750 -12.702 -8.881 1.00 0.00 O ATOM 1433 ND2 ASN A 94 11.612 -12.485 -8.354 1.00 0.00 N ATOM 0 H ASN A 94 13.337 -14.403 -5.548 1.00 0.00 H new ATOM 0 HA ASN A 94 15.272 -12.616 -6.847 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.389 -12.285 -5.998 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.371 -10.962 -6.596 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.314 -12.771 -9.287 1.00 0.00 H new ATOM 0 HD22 ASN A 94 10.916 -12.246 -7.647 1.00 0.00 H new ATOM 1440 N GLY A 95 14.323 -12.555 -3.718 1.00 0.00 N ATOM 1441 CA GLY A 95 14.690 -12.098 -2.396 1.00 0.00 C ATOM 1442 C GLY A 95 13.745 -11.067 -1.851 1.00 0.00 C ATOM 1443 O GLY A 95 14.121 -10.271 -0.998 1.00 0.00 O ATOM 0 H GLY A 95 13.594 -13.268 -3.730 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.720 -12.951 -1.718 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.696 -11.680 -2.428 1.00 0.00 H new ATOM 1447 N TRP A 96 12.515 -11.099 -2.302 1.00 0.00 N ATOM 1448 CA TRP A 96 11.530 -10.136 -1.882 1.00 0.00 C ATOM 1449 C TRP A 96 10.270 -10.826 -1.481 1.00 0.00 C ATOM 1450 O TRP A 96 10.203 -12.056 -1.464 1.00 0.00 O ATOM 1451 CB TRP A 96 11.177 -9.144 -2.981 1.00 0.00 C ATOM 1452 CG TRP A 96 12.299 -8.342 -3.485 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.106 -7.533 -2.761 1.00 0.00 C ATOM 1454 CD2 TRP A 96 12.712 -8.227 -4.833 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.014 -6.941 -3.567 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.794 -7.344 -4.853 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.278 -8.794 -6.031 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.447 -7.009 -6.015 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 12.934 -8.458 -7.189 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.006 -7.570 -7.173 1.00 0.00 C ATOM 0 H TRP A 96 12.171 -11.791 -2.968 1.00 0.00 H new ATOM 0 HA TRP A 96 11.972 -9.597 -1.044 1.00 0.00 H new ATOM 0 HB2 TRP A 96 10.739 -9.692 -3.816 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.409 -8.468 -2.605 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.035 -7.382 -1.694 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.745 -6.297 -3.264 1.00 0.00 H new ATOM 0 HE3 TRP A 96 11.445 -9.481 -6.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 15.282 -6.324 -6.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 12.614 -8.889 -8.126 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.499 -7.321 -8.101 1.00 0.00 H new ATOM 1471 N ASP A 97 9.332 -10.023 -1.049 1.00 0.00 N ATOM 1472 CA ASP A 97 7.923 -10.393 -0.886 1.00 0.00 C ATOM 1473 C ASP A 97 7.541 -11.047 0.421 1.00 0.00 C ATOM 1474 O ASP A 97 6.414 -10.898 0.876 1.00 0.00 O ATOM 1475 CB ASP A 97 7.359 -11.201 -2.078 1.00 0.00 C ATOM 1476 CG ASP A 97 7.431 -10.486 -3.413 1.00 0.00 C ATOM 1477 OD1 ASP A 97 7.719 -9.284 -3.460 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.297 -11.161 -4.464 1.00 0.00 O ATOM 0 H ASP A 97 9.521 -9.055 -0.788 1.00 0.00 H new ATOM 0 HA ASP A 97 7.444 -9.414 -0.863 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.905 -12.141 -2.154 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.319 -11.452 -1.870 1.00 0.00 H new ATOM 1483 N PHE A 98 8.424 -11.777 1.021 1.00 0.00 N ATOM 1484 CA PHE A 98 8.053 -12.471 2.224 1.00 0.00 C ATOM 1485 C PHE A 98 8.033 -11.586 3.485 1.00 0.00 C ATOM 1486 O PHE A 98 6.976 -11.352 4.044 1.00 0.00 O ATOM 1487 CB PHE A 98 8.830 -13.789 2.386 1.00 0.00 C ATOM 1488 CG PHE A 98 8.448 -14.546 3.611 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.196 -15.130 3.699 1.00 0.00 C ATOM 1490 CD2 PHE A 98 9.316 -14.658 4.680 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.821 -15.810 4.823 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.940 -15.341 5.813 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.691 -15.918 5.884 1.00 0.00 C ATOM 0 H PHE A 98 9.387 -11.911 0.712 1.00 0.00 H new ATOM 0 HA PHE A 98 7.007 -12.751 2.103 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.658 -14.415 1.511 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.898 -13.573 2.418 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.508 -15.047 2.870 1.00 0.00 H new ATOM 0 HD2 PHE A 98 10.296 -14.207 4.626 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.842 -16.263 4.879 1.00 0.00 H new ATOM 0 HE2 PHE A 98 9.623 -15.425 6.646 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.394 -16.455 6.773 1.00 0.00 H new ATOM 1503 N ASP A 99 9.187 -11.151 3.943 1.00 0.00 N ATOM 1504 CA ASP A 99 9.305 -10.266 5.136 1.00 0.00 C ATOM 1505 C ASP A 99 9.218 -8.807 4.719 1.00 0.00 C ATOM 1506 O ASP A 99 8.877 -7.933 5.507 1.00 0.00 O ATOM 1507 CB ASP A 99 10.647 -10.559 5.860 1.00 0.00 C ATOM 1508 CG ASP A 99 10.851 -9.791 7.166 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.112 -10.047 8.140 1.00 0.00 O ATOM 1510 OD2 ASP A 99 11.778 -8.951 7.247 1.00 0.00 O ATOM 0 H ASP A 99 10.083 -11.387 3.516 1.00 0.00 H new ATOM 0 HA ASP A 99 8.483 -10.466 5.823 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.705 -11.627 6.070 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.468 -10.322 5.183 1.00 0.00 H new ATOM 1515 N MET A 100 9.544 -8.554 3.456 1.00 0.00 N ATOM 1516 CA MET A 100 9.561 -7.184 2.927 1.00 0.00 C ATOM 1517 C MET A 100 8.164 -6.706 2.537 1.00 0.00 C ATOM 1518 O MET A 100 7.837 -5.523 2.641 1.00 0.00 O ATOM 1519 CB MET A 100 10.516 -7.063 1.731 1.00 0.00 C ATOM 1520 CG MET A 100 11.971 -7.394 2.025 1.00 0.00 C ATOM 1521 SD MET A 100 13.025 -7.169 0.584 1.00 0.00 S ATOM 1522 CE MET A 100 14.643 -7.545 1.267 1.00 0.00 C ATOM 0 H MET A 100 9.800 -9.272 2.778 1.00 0.00 H new ATOM 0 HA MET A 100 9.923 -6.541 3.729 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.164 -7.722 0.938 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.463 -6.045 1.346 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.329 -6.761 2.837 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.045 -8.426 2.369 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.399 -7.447 0.488 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.866 -6.851 2.078 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.648 -8.565 1.651 1.00 0.00 H new ATOM 1532 N LEU A 101 7.373 -7.619 2.071 1.00 0.00 N ATOM 1533 CA LEU A 101 6.011 -7.365 1.659 1.00 0.00 C ATOM 1534 C LEU A 101 5.071 -7.914 2.715 1.00 0.00 C ATOM 1535 O LEU A 101 5.442 -8.824 3.435 1.00 0.00 O ATOM 1536 CB LEU A 101 5.776 -8.052 0.308 1.00 0.00 C ATOM 1537 CG LEU A 101 4.337 -8.284 -0.176 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.631 -7.014 -0.589 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.324 -9.301 -1.308 1.00 0.00 C ATOM 0 H LEU A 101 7.656 -8.593 1.960 1.00 0.00 H new ATOM 0 HA LEU A 101 5.827 -6.296 1.550 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.287 -7.462 -0.453 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.270 -9.023 0.344 1.00 0.00 H new ATOM 0 HG LEU A 101 3.779 -8.676 0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.620 -7.251 -0.920 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.585 -6.331 0.259 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.178 -6.542 -1.405 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.299 -9.458 -1.644 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.925 -8.929 -2.138 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.739 -10.245 -0.954 1.00 0.00 H new ATOM 1551 N THR A 102 3.918 -7.267 2.860 1.00 0.00 N ATOM 1552 CA THR A 102 2.797 -7.712 3.696 1.00 0.00 C ATOM 1553 C THR A 102 3.160 -7.647 5.176 1.00 0.00 C ATOM 1554 O THR A 102 4.056 -6.876 5.564 1.00 0.00 O ATOM 1555 CB THR A 102 2.159 -9.110 3.238 1.00 0.00 C ATOM 1556 OG1 THR A 102 0.844 -9.284 3.806 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.988 -10.344 3.592 1.00 0.00 C ATOM 0 H THR A 102 3.727 -6.386 2.383 1.00 0.00 H new ATOM 0 HA THR A 102 1.983 -7.003 3.541 1.00 0.00 H new ATOM 0 HB THR A 102 2.124 -9.043 2.151 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.380 -8.421 3.827 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.475 -11.240 3.242 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.965 -10.275 3.114 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.116 -10.398 4.673 1.00 0.00 H new ATOM 1661 N ASP A 111 11.359 0.051 6.743 1.00 0.00 N ATOM 1662 CA ASP A 111 12.706 0.387 6.286 1.00 0.00 C ATOM 1663 C ASP A 111 12.936 -0.109 4.880 1.00 0.00 C ATOM 1664 O ASP A 111 13.200 0.699 3.966 1.00 0.00 O ATOM 1665 CB ASP A 111 13.774 -0.211 7.220 1.00 0.00 C ATOM 1666 CG ASP A 111 13.708 0.320 8.625 1.00 0.00 C ATOM 1667 OD1 ASP A 111 12.838 -0.121 9.406 1.00 0.00 O ATOM 1668 OD2 ASP A 111 14.519 1.217 8.971 1.00 0.00 O ATOM 0 HA ASP A 111 12.793 1.473 6.301 1.00 0.00 H new ATOM 0 HB2 ASP A 111 13.659 -1.295 7.244 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.762 -0.005 6.808 1.00 0.00 H new ATOM 1673 N ALA A 112 12.771 -1.429 4.689 1.00 0.00 N ATOM 1674 CA ALA A 112 13.004 -2.107 3.397 1.00 0.00 C ATOM 1675 C ALA A 112 12.341 -1.377 2.244 1.00 0.00 C ATOM 1676 O ALA A 112 12.950 -1.168 1.191 1.00 0.00 O ATOM 1677 CB ALA A 112 12.497 -3.531 3.443 1.00 0.00 C ATOM 0 H ALA A 112 12.470 -2.062 5.430 1.00 0.00 H new ATOM 0 HA ALA A 112 14.081 -2.105 3.229 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.678 -4.013 2.482 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.020 -4.078 4.228 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.427 -3.530 3.653 1.00 0.00 H new ATOM 1683 N GLN A 113 11.118 -0.949 2.455 1.00 0.00 N ATOM 1684 CA GLN A 113 10.410 -0.249 1.430 1.00 0.00 C ATOM 1685 C GLN A 113 10.933 1.143 1.173 1.00 0.00 C ATOM 1686 O GLN A 113 10.897 1.584 0.035 1.00 0.00 O ATOM 1687 CB GLN A 113 8.897 -0.257 1.624 1.00 0.00 C ATOM 1688 CG GLN A 113 8.163 -1.201 0.671 1.00 0.00 C ATOM 1689 CD GLN A 113 8.135 -0.744 -0.819 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.210 -1.056 -1.546 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.120 -0.012 -1.273 1.00 0.00 N ATOM 0 H GLN A 113 10.602 -1.076 3.326 1.00 0.00 H new ATOM 0 HA GLN A 113 10.611 -0.823 0.525 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.672 -0.544 2.651 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.516 0.755 1.485 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.632 -2.184 0.725 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.137 -1.318 1.019 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.891 0.245 -0.656 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.117 0.302 -2.243 1.00 0.00 H new ATOM 1700 N MET A 114 11.439 1.835 2.184 1.00 0.00 N ATOM 1701 CA MET A 114 11.927 3.182 1.956 1.00 0.00 C ATOM 1702 C MET A 114 13.122 3.194 1.027 1.00 0.00 C ATOM 1703 O MET A 114 13.252 4.124 0.241 1.00 0.00 O ATOM 1704 CB MET A 114 12.222 3.943 3.252 1.00 0.00 C ATOM 1705 CG MET A 114 13.609 3.772 3.856 1.00 0.00 C ATOM 1706 SD MET A 114 13.796 4.764 5.345 1.00 0.00 S ATOM 1707 CE MET A 114 15.509 4.426 5.761 1.00 0.00 C ATOM 0 H MET A 114 11.520 1.496 3.143 1.00 0.00 H new ATOM 0 HA MET A 114 11.113 3.716 1.465 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.063 5.005 3.064 1.00 0.00 H new ATOM 0 HB3 MET A 114 11.488 3.638 3.998 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.779 2.721 4.092 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.365 4.061 3.126 1.00 0.00 H new ATOM 0 HE1 MET A 114 15.778 4.971 6.666 1.00 0.00 H new ATOM 0 HE2 MET A 114 15.638 3.357 5.930 1.00 0.00 H new ATOM 0 HE3 MET A 114 16.152 4.744 4.941 1.00 0.00 H new ATOM 1717 N GLN A 115 13.992 2.156 1.086 1.00 0.00 N ATOM 1718 CA GLN A 115 15.120 2.138 0.105 1.00 0.00 C ATOM 1719 C GLN A 115 14.603 1.980 -1.303 1.00 0.00 C ATOM 1720 O GLN A 115 15.194 2.508 -2.225 1.00 0.00 O ATOM 1721 CB GLN A 115 16.244 1.093 0.350 1.00 0.00 C ATOM 1722 CG GLN A 115 17.068 1.303 1.616 1.00 0.00 C ATOM 1723 CD GLN A 115 16.257 1.045 2.832 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.449 1.658 3.880 1.00 0.00 O ATOM 1725 NE2 GLN A 115 15.402 0.066 2.736 1.00 0.00 N ATOM 0 H GLN A 115 13.952 1.376 1.743 1.00 0.00 H new ATOM 0 HA GLN A 115 15.594 3.108 0.257 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.792 0.102 0.391 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.917 1.101 -0.507 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.933 0.640 1.605 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.450 2.324 1.640 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.275 -0.415 1.845 1.00 0.00 H new ATOM 0 HE22 GLN A 115 14.860 -0.219 3.551 1.00 0.00 H new ATOM 1734 N TYR A 116 13.471 1.270 -1.471 1.00 0.00 N ATOM 1735 CA TYR A 116 12.855 1.093 -2.768 1.00 0.00 C ATOM 1736 C TYR A 116 13.681 0.231 -3.707 1.00 0.00 C ATOM 1737 O TYR A 116 14.717 0.645 -4.244 1.00 0.00 O ATOM 1738 CB TYR A 116 12.452 2.444 -3.429 1.00 0.00 C ATOM 1739 CG TYR A 116 12.170 2.341 -4.919 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.026 1.728 -5.394 1.00 0.00 C ATOM 1741 CD2 TYR A 116 13.078 2.838 -5.844 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.794 1.604 -6.749 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.853 2.725 -7.196 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.710 2.103 -7.646 1.00 0.00 C ATOM 1745 OH TYR A 116 11.485 1.978 -8.997 1.00 0.00 O ATOM 0 H TYR A 116 12.973 0.812 -0.707 1.00 0.00 H new ATOM 0 HA TYR A 116 11.932 0.545 -2.578 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.566 2.832 -2.927 1.00 0.00 H new ATOM 0 HB3 TYR A 116 13.251 3.168 -3.270 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.302 1.340 -4.693 1.00 0.00 H new ATOM 0 HD2 TYR A 116 13.978 3.323 -5.495 1.00 0.00 H new ATOM 0 HE1 TYR A 116 9.897 1.117 -7.103 1.00 0.00 H new ATOM 0 HE2 TYR A 116 13.569 3.122 -7.901 1.00 0.00 H new ATOM 0 HH TYR A 116 12.227 2.384 -9.491 1.00 0.00 H new ATOM 1755 N ASP A 117 13.243 -0.971 -3.874 1.00 0.00 N ATOM 1756 CA ASP A 117 13.806 -1.811 -4.855 1.00 0.00 C ATOM 1757 C ASP A 117 12.710 -1.971 -5.895 1.00 0.00 C ATOM 1758 O ASP A 117 11.581 -2.321 -5.518 1.00 0.00 O ATOM 1759 CB ASP A 117 14.170 -3.160 -4.258 1.00 0.00 C ATOM 1760 CG ASP A 117 15.107 -3.927 -5.137 1.00 0.00 C ATOM 1761 OD1 ASP A 117 14.814 -4.102 -6.329 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.188 -4.337 -4.650 1.00 0.00 O ATOM 0 H ASP A 117 12.487 -1.390 -3.332 1.00 0.00 H new ATOM 0 HA ASP A 117 14.723 -1.398 -5.276 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.629 -3.012 -3.281 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.263 -3.743 -4.099 1.00 0.00 H new ATOM 1767 N PRO A 118 12.974 -1.647 -7.186 1.00 0.00 N ATOM 1768 CA PRO A 118 11.970 -1.696 -8.281 1.00 0.00 C ATOM 1769 C PRO A 118 11.177 -3.016 -8.379 1.00 0.00 C ATOM 1770 O PRO A 118 10.005 -3.011 -8.791 1.00 0.00 O ATOM 1771 CB PRO A 118 12.801 -1.478 -9.555 1.00 0.00 C ATOM 1772 CG PRO A 118 14.224 -1.611 -9.129 1.00 0.00 C ATOM 1773 CD PRO A 118 14.265 -1.164 -7.703 1.00 0.00 C ATOM 0 HA PRO A 118 11.197 -0.947 -8.109 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.549 -2.214 -10.319 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.610 -0.495 -9.985 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.567 -2.641 -9.226 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.877 -0.998 -9.750 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.107 -1.599 -7.165 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.358 -0.081 -7.619 1.00 0.00 H new ATOM 1781 N GLY A 119 11.763 -4.107 -7.928 1.00 0.00 N ATOM 1782 CA GLY A 119 11.081 -5.377 -8.036 1.00 0.00 C ATOM 1783 C GLY A 119 10.144 -5.547 -6.870 1.00 0.00 C ATOM 1784 O GLY A 119 8.993 -5.903 -7.031 1.00 0.00 O ATOM 0 H GLY A 119 12.686 -4.140 -7.494 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.525 -5.424 -8.972 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.806 -6.190 -8.054 1.00 0.00 H new ATOM 1788 N LEU A 120 10.678 -5.275 -5.723 1.00 0.00 N ATOM 1789 CA LEU A 120 9.906 -5.312 -4.471 1.00 0.00 C ATOM 1790 C LEU A 120 8.675 -4.411 -4.583 1.00 0.00 C ATOM 1791 O LEU A 120 7.546 -4.852 -4.352 1.00 0.00 O ATOM 1792 CB LEU A 120 10.776 -4.860 -3.309 1.00 0.00 C ATOM 1793 CG LEU A 120 10.096 -4.793 -1.950 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.621 -6.179 -1.503 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.042 -4.171 -0.930 1.00 0.00 C ATOM 0 H LEU A 120 11.658 -5.019 -5.602 1.00 0.00 H new ATOM 0 HA LEU A 120 9.578 -6.336 -4.291 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.627 -5.537 -3.234 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.174 -3.873 -3.542 1.00 0.00 H new ATOM 0 HG LEU A 120 9.211 -4.162 -2.029 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.139 -6.102 -0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.910 -6.572 -2.230 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.476 -6.851 -1.432 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.550 -4.125 0.042 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.944 -4.779 -0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.310 -3.164 -1.249 1.00 0.00 H new ATOM 1807 N PHE A 121 8.910 -3.157 -4.972 1.00 0.00 N ATOM 1808 CA PHE A 121 7.837 -2.191 -5.196 1.00 0.00 C ATOM 1809 C PHE A 121 6.780 -2.726 -6.190 1.00 0.00 C ATOM 1810 O PHE A 121 5.580 -2.549 -5.969 1.00 0.00 O ATOM 1811 CB PHE A 121 8.428 -0.863 -5.685 1.00 0.00 C ATOM 1812 CG PHE A 121 7.410 0.194 -6.033 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.637 0.785 -5.052 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.231 0.586 -7.349 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.709 1.746 -5.369 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.300 1.547 -7.673 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.538 2.130 -6.684 1.00 0.00 C ATOM 0 H PHE A 121 9.845 -2.785 -5.140 1.00 0.00 H new ATOM 0 HA PHE A 121 7.325 -2.025 -4.248 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.089 -0.470 -4.913 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.044 -1.057 -6.563 1.00 0.00 H new ATOM 0 HD1 PHE A 121 6.764 0.487 -4.022 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.827 0.134 -8.128 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.114 2.201 -4.591 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.167 1.844 -8.703 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.809 2.885 -6.937 1.00 0.00 H new ATOM 1827 N ALA A 122 7.238 -3.401 -7.256 1.00 0.00 N ATOM 1828 CA ALA A 122 6.346 -3.968 -8.265 1.00 0.00 C ATOM 1829 C ALA A 122 5.311 -4.905 -7.645 1.00 0.00 C ATOM 1830 O ALA A 122 4.094 -4.747 -7.895 1.00 0.00 O ATOM 1831 CB ALA A 122 7.127 -4.681 -9.357 1.00 0.00 C ATOM 0 H ALA A 122 8.228 -3.565 -7.437 1.00 0.00 H new ATOM 0 HA ALA A 122 5.810 -3.134 -8.719 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.434 -5.091 -10.091 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.797 -3.974 -9.846 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.711 -5.490 -8.918 1.00 0.00 H new ATOM 1837 N GLN A 123 5.757 -5.870 -6.812 1.00 0.00 N ATOM 1838 CA GLN A 123 4.788 -6.760 -6.184 1.00 0.00 C ATOM 1839 C GLN A 123 3.919 -6.020 -5.211 1.00 0.00 C ATOM 1840 O GLN A 123 2.709 -6.172 -5.240 1.00 0.00 O ATOM 1841 CB GLN A 123 5.387 -7.947 -5.455 1.00 0.00 C ATOM 1842 CG GLN A 123 6.054 -9.003 -6.297 1.00 0.00 C ATOM 1843 CD GLN A 123 7.356 -8.576 -6.873 1.00 0.00 C ATOM 1844 OE1 GLN A 123 7.428 -8.101 -7.999 1.00 0.00 O ATOM 1845 NE2 GLN A 123 8.390 -8.679 -6.085 1.00 0.00 N ATOM 0 H GLN A 123 6.734 -6.040 -6.574 1.00 0.00 H new ATOM 0 HA GLN A 123 4.211 -7.146 -7.024 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.120 -7.571 -4.741 1.00 0.00 H new ATOM 0 HB3 GLN A 123 4.595 -8.425 -4.878 1.00 0.00 H new ATOM 0 HG2 GLN A 123 6.211 -9.894 -5.689 1.00 0.00 H new ATOM 0 HG3 GLN A 123 5.383 -9.285 -7.108 1.00 0.00 H new ATOM 0 HE21 GLN A 123 8.284 -9.082 -5.154 1.00 0.00 H new ATOM 0 HE22 GLN A 123 9.305 -8.357 -6.400 1.00 0.00 H new ATOM 1854 N ILE A 124 4.528 -5.193 -4.381 1.00 0.00 N ATOM 1855 CA ILE A 124 3.803 -4.492 -3.330 1.00 0.00 C ATOM 1856 C ILE A 124 2.684 -3.633 -3.903 1.00 0.00 C ATOM 1857 O ILE A 124 1.572 -3.650 -3.394 1.00 0.00 O ATOM 1858 CB ILE A 124 4.748 -3.663 -2.390 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.772 -4.613 -1.729 1.00 0.00 C ATOM 1860 CG2 ILE A 124 3.950 -2.897 -1.326 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.646 -3.998 -0.679 1.00 0.00 C ATOM 0 H ILE A 124 5.527 -4.988 -4.412 1.00 0.00 H new ATOM 0 HA ILE A 124 3.345 -5.258 -2.704 1.00 0.00 H new ATOM 0 HB ILE A 124 5.276 -2.922 -2.991 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.230 -5.447 -1.282 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.410 -5.029 -2.509 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.635 -2.334 -0.693 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.259 -2.210 -1.814 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.388 -3.603 -0.715 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.325 -4.753 -0.283 1.00 0.00 H new ATOM 0 HD12 ILE A 124 7.224 -3.184 -1.117 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.026 -3.609 0.128 1.00 0.00 H new ATOM 1873 N GLN A 125 2.956 -2.962 -4.994 1.00 0.00 N ATOM 1874 CA GLN A 125 1.972 -2.114 -5.611 1.00 0.00 C ATOM 1875 C GLN A 125 0.794 -2.945 -6.150 1.00 0.00 C ATOM 1876 O GLN A 125 -0.378 -2.669 -5.837 1.00 0.00 O ATOM 1877 CB GLN A 125 2.586 -1.351 -6.765 1.00 0.00 C ATOM 1878 CG GLN A 125 1.770 -0.163 -7.161 1.00 0.00 C ATOM 1879 CD GLN A 125 2.155 0.431 -8.507 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.305 0.358 -8.942 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.202 1.038 -9.165 1.00 0.00 N ATOM 0 H GLN A 125 3.856 -2.988 -5.474 1.00 0.00 H new ATOM 0 HA GLN A 125 1.612 -1.420 -4.852 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.588 -1.024 -6.488 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.693 -2.017 -7.621 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.719 -0.450 -7.189 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.870 0.605 -6.394 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.260 1.080 -8.776 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.400 1.469 -10.068 1.00 0.00 H new ATOM 1890 N ALA A 126 1.108 -3.977 -6.921 1.00 0.00 N ATOM 1891 CA ALA A 126 0.086 -4.764 -7.610 1.00 0.00 C ATOM 1892 C ALA A 126 -0.691 -5.690 -6.678 1.00 0.00 C ATOM 1893 O ALA A 126 -1.928 -5.780 -6.756 1.00 0.00 O ATOM 1894 CB ALA A 126 0.702 -5.550 -8.753 1.00 0.00 C ATOM 0 H ALA A 126 2.064 -4.292 -7.087 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.637 -4.052 -8.009 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -0.073 -6.130 -9.255 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.158 -4.861 -9.464 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.464 -6.224 -8.362 1.00 0.00 H new ATOM 1900 N ALA A 127 0.007 -6.314 -5.764 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.599 -7.324 -4.901 1.00 0.00 C ATOM 1902 C ALA A 127 -1.465 -6.667 -3.874 1.00 0.00 C ATOM 1903 O ALA A 127 -2.587 -7.135 -3.575 1.00 0.00 O ATOM 1904 CB ALA A 127 0.453 -8.213 -4.241 1.00 0.00 C ATOM 0 H ALA A 127 0.998 -6.148 -5.590 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.217 -7.971 -5.523 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.040 -8.951 -3.608 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.032 -8.724 -5.010 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.118 -7.600 -3.634 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.003 -5.532 -3.391 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.726 -4.837 -2.417 1.00 0.00 C ATOM 1912 C ALA A 128 -2.954 -4.231 -3.020 1.00 0.00 C ATOM 1913 O ALA A 128 -3.965 -4.433 -2.526 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.879 -3.828 -1.692 1.00 0.00 C ATOM 0 H ALA A 128 -0.127 -5.094 -3.675 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.046 -5.550 -1.657 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.485 -3.314 -0.946 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.050 -4.336 -1.199 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.488 -3.102 -2.405 1.00 0.00 H new ATOM 1920 N THR A 129 -2.871 -3.574 -4.165 1.00 0.00 N ATOM 1921 CA THR A 129 -4.090 -2.970 -4.763 1.00 0.00 C ATOM 1922 C THR A 129 -5.157 -4.034 -5.136 1.00 0.00 C ATOM 1923 O THR A 129 -6.405 -3.781 -5.074 1.00 0.00 O ATOM 1924 CB THR A 129 -3.748 -2.113 -5.982 1.00 0.00 C ATOM 1925 OG1 THR A 129 -2.845 -2.828 -6.853 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.119 -0.825 -5.559 1.00 0.00 C ATOM 0 H THR A 129 -2.012 -3.438 -4.698 1.00 0.00 H new ATOM 0 HA THR A 129 -4.521 -2.328 -3.995 1.00 0.00 H new ATOM 0 HB THR A 129 -4.672 -1.895 -6.518 1.00 0.00 H new ATOM 0 HG1 THR A 129 -1.921 -2.572 -6.648 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.883 -0.229 -6.440 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.811 -0.274 -4.923 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.203 -1.032 -5.005 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.662 -5.247 -5.357 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.530 -6.312 -5.797 1.00 0.00 C ATOM 1936 C LYS A 130 -6.392 -6.677 -4.649 1.00 0.00 C ATOM 1937 O LYS A 130 -7.595 -6.817 -4.774 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.745 -7.510 -6.338 1.00 0.00 C ATOM 1939 CG LYS A 130 -5.590 -8.476 -7.167 1.00 0.00 C ATOM 1940 CD LYS A 130 -6.163 -7.754 -8.391 1.00 0.00 C ATOM 1941 CE LYS A 130 -6.994 -8.670 -9.268 1.00 0.00 C ATOM 1942 NZ LYS A 130 -7.566 -7.944 -10.418 1.00 0.00 N ATOM 0 H LYS A 130 -3.683 -5.506 -5.239 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.143 -5.977 -6.634 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.920 -7.146 -6.950 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.305 -8.053 -5.501 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -4.982 -9.323 -7.486 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -6.401 -8.877 -6.559 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -6.778 -6.917 -8.060 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -5.345 -7.337 -8.979 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -6.375 -9.492 -9.627 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -7.798 -9.110 -8.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -8.128 -8.599 -10.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -8.176 -7.175 -10.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -6.797 -7.545 -10.994 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.745 -6.805 -3.528 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.367 -6.926 -2.261 1.00 0.00 C ATOM 1958 C ALA A 131 -7.251 -5.703 -2.031 1.00 0.00 C ATOM 1959 O ALA A 131 -8.472 -5.831 -1.988 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.241 -7.004 -1.264 1.00 0.00 C ATOM 0 H ALA A 131 -4.726 -6.828 -3.480 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.006 -7.805 -2.175 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.651 -7.099 -0.259 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.618 -7.871 -1.485 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.637 -6.099 -1.325 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.640 -4.525 -2.076 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.249 -3.250 -1.707 1.00 0.00 C ATOM 1968 C TRP A 132 -8.292 -2.708 -2.712 1.00 0.00 C ATOM 1969 O TRP A 132 -8.516 -1.511 -2.801 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.219 -2.156 -1.414 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.294 -2.471 -0.293 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.796 -3.660 -0.019 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.775 -1.606 0.702 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -3.925 -3.625 0.951 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -3.892 -2.380 1.461 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.930 -0.267 1.023 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.167 -1.863 2.499 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.222 0.211 2.056 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.344 -0.585 2.780 1.00 0.00 C ATOM 0 H TRP A 132 -5.672 -4.427 -2.381 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.784 -3.498 -0.790 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.632 -1.976 -2.314 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.745 -1.229 -1.186 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.078 -4.563 -0.540 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.361 -4.412 1.271 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.598 0.369 0.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.479 -2.474 3.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.338 1.248 2.334 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.790 -0.146 3.597 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.869 -3.552 -3.490 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.040 -3.169 -4.261 1.00 0.00 C ATOM 1992 C ARG A 133 -11.393 -3.910 -3.982 1.00 0.00 C ATOM 1993 O ARG A 133 -12.456 -3.282 -3.852 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.721 -2.983 -5.760 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.926 -2.958 -6.710 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.444 -4.360 -6.967 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.934 -4.510 -6.774 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.656 -5.484 -7.380 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.184 -6.085 -8.463 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.860 -5.815 -6.924 1.00 0.00 N ATOM 0 H ARG A 133 -8.564 -4.516 -3.623 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.277 -2.190 -3.844 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.170 -2.050 -5.880 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.056 -3.788 -6.071 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.719 -2.346 -6.281 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.640 -2.493 -7.654 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.189 -4.649 -7.987 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -10.930 -5.054 -6.301 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.417 -3.852 -6.163 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.276 -5.815 -8.842 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.729 -6.818 -8.918 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.248 -5.335 -6.112 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.396 -6.549 -7.386 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.320 -5.207 -3.917 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.459 -6.166 -4.175 1.00 0.00 C ATOM 2016 C LYS A 134 -13.682 -6.204 -3.213 1.00 0.00 C ATOM 2017 O LYS A 134 -14.285 -7.262 -3.038 1.00 0.00 O ATOM 2018 CB LYS A 134 -11.868 -7.529 -4.251 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.278 -7.936 -2.949 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.532 -9.209 -3.052 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.227 -8.987 -3.708 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.629 -10.251 -4.207 1.00 0.00 N ATOM 0 H LYS A 134 -10.452 -5.687 -3.677 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.912 -5.786 -5.091 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.636 -8.245 -4.544 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -11.100 -7.552 -5.024 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -10.610 -7.152 -2.593 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.071 -8.039 -2.208 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.380 -9.631 -2.058 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.114 -9.934 -3.621 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.353 -8.294 -4.539 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.542 -8.517 -3.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.616 -10.106 -4.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.746 -10.997 -3.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.105 -10.537 -5.086 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.120 -5.113 -2.729 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.228 -5.113 -1.761 1.00 0.00 C ATOM 2038 C LEU A 135 -16.571 -5.219 -2.456 1.00 0.00 C ATOM 2039 O LEU A 135 -16.677 -4.819 -3.597 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.211 -3.829 -0.980 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.505 -3.788 0.340 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.155 -4.385 0.239 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.356 -2.364 0.711 1.00 0.00 C ATOM 0 H LEU A 135 -13.754 -4.190 -2.963 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.095 -5.974 -1.106 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -14.764 -3.064 -1.615 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.247 -3.536 -0.808 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.077 -4.350 1.078 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.665 -4.342 1.211 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.240 -5.424 -0.079 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.565 -3.829 -0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.844 -2.290 1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.773 -1.848 -0.052 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.341 -1.903 0.788 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.599 -5.790 -1.793 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.979 -5.772 -2.295 1.00 0.00 C ATOM 2057 C PRO A 136 -19.547 -4.353 -2.120 1.00 0.00 C ATOM 2058 O PRO A 136 -19.066 -3.601 -1.257 1.00 0.00 O ATOM 2059 CB PRO A 136 -19.711 -6.760 -1.369 1.00 0.00 C ATOM 2060 CG PRO A 136 -18.630 -7.497 -0.661 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.509 -6.529 -0.531 1.00 0.00 C ATOM 0 HA PRO A 136 -19.074 -6.039 -3.348 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.358 -6.236 -0.665 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -20.344 -7.440 -1.939 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -18.966 -7.842 0.317 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -18.324 -8.379 -1.223 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.631 -5.877 0.334 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.548 -7.030 -0.419 1.00 0.00 H new