USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 877 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 89 ASN : amide:sc= 1.18 K(o=-0.094,f=-0.96) USER MOD Set 1.2: A 123 GLN : amide:sc= -1.27! K(o=-0.094!,f=-0.96) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.065 K(o=-0.065,f=-4.2!) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -170:sc= 0.422 (180deg=0.256) USER MOD Single : A 29 THR OG1 : rot 83:sc= 1.21 USER MOD Single : A 32 SER OG : rot -78:sc= 1.15 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 153:sc= 0.567 USER MOD Single : A 40 TYR OH : rot -137:sc= 1.25 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00479 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0.957 K(o=0.96,f=0) USER MOD Single : A 54 THR OG1 : rot -1:sc= 0.927 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.148 K(o=-0.15,f=-1.8!) USER MOD Single : A 60 THR OG1 : rot 95:sc= 1.25 USER MOD Single : A 67 SER OG : rot -12:sc= 0.721 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 147:sc= 1.25 (180deg=0.495) USER MOD Single : A 76 SER OG : rot 98:sc= 0.331 USER MOD Single : A 81 ASN : amide:sc= -1.84 K(o=-1.8,f=-3.8!) USER MOD Single : A 82 CYS SG : rot 91:sc= -0.736 USER MOD Single : A 85 THR OG1 : rot 88:sc= 1.07 USER MOD Single : A 87 LYS NZ :NH3+ -131:sc= -0.359 (180deg=-1.76) USER MOD Single : A 90 GLN : amide:sc= 0.483 K(o=0.48,f=-1.5) USER MOD Single : A 91 GLN : amide:sc= 0.0049 X(o=0.0049,f=-0.29) USER MOD Single : A 94 ASN : amide:sc= -0.0893 K(o=-0.089,f=-1) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN :FLIP amide:sc= -1.72 F(o=-2.6!,f=-1.7) USER MOD Single : A 114 MET CE :methyl 139:sc= -0.0389 (180deg=-0.949) USER MOD Single : A 115 GLN :FLIP amide:sc= -0.701 F(o=-5.1!,f=-0.7) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 GLN :FLIP amide:sc= 0.0703 F(o=-2.5!,f=0.07) USER MOD Single : A 129 THR OG1 : rot 170:sc= 1.15 USER MOD Single : A 130 LYS NZ :NH3+ 156:sc= -1.67! (180deg=-2.77!) USER MOD Single : A 134 LYS NZ :NH3+ -146:sc= 0.652 (180deg=-1.43) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.337 11.506 0.559 1.00 0.00 N ATOM 2 CA PRO A 1 3.807 10.675 1.660 1.00 0.00 C ATOM 3 C PRO A 1 5.344 10.577 1.671 1.00 0.00 C ATOM 4 O PRO A 1 5.977 10.825 2.673 1.00 0.00 O ATOM 5 CB PRO A 1 3.212 9.289 1.501 1.00 0.00 C ATOM 6 CG PRO A 1 2.347 9.396 0.276 1.00 0.00 C ATOM 7 CD PRO A 1 2.806 10.629 -0.482 1.00 0.00 C ATOM 0 H2 PRO A 1 4.101 12.073 0.191 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.616 12.151 0.883 1.00 0.00 H new ATOM 0 HA PRO A 1 3.494 11.125 2.602 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.989 8.534 1.375 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.629 9.003 2.376 1.00 0.00 H new ATOM 0 HG2 PRO A 1 2.443 8.504 -0.343 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.296 9.481 0.552 1.00 0.00 H new ATOM 0 HD2 PRO A 1 3.567 10.382 -1.222 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.981 11.099 -1.017 1.00 0.00 H new ATOM 17 N VAL A 2 5.941 10.190 0.553 1.00 0.00 N ATOM 18 CA VAL A 2 7.397 10.051 0.462 1.00 0.00 C ATOM 19 C VAL A 2 7.926 10.856 -0.718 1.00 0.00 C ATOM 20 O VAL A 2 7.342 10.835 -1.785 1.00 0.00 O ATOM 21 CB VAL A 2 7.859 8.554 0.262 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.385 8.445 0.197 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.345 7.639 1.360 1.00 0.00 C ATOM 0 H VAL A 2 5.443 9.965 -0.308 1.00 0.00 H new ATOM 0 HA VAL A 2 7.796 10.417 1.408 1.00 0.00 H new ATOM 0 HB VAL A 2 7.429 8.232 -0.686 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.670 7.402 0.059 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.757 9.036 -0.640 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.816 8.819 1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.690 6.621 1.177 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.720 7.981 2.324 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.255 7.657 1.368 1.00 0.00 H new ATOM 33 N THR A 3 8.984 11.569 -0.503 1.00 0.00 N ATOM 34 CA THR A 3 9.699 12.230 -1.559 1.00 0.00 C ATOM 35 C THR A 3 11.127 11.662 -1.534 1.00 0.00 C ATOM 36 O THR A 3 11.660 11.454 -0.434 1.00 0.00 O ATOM 37 CB THR A 3 9.663 13.797 -1.375 1.00 0.00 C ATOM 38 OG1 THR A 3 10.515 14.456 -2.315 1.00 0.00 O ATOM 39 CG2 THR A 3 10.013 14.223 0.056 1.00 0.00 C ATOM 0 H THR A 3 9.386 11.714 0.423 1.00 0.00 H new ATOM 0 HA THR A 3 9.241 12.047 -2.531 1.00 0.00 H new ATOM 0 HB THR A 3 8.635 14.105 -1.568 1.00 0.00 H new ATOM 0 HG1 THR A 3 10.468 15.425 -2.175 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.975 15.310 0.132 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.297 13.785 0.751 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.017 13.877 0.303 1.00 0.00 H new ATOM 228 N HIS A 16 10.266 11.214 4.577 1.00 0.00 N ATOM 229 CA HIS A 16 8.911 10.729 4.672 1.00 0.00 C ATOM 230 C HIS A 16 8.117 11.837 5.291 1.00 0.00 C ATOM 231 O HIS A 16 8.546 12.467 6.266 1.00 0.00 O ATOM 232 CB HIS A 16 8.807 9.418 5.507 1.00 0.00 C ATOM 233 CG HIS A 16 7.378 8.870 5.718 1.00 0.00 C ATOM 234 ND1 HIS A 16 6.824 8.675 6.959 1.00 0.00 N ATOM 235 CD2 HIS A 16 6.429 8.455 4.833 1.00 0.00 C ATOM 236 CE1 HIS A 16 5.602 8.172 6.832 1.00 0.00 C ATOM 237 NE2 HIS A 16 5.346 8.030 5.557 1.00 0.00 N ATOM 0 HA HIS A 16 8.529 10.467 3.685 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.403 8.648 5.016 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.257 9.595 6.484 1.00 0.00 H new ATOM 0 HD2 HIS A 16 6.515 8.460 3.756 1.00 0.00 H new ATOM 0 HE1 HIS A 16 4.933 7.923 7.643 1.00 0.00 H new ATOM 0 HE2 HIS A 16 4.479 7.662 5.165 1.00 0.00 H new ATOM 246 N ASN A 17 6.991 12.066 4.765 1.00 0.00 N ATOM 247 CA ASN A 17 6.130 13.100 5.208 1.00 0.00 C ATOM 248 C ASN A 17 4.858 12.489 5.711 1.00 0.00 C ATOM 249 O ASN A 17 4.609 11.299 5.489 1.00 0.00 O ATOM 250 CB ASN A 17 5.857 14.104 4.077 1.00 0.00 C ATOM 251 CG ASN A 17 6.992 15.095 3.846 1.00 0.00 C ATOM 252 OD1 ASN A 17 7.073 16.131 4.509 1.00 0.00 O ATOM 253 ND2 ASN A 17 7.837 14.820 2.879 1.00 0.00 N ATOM 0 H ASN A 17 6.618 11.526 3.984 1.00 0.00 H new ATOM 0 HA ASN A 17 6.606 13.651 6.019 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.673 13.555 3.153 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.946 14.657 4.307 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.589 15.473 2.657 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.742 13.953 2.350 1.00 0.00 H new ATOM 260 N GLY A 18 4.077 13.280 6.397 1.00 0.00 N ATOM 261 CA GLY A 18 2.837 12.817 6.951 1.00 0.00 C ATOM 262 C GLY A 18 1.825 12.473 5.886 1.00 0.00 C ATOM 263 O GLY A 18 1.938 12.940 4.735 1.00 0.00 O ATOM 0 H GLY A 18 4.283 14.261 6.586 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.024 11.938 7.569 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.425 13.585 7.605 1.00 0.00 H new ATOM 267 N PHE A 19 0.843 11.687 6.272 1.00 0.00 N ATOM 268 CA PHE A 19 -0.231 11.233 5.395 1.00 0.00 C ATOM 269 C PHE A 19 -0.903 12.438 4.794 1.00 0.00 C ATOM 270 O PHE A 19 -1.324 13.357 5.528 1.00 0.00 O ATOM 271 CB PHE A 19 -1.263 10.431 6.219 1.00 0.00 C ATOM 272 CG PHE A 19 -0.623 9.439 7.161 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.149 8.407 6.683 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.761 9.579 8.535 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.777 7.531 7.552 1.00 0.00 C ATOM 276 CE2 PHE A 19 -0.147 8.701 9.403 1.00 0.00 C ATOM 277 CZ PHE A 19 0.627 7.678 8.909 1.00 0.00 C ATOM 0 H PHE A 19 0.761 11.334 7.225 1.00 0.00 H new ATOM 0 HA PHE A 19 0.174 10.598 4.607 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.879 11.124 6.793 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.929 9.900 5.539 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.267 8.278 5.617 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.358 10.388 8.930 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.387 6.730 7.161 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -0.274 8.817 10.469 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.115 6.992 9.586 1.00 0.00 H new ATOM 287 N ASP A 20 -0.979 12.498 3.485 1.00 0.00 N ATOM 288 CA ASP A 20 -1.598 13.624 2.823 1.00 0.00 C ATOM 289 C ASP A 20 -3.063 13.495 2.970 1.00 0.00 C ATOM 290 O ASP A 20 -3.683 12.578 2.405 1.00 0.00 O ATOM 291 CB ASP A 20 -1.235 13.681 1.334 1.00 0.00 C ATOM 292 CG ASP A 20 0.239 13.827 1.096 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.778 14.935 1.245 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.903 12.835 0.770 1.00 0.00 O ATOM 0 H ASP A 20 -0.620 11.780 2.856 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.236 14.544 3.282 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.589 12.774 0.844 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.757 14.518 0.870 1.00 0.00 H new ATOM 299 N PHE A 21 -3.630 14.391 3.727 1.00 0.00 N ATOM 300 CA PHE A 21 -5.025 14.331 4.051 1.00 0.00 C ATOM 301 C PHE A 21 -5.856 14.512 2.812 1.00 0.00 C ATOM 302 O PHE A 21 -6.892 13.919 2.702 1.00 0.00 O ATOM 303 CB PHE A 21 -5.403 15.339 5.129 1.00 0.00 C ATOM 304 CG PHE A 21 -6.771 15.119 5.682 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.035 14.005 6.463 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.788 16.013 5.427 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.304 13.791 6.972 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.055 15.806 5.935 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.313 14.695 6.706 1.00 0.00 C ATOM 0 H PHE A 21 -3.137 15.184 4.137 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.231 13.343 4.462 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.677 15.284 5.940 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.343 16.345 4.714 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.245 13.299 6.676 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.592 16.886 4.822 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.505 12.919 7.576 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.843 16.515 5.728 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.304 14.531 7.102 1.00 0.00 H new ATOM 319 N ALA A 22 -5.362 15.301 1.878 1.00 0.00 N ATOM 320 CA ALA A 22 -5.998 15.487 0.590 1.00 0.00 C ATOM 321 C ALA A 22 -6.293 14.133 -0.078 1.00 0.00 C ATOM 322 O ALA A 22 -7.384 13.910 -0.606 1.00 0.00 O ATOM 323 CB ALA A 22 -5.100 16.323 -0.301 1.00 0.00 C ATOM 0 H ALA A 22 -4.501 15.835 1.993 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.946 16.003 0.740 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.578 16.463 -1.270 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.929 17.294 0.163 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.146 15.813 -0.437 1.00 0.00 H new ATOM 329 N VAL A 23 -5.324 13.237 -0.010 1.00 0.00 N ATOM 330 CA VAL A 23 -5.445 11.911 -0.597 1.00 0.00 C ATOM 331 C VAL A 23 -6.381 11.031 0.266 1.00 0.00 C ATOM 332 O VAL A 23 -7.283 10.361 -0.256 1.00 0.00 O ATOM 333 CB VAL A 23 -4.054 11.224 -0.727 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.179 9.849 -1.353 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.103 12.075 -1.552 1.00 0.00 C ATOM 0 H VAL A 23 -4.431 13.406 0.453 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.868 12.023 -1.595 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.650 11.115 0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.192 9.394 -1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.819 9.223 -0.731 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.616 9.940 -2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.138 11.573 -1.628 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.517 12.219 -2.550 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.971 13.044 -1.070 1.00 0.00 H new ATOM 345 N ILE A 24 -6.148 11.056 1.577 1.00 0.00 N ATOM 346 CA ILE A 24 -6.943 10.260 2.548 1.00 0.00 C ATOM 347 C ILE A 24 -8.438 10.596 2.399 1.00 0.00 C ATOM 348 O ILE A 24 -9.271 9.726 2.240 1.00 0.00 O ATOM 349 CB ILE A 24 -6.535 10.570 4.027 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.025 10.332 4.282 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.381 9.759 5.009 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.558 8.888 4.153 1.00 0.00 C ATOM 0 H ILE A 24 -5.413 11.618 2.006 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.749 9.209 2.333 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.728 11.630 4.193 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.455 10.944 3.582 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.783 10.686 5.284 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.078 9.993 6.030 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.433 10.010 4.877 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.236 8.695 4.822 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.488 8.833 4.351 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.093 8.267 4.872 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.759 8.529 3.144 1.00 0.00 H new ATOM 364 N LYS A 25 -8.709 11.875 2.418 1.00 0.00 N ATOM 365 CA LYS A 25 -10.033 12.470 2.298 1.00 0.00 C ATOM 366 C LYS A 25 -10.715 12.055 1.001 1.00 0.00 C ATOM 367 O LYS A 25 -11.876 11.640 1.011 1.00 0.00 O ATOM 368 CB LYS A 25 -9.833 13.975 2.325 1.00 0.00 C ATOM 369 CG LYS A 25 -10.940 14.807 1.746 1.00 0.00 C ATOM 370 CD LYS A 25 -10.449 16.228 1.563 1.00 0.00 C ATOM 371 CE LYS A 25 -11.359 16.986 0.630 1.00 0.00 C ATOM 372 NZ LYS A 25 -12.706 17.184 1.180 1.00 0.00 N ATOM 0 H LYS A 25 -7.976 12.577 2.523 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.675 12.134 3.112 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.682 14.281 3.360 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.914 14.207 1.787 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.260 14.394 0.789 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.807 14.791 2.406 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.408 16.732 2.529 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.435 16.220 1.164 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.916 17.957 0.408 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.433 16.447 -0.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.286 17.710 0.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.144 16.259 1.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.643 17.723 2.067 1.00 0.00 H new ATOM 386 N GLU A 26 -9.994 12.173 -0.101 1.00 0.00 N ATOM 387 CA GLU A 26 -10.514 11.853 -1.424 1.00 0.00 C ATOM 388 C GLU A 26 -10.991 10.401 -1.451 1.00 0.00 C ATOM 389 O GLU A 26 -12.155 10.111 -1.771 1.00 0.00 O ATOM 390 CB GLU A 26 -9.396 12.082 -2.453 1.00 0.00 C ATOM 391 CG GLU A 26 -9.764 12.981 -3.618 1.00 0.00 C ATOM 392 CD GLU A 26 -10.690 12.344 -4.625 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.925 12.402 -4.447 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.190 11.816 -5.652 1.00 0.00 O ATOM 0 H GLU A 26 -9.026 12.495 -0.105 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.363 12.492 -1.667 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -8.535 12.512 -1.941 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.082 11.115 -2.846 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.234 13.885 -3.230 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.851 13.290 -4.126 1.00 0.00 H new ATOM 401 N LEU A 27 -10.110 9.510 -1.052 1.00 0.00 N ATOM 402 CA LEU A 27 -10.440 8.096 -1.074 1.00 0.00 C ATOM 403 C LEU A 27 -11.481 7.747 0.002 1.00 0.00 C ATOM 404 O LEU A 27 -12.294 6.885 -0.211 1.00 0.00 O ATOM 405 CB LEU A 27 -9.207 7.168 -0.984 1.00 0.00 C ATOM 406 CG LEU A 27 -9.488 5.682 -1.252 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.112 5.465 -2.622 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.217 4.880 -1.126 1.00 0.00 C ATOM 0 H LEU A 27 -9.174 9.731 -0.713 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.880 7.911 -2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.458 7.514 -1.697 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.770 7.266 0.010 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.204 5.341 -0.504 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.296 4.401 -2.774 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.055 6.008 -2.682 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.433 5.830 -3.393 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.430 3.828 -1.318 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.486 5.241 -1.850 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.815 4.991 -0.119 1.00 0.00 H new ATOM 420 N LYS A 28 -11.476 8.449 1.132 1.00 0.00 N ATOM 421 CA LYS A 28 -12.492 8.247 2.178 1.00 0.00 C ATOM 422 C LYS A 28 -13.869 8.659 1.673 1.00 0.00 C ATOM 423 O LYS A 28 -14.884 8.020 1.990 1.00 0.00 O ATOM 424 CB LYS A 28 -12.120 9.012 3.475 1.00 0.00 C ATOM 425 CG LYS A 28 -13.155 8.923 4.609 1.00 0.00 C ATOM 426 CD LYS A 28 -13.562 7.487 4.860 1.00 0.00 C ATOM 427 CE LYS A 28 -14.506 7.329 6.020 1.00 0.00 C ATOM 428 NZ LYS A 28 -13.865 7.679 7.283 1.00 0.00 N ATOM 0 H LYS A 28 -10.783 9.164 1.353 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.523 7.185 2.421 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.168 8.629 3.843 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -11.967 10.062 3.227 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -12.739 9.351 5.521 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -14.034 9.514 4.351 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -14.032 7.088 3.961 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.668 6.891 5.044 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.381 7.961 5.867 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.861 6.299 6.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.481 7.400 8.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.955 7.181 7.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -13.702 8.706 7.317 1.00 0.00 H new ATOM 442 N THR A 29 -13.907 9.696 0.885 1.00 0.00 N ATOM 443 CA THR A 29 -15.146 10.145 0.331 1.00 0.00 C ATOM 444 C THR A 29 -15.675 9.107 -0.669 1.00 0.00 C ATOM 445 O THR A 29 -16.842 8.712 -0.610 1.00 0.00 O ATOM 446 CB THR A 29 -15.006 11.541 -0.299 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.420 12.431 0.679 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.371 12.085 -0.699 1.00 0.00 C ATOM 0 H THR A 29 -13.091 10.245 0.613 1.00 0.00 H new ATOM 0 HA THR A 29 -15.877 10.243 1.134 1.00 0.00 H new ATOM 0 HB THR A 29 -14.378 11.471 -1.187 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.445 12.328 0.672 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.253 13.073 -1.143 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.832 11.414 -1.424 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.007 12.157 0.183 1.00 0.00 H new ATOM 456 N ALA A 30 -14.790 8.600 -1.519 1.00 0.00 N ATOM 457 CA ALA A 30 -15.134 7.590 -2.445 1.00 0.00 C ATOM 458 C ALA A 30 -15.529 6.311 -1.712 1.00 0.00 C ATOM 459 O ALA A 30 -16.391 5.627 -2.117 1.00 0.00 O ATOM 460 CB ALA A 30 -13.968 7.341 -3.392 1.00 0.00 C ATOM 0 H ALA A 30 -13.815 8.896 -1.566 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.992 7.918 -3.032 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.238 6.561 -4.104 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.734 8.259 -3.931 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.096 7.024 -2.820 1.00 0.00 H new ATOM 466 N ALA A 31 -14.877 6.027 -0.632 1.00 0.00 N ATOM 467 CA ALA A 31 -15.120 4.861 0.175 1.00 0.00 C ATOM 468 C ALA A 31 -16.502 4.889 0.837 1.00 0.00 C ATOM 469 O ALA A 31 -17.159 3.853 0.958 1.00 0.00 O ATOM 470 CB ALA A 31 -14.073 4.796 1.211 1.00 0.00 C ATOM 0 H ALA A 31 -14.131 6.619 -0.268 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.095 3.981 -0.468 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.235 3.919 1.838 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.095 4.727 0.736 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.114 5.694 1.827 1.00 0.00 H new ATOM 476 N SER A 32 -16.942 6.030 1.249 1.00 0.00 N ATOM 477 CA SER A 32 -18.216 6.122 1.913 1.00 0.00 C ATOM 478 C SER A 32 -19.368 6.196 0.905 1.00 0.00 C ATOM 479 O SER A 32 -20.359 5.476 1.021 1.00 0.00 O ATOM 480 CB SER A 32 -18.198 7.295 2.910 1.00 0.00 C ATOM 481 OG SER A 32 -17.561 8.430 2.335 1.00 0.00 O ATOM 0 H SER A 32 -16.446 6.915 1.142 1.00 0.00 H new ATOM 0 HA SER A 32 -18.393 5.213 2.487 1.00 0.00 H new ATOM 0 HB2 SER A 32 -19.218 7.550 3.198 1.00 0.00 H new ATOM 0 HB3 SER A 32 -17.675 6.999 3.819 1.00 0.00 H new ATOM 0 HG SER A 32 -16.589 8.307 2.359 1.00 0.00 H new ATOM 487 N GLN A 33 -19.202 7.042 -0.097 1.00 0.00 N ATOM 488 CA GLN A 33 -20.192 7.256 -1.142 1.00 0.00 C ATOM 489 C GLN A 33 -20.230 6.107 -2.129 1.00 0.00 C ATOM 490 O GLN A 33 -21.275 5.524 -2.397 1.00 0.00 O ATOM 491 CB GLN A 33 -19.788 8.489 -1.928 1.00 0.00 C ATOM 492 CG GLN A 33 -19.769 9.752 -1.148 1.00 0.00 C ATOM 493 CD GLN A 33 -21.132 10.276 -0.953 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.805 9.991 0.035 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.577 10.997 -1.913 1.00 0.00 N ATOM 0 H GLN A 33 -18.362 7.610 -0.210 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.167 7.354 -0.664 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.796 8.324 -2.349 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.474 8.608 -2.767 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.301 9.578 -0.179 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.162 10.494 -1.666 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.980 11.206 -2.713 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.529 11.362 -1.878 1.00 0.00 H new ATOM 504 N TYR A 34 -19.079 5.787 -2.631 1.00 0.00 N ATOM 505 CA TYR A 34 -18.926 4.913 -3.758 1.00 0.00 C ATOM 506 C TYR A 34 -18.556 3.512 -3.312 1.00 0.00 C ATOM 507 O TYR A 34 -18.772 2.544 -4.044 1.00 0.00 O ATOM 508 CB TYR A 34 -17.820 5.497 -4.686 1.00 0.00 C ATOM 509 CG TYR A 34 -18.191 6.753 -5.453 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.063 8.000 -4.871 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.648 6.690 -6.766 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.368 9.154 -5.562 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.961 7.838 -7.466 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.816 9.070 -6.860 1.00 0.00 C ATOM 515 OH TYR A 34 -19.111 10.224 -7.565 1.00 0.00 O ATOM 0 H TYR A 34 -18.194 6.134 -2.261 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.871 4.846 -4.298 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.940 5.712 -4.079 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.532 4.729 -5.403 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.716 8.073 -3.851 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -18.759 5.728 -7.245 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -18.256 10.117 -5.087 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -19.318 7.773 -8.483 1.00 0.00 H new ATOM 0 HH TYR A 34 -19.413 9.988 -8.467 1.00 0.00 H new ATOM 525 N GLY A 35 -17.986 3.405 -2.122 1.00 0.00 N ATOM 526 CA GLY A 35 -17.533 2.127 -1.621 1.00 0.00 C ATOM 527 C GLY A 35 -16.341 1.698 -2.417 1.00 0.00 C ATOM 528 O GLY A 35 -15.806 2.495 -3.166 1.00 0.00 O ATOM 0 H GLY A 35 -17.828 4.190 -1.489 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.275 2.205 -0.565 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.328 1.386 -1.701 1.00 0.00 H new ATOM 532 N ALA A 36 -15.868 0.511 -2.244 1.00 0.00 N ATOM 533 CA ALA A 36 -14.825 0.065 -3.107 1.00 0.00 C ATOM 534 C ALA A 36 -15.378 -0.812 -4.218 1.00 0.00 C ATOM 535 O ALA A 36 -15.569 -1.990 -4.023 1.00 0.00 O ATOM 536 CB ALA A 36 -13.743 -0.617 -2.364 1.00 0.00 C ATOM 0 H ALA A 36 -16.175 -0.154 -1.534 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.381 0.949 -3.566 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.970 -0.940 -3.062 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.311 0.071 -1.637 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.149 -1.485 -1.845 1.00 0.00 H new ATOM 542 N THR A 37 -15.609 -0.241 -5.376 1.00 0.00 N ATOM 543 CA THR A 37 -16.226 -0.957 -6.487 1.00 0.00 C ATOM 544 C THR A 37 -16.370 -0.058 -7.696 1.00 0.00 C ATOM 545 O THR A 37 -16.031 -0.462 -8.802 1.00 0.00 O ATOM 546 CB THR A 37 -17.589 -1.650 -6.128 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.213 -2.192 -7.301 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.531 -0.702 -5.417 1.00 0.00 C ATOM 0 H THR A 37 -15.378 0.731 -5.583 1.00 0.00 H new ATOM 0 HA THR A 37 -15.543 -1.771 -6.729 1.00 0.00 H new ATOM 0 HB THR A 37 -17.364 -2.468 -5.444 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.785 -2.947 -7.048 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.462 -1.219 -5.186 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.069 -0.356 -4.492 1.00 0.00 H new ATOM 0 HG23 THR A 37 -18.741 0.153 -6.060 1.00 0.00 H new ATOM 556 N ALA A 38 -16.834 1.167 -7.480 1.00 0.00 N ATOM 557 CA ALA A 38 -16.969 2.124 -8.556 1.00 0.00 C ATOM 558 C ALA A 38 -15.593 2.413 -9.155 1.00 0.00 C ATOM 559 O ALA A 38 -14.618 2.537 -8.415 1.00 0.00 O ATOM 560 CB ALA A 38 -17.607 3.394 -8.039 1.00 0.00 C ATOM 0 H ALA A 38 -17.122 1.515 -6.566 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.611 1.712 -9.335 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.705 4.110 -8.855 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.593 3.167 -7.634 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.983 3.822 -7.254 1.00 0.00 H new ATOM 566 N PRO A 39 -15.495 2.538 -10.493 1.00 0.00 N ATOM 567 CA PRO A 39 -14.210 2.736 -11.210 1.00 0.00 C ATOM 568 C PRO A 39 -13.410 3.909 -10.651 1.00 0.00 C ATOM 569 O PRO A 39 -12.173 3.911 -10.684 1.00 0.00 O ATOM 570 CB PRO A 39 -14.638 3.033 -12.656 1.00 0.00 C ATOM 571 CG PRO A 39 -16.096 3.325 -12.577 1.00 0.00 C ATOM 572 CD PRO A 39 -16.621 2.511 -11.437 1.00 0.00 C ATOM 0 HA PRO A 39 -13.560 1.866 -11.114 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.088 3.881 -13.064 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.441 2.182 -13.308 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.272 4.388 -12.411 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.597 3.061 -13.508 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.523 2.946 -11.007 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.872 1.495 -11.743 1.00 0.00 H new ATOM 580 N TYR A 40 -14.138 4.870 -10.124 1.00 0.00 N ATOM 581 CA TYR A 40 -13.595 6.045 -9.494 1.00 0.00 C ATOM 582 C TYR A 40 -12.698 5.670 -8.305 1.00 0.00 C ATOM 583 O TYR A 40 -11.498 5.889 -8.347 1.00 0.00 O ATOM 584 CB TYR A 40 -14.772 6.947 -9.049 1.00 0.00 C ATOM 585 CG TYR A 40 -14.391 8.251 -8.369 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.927 9.316 -9.106 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.498 8.408 -6.989 1.00 0.00 C ATOM 588 CE1 TYR A 40 -13.575 10.507 -8.503 1.00 0.00 C ATOM 589 CE2 TYR A 40 -14.154 9.598 -6.381 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.691 10.640 -7.147 1.00 0.00 C ATOM 591 OH TYR A 40 -13.364 11.834 -6.559 1.00 0.00 O ATOM 0 H TYR A 40 -15.158 4.850 -10.125 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.967 6.587 -10.202 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.377 7.180 -9.925 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.404 6.376 -8.368 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.836 9.218 -10.178 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.855 7.586 -6.386 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -13.210 11.330 -9.100 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.248 9.709 -5.311 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.842 11.666 -5.746 1.00 0.00 H new ATOM 601 N THR A 41 -13.286 5.059 -7.269 1.00 0.00 N ATOM 602 CA THR A 41 -12.605 4.744 -6.020 1.00 0.00 C ATOM 603 C THR A 41 -11.337 3.878 -6.210 1.00 0.00 C ATOM 604 O THR A 41 -10.285 4.220 -5.712 1.00 0.00 O ATOM 605 CB THR A 41 -13.609 4.092 -5.004 1.00 0.00 C ATOM 606 OG1 THR A 41 -13.031 3.945 -3.713 1.00 0.00 O ATOM 607 CG2 THR A 41 -14.056 2.739 -5.473 1.00 0.00 C ATOM 0 H THR A 41 -14.263 4.768 -7.281 1.00 0.00 H new ATOM 0 HA THR A 41 -12.248 5.687 -5.606 1.00 0.00 H new ATOM 0 HB THR A 41 -14.463 4.766 -4.945 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.684 3.538 -3.107 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.750 2.314 -4.748 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.553 2.834 -6.439 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.190 2.084 -5.573 1.00 0.00 H new ATOM 615 N LEU A 42 -11.406 2.801 -6.988 1.00 0.00 N ATOM 616 CA LEU A 42 -10.231 1.968 -7.152 1.00 0.00 C ATOM 617 C LEU A 42 -9.163 2.580 -8.032 1.00 0.00 C ATOM 618 O LEU A 42 -7.998 2.206 -7.951 1.00 0.00 O ATOM 619 CB LEU A 42 -10.436 0.419 -7.295 1.00 0.00 C ATOM 620 CG LEU A 42 -11.535 -0.129 -8.218 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.897 0.038 -7.589 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.488 0.503 -9.602 1.00 0.00 C ATOM 0 H LEU A 42 -12.236 2.496 -7.497 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.808 1.983 -6.147 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.489 -0.003 -7.632 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.624 0.024 -6.297 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.347 -1.195 -8.349 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.659 -0.357 -8.261 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.930 -0.504 -6.644 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.087 1.096 -7.407 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.283 0.085 -10.220 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.625 1.581 -9.515 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.523 0.296 -10.064 1.00 0.00 H new ATOM 634 N ALA A 43 -9.558 3.542 -8.867 1.00 0.00 N ATOM 635 CA ALA A 43 -8.586 4.335 -9.621 1.00 0.00 C ATOM 636 C ALA A 43 -7.774 5.149 -8.636 1.00 0.00 C ATOM 637 O ALA A 43 -6.574 5.366 -8.805 1.00 0.00 O ATOM 638 CB ALA A 43 -9.273 5.258 -10.604 1.00 0.00 C ATOM 0 H ALA A 43 -10.533 3.789 -9.037 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.943 3.665 -10.192 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.524 5.833 -11.148 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.859 4.668 -11.308 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.931 5.939 -10.065 1.00 0.00 H new ATOM 644 N ILE A 44 -8.447 5.548 -7.579 1.00 0.00 N ATOM 645 CA ILE A 44 -7.850 6.285 -6.508 1.00 0.00 C ATOM 646 C ILE A 44 -7.022 5.341 -5.621 1.00 0.00 C ATOM 647 O ILE A 44 -5.960 5.704 -5.187 1.00 0.00 O ATOM 648 CB ILE A 44 -8.917 7.004 -5.671 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.789 7.885 -6.568 1.00 0.00 C ATOM 650 CG2 ILE A 44 -8.251 7.849 -4.598 1.00 0.00 C ATOM 651 CD1 ILE A 44 -11.000 8.402 -5.890 1.00 0.00 C ATOM 0 H ILE A 44 -9.441 5.362 -7.446 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.193 7.042 -6.936 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.551 6.258 -5.192 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.195 8.726 -6.925 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -10.090 7.312 -7.445 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -9.015 8.356 -4.008 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.656 7.208 -3.947 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.604 8.590 -5.068 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.571 9.018 -6.585 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.615 7.566 -5.557 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.707 9.003 -5.029 1.00 0.00 H new ATOM 663 N VAL A 45 -7.508 4.106 -5.402 1.00 0.00 N ATOM 664 CA VAL A 45 -6.751 3.086 -4.610 1.00 0.00 C ATOM 665 C VAL A 45 -5.379 2.869 -5.282 1.00 0.00 C ATOM 666 O VAL A 45 -4.328 2.836 -4.624 1.00 0.00 O ATOM 667 CB VAL A 45 -7.542 1.712 -4.483 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.751 0.658 -3.715 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.884 1.909 -3.790 1.00 0.00 C ATOM 0 H VAL A 45 -8.409 3.781 -5.752 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.620 3.457 -3.594 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.699 1.361 -5.503 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.333 -0.262 -3.655 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.812 0.460 -4.231 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.542 1.021 -2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.401 0.952 -3.718 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.721 2.309 -2.789 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.492 2.607 -4.366 1.00 0.00 H new ATOM 679 N GLU A 46 -5.415 2.806 -6.604 1.00 0.00 N ATOM 680 CA GLU A 46 -4.227 2.726 -7.446 1.00 0.00 C ATOM 681 C GLU A 46 -3.377 4.007 -7.345 1.00 0.00 C ATOM 682 O GLU A 46 -2.158 3.956 -7.374 1.00 0.00 O ATOM 683 CB GLU A 46 -4.678 2.511 -8.890 1.00 0.00 C ATOM 684 CG GLU A 46 -5.171 1.108 -9.204 1.00 0.00 C ATOM 685 CD GLU A 46 -4.067 0.207 -9.706 1.00 0.00 C ATOM 686 OE1 GLU A 46 -3.639 0.362 -10.861 1.00 0.00 O ATOM 687 OE2 GLU A 46 -3.625 -0.694 -8.978 1.00 0.00 O ATOM 0 H GLU A 46 -6.287 2.809 -7.134 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.606 1.896 -7.110 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.475 3.219 -9.116 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.846 2.745 -9.554 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.612 0.672 -8.308 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.960 1.163 -9.954 1.00 0.00 H new ATOM 694 N SER A 47 -4.036 5.134 -7.209 1.00 0.00 N ATOM 695 CA SER A 47 -3.380 6.429 -7.155 1.00 0.00 C ATOM 696 C SER A 47 -2.698 6.639 -5.790 1.00 0.00 C ATOM 697 O SER A 47 -1.668 7.304 -5.693 1.00 0.00 O ATOM 698 CB SER A 47 -4.412 7.534 -7.452 1.00 0.00 C ATOM 699 OG SER A 47 -3.839 8.823 -7.481 1.00 0.00 O ATOM 0 H SER A 47 -5.052 5.183 -7.132 1.00 0.00 H new ATOM 0 HA SER A 47 -2.597 6.473 -7.912 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.889 7.331 -8.411 1.00 0.00 H new ATOM 0 HB3 SER A 47 -5.195 7.506 -6.695 1.00 0.00 H new ATOM 0 HG SER A 47 -4.534 9.486 -7.674 1.00 0.00 H new ATOM 705 N VAL A 48 -3.257 6.065 -4.746 1.00 0.00 N ATOM 706 CA VAL A 48 -2.657 6.148 -3.445 1.00 0.00 C ATOM 707 C VAL A 48 -1.392 5.290 -3.430 1.00 0.00 C ATOM 708 O VAL A 48 -0.321 5.740 -3.004 1.00 0.00 O ATOM 709 CB VAL A 48 -3.622 5.695 -2.329 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.977 5.876 -0.974 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.930 6.468 -2.386 1.00 0.00 C ATOM 0 H VAL A 48 -4.128 5.536 -4.780 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.410 7.191 -3.247 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.842 4.639 -2.485 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.668 5.553 -0.196 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.067 5.279 -0.922 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.730 6.927 -0.826 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.589 6.127 -1.588 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.730 7.532 -2.261 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.410 6.300 -3.350 1.00 0.00 H new ATOM 721 N ALA A 49 -1.509 4.099 -4.000 1.00 0.00 N ATOM 722 CA ALA A 49 -0.407 3.142 -4.089 1.00 0.00 C ATOM 723 C ALA A 49 0.593 3.535 -5.153 1.00 0.00 C ATOM 724 O ALA A 49 1.605 2.902 -5.304 1.00 0.00 O ATOM 725 CB ALA A 49 -0.948 1.764 -4.378 1.00 0.00 C ATOM 0 H ALA A 49 -2.377 3.764 -4.418 1.00 0.00 H new ATOM 0 HA ALA A 49 0.111 3.141 -3.130 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.122 1.055 -4.443 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.623 1.463 -3.577 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.491 1.777 -5.323 1.00 0.00 H new ATOM 731 N ASP A 50 0.288 4.581 -5.889 1.00 0.00 N ATOM 732 CA ASP A 50 1.190 5.119 -6.909 1.00 0.00 C ATOM 733 C ASP A 50 2.398 5.760 -6.227 1.00 0.00 C ATOM 734 O ASP A 50 3.496 5.869 -6.805 1.00 0.00 O ATOM 735 CB ASP A 50 0.438 6.154 -7.772 1.00 0.00 C ATOM 736 CG ASP A 50 1.291 6.852 -8.805 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.879 7.905 -8.492 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.325 6.408 -9.972 1.00 0.00 O ATOM 0 H ASP A 50 -0.592 5.090 -5.804 1.00 0.00 H new ATOM 0 HA ASP A 50 1.538 4.315 -7.558 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.387 5.654 -8.279 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.001 6.905 -7.115 1.00 0.00 H new ATOM 743 N ASN A 51 2.192 6.121 -4.984 1.00 0.00 N ATOM 744 CA ASN A 51 3.197 6.734 -4.157 1.00 0.00 C ATOM 745 C ASN A 51 4.058 5.647 -3.545 1.00 0.00 C ATOM 746 O ASN A 51 3.684 4.491 -3.561 1.00 0.00 O ATOM 747 CB ASN A 51 2.534 7.536 -3.021 1.00 0.00 C ATOM 748 CG ASN A 51 1.673 8.684 -3.491 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.154 9.797 -3.681 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.394 8.449 -3.612 1.00 0.00 N ATOM 0 H ASN A 51 1.298 5.993 -4.510 1.00 0.00 H new ATOM 0 HA ASN A 51 3.801 7.405 -4.767 1.00 0.00 H new ATOM 0 HB2 ASN A 51 1.923 6.860 -2.423 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.312 7.926 -2.365 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -0.241 9.204 -3.872 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.030 7.511 -3.446 1.00 0.00 H new ATOM 757 N TRP A 52 5.167 6.033 -2.942 1.00 0.00 N ATOM 758 CA TRP A 52 6.093 5.067 -2.322 1.00 0.00 C ATOM 759 C TRP A 52 5.748 4.889 -0.837 1.00 0.00 C ATOM 760 O TRP A 52 6.561 4.391 -0.058 1.00 0.00 O ATOM 761 CB TRP A 52 7.534 5.579 -2.434 1.00 0.00 C ATOM 762 CG TRP A 52 7.973 5.952 -3.830 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.061 5.131 -4.901 1.00 0.00 C ATOM 764 CD2 TRP A 52 8.428 7.236 -4.275 1.00 0.00 C ATOM 765 NE1 TRP A 52 8.514 5.818 -5.993 1.00 0.00 N ATOM 766 CE2 TRP A 52 8.753 7.112 -5.634 1.00 0.00 C ATOM 767 CE3 TRP A 52 8.581 8.470 -3.660 1.00 0.00 C ATOM 768 CZ2 TRP A 52 9.231 8.184 -6.391 1.00 0.00 C ATOM 769 CZ3 TRP A 52 9.052 9.525 -4.401 1.00 0.00 C ATOM 770 CH2 TRP A 52 9.373 9.379 -5.751 1.00 0.00 C ATOM 0 H TRP A 52 5.460 7.007 -2.861 1.00 0.00 H new ATOM 0 HA TRP A 52 5.998 4.113 -2.840 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.645 6.451 -1.790 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.207 4.812 -2.051 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.809 4.081 -4.895 1.00 0.00 H new ATOM 0 HE1 TRP A 52 8.651 5.426 -6.925 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.334 8.598 -2.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.477 8.071 -7.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 9.177 10.488 -3.929 1.00 0.00 H new ATOM 0 HH2 TRP A 52 9.742 10.232 -6.301 1.00 0.00 H new ATOM 781 N LEU A 53 4.582 5.414 -0.492 1.00 0.00 N ATOM 782 CA LEU A 53 4.014 5.379 0.871 1.00 0.00 C ATOM 783 C LEU A 53 4.341 4.063 1.618 1.00 0.00 C ATOM 784 O LEU A 53 4.163 2.964 1.098 1.00 0.00 O ATOM 785 CB LEU A 53 2.483 5.624 0.851 1.00 0.00 C ATOM 786 CG LEU A 53 1.532 4.475 0.454 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.099 4.913 0.655 1.00 0.00 C ATOM 788 CD2 LEU A 53 1.717 4.045 -0.986 1.00 0.00 C ATOM 0 H LEU A 53 3.979 5.892 -1.162 1.00 0.00 H new ATOM 0 HA LEU A 53 4.490 6.191 1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.193 5.958 1.847 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.294 6.454 0.170 1.00 0.00 H new ATOM 0 HG LEU A 53 1.770 3.623 1.091 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.572 4.101 0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.060 5.169 1.702 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.106 5.784 0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.025 3.235 -1.215 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.519 4.889 -1.646 1.00 0.00 H new ATOM 0 HD23 LEU A 53 2.741 3.701 -1.134 1.00 0.00 H new ATOM 800 N THR A 54 4.818 4.208 2.821 1.00 0.00 N ATOM 801 CA THR A 54 5.299 3.084 3.588 1.00 0.00 C ATOM 802 C THR A 54 4.137 2.274 4.228 1.00 0.00 C ATOM 803 O THR A 54 2.991 2.730 4.216 1.00 0.00 O ATOM 804 CB THR A 54 6.315 3.565 4.658 1.00 0.00 C ATOM 805 OG1 THR A 54 5.755 4.616 5.467 1.00 0.00 O ATOM 806 CG2 THR A 54 7.609 4.053 4.014 1.00 0.00 C ATOM 0 H THR A 54 4.886 5.105 3.301 1.00 0.00 H new ATOM 0 HA THR A 54 5.809 2.404 2.906 1.00 0.00 H new ATOM 0 HB THR A 54 6.541 2.709 5.294 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.849 4.821 5.155 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.300 4.383 4.790 1.00 0.00 H new ATOM 0 HG22 THR A 54 8.062 3.240 3.447 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.391 4.885 3.345 1.00 0.00 H new ATOM 814 N PRO A 55 4.405 1.054 4.792 1.00 0.00 N ATOM 815 CA PRO A 55 3.375 0.216 5.434 1.00 0.00 C ATOM 816 C PRO A 55 2.522 0.958 6.490 1.00 0.00 C ATOM 817 O PRO A 55 1.345 0.643 6.663 1.00 0.00 O ATOM 818 CB PRO A 55 4.183 -0.912 6.081 1.00 0.00 C ATOM 819 CG PRO A 55 5.369 -1.047 5.209 1.00 0.00 C ATOM 820 CD PRO A 55 5.712 0.350 4.774 1.00 0.00 C ATOM 0 HA PRO A 55 2.640 -0.123 4.704 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.466 -0.664 7.104 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.611 -1.839 6.124 1.00 0.00 H new ATOM 0 HG2 PRO A 55 6.200 -1.506 5.745 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.154 -1.683 4.350 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.427 0.816 5.451 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.160 0.362 3.780 1.00 0.00 H new ATOM 828 N THR A 56 3.109 1.950 7.174 1.00 0.00 N ATOM 829 CA THR A 56 2.361 2.728 8.147 1.00 0.00 C ATOM 830 C THR A 56 1.311 3.602 7.414 1.00 0.00 C ATOM 831 O THR A 56 0.160 3.724 7.868 1.00 0.00 O ATOM 832 CB THR A 56 3.298 3.578 9.096 1.00 0.00 C ATOM 833 OG1 THR A 56 2.535 4.335 10.049 1.00 0.00 O ATOM 834 CG2 THR A 56 4.193 4.525 8.314 1.00 0.00 C ATOM 0 H THR A 56 4.086 2.223 7.068 1.00 0.00 H new ATOM 0 HA THR A 56 1.837 2.038 8.808 1.00 0.00 H new ATOM 0 HB THR A 56 3.925 2.860 9.625 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.143 4.848 10.621 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.819 5.088 9.006 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.826 3.952 7.637 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.577 5.215 7.738 1.00 0.00 H new ATOM 842 N ASP A 57 1.702 4.159 6.246 1.00 0.00 N ATOM 843 CA ASP A 57 0.788 4.926 5.388 1.00 0.00 C ATOM 844 C ASP A 57 -0.314 4.020 4.938 1.00 0.00 C ATOM 845 O ASP A 57 -1.475 4.374 5.010 1.00 0.00 O ATOM 846 CB ASP A 57 1.483 5.506 4.138 1.00 0.00 C ATOM 847 CG ASP A 57 2.573 6.528 4.399 1.00 0.00 C ATOM 848 OD1 ASP A 57 3.761 6.129 4.589 1.00 0.00 O ATOM 849 OD2 ASP A 57 2.290 7.730 4.374 1.00 0.00 O ATOM 0 H ASP A 57 2.651 4.088 5.879 1.00 0.00 H new ATOM 0 HA ASP A 57 0.414 5.764 5.976 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.914 4.681 3.570 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.724 5.966 3.505 1.00 0.00 H new ATOM 854 N TRP A 58 0.075 2.835 4.492 1.00 0.00 N ATOM 855 CA TRP A 58 -0.849 1.789 4.086 1.00 0.00 C ATOM 856 C TRP A 58 -1.885 1.488 5.162 1.00 0.00 C ATOM 857 O TRP A 58 -3.091 1.606 4.930 1.00 0.00 O ATOM 858 CB TRP A 58 -0.095 0.492 3.771 1.00 0.00 C ATOM 859 CG TRP A 58 0.414 0.371 2.390 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.428 1.320 1.422 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.970 -0.804 1.804 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.949 0.795 0.270 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.287 -0.495 0.484 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.233 -2.099 2.270 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.837 -1.405 -0.378 1.00 0.00 C ATOM 866 CZ3 TRP A 58 1.799 -3.018 1.394 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.090 -2.662 0.080 1.00 0.00 C ATOM 0 H TRP A 58 1.056 2.570 4.401 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.359 2.158 3.197 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.746 0.405 4.458 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.757 -0.350 3.970 1.00 0.00 H new ATOM 0 HD1 TRP A 58 0.081 2.336 1.541 1.00 0.00 H new ATOM 0 HE1 TRP A 58 1.064 1.298 -0.610 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.001 -2.377 3.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.065 -1.132 -1.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.015 -4.019 1.737 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.523 -3.394 -0.586 1.00 0.00 H new ATOM 878 N ASN A 59 -1.400 1.110 6.326 1.00 0.00 N ATOM 879 CA ASN A 59 -2.230 0.715 7.461 1.00 0.00 C ATOM 880 C ASN A 59 -3.204 1.839 7.798 1.00 0.00 C ATOM 881 O ASN A 59 -4.410 1.623 7.907 1.00 0.00 O ATOM 882 CB ASN A 59 -1.317 0.410 8.662 1.00 0.00 C ATOM 883 CG ASN A 59 -2.017 -0.227 9.865 1.00 0.00 C ATOM 884 OD1 ASN A 59 -3.201 -0.014 10.126 1.00 0.00 O ATOM 885 ND2 ASN A 59 -1.279 -1.014 10.604 1.00 0.00 N ATOM 0 H ASN A 59 -0.400 1.065 6.521 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.806 -0.177 7.214 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.519 -0.255 8.332 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.846 1.338 8.985 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -1.682 -1.471 11.422 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.301 -1.171 10.362 1.00 0.00 H new ATOM 892 N THR A 60 -2.685 3.047 7.847 1.00 0.00 N ATOM 893 CA THR A 60 -3.476 4.213 8.184 1.00 0.00 C ATOM 894 C THR A 60 -4.508 4.513 7.075 1.00 0.00 C ATOM 895 O THR A 60 -5.636 4.946 7.360 1.00 0.00 O ATOM 896 CB THR A 60 -2.563 5.439 8.434 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.549 5.077 9.398 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.357 6.632 8.965 1.00 0.00 C ATOM 0 H THR A 60 -1.704 3.249 7.655 1.00 0.00 H new ATOM 0 HA THR A 60 -4.021 4.002 9.104 1.00 0.00 H new ATOM 0 HB THR A 60 -2.110 5.729 7.486 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.737 4.793 8.928 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.684 7.473 9.129 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.120 6.914 8.239 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.835 6.361 9.907 1.00 0.00 H new ATOM 906 N LEU A 61 -4.140 4.195 5.834 1.00 0.00 N ATOM 907 CA LEU A 61 -4.966 4.465 4.675 1.00 0.00 C ATOM 908 C LEU A 61 -6.205 3.596 4.740 1.00 0.00 C ATOM 909 O LEU A 61 -7.270 4.108 4.996 1.00 0.00 O ATOM 910 CB LEU A 61 -4.144 4.225 3.357 1.00 0.00 C ATOM 911 CG LEU A 61 -4.745 4.610 1.955 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.942 3.756 1.526 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.071 6.097 1.896 1.00 0.00 C ATOM 0 H LEU A 61 -3.254 3.741 5.612 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.281 5.509 4.670 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.204 4.766 3.462 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.899 3.164 3.321 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.965 4.389 1.227 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -6.294 4.088 0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.640 2.710 1.467 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.744 3.861 2.256 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.485 6.340 0.918 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.800 6.341 2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.162 6.676 2.059 1.00 0.00 H new ATOM 925 N VAL A 62 -6.034 2.264 4.623 1.00 0.00 N ATOM 926 CA VAL A 62 -7.183 1.327 4.577 1.00 0.00 C ATOM 927 C VAL A 62 -8.083 1.484 5.793 1.00 0.00 C ATOM 928 O VAL A 62 -9.310 1.522 5.688 1.00 0.00 O ATOM 929 CB VAL A 62 -6.742 -0.177 4.394 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.851 -0.692 5.518 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.948 -1.071 4.273 1.00 0.00 C ATOM 0 H VAL A 62 -5.122 1.812 4.559 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.757 1.598 3.691 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.154 -0.203 3.477 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.587 -1.732 5.326 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.943 -0.090 5.567 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.384 -0.622 6.466 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.624 -2.104 4.147 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.554 -0.988 5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.540 -0.769 3.409 1.00 0.00 H new ATOM 941 N ARG A 63 -7.437 1.646 6.911 1.00 0.00 N ATOM 942 CA ARG A 63 -8.097 1.795 8.203 1.00 0.00 C ATOM 943 C ARG A 63 -9.031 3.013 8.311 1.00 0.00 C ATOM 944 O ARG A 63 -10.109 2.918 8.912 1.00 0.00 O ATOM 945 CB ARG A 63 -7.063 1.690 9.368 1.00 0.00 C ATOM 946 CG ARG A 63 -7.406 2.403 10.672 1.00 0.00 C ATOM 947 CD ARG A 63 -6.949 3.843 10.620 1.00 0.00 C ATOM 948 NE ARG A 63 -7.499 4.634 11.714 1.00 0.00 N ATOM 949 CZ ARG A 63 -6.933 5.711 12.252 1.00 0.00 C ATOM 950 NH1 ARG A 63 -5.668 6.007 11.984 1.00 0.00 N ATOM 951 NH2 ARG A 63 -7.619 6.455 13.113 1.00 0.00 N ATOM 0 H ARG A 63 -6.419 1.681 6.966 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.784 0.954 8.297 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.911 0.634 9.591 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.110 2.080 9.010 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.481 2.362 10.845 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.929 1.893 11.509 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.860 3.879 10.659 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.248 4.283 9.669 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.395 4.336 12.100 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.125 5.408 11.363 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.239 6.834 12.399 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.575 6.199 13.359 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.189 7.282 13.528 1.00 0.00 H new ATOM 965 N ALA A 64 -8.658 4.130 7.717 1.00 0.00 N ATOM 966 CA ALA A 64 -9.479 5.332 7.835 1.00 0.00 C ATOM 967 C ALA A 64 -10.401 5.427 6.646 1.00 0.00 C ATOM 968 O ALA A 64 -11.573 5.796 6.768 1.00 0.00 O ATOM 969 CB ALA A 64 -8.578 6.551 7.901 1.00 0.00 C ATOM 0 H ALA A 64 -7.811 4.236 7.158 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.078 5.284 8.744 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.188 7.450 7.989 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.921 6.472 8.767 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.976 6.608 6.994 1.00 0.00 H new ATOM 975 N VAL A 65 -9.793 5.138 5.555 1.00 0.00 N ATOM 976 CA VAL A 65 -10.479 5.120 4.290 1.00 0.00 C ATOM 977 C VAL A 65 -11.769 4.265 4.312 1.00 0.00 C ATOM 978 O VAL A 65 -12.821 4.745 3.942 1.00 0.00 O ATOM 979 CB VAL A 65 -9.531 4.718 3.136 1.00 0.00 C ATOM 980 CG1 VAL A 65 -10.305 4.327 1.916 1.00 0.00 C ATOM 981 CG2 VAL A 65 -8.604 5.881 2.803 1.00 0.00 C ATOM 0 H VAL A 65 -8.802 4.904 5.500 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.806 6.142 4.102 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.943 3.859 3.460 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -9.614 4.049 1.120 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -10.949 3.479 2.150 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -10.917 5.168 1.588 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.938 5.594 1.990 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.197 6.743 2.499 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.013 6.139 3.682 1.00 0.00 H new ATOM 991 N LEU A 66 -11.711 3.057 4.776 1.00 0.00 N ATOM 992 CA LEU A 66 -12.908 2.259 4.789 1.00 0.00 C ATOM 993 C LEU A 66 -13.140 1.628 6.133 1.00 0.00 C ATOM 994 O LEU A 66 -12.375 1.865 7.081 1.00 0.00 O ATOM 995 CB LEU A 66 -12.951 1.234 3.637 1.00 0.00 C ATOM 996 CG LEU A 66 -13.769 1.677 2.406 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.637 0.706 1.272 1.00 0.00 C ATOM 998 CD2 LEU A 66 -15.244 1.860 2.784 1.00 0.00 C ATOM 0 H LEU A 66 -10.874 2.605 5.143 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.742 2.939 4.611 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.930 1.022 3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.367 0.301 4.016 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.367 2.632 2.069 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.228 1.054 0.425 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.590 0.630 0.978 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.997 -0.273 1.588 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.809 2.173 1.906 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.644 0.917 3.156 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.329 2.621 3.560 1.00 0.00 H new ATOM 1010 N SER A 67 -14.211 0.882 6.251 1.00 0.00 N ATOM 1011 CA SER A 67 -14.557 0.222 7.500 1.00 0.00 C ATOM 1012 C SER A 67 -15.433 -1.014 7.273 1.00 0.00 C ATOM 1013 O SER A 67 -16.571 -0.914 6.790 1.00 0.00 O ATOM 1014 CB SER A 67 -15.271 1.198 8.445 1.00 0.00 C ATOM 1015 OG SER A 67 -14.446 2.326 8.749 1.00 0.00 O ATOM 0 H SER A 67 -14.869 0.711 5.491 1.00 0.00 H new ATOM 0 HA SER A 67 -13.624 -0.108 7.957 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.200 1.537 7.986 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.540 0.683 9.367 1.00 0.00 H new ATOM 0 HG SER A 67 -13.529 2.149 8.453 1.00 0.00 H new ATOM 1021 N GLY A 68 -14.898 -2.160 7.618 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.646 -3.399 7.574 1.00 0.00 C ATOM 1023 C GLY A 68 -15.347 -4.216 6.338 1.00 0.00 C ATOM 1024 O GLY A 68 -14.571 -5.181 6.394 1.00 0.00 O ATOM 0 H GLY A 68 -13.935 -2.263 7.937 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.415 -3.990 8.460 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -16.712 -3.176 7.609 1.00 0.00 H new ATOM 1028 N GLY A 69 -15.943 -3.820 5.225 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.766 -4.523 3.975 1.00 0.00 C ATOM 1030 C GLY A 69 -14.327 -4.535 3.509 1.00 0.00 C ATOM 1031 O GLY A 69 -13.851 -5.539 2.957 1.00 0.00 O ATOM 0 H GLY A 69 -16.558 -3.008 5.167 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.115 -5.549 4.088 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.387 -4.057 3.210 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.647 -3.410 3.701 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.224 -3.272 3.365 1.00 0.00 C ATOM 1037 C ASP A 70 -11.429 -4.388 3.978 1.00 0.00 C ATOM 1038 O ASP A 70 -10.681 -5.057 3.294 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.654 -1.921 3.846 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.586 -1.774 5.370 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.639 -1.630 6.011 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.492 -1.863 5.942 1.00 0.00 O ATOM 0 H ASP A 70 -14.062 -2.565 4.094 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.144 -3.316 2.279 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.652 -1.795 3.435 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.268 -1.116 3.442 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.676 -4.631 5.245 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.949 -5.589 6.000 1.00 0.00 C ATOM 1049 C HIS A 71 -11.108 -6.943 5.342 1.00 0.00 C ATOM 1050 O HIS A 71 -10.129 -7.542 4.889 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.484 -5.617 7.433 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.714 -6.507 8.377 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -11.085 -7.794 8.674 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.587 -6.279 9.088 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -10.227 -8.317 9.515 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -9.311 -7.424 9.785 1.00 0.00 N ATOM 0 H HIS A 71 -12.403 -4.153 5.776 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.891 -5.328 6.032 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.479 -4.601 7.828 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.523 -5.946 7.412 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.012 -5.365 9.103 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.269 -9.318 9.918 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.519 -7.559 10.413 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.349 -7.365 5.203 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.629 -8.653 4.639 1.00 0.00 C ATOM 1067 C LEU A 72 -12.072 -8.855 3.222 1.00 0.00 C ATOM 1068 O LEU A 72 -11.215 -9.713 3.041 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.092 -9.135 4.877 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.252 -8.172 4.553 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.568 -8.124 3.069 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.482 -8.527 5.360 1.00 0.00 C ATOM 0 H LEU A 72 -13.173 -6.829 5.475 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.040 -9.361 5.222 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.241 -10.041 4.290 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.180 -9.417 5.926 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.927 -7.171 4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.392 -7.432 2.895 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.688 -7.787 2.520 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.851 -9.119 2.725 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.289 -7.836 5.117 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.792 -9.545 5.122 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.252 -8.457 6.423 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.445 -8.043 2.253 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.913 -8.280 0.916 1.00 0.00 C ATOM 1086 C LEU A 73 -10.554 -7.669 0.666 1.00 0.00 C ATOM 1087 O LEU A 73 -9.618 -8.422 0.405 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.887 -8.034 -0.224 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.647 -9.280 -0.776 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.692 -10.353 -1.289 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.585 -9.880 0.241 1.00 0.00 C ATOM 0 H LEU A 73 -13.081 -7.251 2.350 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.756 -9.359 0.914 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.625 -7.305 0.110 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.339 -7.577 -1.048 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.241 -8.914 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.265 -11.201 -1.663 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.083 -9.943 -2.094 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.045 -10.683 -0.476 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.089 -10.744 -0.193 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.019 -10.193 1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.327 -9.137 0.535 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.419 -6.322 0.783 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.143 -5.655 0.568 1.00 0.00 C ATOM 1105 C TRP A 74 -8.031 -6.344 1.396 1.00 0.00 C ATOM 1106 O TRP A 74 -6.981 -6.673 0.921 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.191 -4.149 1.015 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.926 -3.054 0.193 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.897 -3.135 -0.779 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.633 -1.666 0.315 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.223 -1.853 -1.224 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.477 -0.945 -0.539 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.741 -0.996 1.081 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.445 0.452 -0.626 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.686 0.404 1.010 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.546 1.116 0.167 1.00 0.00 C ATOM 0 H TRP A 74 -11.185 -5.694 1.025 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.934 -5.716 -0.500 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.628 -4.135 2.013 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.156 -3.821 1.115 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.339 -4.051 -1.142 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.909 -1.633 -1.946 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.077 -1.534 1.741 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.105 0.987 -1.294 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.969 0.940 1.615 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.501 2.195 0.141 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.308 -6.549 2.623 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.308 -6.992 3.569 1.00 0.00 C ATOM 1129 C LYS A 75 -7.056 -8.469 3.713 1.00 0.00 C ATOM 1130 O LYS A 75 -5.891 -8.855 3.876 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.397 -6.247 4.855 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.343 -4.746 4.601 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.993 -4.297 4.014 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.916 -4.333 5.100 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.623 -3.808 4.669 1.00 0.00 N ATOM 0 H LYS A 75 -9.237 -6.419 3.024 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.374 -6.713 3.081 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.324 -6.503 5.368 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.578 -6.541 5.511 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.144 -4.467 3.916 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.524 -4.216 5.536 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.711 -4.949 3.188 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.080 -3.289 3.609 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.262 -3.759 5.960 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.786 -5.362 5.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.150 -3.347 5.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.031 -4.588 4.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.766 -3.114 3.907 1.00 0.00 H new ATOM 1149 N SER A 76 -8.075 -9.319 3.656 1.00 0.00 N ATOM 1150 CA SER A 76 -7.776 -10.740 3.718 1.00 0.00 C ATOM 1151 C SER A 76 -6.983 -11.126 2.477 1.00 0.00 C ATOM 1152 O SER A 76 -6.057 -11.944 2.537 1.00 0.00 O ATOM 1153 CB SER A 76 -9.033 -11.578 3.837 1.00 0.00 C ATOM 1154 OG SER A 76 -9.794 -11.208 4.980 1.00 0.00 O ATOM 0 H SER A 76 -9.060 -9.068 3.572 1.00 0.00 H new ATOM 0 HA SER A 76 -7.185 -10.937 4.613 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.639 -11.458 2.939 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.765 -12.633 3.902 1.00 0.00 H new ATOM 0 HG SER A 76 -10.509 -10.593 4.712 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.298 -10.450 1.374 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.625 -10.660 0.113 1.00 0.00 C ATOM 1162 C GLU A 77 -5.255 -10.101 0.188 1.00 0.00 C ATOM 1163 O GLU A 77 -4.353 -10.618 -0.447 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.358 -9.942 -0.987 1.00 0.00 C ATOM 1165 CG GLU A 77 -6.869 -10.220 -2.398 1.00 0.00 C ATOM 1166 CD GLU A 77 -7.195 -11.597 -2.876 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.354 -11.817 -3.287 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -6.309 -12.454 -2.920 1.00 0.00 O ATOM 0 H GLU A 77 -8.031 -9.741 1.339 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.595 -11.730 -0.093 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.413 -10.209 -0.929 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.290 -8.870 -0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.312 -9.492 -3.078 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -5.789 -10.076 -2.436 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.102 -9.032 0.951 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.819 -8.421 1.113 1.00 0.00 C ATOM 1177 C PHE A 78 -2.823 -9.449 1.597 1.00 0.00 C ATOM 1178 O PHE A 78 -1.777 -9.644 1.017 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.912 -7.219 2.063 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.620 -6.599 2.427 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.972 -5.772 1.546 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.061 -6.832 3.670 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.780 -5.180 1.895 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.875 -6.255 4.028 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.230 -5.422 3.137 1.00 0.00 C ATOM 0 H PHE A 78 -5.858 -8.578 1.463 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.472 -8.043 0.151 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.543 -6.460 1.601 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.414 -7.537 2.977 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.400 -5.584 0.572 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.569 -7.480 4.369 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.276 -4.527 1.198 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.446 -6.449 5.000 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.706 -4.959 3.412 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.207 -10.146 2.610 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.383 -11.162 3.178 1.00 0.00 C ATOM 1197 C PHE A 79 -2.134 -12.326 2.215 1.00 0.00 C ATOM 1198 O PHE A 79 -1.003 -12.853 2.131 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.976 -11.588 4.500 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.767 -10.529 5.561 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.530 -10.373 6.173 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -3.787 -9.651 5.897 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.322 -9.361 7.096 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -3.586 -8.651 6.825 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.353 -8.500 7.422 1.00 0.00 C ATOM 0 H PHE A 79 -4.108 -10.028 3.073 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.389 -10.756 3.365 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.042 -11.779 4.378 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.519 -12.524 4.822 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.723 -11.047 5.927 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.753 -9.752 5.425 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.354 -9.245 7.561 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.396 -7.985 7.084 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.193 -7.711 8.142 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.148 -12.665 1.442 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.052 -13.726 0.463 1.00 0.00 C ATOM 1217 C GLU A 80 -2.086 -13.373 -0.670 1.00 0.00 C ATOM 1218 O GLU A 80 -1.083 -14.045 -0.848 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.417 -14.065 -0.112 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.410 -14.592 0.902 1.00 0.00 C ATOM 1221 CD GLU A 80 -6.715 -14.940 0.255 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -6.783 -15.978 -0.432 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -7.704 -14.202 0.432 1.00 0.00 O ATOM 0 H GLU A 80 -4.061 -12.211 1.477 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.659 -14.599 0.984 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.833 -13.172 -0.579 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.292 -14.808 -0.900 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -4.998 -15.474 1.393 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.574 -13.843 1.677 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.360 -12.299 -1.399 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.543 -11.942 -2.566 1.00 0.00 C ATOM 1232 C ASN A 81 -0.129 -11.469 -2.205 1.00 0.00 C ATOM 1233 O ASN A 81 0.813 -11.650 -2.999 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.262 -11.000 -3.565 1.00 0.00 C ATOM 1235 CG ASN A 81 -2.648 -9.638 -3.017 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -1.976 -9.072 -2.160 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -3.758 -9.119 -3.486 1.00 0.00 N ATOM 0 H ASN A 81 -3.133 -11.661 -1.211 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.406 -12.880 -3.103 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.615 -10.854 -4.430 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.164 -11.498 -3.922 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -4.087 -8.218 -3.138 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.292 -9.616 -4.198 1.00 0.00 H new ATOM 1244 N CYS A 82 0.040 -10.911 -1.012 1.00 0.00 N ATOM 1245 CA CYS A 82 1.362 -10.557 -0.533 1.00 0.00 C ATOM 1246 C CYS A 82 2.203 -11.797 -0.329 1.00 0.00 C ATOM 1247 O CYS A 82 3.335 -11.855 -0.764 1.00 0.00 O ATOM 1248 CB CYS A 82 1.277 -9.710 0.719 1.00 0.00 C ATOM 1249 SG CYS A 82 0.617 -8.055 0.400 1.00 0.00 S ATOM 0 H CYS A 82 -0.719 -10.697 -0.365 1.00 0.00 H new ATOM 0 HA CYS A 82 1.857 -9.951 -1.292 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.646 -10.213 1.451 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.269 -9.622 1.161 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.674 -8.065 0.555 1.00 0.00 H new ATOM 1255 N ARG A 83 1.621 -12.832 0.250 1.00 0.00 N ATOM 1256 CA ARG A 83 2.370 -14.062 0.445 1.00 0.00 C ATOM 1257 C ARG A 83 2.434 -14.922 -0.821 1.00 0.00 C ATOM 1258 O ARG A 83 3.350 -15.719 -1.002 1.00 0.00 O ATOM 1259 CB ARG A 83 1.967 -14.838 1.700 1.00 0.00 C ATOM 1260 CG ARG A 83 2.679 -14.340 2.964 1.00 0.00 C ATOM 1261 CD ARG A 83 2.316 -12.907 3.340 1.00 0.00 C ATOM 1262 NE ARG A 83 3.261 -12.354 4.321 1.00 0.00 N ATOM 1263 CZ ARG A 83 3.251 -12.591 5.643 1.00 0.00 C ATOM 1264 NH1 ARG A 83 2.246 -13.273 6.220 1.00 0.00 N ATOM 1265 NH2 ARG A 83 4.254 -12.129 6.384 1.00 0.00 N ATOM 0 H ARG A 83 0.658 -12.849 0.586 1.00 0.00 H new ATOM 0 HA ARG A 83 3.397 -13.752 0.640 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.889 -14.757 1.841 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.191 -15.895 1.555 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.431 -15.000 3.795 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.757 -14.407 2.815 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.312 -12.284 2.445 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.307 -12.882 3.751 1.00 0.00 H new ATOM 0 HE ARG A 83 3.990 -11.735 3.966 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.473 -13.620 5.652 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.256 -13.443 7.226 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.012 -11.605 5.947 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.265 -12.298 7.390 1.00 0.00 H new ATOM 1279 N ASP A 84 1.472 -14.725 -1.681 1.00 0.00 N ATOM 1280 CA ASP A 84 1.385 -15.374 -3.010 1.00 0.00 C ATOM 1281 C ASP A 84 2.600 -14.967 -3.841 1.00 0.00 C ATOM 1282 O ASP A 84 3.422 -15.796 -4.298 1.00 0.00 O ATOM 1283 CB ASP A 84 0.135 -14.834 -3.700 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.230 -15.507 -5.005 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.615 -16.713 -5.008 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.118 -14.853 -6.056 1.00 0.00 O ATOM 0 H ASP A 84 0.692 -14.094 -1.494 1.00 0.00 H new ATOM 0 HA ASP A 84 1.349 -16.459 -2.908 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.707 -14.929 -3.014 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.275 -13.769 -3.887 1.00 0.00 H new ATOM 1291 N THR A 85 2.729 -13.689 -3.979 1.00 0.00 N ATOM 1292 CA THR A 85 3.801 -13.080 -4.690 1.00 0.00 C ATOM 1293 C THR A 85 5.134 -13.346 -3.947 1.00 0.00 C ATOM 1294 O THR A 85 6.181 -13.612 -4.570 1.00 0.00 O ATOM 1295 CB THR A 85 3.480 -11.589 -4.778 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.162 -11.443 -5.388 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.530 -10.818 -5.568 1.00 0.00 C ATOM 0 H THR A 85 2.068 -13.019 -3.586 1.00 0.00 H new ATOM 0 HA THR A 85 3.913 -13.490 -5.694 1.00 0.00 H new ATOM 0 HB THR A 85 3.484 -11.166 -3.773 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.474 -11.472 -4.691 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.257 -9.763 -5.602 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.501 -10.926 -5.085 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.584 -11.212 -6.583 1.00 0.00 H new ATOM 1305 N ALA A 86 5.053 -13.349 -2.611 1.00 0.00 N ATOM 1306 CA ALA A 86 6.178 -13.653 -1.754 1.00 0.00 C ATOM 1307 C ALA A 86 6.744 -15.007 -2.049 1.00 0.00 C ATOM 1308 O ALA A 86 7.932 -15.137 -2.227 1.00 0.00 O ATOM 1309 CB ALA A 86 5.807 -13.593 -0.291 1.00 0.00 C ATOM 0 H ALA A 86 4.194 -13.138 -2.102 1.00 0.00 H new ATOM 0 HA ALA A 86 6.929 -12.891 -1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.681 -13.828 0.316 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.454 -12.591 -0.046 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.018 -14.316 -0.086 1.00 0.00 H new ATOM 1315 N LYS A 87 5.895 -16.024 -2.112 1.00 0.00 N ATOM 1316 CA LYS A 87 6.384 -17.372 -2.363 1.00 0.00 C ATOM 1317 C LYS A 87 7.050 -17.477 -3.711 1.00 0.00 C ATOM 1318 O LYS A 87 8.067 -18.148 -3.830 1.00 0.00 O ATOM 1319 CB LYS A 87 5.335 -18.481 -2.161 1.00 0.00 C ATOM 1320 CG LYS A 87 4.089 -18.367 -3.003 1.00 0.00 C ATOM 1321 CD LYS A 87 3.172 -19.597 -2.919 1.00 0.00 C ATOM 1322 CE LYS A 87 2.771 -20.007 -1.502 1.00 0.00 C ATOM 1323 NZ LYS A 87 3.821 -20.784 -0.791 1.00 0.00 N ATOM 0 H LYS A 87 4.885 -15.945 -1.995 1.00 0.00 H new ATOM 0 HA LYS A 87 7.134 -17.550 -1.593 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.805 -19.442 -2.370 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.042 -18.491 -1.111 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.529 -17.486 -2.690 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.377 -18.210 -4.042 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.267 -19.397 -3.493 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.673 -20.439 -3.397 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.539 -19.112 -0.925 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.859 -20.602 -1.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.398 -21.637 -0.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.564 -21.061 -1.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 4.237 -20.198 -0.039 1.00 0.00 H new ATOM 1337 N ARG A 88 6.531 -16.749 -4.716 1.00 0.00 N ATOM 1338 CA ARG A 88 7.180 -16.786 -6.038 1.00 0.00 C ATOM 1339 C ARG A 88 8.591 -16.229 -5.971 1.00 0.00 C ATOM 1340 O ARG A 88 9.532 -16.824 -6.502 1.00 0.00 O ATOM 1341 CB ARG A 88 6.418 -16.019 -7.120 1.00 0.00 C ATOM 1342 CG ARG A 88 5.354 -16.785 -7.885 1.00 0.00 C ATOM 1343 CD ARG A 88 4.249 -17.251 -6.989 1.00 0.00 C ATOM 1344 NE ARG A 88 3.151 -17.866 -7.731 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.917 -17.985 -7.250 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.683 -17.652 -6.002 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.933 -18.444 -8.008 1.00 0.00 N ATOM 0 H ARG A 88 5.705 -16.155 -4.647 1.00 0.00 H new ATOM 0 HA ARG A 88 7.191 -17.840 -6.314 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.945 -15.155 -6.654 1.00 0.00 H new ATOM 0 HB3 ARG A 88 7.143 -15.636 -7.838 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.942 -16.149 -8.669 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.809 -17.644 -8.378 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.646 -17.969 -6.271 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.868 -16.405 -6.417 1.00 0.00 H new ATOM 0 HE ARG A 88 3.341 -18.223 -8.667 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.443 -17.307 -5.415 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.741 -17.738 -5.619 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.117 -18.712 -8.975 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.008 -18.530 -7.625 1.00 0.00 H new ATOM 1361 N ASN A 89 8.753 -15.118 -5.272 1.00 0.00 N ATOM 1362 CA ASN A 89 10.041 -14.457 -5.207 1.00 0.00 C ATOM 1363 C ASN A 89 10.990 -15.147 -4.233 1.00 0.00 C ATOM 1364 O ASN A 89 12.217 -15.089 -4.390 1.00 0.00 O ATOM 1365 CB ASN A 89 9.921 -12.936 -4.927 1.00 0.00 C ATOM 1366 CG ASN A 89 9.279 -12.173 -6.087 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.341 -12.599 -7.237 1.00 0.00 O ATOM 1368 ND2 ASN A 89 8.730 -11.034 -5.809 1.00 0.00 N ATOM 0 H ASN A 89 8.011 -14.658 -4.744 1.00 0.00 H new ATOM 0 HA ASN A 89 10.482 -14.549 -6.200 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.330 -12.782 -4.024 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.912 -12.527 -4.732 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.333 -10.463 -6.556 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.694 -10.707 -4.843 1.00 0.00 H new ATOM 1375 N GLN A 90 10.433 -15.808 -3.239 1.00 0.00 N ATOM 1376 CA GLN A 90 11.222 -16.586 -2.298 1.00 0.00 C ATOM 1377 C GLN A 90 11.853 -17.797 -2.947 1.00 0.00 C ATOM 1378 O GLN A 90 12.953 -18.163 -2.576 1.00 0.00 O ATOM 1379 CB GLN A 90 10.423 -16.961 -1.049 1.00 0.00 C ATOM 1380 CG GLN A 90 10.467 -15.916 0.072 1.00 0.00 C ATOM 1381 CD GLN A 90 10.824 -14.508 -0.407 1.00 0.00 C ATOM 1382 OE1 GLN A 90 12.003 -14.120 -0.430 1.00 0.00 O ATOM 1383 NE2 GLN A 90 9.856 -13.769 -0.848 1.00 0.00 N ATOM 0 H GLN A 90 9.429 -15.823 -3.059 1.00 0.00 H new ATOM 0 HA GLN A 90 12.038 -15.942 -1.971 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.384 -17.126 -1.334 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.801 -17.907 -0.662 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.496 -15.886 0.566 1.00 0.00 H new ATOM 0 HG3 GLN A 90 11.195 -16.230 0.820 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.896 -14.113 -0.817 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.053 -12.843 -1.226 1.00 0.00 H new ATOM 1392 N GLN A 91 11.157 -18.421 -3.922 1.00 0.00 N ATOM 1393 CA GLN A 91 11.743 -19.543 -4.698 1.00 0.00 C ATOM 1394 C GLN A 91 13.105 -19.146 -5.246 1.00 0.00 C ATOM 1395 O GLN A 91 14.091 -19.884 -5.128 1.00 0.00 O ATOM 1396 CB GLN A 91 10.905 -19.911 -5.923 1.00 0.00 C ATOM 1397 CG GLN A 91 9.461 -20.203 -5.690 1.00 0.00 C ATOM 1398 CD GLN A 91 9.194 -21.290 -4.671 1.00 0.00 C ATOM 1399 OE1 GLN A 91 9.991 -22.212 -4.482 1.00 0.00 O ATOM 1400 NE2 GLN A 91 8.073 -21.179 -4.005 1.00 0.00 N ATOM 0 H GLN A 91 10.204 -18.175 -4.190 1.00 0.00 H new ATOM 0 HA GLN A 91 11.794 -20.384 -4.006 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.974 -19.093 -6.640 1.00 0.00 H new ATOM 0 HB3 GLN A 91 11.356 -20.785 -6.393 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.967 -19.288 -5.363 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.005 -20.491 -6.637 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.443 -20.400 -4.194 1.00 0.00 H new ATOM 0 HE22 GLN A 91 7.830 -21.872 -3.297 1.00 0.00 H new ATOM 1409 N ALA A 92 13.157 -17.965 -5.822 1.00 0.00 N ATOM 1410 CA ALA A 92 14.351 -17.492 -6.465 1.00 0.00 C ATOM 1411 C ALA A 92 15.281 -16.773 -5.477 1.00 0.00 C ATOM 1412 O ALA A 92 16.316 -16.237 -5.854 1.00 0.00 O ATOM 1413 CB ALA A 92 13.993 -16.593 -7.622 1.00 0.00 C ATOM 0 H ALA A 92 12.374 -17.312 -5.855 1.00 0.00 H new ATOM 0 HA ALA A 92 14.895 -18.356 -6.846 1.00 0.00 H new ATOM 0 HB1 ALA A 92 14.905 -16.239 -8.103 1.00 0.00 H new ATOM 0 HB2 ALA A 92 13.394 -17.149 -8.343 1.00 0.00 H new ATOM 0 HB3 ALA A 92 13.421 -15.740 -7.257 1.00 0.00 H new ATOM 1419 N GLY A 93 14.883 -16.759 -4.222 1.00 0.00 N ATOM 1420 CA GLY A 93 15.681 -16.165 -3.162 1.00 0.00 C ATOM 1421 C GLY A 93 15.857 -14.666 -3.306 1.00 0.00 C ATOM 1422 O GLY A 93 16.929 -14.135 -3.054 1.00 0.00 O ATOM 0 H GLY A 93 13.999 -17.158 -3.905 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.211 -16.377 -2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.663 -16.639 -3.148 1.00 0.00 H new ATOM 1426 N ASN A 94 14.799 -13.987 -3.706 1.00 0.00 N ATOM 1427 CA ASN A 94 14.825 -12.519 -3.903 1.00 0.00 C ATOM 1428 C ASN A 94 15.076 -11.759 -2.615 1.00 0.00 C ATOM 1429 O ASN A 94 15.758 -10.737 -2.616 1.00 0.00 O ATOM 1430 CB ASN A 94 13.519 -12.026 -4.530 1.00 0.00 C ATOM 1431 CG ASN A 94 13.367 -12.350 -6.011 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.962 -13.296 -6.531 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.545 -11.590 -6.689 1.00 0.00 N ATOM 0 H ASN A 94 13.896 -14.417 -3.907 1.00 0.00 H new ATOM 0 HA ASN A 94 15.657 -12.321 -4.579 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.682 -12.465 -3.987 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.453 -10.946 -4.399 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.381 -11.773 -7.679 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.069 -10.815 -6.227 1.00 0.00 H new ATOM 1440 N GLY A 95 14.511 -12.247 -1.528 1.00 0.00 N ATOM 1441 CA GLY A 95 14.698 -11.593 -0.254 1.00 0.00 C ATOM 1442 C GLY A 95 13.756 -10.421 -0.063 1.00 0.00 C ATOM 1443 O GLY A 95 14.000 -9.536 0.759 1.00 0.00 O ATOM 0 H GLY A 95 13.927 -13.083 -1.503 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.543 -12.315 0.548 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.728 -11.245 -0.175 1.00 0.00 H new ATOM 1447 N TRP A 96 12.688 -10.419 -0.814 1.00 0.00 N ATOM 1448 CA TRP A 96 11.684 -9.392 -0.767 1.00 0.00 C ATOM 1449 C TRP A 96 10.371 -10.032 -0.528 1.00 0.00 C ATOM 1450 O TRP A 96 10.296 -11.238 -0.418 1.00 0.00 O ATOM 1451 CB TRP A 96 11.579 -8.649 -2.101 1.00 0.00 C ATOM 1452 CG TRP A 96 12.741 -7.820 -2.489 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.367 -6.884 -1.734 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.360 -7.796 -3.762 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.371 -6.305 -2.446 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.385 -6.847 -3.705 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.158 -8.502 -4.948 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.201 -6.578 -4.787 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.971 -8.229 -6.022 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.980 -7.277 -5.929 1.00 0.00 C ATOM 0 H TRP A 96 12.487 -11.152 -1.494 1.00 0.00 H new ATOM 0 HA TRP A 96 11.957 -8.690 0.021 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.406 -9.383 -2.888 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.699 -8.007 -2.065 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.107 -6.635 -0.716 1.00 0.00 H new ATOM 0 HE1 TRP A 96 15.008 -5.587 -2.101 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.380 -9.247 -5.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 15.986 -5.839 -4.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.824 -8.761 -6.950 1.00 0.00 H new ATOM 0 HH2 TRP A 96 15.605 -7.089 -6.789 1.00 0.00 H new ATOM 1471 N ASP A 97 9.373 -9.223 -0.382 1.00 0.00 N ATOM 1472 CA ASP A 97 7.970 -9.632 -0.414 1.00 0.00 C ATOM 1473 C ASP A 97 7.443 -10.381 0.782 1.00 0.00 C ATOM 1474 O ASP A 97 6.427 -10.016 1.299 1.00 0.00 O ATOM 1475 CB ASP A 97 7.608 -10.341 -1.706 1.00 0.00 C ATOM 1476 CG ASP A 97 7.882 -9.486 -2.900 1.00 0.00 C ATOM 1477 OD1 ASP A 97 7.126 -8.554 -3.167 1.00 0.00 O ATOM 1478 OD2 ASP A 97 8.904 -9.739 -3.579 1.00 0.00 O ATOM 0 H ASP A 97 9.495 -8.222 -0.231 1.00 0.00 H new ATOM 0 HA ASP A 97 7.451 -8.675 -0.364 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.176 -11.268 -1.784 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.553 -10.614 -1.688 1.00 0.00 H new ATOM 1483 N PHE A 98 8.106 -11.418 1.237 1.00 0.00 N ATOM 1484 CA PHE A 98 7.563 -12.183 2.356 1.00 0.00 C ATOM 1485 C PHE A 98 7.426 -11.319 3.616 1.00 0.00 C ATOM 1486 O PHE A 98 6.370 -11.308 4.269 1.00 0.00 O ATOM 1487 CB PHE A 98 8.315 -13.508 2.587 1.00 0.00 C ATOM 1488 CG PHE A 98 7.878 -14.229 3.828 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.633 -14.825 3.877 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.692 -14.283 4.953 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.200 -15.469 5.021 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.265 -14.922 6.098 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.018 -15.517 6.137 1.00 0.00 C ATOM 0 H PHE A 98 8.997 -11.752 0.869 1.00 0.00 H new ATOM 0 HA PHE A 98 6.550 -12.482 2.086 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.165 -14.158 1.725 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.384 -13.305 2.650 1.00 0.00 H new ATOM 0 HD1 PHE A 98 5.990 -14.787 3.010 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.668 -13.820 4.930 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.225 -15.934 5.044 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.906 -14.958 6.966 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.683 -16.017 7.034 1.00 0.00 H new ATOM 1503 N ASP A 99 8.481 -10.636 3.956 1.00 0.00 N ATOM 1504 CA ASP A 99 8.469 -9.637 5.007 1.00 0.00 C ATOM 1505 C ASP A 99 8.062 -8.282 4.451 1.00 0.00 C ATOM 1506 O ASP A 99 7.105 -7.683 4.909 1.00 0.00 O ATOM 1507 CB ASP A 99 9.862 -9.546 5.597 1.00 0.00 C ATOM 1508 CG ASP A 99 10.037 -8.373 6.516 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.220 -8.186 7.427 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.979 -7.627 6.345 1.00 0.00 O ATOM 0 H ASP A 99 9.391 -10.753 3.510 1.00 0.00 H new ATOM 0 HA ASP A 99 7.748 -9.924 5.773 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.079 -10.464 6.144 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.589 -9.477 4.788 1.00 0.00 H new ATOM 1515 N MET A 100 8.808 -7.833 3.449 1.00 0.00 N ATOM 1516 CA MET A 100 8.653 -6.490 2.855 1.00 0.00 C ATOM 1517 C MET A 100 7.273 -6.201 2.234 1.00 0.00 C ATOM 1518 O MET A 100 6.782 -5.089 2.344 1.00 0.00 O ATOM 1519 CB MET A 100 9.780 -6.226 1.853 1.00 0.00 C ATOM 1520 CG MET A 100 11.166 -6.235 2.481 1.00 0.00 C ATOM 1521 SD MET A 100 12.471 -5.872 1.302 1.00 0.00 S ATOM 1522 CE MET A 100 13.921 -6.086 2.335 1.00 0.00 C ATOM 0 H MET A 100 9.546 -8.387 3.015 1.00 0.00 H new ATOM 0 HA MET A 100 8.722 -5.791 3.689 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.741 -6.981 1.067 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.612 -5.260 1.376 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.198 -5.503 3.288 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.350 -7.211 2.929 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.818 -5.895 1.747 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.879 -5.387 3.170 1.00 0.00 H new ATOM 0 HE3 MET A 100 13.948 -7.106 2.717 1.00 0.00 H new ATOM 1532 N LEU A 101 6.655 -7.176 1.605 1.00 0.00 N ATOM 1533 CA LEU A 101 5.350 -6.961 1.002 1.00 0.00 C ATOM 1534 C LEU A 101 4.298 -7.581 1.874 1.00 0.00 C ATOM 1535 O LEU A 101 3.964 -8.755 1.708 1.00 0.00 O ATOM 1536 CB LEU A 101 5.272 -7.571 -0.416 1.00 0.00 C ATOM 1537 CG LEU A 101 3.907 -7.520 -1.114 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.557 -6.114 -1.531 1.00 0.00 C ATOM 1539 CD2 LEU A 101 3.863 -8.491 -2.289 1.00 0.00 C ATOM 0 H LEU A 101 7.028 -8.119 1.496 1.00 0.00 H new ATOM 0 HA LEU A 101 5.186 -5.887 0.914 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.997 -7.057 -1.048 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.584 -8.613 -0.356 1.00 0.00 H new ATOM 0 HG LEU A 101 3.148 -7.837 -0.399 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.584 -6.112 -2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.520 -5.472 -0.651 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.313 -5.740 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.886 -8.438 -2.769 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.636 -8.225 -3.010 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.036 -9.505 -1.929 1.00 0.00 H new ATOM 1551 N THR A 102 3.871 -6.816 2.867 1.00 0.00 N ATOM 1552 CA THR A 102 2.804 -7.172 3.790 1.00 0.00 C ATOM 1553 C THR A 102 2.932 -6.273 5.030 1.00 0.00 C ATOM 1554 O THR A 102 3.605 -5.233 4.981 1.00 0.00 O ATOM 1555 CB THR A 102 2.816 -8.705 4.206 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.640 -9.059 4.969 1.00 0.00 O ATOM 1557 CG2 THR A 102 4.080 -9.073 4.977 1.00 0.00 C ATOM 0 H THR A 102 4.272 -5.898 3.059 1.00 0.00 H new ATOM 0 HA THR A 102 1.850 -7.015 3.287 1.00 0.00 H new ATOM 0 HB THR A 102 2.807 -9.280 3.280 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.678 -10.009 5.207 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.049 -10.130 5.243 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.954 -8.881 4.355 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.141 -8.472 5.884 1.00 0.00 H new ATOM 1661 N ASP A 111 11.284 1.296 7.237 1.00 0.00 N ATOM 1662 CA ASP A 111 12.683 1.124 6.834 1.00 0.00 C ATOM 1663 C ASP A 111 12.823 0.391 5.507 1.00 0.00 C ATOM 1664 O ASP A 111 13.318 0.967 4.520 1.00 0.00 O ATOM 1665 CB ASP A 111 13.449 0.359 7.906 1.00 0.00 C ATOM 1666 CG ASP A 111 14.925 0.207 7.590 1.00 0.00 C ATOM 1667 OD1 ASP A 111 15.323 -0.782 6.950 1.00 0.00 O ATOM 1668 OD2 ASP A 111 15.727 1.057 8.029 1.00 0.00 O ATOM 0 HA ASP A 111 13.098 2.124 6.711 1.00 0.00 H new ATOM 0 HB2 ASP A 111 13.339 0.875 8.860 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.006 -0.630 8.025 1.00 0.00 H new ATOM 1673 N ALA A 112 12.353 -0.869 5.464 1.00 0.00 N ATOM 1674 CA ALA A 112 12.518 -1.734 4.284 1.00 0.00 C ATOM 1675 C ALA A 112 11.949 -1.103 3.025 1.00 0.00 C ATOM 1676 O ALA A 112 12.505 -1.257 1.938 1.00 0.00 O ATOM 1677 CB ALA A 112 11.921 -3.101 4.512 1.00 0.00 C ATOM 0 H ALA A 112 11.854 -1.311 6.236 1.00 0.00 H new ATOM 0 HA ALA A 112 13.591 -1.852 4.134 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.061 -3.712 3.621 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.414 -3.577 5.360 1.00 0.00 H new ATOM 0 HB3 ALA A 112 10.856 -3.003 4.721 1.00 0.00 H new ATOM 1683 N GLN A 113 10.869 -0.359 3.181 1.00 0.00 N ATOM 1684 CA GLN A 113 10.296 0.349 2.070 1.00 0.00 C ATOM 1685 C GLN A 113 11.124 1.537 1.676 1.00 0.00 C ATOM 1686 O GLN A 113 11.281 1.791 0.491 1.00 0.00 O ATOM 1687 CB GLN A 113 8.851 0.762 2.327 1.00 0.00 C ATOM 1688 CG GLN A 113 7.835 -0.036 1.511 1.00 0.00 C ATOM 1689 CD GLN A 113 7.810 0.326 0.013 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.907 0.801 -0.543 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 6.800 0.192 -0.629 1.00 0.00 N flip ATOM 0 H GLN A 113 10.378 -0.235 4.067 1.00 0.00 H new ATOM 0 HA GLN A 113 10.293 -0.351 1.235 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.630 0.640 3.387 1.00 0.00 H new ATOM 0 HB3 GLN A 113 8.738 1.822 2.097 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.056 -1.098 1.614 1.00 0.00 H new ATOM 0 HG3 GLN A 113 6.842 0.125 1.930 1.00 0.00 H new ATOM 0 HE21 GLN A 113 5.959 -0.177 -0.185 1.00 0.00 H new ATOM 0 HE22 GLN A 113 6.786 0.447 -1.616 1.00 0.00 H new ATOM 1700 N MET A 114 11.668 2.230 2.653 1.00 0.00 N ATOM 1701 CA MET A 114 12.468 3.421 2.433 1.00 0.00 C ATOM 1702 C MET A 114 13.620 3.192 1.464 1.00 0.00 C ATOM 1703 O MET A 114 13.920 4.070 0.663 1.00 0.00 O ATOM 1704 CB MET A 114 12.964 4.004 3.771 1.00 0.00 C ATOM 1705 CG MET A 114 14.063 5.039 3.627 1.00 0.00 C ATOM 1706 SD MET A 114 14.536 5.815 5.190 1.00 0.00 S ATOM 1707 CE MET A 114 15.167 4.405 6.105 1.00 0.00 C ATOM 0 H MET A 114 11.567 1.981 3.637 1.00 0.00 H new ATOM 0 HA MET A 114 11.816 4.154 1.959 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.120 4.456 4.293 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.327 3.189 4.398 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.940 4.566 3.186 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.734 5.812 2.932 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.064 4.697 6.650 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.410 4.060 6.810 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.410 3.600 5.411 1.00 0.00 H new ATOM 1717 N GLN A 115 14.267 2.025 1.526 1.00 0.00 N ATOM 1718 CA GLN A 115 15.358 1.767 0.538 1.00 0.00 C ATOM 1719 C GLN A 115 14.881 1.814 -0.903 1.00 0.00 C ATOM 1720 O GLN A 115 15.654 2.166 -1.785 1.00 0.00 O ATOM 1721 CB GLN A 115 16.191 0.505 0.771 1.00 0.00 C ATOM 1722 CG GLN A 115 17.073 0.559 2.002 1.00 0.00 C ATOM 1723 CD GLN A 115 16.297 0.468 3.264 1.00 0.00 C ATOM 1724 OE1 GLN A 115 15.219 -0.264 3.215 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 16.682 1.035 4.287 1.00 0.00 N flip ATOM 0 H GLN A 115 14.084 1.278 2.196 1.00 0.00 H new ATOM 0 HA GLN A 115 16.032 2.604 0.721 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.519 -0.349 0.857 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.818 0.331 -0.104 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.794 -0.257 1.964 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.642 1.488 1.996 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.534 1.596 4.269 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.149 0.944 5.152 1.00 0.00 H new ATOM 1734 N TYR A 116 13.621 1.435 -1.140 1.00 0.00 N ATOM 1735 CA TYR A 116 12.978 1.581 -2.431 1.00 0.00 C ATOM 1736 C TYR A 116 13.682 0.867 -3.596 1.00 0.00 C ATOM 1737 O TYR A 116 14.522 1.428 -4.316 1.00 0.00 O ATOM 1738 CB TYR A 116 12.658 3.071 -2.720 1.00 0.00 C ATOM 1739 CG TYR A 116 12.134 3.381 -4.114 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.093 2.654 -4.681 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.696 4.405 -4.860 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.643 2.942 -5.955 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.245 4.696 -6.125 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.224 3.962 -6.666 1.00 0.00 C ATOM 1745 OH TYR A 116 10.791 4.240 -7.935 1.00 0.00 O ATOM 0 H TYR A 116 13.022 1.016 -0.429 1.00 0.00 H new ATOM 0 HA TYR A 116 12.033 1.043 -2.358 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.922 3.412 -1.992 1.00 0.00 H new ATOM 0 HB3 TYR A 116 13.563 3.655 -2.555 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.631 1.855 -4.119 1.00 0.00 H new ATOM 0 HD2 TYR A 116 13.504 4.985 -4.439 1.00 0.00 H new ATOM 0 HE1 TYR A 116 9.838 2.367 -6.389 1.00 0.00 H new ATOM 0 HE2 TYR A 116 12.694 5.500 -6.690 1.00 0.00 H new ATOM 0 HH TYR A 116 11.305 4.991 -8.299 1.00 0.00 H new ATOM 1755 N ASP A 117 13.342 -0.376 -3.744 1.00 0.00 N ATOM 1756 CA ASP A 117 13.761 -1.153 -4.877 1.00 0.00 C ATOM 1757 C ASP A 117 12.655 -1.061 -5.925 1.00 0.00 C ATOM 1758 O ASP A 117 11.475 -1.185 -5.574 1.00 0.00 O ATOM 1759 CB ASP A 117 13.998 -2.611 -4.484 1.00 0.00 C ATOM 1760 CG ASP A 117 14.242 -3.489 -5.689 1.00 0.00 C ATOM 1761 OD1 ASP A 117 13.263 -4.018 -6.251 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.399 -3.642 -6.108 1.00 0.00 O ATOM 0 H ASP A 117 12.762 -0.887 -3.079 1.00 0.00 H new ATOM 0 HA ASP A 117 14.702 -0.768 -5.270 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.854 -2.671 -3.812 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.134 -2.983 -3.933 1.00 0.00 H new ATOM 1767 N PRO A 118 12.999 -0.843 -7.203 1.00 0.00 N ATOM 1768 CA PRO A 118 12.009 -0.635 -8.282 1.00 0.00 C ATOM 1769 C PRO A 118 11.115 -1.856 -8.536 1.00 0.00 C ATOM 1770 O PRO A 118 9.955 -1.720 -8.946 1.00 0.00 O ATOM 1771 CB PRO A 118 12.877 -0.354 -9.505 1.00 0.00 C ATOM 1772 CG PRO A 118 14.191 -0.985 -9.193 1.00 0.00 C ATOM 1773 CD PRO A 118 14.383 -0.795 -7.728 1.00 0.00 C ATOM 0 HA PRO A 118 11.312 0.164 -8.030 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.438 -0.780 -10.408 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.983 0.717 -9.677 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.191 -2.043 -9.455 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.996 -0.516 -9.759 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.006 -1.579 -7.297 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.867 0.156 -7.504 1.00 0.00 H new ATOM 1781 N GLY A 119 11.611 -3.024 -8.198 1.00 0.00 N ATOM 1782 CA GLY A 119 10.897 -4.240 -8.477 1.00 0.00 C ATOM 1783 C GLY A 119 10.002 -4.520 -7.334 1.00 0.00 C ATOM 1784 O GLY A 119 8.830 -4.857 -7.513 1.00 0.00 O ATOM 0 H GLY A 119 12.507 -3.154 -7.729 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.320 -4.140 -9.396 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.594 -5.065 -8.626 1.00 0.00 H new ATOM 1788 N LEU A 120 10.560 -4.355 -6.149 1.00 0.00 N ATOM 1789 CA LEU A 120 9.796 -4.457 -4.916 1.00 0.00 C ATOM 1790 C LEU A 120 8.603 -3.520 -4.998 1.00 0.00 C ATOM 1791 O LEU A 120 7.469 -3.962 -4.921 1.00 0.00 O ATOM 1792 CB LEU A 120 10.667 -4.090 -3.711 1.00 0.00 C ATOM 1793 CG LEU A 120 9.985 -4.074 -2.335 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.480 -5.463 -1.956 1.00 0.00 C ATOM 1795 CD2 LEU A 120 10.942 -3.534 -1.279 1.00 0.00 C ATOM 0 H LEU A 120 11.549 -4.148 -6.012 1.00 0.00 H new ATOM 0 HA LEU A 120 9.454 -5.484 -4.788 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.499 -4.793 -3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.093 -3.103 -3.889 1.00 0.00 H new ATOM 0 HG LEU A 120 9.120 -3.413 -2.388 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.002 -5.422 -0.977 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.758 -5.803 -2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.319 -6.158 -1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.447 -3.528 -0.308 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.827 -4.169 -1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.238 -2.518 -1.542 1.00 0.00 H new ATOM 1807 N PHE A 121 8.882 -2.230 -5.236 1.00 0.00 N ATOM 1808 CA PHE A 121 7.850 -1.201 -5.374 1.00 0.00 C ATOM 1809 C PHE A 121 6.759 -1.542 -6.421 1.00 0.00 C ATOM 1810 O PHE A 121 5.572 -1.277 -6.191 1.00 0.00 O ATOM 1811 CB PHE A 121 8.486 0.149 -5.683 1.00 0.00 C ATOM 1812 CG PHE A 121 7.487 1.242 -5.899 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.641 1.648 -4.872 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.377 1.848 -7.136 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.717 2.640 -5.082 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.458 2.836 -7.348 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.623 3.238 -6.322 1.00 0.00 C ATOM 0 H PHE A 121 9.832 -1.874 -5.338 1.00 0.00 H new ATOM 0 HA PHE A 121 7.337 -1.156 -4.413 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.146 0.428 -4.862 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.108 0.054 -6.573 1.00 0.00 H new ATOM 0 HD1 PHE A 121 6.712 1.179 -3.902 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.024 1.537 -7.943 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.065 2.952 -4.279 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.384 3.304 -8.319 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.897 4.020 -6.491 1.00 0.00 H new ATOM 1827 N ALA A 122 7.154 -2.127 -7.546 1.00 0.00 N ATOM 1828 CA ALA A 122 6.188 -2.502 -8.591 1.00 0.00 C ATOM 1829 C ALA A 122 5.175 -3.507 -8.038 1.00 0.00 C ATOM 1830 O ALA A 122 3.955 -3.371 -8.234 1.00 0.00 O ATOM 1831 CB ALA A 122 6.904 -3.086 -9.812 1.00 0.00 C ATOM 0 H ALA A 122 8.124 -2.353 -7.764 1.00 0.00 H new ATOM 0 HA ALA A 122 5.658 -1.603 -8.905 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.169 -3.356 -10.570 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.591 -2.345 -10.220 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.462 -3.974 -9.516 1.00 0.00 H new ATOM 1837 N GLN A 123 5.686 -4.486 -7.310 1.00 0.00 N ATOM 1838 CA GLN A 123 4.863 -5.512 -6.709 1.00 0.00 C ATOM 1839 C GLN A 123 4.060 -4.925 -5.549 1.00 0.00 C ATOM 1840 O GLN A 123 2.899 -5.289 -5.346 1.00 0.00 O ATOM 1841 CB GLN A 123 5.754 -6.653 -6.257 1.00 0.00 C ATOM 1842 CG GLN A 123 6.617 -7.195 -7.399 1.00 0.00 C ATOM 1843 CD GLN A 123 7.660 -8.188 -6.969 1.00 0.00 C ATOM 1844 OE1 GLN A 123 8.047 -9.074 -7.744 1.00 0.00 O ATOM 1845 NE2 GLN A 123 8.092 -8.100 -5.752 1.00 0.00 N ATOM 0 H GLN A 123 6.683 -4.588 -7.121 1.00 0.00 H new ATOM 0 HA GLN A 123 4.148 -5.899 -7.436 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.398 -6.311 -5.447 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.137 -7.457 -5.856 1.00 0.00 H new ATOM 0 HG2 GLN A 123 5.968 -7.665 -8.138 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.111 -6.359 -7.894 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.751 -7.357 -5.142 1.00 0.00 H new ATOM 0 HE22 GLN A 123 8.774 -8.774 -5.403 1.00 0.00 H new ATOM 1854 N ILE A 124 4.694 -4.004 -4.808 1.00 0.00 N ATOM 1855 CA ILE A 124 4.070 -3.241 -3.718 1.00 0.00 C ATOM 1856 C ILE A 124 2.731 -2.651 -4.149 1.00 0.00 C ATOM 1857 O ILE A 124 1.704 -2.934 -3.523 1.00 0.00 O ATOM 1858 CB ILE A 124 5.033 -2.097 -3.214 1.00 0.00 C ATOM 1859 CG1 ILE A 124 6.240 -2.656 -2.444 1.00 0.00 C ATOM 1860 CG2 ILE A 124 4.328 -1.047 -2.396 1.00 0.00 C ATOM 1861 CD1 ILE A 124 5.906 -3.352 -1.134 1.00 0.00 C ATOM 0 H ILE A 124 5.675 -3.764 -4.953 1.00 0.00 H new ATOM 0 HA ILE A 124 3.887 -3.932 -2.896 1.00 0.00 H new ATOM 0 HB ILE A 124 5.398 -1.609 -4.118 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.767 -3.361 -3.088 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.929 -1.837 -2.237 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.045 -0.290 -2.080 1.00 0.00 H new ATOM 0 HG22 ILE A 124 3.548 -0.580 -2.998 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.879 -1.511 -1.517 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.824 -3.710 -0.668 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.410 -2.649 -0.465 1.00 0.00 H new ATOM 0 HD13 ILE A 124 5.245 -4.196 -1.329 1.00 0.00 H new ATOM 1873 N GLN A 125 2.724 -1.891 -5.249 1.00 0.00 N ATOM 1874 CA GLN A 125 1.485 -1.268 -5.705 1.00 0.00 C ATOM 1875 C GLN A 125 0.494 -2.330 -6.112 1.00 0.00 C ATOM 1876 O GLN A 125 -0.612 -2.404 -5.581 1.00 0.00 O ATOM 1877 CB GLN A 125 1.671 -0.381 -6.930 1.00 0.00 C ATOM 1878 CG GLN A 125 2.802 0.613 -6.898 1.00 0.00 C ATOM 1879 CD GLN A 125 2.692 1.660 -8.023 1.00 0.00 C ATOM 1880 OE1 GLN A 125 1.479 2.048 -8.361 1.00 0.00 O flip ATOM 1881 NE2 GLN A 125 3.688 2.147 -8.557 1.00 0.00 N flip ATOM 0 H GLN A 125 3.543 -1.697 -5.826 1.00 0.00 H new ATOM 0 HA GLN A 125 1.139 -0.664 -4.866 1.00 0.00 H new ATOM 0 HB2 GLN A 125 1.815 -1.027 -7.796 1.00 0.00 H new ATOM 0 HB3 GLN A 125 0.744 0.168 -7.093 1.00 0.00 H new ATOM 0 HG2 GLN A 125 2.810 1.119 -5.933 1.00 0.00 H new ATOM 0 HG3 GLN A 125 3.751 0.084 -6.989 1.00 0.00 H new ATOM 0 HE21 GLN A 125 4.619 1.834 -8.282 1.00 0.00 H new ATOM 0 HE22 GLN A 125 3.583 2.864 -9.275 1.00 0.00 H new ATOM 1890 N ALA A 126 0.944 -3.176 -7.038 1.00 0.00 N ATOM 1891 CA ALA A 126 0.123 -4.176 -7.680 1.00 0.00 C ATOM 1892 C ALA A 126 -0.583 -5.123 -6.701 1.00 0.00 C ATOM 1893 O ALA A 126 -1.800 -5.339 -6.817 1.00 0.00 O ATOM 1894 CB ALA A 126 0.934 -4.947 -8.691 1.00 0.00 C ATOM 0 H ALA A 126 1.911 -3.177 -7.363 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.676 -3.637 -8.190 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.303 -5.697 -9.167 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.318 -4.263 -9.447 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.768 -5.439 -8.190 1.00 0.00 H new ATOM 1900 N ALA A 127 0.141 -5.654 -5.731 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.447 -6.593 -4.791 1.00 0.00 C ATOM 1902 C ALA A 127 -1.383 -5.877 -3.832 1.00 0.00 C ATOM 1903 O ALA A 127 -2.486 -6.373 -3.542 1.00 0.00 O ATOM 1904 CB ALA A 127 0.631 -7.363 -4.041 1.00 0.00 C ATOM 0 H ALA A 127 1.129 -5.453 -5.574 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.035 -7.317 -5.355 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.163 -8.059 -3.344 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.243 -7.918 -4.752 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.260 -6.664 -3.489 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.974 -4.693 -3.376 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.787 -3.920 -2.467 1.00 0.00 C ATOM 1912 C ALA A 128 -3.124 -3.620 -3.085 1.00 0.00 C ATOM 1913 O ALA A 128 -4.100 -4.058 -2.593 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.097 -2.633 -2.037 1.00 0.00 C ATOM 0 H ALA A 128 -0.086 -4.258 -3.626 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.937 -4.522 -1.571 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.745 -2.084 -1.354 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.160 -2.873 -1.535 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.892 -2.020 -2.914 1.00 0.00 H new ATOM 1920 N THR A 129 -3.140 -2.930 -4.178 1.00 0.00 N ATOM 1921 CA THR A 129 -4.398 -2.558 -4.840 1.00 0.00 C ATOM 1922 C THR A 129 -5.283 -3.821 -5.168 1.00 0.00 C ATOM 1923 O THR A 129 -6.569 -3.828 -5.003 1.00 0.00 O ATOM 1924 CB THR A 129 -4.081 -1.742 -6.115 1.00 0.00 C ATOM 1925 OG1 THR A 129 -3.310 -2.532 -7.017 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.250 -0.505 -5.770 1.00 0.00 C ATOM 0 H THR A 129 -2.301 -2.599 -4.654 1.00 0.00 H new ATOM 0 HA THR A 129 -4.984 -1.941 -4.158 1.00 0.00 H new ATOM 0 HB THR A 129 -5.029 -1.447 -6.565 1.00 0.00 H new ATOM 0 HG1 THR A 129 -3.251 -2.077 -7.883 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.037 0.056 -6.680 1.00 0.00 H new ATOM 0 HG22 THR A 129 -3.807 0.126 -5.077 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.313 -0.814 -5.307 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.584 -4.930 -5.466 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.234 -6.180 -5.876 1.00 0.00 C ATOM 1936 C LYS A 130 -6.002 -6.755 -4.724 1.00 0.00 C ATOM 1937 O LYS A 130 -6.926 -7.509 -4.886 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.221 -7.178 -6.438 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.816 -8.456 -7.003 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.778 -9.297 -7.749 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.465 -8.779 -9.181 1.00 0.00 C ATOM 1942 NZ LYS A 130 -2.850 -7.416 -9.248 1.00 0.00 N ATOM 0 H LYS A 130 -3.566 -4.983 -5.429 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.936 -5.962 -6.681 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.647 -6.685 -7.223 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.518 -7.442 -5.648 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.243 -9.045 -6.192 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.633 -8.206 -7.680 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.855 -9.316 -7.170 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.135 -10.325 -7.814 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -2.793 -9.487 -9.667 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.390 -8.771 -9.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.319 -7.318 -10.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -3.599 -6.695 -9.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.205 -7.286 -8.443 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.578 -6.403 -3.581 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.233 -6.676 -2.377 1.00 0.00 C ATOM 1958 C ALA A 131 -7.267 -5.607 -2.164 1.00 0.00 C ATOM 1959 O ALA A 131 -8.474 -5.889 -2.211 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.171 -6.634 -1.346 1.00 0.00 C ATOM 0 H ALA A 131 -4.709 -5.884 -3.455 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.745 -7.638 -2.353 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.605 -6.839 -0.368 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.415 -7.386 -1.572 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.710 -5.646 -1.338 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.786 -4.365 -2.121 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.528 -3.161 -1.747 1.00 0.00 C ATOM 1968 C TRP A 132 -8.611 -2.723 -2.776 1.00 0.00 C ATOM 1969 O TRP A 132 -8.891 -1.546 -2.939 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.602 -1.965 -1.379 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.609 -2.255 -0.281 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.108 -3.448 -0.011 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.004 -1.358 0.687 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.171 -3.394 0.905 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.082 -2.136 1.393 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.103 0.011 1.017 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.268 -1.617 2.381 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.291 0.496 2.012 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.389 -0.313 2.665 1.00 0.00 C ATOM 0 H TRP A 132 -5.815 -4.161 -2.359 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.065 -3.461 -0.847 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -6.057 -1.656 -2.271 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.223 -1.122 -1.076 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.432 -4.361 -0.489 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.596 -4.182 1.204 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.797 0.658 0.502 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.559 -2.240 2.906 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.362 1.537 2.289 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.759 0.117 3.430 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.157 -3.651 -3.495 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.343 -3.395 -4.280 1.00 0.00 C ATOM 1992 C ARG A 133 -11.661 -4.174 -3.880 1.00 0.00 C ATOM 1993 O ARG A 133 -12.699 -3.540 -3.770 1.00 0.00 O ATOM 1994 CB ARG A 133 -10.077 -3.431 -5.819 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.308 -3.126 -6.695 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.258 -4.308 -6.781 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.699 -3.928 -7.003 1.00 0.00 N ATOM 1998 CZ ARG A 133 -14.537 -4.565 -7.841 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -14.097 -5.567 -8.572 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.822 -4.212 -7.921 1.00 0.00 N ATOM 0 H ARG A 133 -8.803 -4.605 -3.561 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.577 -2.368 -4.000 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.293 -2.711 -6.055 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.695 -4.417 -6.085 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.838 -2.265 -6.287 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.980 -2.852 -7.698 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.937 -4.960 -7.594 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.184 -4.887 -5.860 1.00 0.00 H new ATOM 0 HE ARG A 133 -14.065 -3.132 -6.481 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -13.122 -5.859 -8.503 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -14.731 -6.051 -9.208 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -16.179 -3.451 -7.343 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -16.447 -4.703 -8.560 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.592 -5.511 -3.655 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.804 -6.454 -3.842 1.00 0.00 C ATOM 2016 C LYS A 134 -14.132 -6.297 -3.091 1.00 0.00 C ATOM 2017 O LYS A 134 -14.757 -7.298 -2.745 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.480 -7.934 -3.968 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.913 -8.318 -5.319 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.562 -7.761 -5.518 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.617 -8.332 -4.513 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.273 -9.748 -4.804 1.00 0.00 N ATOM 0 H LYS A 134 -10.743 -5.986 -3.349 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.040 -5.981 -4.795 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.765 -8.208 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.386 -8.512 -3.786 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.876 -9.404 -5.403 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.575 -7.960 -6.107 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.213 -7.986 -6.526 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.591 -6.675 -5.425 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.705 -7.735 -4.495 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -10.062 -8.265 -3.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -9.138 -10.263 -3.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -10.044 -10.189 -5.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.395 -9.785 -5.361 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.595 -5.138 -2.888 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.891 -4.976 -2.267 1.00 0.00 C ATOM 2038 C LEU A 135 -16.973 -5.066 -3.339 1.00 0.00 C ATOM 2039 O LEU A 135 -16.728 -4.706 -4.492 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.948 -3.690 -1.439 1.00 0.00 C ATOM 2041 CG LEU A 135 -15.286 -3.753 -0.020 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.963 -4.508 -0.038 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -15.016 -2.374 0.468 1.00 0.00 C ATOM 0 H LEU A 135 -14.119 -4.270 -3.132 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.071 -5.782 -1.555 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.466 -2.895 -2.007 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.993 -3.406 -1.317 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.983 -4.277 0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.541 -4.526 0.967 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.132 -5.529 -0.379 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.269 -4.009 -0.714 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.556 -2.421 1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.341 -1.869 -0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.953 -1.820 0.531 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.154 -5.601 -2.998 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.190 -5.887 -3.977 1.00 0.00 C ATOM 2057 C PRO A 136 -19.902 -4.657 -4.587 1.00 0.00 C ATOM 2058 O PRO A 136 -19.425 -4.098 -5.563 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.147 -6.815 -3.233 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.994 -6.427 -1.802 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.569 -5.988 -1.633 1.00 0.00 C ATOM 0 HA PRO A 136 -18.754 -6.335 -4.870 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.174 -6.684 -3.574 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -19.890 -7.862 -3.391 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.682 -5.622 -1.542 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.222 -7.266 -1.145 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.488 -5.152 -0.938 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.947 -6.792 -1.239 1.00 0.00 H new