USER MOD reduce.3.24.130724 H: found=0, std=0, add=583, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 583 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 84 GLN : amide:sc= 0.0977 X(o=-2.8,f=-3) USER MOD Set 1.2: A 123 ASN : amide:sc= -2.93! C(o=-2.8!,f=-4.7!) USER MOD Single : A 82 LYS NZ :NH3+ -147:sc= -0.282 (180deg=-1.33) USER MOD Single : A 87 ASN : amide:sc= -0.767 X(o=-0.77,f=-0.89) USER MOD Single : A 91 HIS : no HE2:sc= 0.448 K(o=0.45,f=-2!) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc=-0.00553 K(o=-0.0055,f=-0.85) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 CYS SG : rot -104:sc= 0.075 USER MOD Single : A 112 GLN : amide:sc= -2.09 K(o=-2.1,f=-4.1!) USER MOD Single : A 114 ASN : amide:sc= 0.81 K(o=0.81,f=-5.3!) USER MOD Single : A 115 THR OG1 : rot -50:sc= 0.55 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.0571 USER MOD Single : A 126 TYR OH : rot -21:sc= 1.26 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot -114:sc= 0.199 USER MOD Single : A 129 LYS NZ :NH3+ 145:sc= -0.269 (180deg=-1.66!) USER MOD Single : A 131 GLN : amide:sc= -3.44! K(o=-3.4!,f=-0.093) USER MOD Single : A 134 GLN : amide:sc= -11.5! C(o=-11!,f=-21!) USER MOD Single : A 138 LYS NZ :NH3+ 138:sc= -0.224 (180deg=-1.49!) USER MOD Single : A 140 ASN : amide:sc= 0.38 K(o=0.38,f=-0.57) USER MOD Single : A 143 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 146 ASN : amide:sc= -3.11! C(o=-3.1!,f=-8.5!) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 TYR OH : rot 30:sc= -0.232 USER MOD ----------------------------------------------------------------- ATOM 237 N LYS A 82 9.260 -1.728 -3.575 1.00 0.00 N ATOM 238 CA LYS A 82 8.539 -1.409 -2.348 1.00 0.00 C ATOM 239 C LYS A 82 7.231 -0.688 -2.657 1.00 0.00 C ATOM 240 O LYS A 82 6.903 -0.447 -3.820 1.00 0.00 O ATOM 241 CB LYS A 82 9.408 -0.543 -1.433 1.00 0.00 C ATOM 242 CG LYS A 82 9.075 -0.692 0.041 1.00 0.00 C ATOM 243 CD LYS A 82 10.297 -0.464 0.915 1.00 0.00 C ATOM 244 CE LYS A 82 10.761 0.984 0.858 1.00 0.00 C ATOM 245 NZ LYS A 82 11.655 1.235 -0.306 1.00 0.00 N ATOM 0 HA LYS A 82 8.306 -2.344 -1.839 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.455 -0.802 -1.588 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.293 0.502 -1.719 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.295 0.019 0.312 1.00 0.00 H new ATOM 0 HG3 LYS A 82 8.676 -1.689 0.226 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.064 -0.732 1.945 1.00 0.00 H new ATOM 0 HD3 LYS A 82 11.105 -1.119 0.590 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.893 1.641 0.798 1.00 0.00 H new ATOM 0 HE3 LYS A 82 11.286 1.233 1.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 12.360 1.957 -0.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 12.141 0.353 -0.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 11.090 1.571 -1.112 1.00 0.00 H new ATOM 259 N LEU A 83 6.489 -0.345 -1.610 1.00 0.00 N ATOM 260 CA LEU A 83 5.216 0.351 -1.770 1.00 0.00 C ATOM 261 C LEU A 83 4.950 1.278 -0.588 1.00 0.00 C ATOM 262 O LEU A 83 5.230 0.931 0.559 1.00 0.00 O ATOM 263 CB LEU A 83 4.075 -0.658 -1.908 1.00 0.00 C ATOM 264 CG LEU A 83 3.922 -1.314 -3.281 1.00 0.00 C ATOM 265 CD1 LEU A 83 3.047 -2.554 -3.185 1.00 0.00 C ATOM 266 CD2 LEU A 83 3.341 -0.326 -4.282 1.00 0.00 C ATOM 0 H LEU A 83 6.746 -0.537 -0.642 1.00 0.00 H new ATOM 0 HA LEU A 83 5.271 0.954 -2.676 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.220 -1.443 -1.166 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.140 -0.155 -1.662 1.00 0.00 H new ATOM 0 HG LEU A 83 4.909 -1.617 -3.630 1.00 0.00 H new ATOM 0 HD11 LEU A 83 2.949 -3.008 -4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.503 -3.269 -2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.061 -2.275 -2.814 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.239 -0.810 -5.253 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.362 0.007 -3.938 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.005 0.533 -4.373 1.00 0.00 H new ATOM 278 N GLN A 84 4.407 2.456 -0.877 1.00 0.00 N ATOM 279 CA GLN A 84 4.102 3.431 0.163 1.00 0.00 C ATOM 280 C GLN A 84 2.595 3.579 0.346 1.00 0.00 C ATOM 281 O GLN A 84 1.862 3.803 -0.618 1.00 0.00 O ATOM 282 CB GLN A 84 4.720 4.787 -0.183 1.00 0.00 C ATOM 283 CG GLN A 84 4.265 5.914 0.730 1.00 0.00 C ATOM 284 CD GLN A 84 5.302 7.012 0.863 1.00 0.00 C ATOM 285 OE1 GLN A 84 5.183 8.072 0.247 1.00 0.00 O ATOM 286 NE2 GLN A 84 6.327 6.764 1.670 1.00 0.00 N ATOM 0 H GLN A 84 4.169 2.758 -1.822 1.00 0.00 H new ATOM 0 HA GLN A 84 4.530 3.072 1.099 1.00 0.00 H new ATOM 0 HB2 GLN A 84 5.806 4.706 -0.132 1.00 0.00 H new ATOM 0 HB3 GLN A 84 4.467 5.040 -1.213 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.339 6.339 0.343 1.00 0.00 H new ATOM 0 HG3 GLN A 84 4.041 5.509 1.717 1.00 0.00 H new ATOM 0 HE21 GLN A 84 6.385 5.872 2.161 1.00 0.00 H new ATOM 0 HE22 GLN A 84 7.056 7.466 1.799 1.00 0.00 H new ATOM 295 N ILE A 85 2.139 3.451 1.588 1.00 0.00 N ATOM 296 CA ILE A 85 0.720 3.571 1.896 1.00 0.00 C ATOM 297 C ILE A 85 0.452 4.772 2.796 1.00 0.00 C ATOM 298 O ILE A 85 1.078 4.926 3.845 1.00 0.00 O ATOM 299 CB ILE A 85 0.184 2.300 2.582 1.00 0.00 C ATOM 300 CG1 ILE A 85 0.421 1.076 1.695 1.00 0.00 C ATOM 301 CG2 ILE A 85 -1.297 2.453 2.897 1.00 0.00 C ATOM 302 CD1 ILE A 85 -0.075 -0.217 2.303 1.00 0.00 C ATOM 0 H ILE A 85 2.732 3.264 2.397 1.00 0.00 H new ATOM 0 HA ILE A 85 0.202 3.709 0.947 1.00 0.00 H new ATOM 0 HB ILE A 85 0.723 2.156 3.519 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.075 1.231 0.737 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.488 0.986 1.491 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.661 1.547 3.381 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -1.441 3.304 3.563 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -1.850 2.618 1.973 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.126 -1.041 1.619 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.439 -0.395 3.248 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.148 -0.147 2.481 1.00 0.00 H new ATOM 314 N ARG A 86 -0.482 5.620 2.380 1.00 0.00 N ATOM 315 CA ARG A 86 -0.833 6.808 3.149 1.00 0.00 C ATOM 316 C ARG A 86 -2.341 6.889 3.365 1.00 0.00 C ATOM 317 O ARG A 86 -3.085 5.995 2.965 1.00 0.00 O ATOM 318 CB ARG A 86 -0.341 8.068 2.434 1.00 0.00 C ATOM 319 CG ARG A 86 1.145 8.046 2.115 1.00 0.00 C ATOM 320 CD ARG A 86 1.465 8.898 0.897 1.00 0.00 C ATOM 321 NE ARG A 86 1.338 8.144 -0.347 1.00 0.00 N ATOM 322 CZ ARG A 86 1.553 8.667 -1.549 1.00 0.00 C ATOM 323 NH1 ARG A 86 1.904 9.940 -1.668 1.00 0.00 N ATOM 324 NH2 ARG A 86 1.417 7.917 -2.635 1.00 0.00 N ATOM 0 H ARG A 86 -1.010 5.507 1.514 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.347 6.737 4.122 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -0.901 8.192 1.507 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.558 8.937 3.056 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.708 8.411 2.974 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.465 7.019 1.937 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.795 9.758 0.870 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.480 9.287 0.983 1.00 0.00 H new ATOM 0 HE ARG A 86 1.069 7.162 -0.290 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.009 10.520 -0.836 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.069 10.339 -2.592 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.147 6.937 -2.548 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.582 8.320 -3.557 1.00 0.00 H new ATOM 338 N ASN A 87 -2.785 7.968 4.002 1.00 0.00 N ATOM 339 CA ASN A 87 -4.205 8.166 4.273 1.00 0.00 C ATOM 340 C ASN A 87 -4.738 7.078 5.201 1.00 0.00 C ATOM 341 O ASN A 87 -5.888 6.654 5.080 1.00 0.00 O ATOM 342 CB ASN A 87 -4.999 8.171 2.966 1.00 0.00 C ATOM 343 CG ASN A 87 -5.149 9.564 2.386 1.00 0.00 C ATOM 344 OD1 ASN A 87 -4.189 10.333 2.333 1.00 0.00 O ATOM 345 ND2 ASN A 87 -6.357 9.895 1.947 1.00 0.00 N ATOM 0 H ASN A 87 -2.182 8.718 4.340 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.325 9.131 4.766 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -4.501 7.529 2.239 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.987 7.746 3.143 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -6.518 10.819 1.546 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.124 9.226 2.011 1.00 0.00 H new ATOM 352 N ILE A 88 -3.895 6.632 6.126 1.00 0.00 N ATOM 353 CA ILE A 88 -4.283 5.596 7.076 1.00 0.00 C ATOM 354 C ILE A 88 -4.882 6.204 8.339 1.00 0.00 C ATOM 355 O ILE A 88 -4.341 7.142 8.923 1.00 0.00 O ATOM 356 CB ILE A 88 -3.083 4.712 7.464 1.00 0.00 C ATOM 357 CG1 ILE A 88 -2.514 4.014 6.227 1.00 0.00 C ATOM 358 CG2 ILE A 88 -3.496 3.690 8.513 1.00 0.00 C ATOM 359 CD1 ILE A 88 -1.055 3.636 6.364 1.00 0.00 C ATOM 0 H ILE A 88 -2.940 6.971 6.238 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.034 4.980 6.582 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.305 5.347 7.889 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.097 3.115 6.027 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -2.632 4.669 5.364 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.637 3.073 8.777 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.858 4.207 9.402 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -4.288 3.058 8.113 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.719 3.146 5.450 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.461 4.534 6.534 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.933 2.956 7.207 1.00 0.00 H new ATOM 371 N PRO A 89 -6.027 5.656 8.773 1.00 0.00 N ATOM 372 CA PRO A 89 -6.725 6.127 9.973 1.00 0.00 C ATOM 373 C PRO A 89 -5.966 5.794 11.253 1.00 0.00 C ATOM 374 O PRO A 89 -5.647 4.637 11.531 1.00 0.00 O ATOM 375 CB PRO A 89 -8.056 5.372 9.929 1.00 0.00 C ATOM 376 CG PRO A 89 -7.767 4.142 9.139 1.00 0.00 C ATOM 377 CD PRO A 89 -6.728 4.534 8.126 1.00 0.00 C ATOM 0 HA PRO A 89 -6.835 7.211 9.981 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -8.405 5.126 10.932 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.836 5.971 9.458 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -7.402 3.342 9.783 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -8.668 3.772 8.650 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -6.050 3.709 7.906 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.181 4.834 7.181 1.00 0.00 H new ATOM 385 N PRO A 90 -5.668 6.829 12.052 1.00 0.00 N ATOM 386 CA PRO A 90 -4.943 6.670 13.316 1.00 0.00 C ATOM 387 C PRO A 90 -5.779 5.965 14.379 1.00 0.00 C ATOM 388 O PRO A 90 -5.326 5.762 15.506 1.00 0.00 O ATOM 389 CB PRO A 90 -4.648 8.112 13.739 1.00 0.00 C ATOM 390 CG PRO A 90 -5.710 8.924 13.083 1.00 0.00 C ATOM 391 CD PRO A 90 -6.016 8.234 11.783 1.00 0.00 C ATOM 0 HA PRO A 90 -4.052 6.054 13.200 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.679 8.221 14.823 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -3.655 8.424 13.416 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.599 8.985 13.711 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.370 9.946 12.912 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.065 8.342 11.508 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -5.427 8.644 10.962 1.00 0.00 H new ATOM 399 N HIS A 91 -7.001 5.592 14.013 1.00 0.00 N ATOM 400 CA HIS A 91 -7.900 4.907 14.935 1.00 0.00 C ATOM 401 C HIS A 91 -7.700 3.396 14.867 1.00 0.00 C ATOM 402 O HIS A 91 -7.799 2.700 15.878 1.00 0.00 O ATOM 403 CB HIS A 91 -9.354 5.256 14.617 1.00 0.00 C ATOM 404 CG HIS A 91 -9.559 6.694 14.253 1.00 0.00 C ATOM 405 ND1 HIS A 91 -10.458 7.106 13.292 1.00 0.00 N ATOM 406 CD2 HIS A 91 -8.976 7.819 14.727 1.00 0.00 C ATOM 407 CE1 HIS A 91 -10.418 8.423 13.191 1.00 0.00 C ATOM 408 NE2 HIS A 91 -9.527 8.880 14.051 1.00 0.00 N ATOM 0 H HIS A 91 -7.392 5.753 13.084 1.00 0.00 H new ATOM 0 HA HIS A 91 -7.667 5.241 15.946 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -9.698 4.629 13.794 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -9.974 5.017 15.481 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -11.060 6.491 12.745 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.218 7.873 15.494 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -11.013 9.023 12.519 1.00 0.00 H new ATOM 416 N LEU A 92 -7.420 2.895 13.669 1.00 0.00 N ATOM 417 CA LEU A 92 -7.207 1.465 13.468 1.00 0.00 C ATOM 418 C LEU A 92 -5.943 0.998 14.184 1.00 0.00 C ATOM 419 O LEU A 92 -5.025 1.782 14.417 1.00 0.00 O ATOM 420 CB LEU A 92 -7.108 1.149 11.975 1.00 0.00 C ATOM 421 CG LEU A 92 -6.244 -0.056 11.600 1.00 0.00 C ATOM 422 CD1 LEU A 92 -6.721 -0.667 10.291 1.00 0.00 C ATOM 423 CD2 LEU A 92 -4.780 0.348 11.501 1.00 0.00 C ATOM 0 H LEU A 92 -7.335 3.457 12.822 1.00 0.00 H new ATOM 0 HA LEU A 92 -8.059 0.932 13.889 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.115 0.982 11.592 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -6.713 2.027 11.464 1.00 0.00 H new ATOM 0 HG LEU A 92 -6.340 -0.807 12.384 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -6.095 -1.523 10.040 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.756 -0.993 10.397 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -6.655 0.077 9.497 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.180 -0.522 11.233 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.666 1.117 10.737 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.445 0.739 12.462 1.00 0.00 H new ATOM 435 N GLN A 93 -5.905 -0.286 14.527 1.00 0.00 N ATOM 436 CA GLN A 93 -4.753 -0.858 15.214 1.00 0.00 C ATOM 437 C GLN A 93 -3.746 -1.418 14.215 1.00 0.00 C ATOM 438 O GLN A 93 -4.124 -1.971 13.182 1.00 0.00 O ATOM 439 CB GLN A 93 -5.202 -1.960 16.175 1.00 0.00 C ATOM 440 CG GLN A 93 -6.061 -1.454 17.323 1.00 0.00 C ATOM 441 CD GLN A 93 -6.084 -2.409 18.500 1.00 0.00 C ATOM 442 OE1 GLN A 93 -5.147 -2.452 19.298 1.00 0.00 O ATOM 443 NE2 GLN A 93 -7.158 -3.182 18.615 1.00 0.00 N ATOM 0 H GLN A 93 -6.658 -0.949 14.341 1.00 0.00 H new ATOM 0 HA GLN A 93 -4.270 -0.064 15.783 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -5.761 -2.711 15.617 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -4.321 -2.456 16.583 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -5.685 -0.485 17.653 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -7.079 -1.297 16.968 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -7.911 -3.113 17.931 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -7.229 -3.844 19.388 1.00 0.00 H new ATOM 452 N TRP A 94 -2.464 -1.269 14.529 1.00 0.00 N ATOM 453 CA TRP A 94 -1.402 -1.759 13.658 1.00 0.00 C ATOM 454 C TRP A 94 -1.595 -3.239 13.344 1.00 0.00 C ATOM 455 O TRP A 94 -1.566 -3.645 12.183 1.00 0.00 O ATOM 456 CB TRP A 94 -0.036 -1.537 14.310 1.00 0.00 C ATOM 457 CG TRP A 94 1.112 -1.753 13.371 1.00 0.00 C ATOM 458 CD1 TRP A 94 1.725 -2.940 13.086 1.00 0.00 C ATOM 459 CD2 TRP A 94 1.785 -0.755 12.596 1.00 0.00 C ATOM 460 NE1 TRP A 94 2.739 -2.739 12.180 1.00 0.00 N ATOM 461 CE2 TRP A 94 2.796 -1.408 11.864 1.00 0.00 C ATOM 462 CE3 TRP A 94 1.631 0.626 12.448 1.00 0.00 C ATOM 463 CZ2 TRP A 94 3.647 -0.725 10.999 1.00 0.00 C ATOM 464 CZ3 TRP A 94 2.477 1.302 11.590 1.00 0.00 C ATOM 465 CH2 TRP A 94 3.474 0.627 10.873 1.00 0.00 C ATOM 0 H TRP A 94 -2.135 -0.813 15.380 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.446 -1.200 12.723 1.00 0.00 H new ATOM 0 HB2 TRP A 94 0.011 -0.521 14.702 1.00 0.00 H new ATOM 0 HB3 TRP A 94 0.067 -2.212 15.160 1.00 0.00 H new ATOM 0 HD1 TRP A 94 1.453 -3.895 13.510 1.00 0.00 H new ATOM 0 HE1 TRP A 94 3.350 -3.464 11.804 1.00 0.00 H new ATOM 0 HE3 TRP A 94 0.864 1.155 12.994 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 4.417 -1.244 10.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 2.368 2.370 11.470 1.00 0.00 H new ATOM 0 HH2 TRP A 94 4.118 1.184 10.209 1.00 0.00 H new ATOM 476 N GLU A 95 -1.791 -4.040 14.387 1.00 0.00 N ATOM 477 CA GLU A 95 -1.988 -5.475 14.221 1.00 0.00 C ATOM 478 C GLU A 95 -2.920 -5.764 13.048 1.00 0.00 C ATOM 479 O GLU A 95 -2.647 -6.635 12.223 1.00 0.00 O ATOM 480 CB GLU A 95 -2.558 -6.086 15.503 1.00 0.00 C ATOM 481 CG GLU A 95 -4.029 -5.777 15.722 1.00 0.00 C ATOM 482 CD GLU A 95 -4.517 -6.203 17.093 1.00 0.00 C ATOM 483 OE1 GLU A 95 -4.727 -7.418 17.296 1.00 0.00 O ATOM 484 OE2 GLU A 95 -4.689 -5.324 17.962 1.00 0.00 O ATOM 0 H GLU A 95 -1.818 -3.720 15.355 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.018 -5.927 14.012 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.423 -7.167 15.471 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -1.987 -5.718 16.356 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.194 -4.707 15.598 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.620 -6.281 14.957 1.00 0.00 H new ATOM 491 N VAL A 96 -4.025 -5.027 12.982 1.00 0.00 N ATOM 492 CA VAL A 96 -4.998 -5.202 11.911 1.00 0.00 C ATOM 493 C VAL A 96 -4.388 -4.870 10.554 1.00 0.00 C ATOM 494 O VAL A 96 -4.637 -5.559 9.564 1.00 0.00 O ATOM 495 CB VAL A 96 -6.242 -4.321 12.133 1.00 0.00 C ATOM 496 CG1 VAL A 96 -7.257 -4.540 11.021 1.00 0.00 C ATOM 497 CG2 VAL A 96 -6.860 -4.605 13.494 1.00 0.00 C ATOM 0 H VAL A 96 -4.268 -4.303 13.658 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.298 -6.250 11.924 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.934 -3.276 12.110 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.129 -3.909 11.195 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.808 -4.282 10.062 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.563 -5.586 11.008 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.738 -3.974 13.634 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.154 -5.653 13.548 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.131 -4.392 14.276 1.00 0.00 H new ATOM 507 N LEU A 97 -3.588 -3.810 10.515 1.00 0.00 N ATOM 508 CA LEU A 97 -2.941 -3.385 9.279 1.00 0.00 C ATOM 509 C LEU A 97 -2.030 -4.482 8.736 1.00 0.00 C ATOM 510 O LEU A 97 -2.262 -5.015 7.651 1.00 0.00 O ATOM 511 CB LEU A 97 -2.135 -2.107 9.515 1.00 0.00 C ATOM 512 CG LEU A 97 -1.542 -1.448 8.269 1.00 0.00 C ATOM 513 CD1 LEU A 97 -2.644 -1.047 7.301 1.00 0.00 C ATOM 514 CD2 LEU A 97 -0.703 -0.238 8.655 1.00 0.00 C ATOM 0 H LEU A 97 -3.372 -3.229 11.325 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.718 -3.186 8.541 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -2.779 -1.382 10.014 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.321 -2.336 10.203 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.895 -2.171 7.772 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.203 -0.580 6.421 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.204 -1.933 7.000 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.317 -0.341 7.788 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.289 0.219 7.756 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -1.328 0.487 9.176 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.110 -0.553 9.310 1.00 0.00 H new ATOM 526 N ASP A 98 -0.995 -4.815 9.499 1.00 0.00 N ATOM 527 CA ASP A 98 -0.051 -5.851 9.097 1.00 0.00 C ATOM 528 C ASP A 98 -0.756 -6.957 8.319 1.00 0.00 C ATOM 529 O ASP A 98 -0.391 -7.261 7.183 1.00 0.00 O ATOM 530 CB ASP A 98 0.647 -6.439 10.324 1.00 0.00 C ATOM 531 CG ASP A 98 1.914 -7.191 9.965 1.00 0.00 C ATOM 532 OD1 ASP A 98 2.932 -6.530 9.672 1.00 0.00 O ATOM 533 OD2 ASP A 98 1.887 -8.439 9.977 1.00 0.00 O ATOM 0 H ASP A 98 -0.788 -4.383 10.399 1.00 0.00 H new ATOM 0 HA ASP A 98 0.696 -5.394 8.448 1.00 0.00 H new ATOM 0 HB2 ASP A 98 0.890 -5.636 11.020 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -0.038 -7.112 10.840 1.00 0.00 H new ATOM 538 N SER A 99 -1.768 -7.557 8.938 1.00 0.00 N ATOM 539 CA SER A 99 -2.522 -8.633 8.306 1.00 0.00 C ATOM 540 C SER A 99 -3.107 -8.176 6.973 1.00 0.00 C ATOM 541 O SER A 99 -2.894 -8.810 5.938 1.00 0.00 O ATOM 542 CB SER A 99 -3.643 -9.111 9.231 1.00 0.00 C ATOM 543 OG SER A 99 -3.935 -10.480 9.013 1.00 0.00 O ATOM 0 H SER A 99 -2.085 -7.316 9.877 1.00 0.00 H new ATOM 0 HA SER A 99 -1.838 -9.461 8.118 1.00 0.00 H new ATOM 0 HB2 SER A 99 -3.351 -8.959 10.270 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.539 -8.513 9.061 1.00 0.00 H new ATOM 0 HG SER A 99 -4.653 -10.762 9.617 1.00 0.00 H new ATOM 549 N LEU A 100 -3.845 -7.072 7.005 1.00 0.00 N ATOM 550 CA LEU A 100 -4.462 -6.528 5.801 1.00 0.00 C ATOM 551 C LEU A 100 -3.480 -6.540 4.633 1.00 0.00 C ATOM 552 O LEU A 100 -3.872 -6.720 3.480 1.00 0.00 O ATOM 553 CB LEU A 100 -4.953 -5.102 6.054 1.00 0.00 C ATOM 554 CG LEU A 100 -6.289 -4.972 6.785 1.00 0.00 C ATOM 555 CD1 LEU A 100 -6.467 -3.563 7.328 1.00 0.00 C ATOM 556 CD2 LEU A 100 -7.441 -5.338 5.860 1.00 0.00 C ATOM 0 H LEU A 100 -4.031 -6.536 7.853 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.313 -7.158 5.543 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.193 -4.575 6.631 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.036 -4.592 5.094 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.289 -5.666 7.626 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.424 -3.490 7.845 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.660 -3.337 8.025 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.445 -2.850 6.504 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.384 -5.240 6.397 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.443 -4.670 4.999 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.322 -6.367 5.521 1.00 0.00 H new ATOM 568 N LEU A 101 -2.201 -6.350 4.940 1.00 0.00 N ATOM 569 CA LEU A 101 -1.162 -6.341 3.917 1.00 0.00 C ATOM 570 C LEU A 101 -0.704 -7.759 3.594 1.00 0.00 C ATOM 571 O LEU A 101 -0.401 -8.078 2.444 1.00 0.00 O ATOM 572 CB LEU A 101 0.030 -5.501 4.380 1.00 0.00 C ATOM 573 CG LEU A 101 -0.308 -4.216 5.137 1.00 0.00 C ATOM 574 CD1 LEU A 101 0.946 -3.608 5.744 1.00 0.00 C ATOM 575 CD2 LEU A 101 -0.994 -3.218 4.214 1.00 0.00 C ATOM 0 H LEU A 101 -1.859 -6.200 5.889 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.581 -5.899 3.013 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.659 -6.121 5.019 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.625 -5.238 3.505 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.995 -4.464 5.946 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.685 -2.695 6.279 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.396 -4.318 6.438 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.657 -3.374 4.952 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -1.227 -2.310 4.769 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.331 -2.975 3.383 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.915 -3.654 3.828 1.00 0.00 H new ATOM 587 N VAL A 102 -0.657 -8.608 4.616 1.00 0.00 N ATOM 588 CA VAL A 102 -0.239 -9.994 4.441 1.00 0.00 C ATOM 589 C VAL A 102 -1.335 -10.818 3.775 1.00 0.00 C ATOM 590 O VAL A 102 -1.129 -11.983 3.436 1.00 0.00 O ATOM 591 CB VAL A 102 0.131 -10.643 5.787 1.00 0.00 C ATOM 592 CG1 VAL A 102 -1.092 -11.287 6.423 1.00 0.00 C ATOM 593 CG2 VAL A 102 1.243 -11.663 5.599 1.00 0.00 C ATOM 0 H VAL A 102 -0.903 -8.360 5.574 1.00 0.00 H new ATOM 0 HA VAL A 102 0.642 -9.981 3.799 1.00 0.00 H new ATOM 0 HB VAL A 102 0.493 -9.864 6.458 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.811 -11.741 7.374 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -1.855 -10.528 6.594 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.487 -12.054 5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 102 1.492 -12.112 6.561 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.911 -12.440 4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 102 2.125 -11.169 5.190 1.00 0.00 H new ATOM 603 N GLN A 103 -2.500 -10.205 3.590 1.00 0.00 N ATOM 604 CA GLN A 103 -3.629 -10.883 2.965 1.00 0.00 C ATOM 605 C GLN A 103 -3.483 -10.896 1.447 1.00 0.00 C ATOM 606 O GLN A 103 -3.746 -11.908 0.797 1.00 0.00 O ATOM 607 CB GLN A 103 -4.941 -10.201 3.357 1.00 0.00 C ATOM 608 CG GLN A 103 -5.430 -10.576 4.747 1.00 0.00 C ATOM 609 CD GLN A 103 -6.933 -10.446 4.892 1.00 0.00 C ATOM 610 OE1 GLN A 103 -7.593 -9.796 4.080 1.00 0.00 O ATOM 611 NE2 GLN A 103 -7.484 -11.065 5.929 1.00 0.00 N ATOM 0 H GLN A 103 -2.686 -9.240 3.864 1.00 0.00 H new ATOM 0 HA GLN A 103 -3.643 -11.914 3.319 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -4.808 -9.120 3.307 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -5.708 -10.462 2.628 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -5.135 -11.602 4.967 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -4.941 -9.939 5.484 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -6.900 -11.593 6.577 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -8.492 -11.013 6.077 1.00 0.00 H new ATOM 620 N TYR A 104 -3.063 -9.767 0.888 1.00 0.00 N ATOM 621 CA TYR A 104 -2.885 -9.648 -0.554 1.00 0.00 C ATOM 622 C TYR A 104 -1.783 -10.581 -1.046 1.00 0.00 C ATOM 623 O TYR A 104 -1.963 -11.316 -2.016 1.00 0.00 O ATOM 624 CB TYR A 104 -2.551 -8.203 -0.930 1.00 0.00 C ATOM 625 CG TYR A 104 -3.682 -7.233 -0.673 1.00 0.00 C ATOM 626 CD1 TYR A 104 -4.722 -7.091 -1.584 1.00 0.00 C ATOM 627 CD2 TYR A 104 -3.711 -6.460 0.481 1.00 0.00 C ATOM 628 CE1 TYR A 104 -5.757 -6.206 -1.354 1.00 0.00 C ATOM 629 CE2 TYR A 104 -4.743 -5.573 0.720 1.00 0.00 C ATOM 630 CZ TYR A 104 -5.763 -5.449 -0.200 1.00 0.00 C ATOM 631 OH TYR A 104 -6.793 -4.567 0.034 1.00 0.00 O ATOM 0 H TYR A 104 -2.839 -8.921 1.412 1.00 0.00 H new ATOM 0 HA TYR A 104 -3.820 -9.935 -1.035 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -1.674 -7.883 -0.367 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -2.283 -8.164 -1.986 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -4.721 -7.683 -2.487 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -2.914 -6.554 1.203 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -6.557 -6.107 -2.073 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -4.751 -4.980 1.623 1.00 0.00 H new ATOM 0 HH TYR A 104 -6.647 -4.113 0.890 1.00 0.00 H new ATOM 641 N GLY A 105 -0.640 -10.546 -0.367 1.00 0.00 N ATOM 642 CA GLY A 105 0.475 -11.393 -0.748 1.00 0.00 C ATOM 643 C GLY A 105 1.454 -11.609 0.389 1.00 0.00 C ATOM 644 O GLY A 105 1.099 -11.467 1.559 1.00 0.00 O ATOM 0 H GLY A 105 -0.467 -9.946 0.440 1.00 0.00 H new ATOM 0 HA2 GLY A 105 0.096 -12.358 -1.085 1.00 0.00 H new ATOM 0 HA3 GLY A 105 0.997 -10.943 -1.592 1.00 0.00 H new ATOM 648 N VAL A 106 2.691 -11.955 0.046 1.00 0.00 N ATOM 649 CA VAL A 106 3.724 -12.192 1.047 1.00 0.00 C ATOM 650 C VAL A 106 4.481 -10.909 1.370 1.00 0.00 C ATOM 651 O VAL A 106 5.453 -10.563 0.698 1.00 0.00 O ATOM 652 CB VAL A 106 4.727 -13.262 0.576 1.00 0.00 C ATOM 653 CG1 VAL A 106 5.839 -13.439 1.598 1.00 0.00 C ATOM 654 CG2 VAL A 106 4.016 -14.581 0.316 1.00 0.00 C ATOM 0 H VAL A 106 3.002 -12.077 -0.918 1.00 0.00 H new ATOM 0 HA VAL A 106 3.219 -12.548 1.945 1.00 0.00 H new ATOM 0 HB VAL A 106 5.176 -12.927 -0.359 1.00 0.00 H new ATOM 0 HG11 VAL A 106 6.538 -14.199 1.248 1.00 0.00 H new ATOM 0 HG12 VAL A 106 6.366 -12.494 1.729 1.00 0.00 H new ATOM 0 HG13 VAL A 106 5.411 -13.751 2.551 1.00 0.00 H new ATOM 0 HG21 VAL A 106 4.740 -15.325 -0.016 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.538 -14.924 1.234 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.260 -14.441 -0.456 1.00 0.00 H new ATOM 664 N VAL A 107 4.029 -10.206 2.404 1.00 0.00 N ATOM 665 CA VAL A 107 4.664 -8.961 2.819 1.00 0.00 C ATOM 666 C VAL A 107 6.008 -9.226 3.489 1.00 0.00 C ATOM 667 O VAL A 107 6.070 -9.500 4.687 1.00 0.00 O ATOM 668 CB VAL A 107 3.767 -8.168 3.787 1.00 0.00 C ATOM 669 CG1 VAL A 107 3.445 -9.000 5.019 1.00 0.00 C ATOM 670 CG2 VAL A 107 4.433 -6.858 4.178 1.00 0.00 C ATOM 0 H VAL A 107 3.225 -10.478 2.970 1.00 0.00 H new ATOM 0 HA VAL A 107 4.822 -8.370 1.917 1.00 0.00 H new ATOM 0 HB VAL A 107 2.831 -7.936 3.280 1.00 0.00 H new ATOM 0 HG11 VAL A 107 2.810 -8.423 5.692 1.00 0.00 H new ATOM 0 HG12 VAL A 107 2.924 -9.909 4.718 1.00 0.00 H new ATOM 0 HG13 VAL A 107 4.370 -9.265 5.531 1.00 0.00 H new ATOM 0 HG21 VAL A 107 3.785 -6.310 4.862 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.385 -7.065 4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.607 -6.258 3.285 1.00 0.00 H new ATOM 680 N GLU A 108 7.080 -9.143 2.708 1.00 0.00 N ATOM 681 CA GLU A 108 8.423 -9.375 3.227 1.00 0.00 C ATOM 682 C GLU A 108 8.624 -8.652 4.556 1.00 0.00 C ATOM 683 O GLU A 108 8.996 -9.263 5.557 1.00 0.00 O ATOM 684 CB GLU A 108 9.472 -8.908 2.216 1.00 0.00 C ATOM 685 CG GLU A 108 10.778 -9.681 2.294 1.00 0.00 C ATOM 686 CD GLU A 108 11.415 -9.612 3.668 1.00 0.00 C ATOM 687 OE1 GLU A 108 11.859 -8.514 4.063 1.00 0.00 O ATOM 688 OE2 GLU A 108 11.470 -10.658 4.349 1.00 0.00 O ATOM 0 H GLU A 108 7.045 -8.917 1.714 1.00 0.00 H new ATOM 0 HA GLU A 108 8.541 -10.446 3.394 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.063 -9.003 1.210 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.676 -7.850 2.379 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.595 -10.724 2.034 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.474 -9.286 1.554 1.00 0.00 H new ATOM 695 N SER A 109 8.376 -7.346 4.556 1.00 0.00 N ATOM 696 CA SER A 109 8.534 -6.538 5.760 1.00 0.00 C ATOM 697 C SER A 109 7.713 -5.255 5.665 1.00 0.00 C ATOM 698 O SER A 109 7.622 -4.641 4.601 1.00 0.00 O ATOM 699 CB SER A 109 10.009 -6.198 5.982 1.00 0.00 C ATOM 700 OG SER A 109 10.220 -5.665 7.277 1.00 0.00 O ATOM 0 H SER A 109 8.065 -6.825 3.736 1.00 0.00 H new ATOM 0 HA SER A 109 8.171 -7.119 6.608 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.616 -7.094 5.851 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.337 -5.479 5.231 1.00 0.00 H new ATOM 0 HG SER A 109 11.171 -5.458 7.394 1.00 0.00 H new ATOM 706 N CYS A 110 7.118 -4.857 6.784 1.00 0.00 N ATOM 707 CA CYS A 110 6.303 -3.648 6.828 1.00 0.00 C ATOM 708 C CYS A 110 6.982 -2.565 7.660 1.00 0.00 C ATOM 709 O CYS A 110 6.913 -2.579 8.888 1.00 0.00 O ATOM 710 CB CYS A 110 4.921 -3.960 7.404 1.00 0.00 C ATOM 711 SG CYS A 110 3.867 -2.507 7.620 1.00 0.00 S ATOM 0 H CYS A 110 7.185 -5.353 7.673 1.00 0.00 H new ATOM 0 HA CYS A 110 6.188 -3.279 5.809 1.00 0.00 H new ATOM 0 HB2 CYS A 110 4.416 -4.667 6.746 1.00 0.00 H new ATOM 0 HB3 CYS A 110 5.044 -4.453 8.368 1.00 0.00 H new ATOM 0 HG CYS A 110 3.825 -2.185 8.879 1.00 0.00 H new ATOM 717 N GLU A 111 7.640 -1.630 6.982 1.00 0.00 N ATOM 718 CA GLU A 111 8.334 -0.541 7.660 1.00 0.00 C ATOM 719 C GLU A 111 7.394 0.637 7.900 1.00 0.00 C ATOM 720 O GLU A 111 6.383 0.787 7.214 1.00 0.00 O ATOM 721 CB GLU A 111 9.541 -0.086 6.837 1.00 0.00 C ATOM 722 CG GLU A 111 10.500 0.807 7.607 1.00 0.00 C ATOM 723 CD GLU A 111 11.838 0.962 6.911 1.00 0.00 C ATOM 724 OE1 GLU A 111 12.689 0.058 7.051 1.00 0.00 O ATOM 725 OE2 GLU A 111 12.035 1.988 6.226 1.00 0.00 O ATOM 0 H GLU A 111 7.707 -1.605 5.965 1.00 0.00 H new ATOM 0 HA GLU A 111 8.680 -0.910 8.626 1.00 0.00 H new ATOM 0 HB2 GLU A 111 10.081 -0.964 6.483 1.00 0.00 H new ATOM 0 HB3 GLU A 111 9.188 0.449 5.955 1.00 0.00 H new ATOM 0 HG2 GLU A 111 10.048 1.790 7.740 1.00 0.00 H new ATOM 0 HG3 GLU A 111 10.658 0.391 8.602 1.00 0.00 H new ATOM 732 N GLN A 112 7.736 1.469 8.878 1.00 0.00 N ATOM 733 CA GLN A 112 6.922 2.633 9.210 1.00 0.00 C ATOM 734 C GLN A 112 7.483 3.892 8.558 1.00 0.00 C ATOM 735 O GLN A 112 8.669 3.962 8.236 1.00 0.00 O ATOM 736 CB GLN A 112 6.853 2.817 10.727 1.00 0.00 C ATOM 737 CG GLN A 112 5.655 3.633 11.186 1.00 0.00 C ATOM 738 CD GLN A 112 5.921 5.125 11.159 1.00 0.00 C ATOM 739 OE1 GLN A 112 7.071 5.563 11.123 1.00 0.00 O ATOM 740 NE2 GLN A 112 4.854 5.917 11.175 1.00 0.00 N ATOM 0 H GLN A 112 8.570 1.359 9.454 1.00 0.00 H new ATOM 0 HA GLN A 112 5.916 2.464 8.826 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.818 1.837 11.203 1.00 0.00 H new ATOM 0 HB3 GLN A 112 7.766 3.304 11.068 1.00 0.00 H new ATOM 0 HG2 GLN A 112 4.801 3.408 10.547 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.383 3.334 12.198 1.00 0.00 H new ATOM 0 HE21 GLN A 112 3.918 5.512 11.205 1.00 0.00 H new ATOM 0 HE22 GLN A 112 4.971 6.930 11.157 1.00 0.00 H new ATOM 749 N VAL A 113 6.621 4.886 8.365 1.00 0.00 N ATOM 750 CA VAL A 113 7.031 6.144 7.751 1.00 0.00 C ATOM 751 C VAL A 113 6.122 7.289 8.186 1.00 0.00 C ATOM 752 O VAL A 113 5.002 7.066 8.643 1.00 0.00 O ATOM 753 CB VAL A 113 7.018 6.049 6.214 1.00 0.00 C ATOM 754 CG1 VAL A 113 7.763 7.224 5.600 1.00 0.00 C ATOM 755 CG2 VAL A 113 7.619 4.729 5.757 1.00 0.00 C ATOM 0 H VAL A 113 5.635 4.845 8.625 1.00 0.00 H new ATOM 0 HA VAL A 113 8.049 6.343 8.087 1.00 0.00 H new ATOM 0 HB VAL A 113 5.983 6.088 5.874 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.743 7.140 4.513 1.00 0.00 H new ATOM 0 HG12 VAL A 113 7.284 8.156 5.900 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.797 7.220 5.945 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.602 4.679 4.668 1.00 0.00 H new ATOM 0 HG22 VAL A 113 8.649 4.657 6.107 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.038 3.903 6.167 1.00 0.00 H new ATOM 765 N ASN A 114 6.614 8.515 8.041 1.00 0.00 N ATOM 766 CA ASN A 114 5.846 9.696 8.419 1.00 0.00 C ATOM 767 C ASN A 114 5.847 10.728 7.296 1.00 0.00 C ATOM 768 O ASN A 114 6.904 11.158 6.832 1.00 0.00 O ATOM 769 CB ASN A 114 6.419 10.315 9.696 1.00 0.00 C ATOM 770 CG ASN A 114 5.712 11.599 10.083 1.00 0.00 C ATOM 771 OD1 ASN A 114 4.565 11.830 9.698 1.00 0.00 O ATOM 772 ND2 ASN A 114 6.395 12.443 10.848 1.00 0.00 N ATOM 0 H ASN A 114 7.540 8.717 7.665 1.00 0.00 H new ATOM 0 HA ASN A 114 4.817 9.386 8.603 1.00 0.00 H new ATOM 0 HB2 ASN A 114 6.337 9.598 10.513 1.00 0.00 H new ATOM 0 HB3 ASN A 114 7.481 10.517 9.554 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.971 13.324 11.140 1.00 0.00 H new ATOM 0 HD22 ASN A 114 7.343 12.210 11.144 1.00 0.00 H new ATOM 779 N THR A 115 4.654 11.123 6.861 1.00 0.00 N ATOM 780 CA THR A 115 4.516 12.104 5.792 1.00 0.00 C ATOM 781 C THR A 115 4.221 13.490 6.353 1.00 0.00 C ATOM 782 O THR A 115 3.861 14.406 5.613 1.00 0.00 O ATOM 783 CB THR A 115 3.397 11.711 4.810 1.00 0.00 C ATOM 784 OG1 THR A 115 3.472 12.522 3.632 1.00 0.00 O ATOM 785 CG2 THR A 115 2.029 11.870 5.456 1.00 0.00 C ATOM 0 H THR A 115 3.769 10.778 7.233 1.00 0.00 H new ATOM 0 HA THR A 115 5.466 12.126 5.258 1.00 0.00 H new ATOM 0 HB THR A 115 3.533 10.664 4.539 1.00 0.00 H new ATOM 0 HG1 THR A 115 3.534 13.466 3.888 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.255 11.587 4.743 1.00 0.00 H new ATOM 0 HG22 THR A 115 1.965 11.229 6.335 1.00 0.00 H new ATOM 0 HG23 THR A 115 1.886 12.909 5.753 1.00 0.00 H new ATOM 793 N ASP A 116 4.376 13.639 7.664 1.00 0.00 N ATOM 794 CA ASP A 116 4.128 14.915 8.324 1.00 0.00 C ATOM 795 C ASP A 116 2.653 15.296 8.232 1.00 0.00 C ATOM 796 O ASP A 116 2.314 16.426 7.881 1.00 0.00 O ATOM 797 CB ASP A 116 4.990 16.013 7.699 1.00 0.00 C ATOM 798 CG ASP A 116 4.922 17.314 8.474 1.00 0.00 C ATOM 799 OD1 ASP A 116 5.379 17.338 9.635 1.00 0.00 O ATOM 800 OD2 ASP A 116 4.410 18.309 7.919 1.00 0.00 O ATOM 0 H ASP A 116 4.673 12.891 8.291 1.00 0.00 H new ATOM 0 HA ASP A 116 4.394 14.810 9.376 1.00 0.00 H new ATOM 0 HB2 ASP A 116 6.025 15.675 7.652 1.00 0.00 H new ATOM 0 HB3 ASP A 116 4.664 16.187 6.673 1.00 0.00 H new ATOM 805 N SER A 117 1.781 14.345 8.550 1.00 0.00 N ATOM 806 CA SER A 117 0.342 14.579 8.499 1.00 0.00 C ATOM 807 C SER A 117 -0.386 13.709 9.518 1.00 0.00 C ATOM 808 O SER A 117 0.108 12.653 9.914 1.00 0.00 O ATOM 809 CB SER A 117 -0.193 14.294 7.094 1.00 0.00 C ATOM 810 OG SER A 117 0.378 15.176 6.143 1.00 0.00 O ATOM 0 H SER A 117 2.045 13.405 8.846 1.00 0.00 H new ATOM 0 HA SER A 117 0.160 15.625 8.744 1.00 0.00 H new ATOM 0 HB2 SER A 117 0.030 13.263 6.819 1.00 0.00 H new ATOM 0 HB3 SER A 117 -1.278 14.398 7.086 1.00 0.00 H new ATOM 0 HG SER A 117 0.022 14.973 5.253 1.00 0.00 H new ATOM 816 N GLU A 118 -1.563 14.161 9.939 1.00 0.00 N ATOM 817 CA GLU A 118 -2.360 13.424 10.914 1.00 0.00 C ATOM 818 C GLU A 118 -2.367 11.932 10.594 1.00 0.00 C ATOM 819 O GLU A 118 -1.897 11.113 11.385 1.00 0.00 O ATOM 820 CB GLU A 118 -3.793 13.958 10.941 1.00 0.00 C ATOM 821 CG GLU A 118 -3.911 15.356 11.523 1.00 0.00 C ATOM 822 CD GLU A 118 -3.422 16.428 10.568 1.00 0.00 C ATOM 823 OE1 GLU A 118 -2.191 16.607 10.459 1.00 0.00 O ATOM 824 OE2 GLU A 118 -4.270 17.088 9.931 1.00 0.00 O ATOM 0 H GLU A 118 -1.986 15.033 9.621 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.909 13.565 11.896 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -4.189 13.962 9.926 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -4.414 13.278 11.523 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.952 15.552 11.781 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.338 15.410 12.448 1.00 0.00 H new ATOM 831 N THR A 119 -2.904 11.585 9.429 1.00 0.00 N ATOM 832 CA THR A 119 -2.974 10.192 9.004 1.00 0.00 C ATOM 833 C THR A 119 -1.629 9.496 9.177 1.00 0.00 C ATOM 834 O THR A 119 -0.587 10.147 9.245 1.00 0.00 O ATOM 835 CB THR A 119 -3.414 10.075 7.533 1.00 0.00 C ATOM 836 OG1 THR A 119 -2.507 10.795 6.691 1.00 0.00 O ATOM 837 CG2 THR A 119 -4.824 10.615 7.345 1.00 0.00 C ATOM 0 H THR A 119 -3.297 12.249 8.762 1.00 0.00 H new ATOM 0 HA THR A 119 -3.716 9.705 9.637 1.00 0.00 H new ATOM 0 HB THR A 119 -3.406 9.020 7.258 1.00 0.00 H new ATOM 0 HG1 THR A 119 -2.793 10.714 5.757 1.00 0.00 H new ATOM 0 HG21 THR A 119 -5.113 10.522 6.298 1.00 0.00 H new ATOM 0 HG22 THR A 119 -5.517 10.046 7.965 1.00 0.00 H new ATOM 0 HG23 THR A 119 -4.854 11.665 7.637 1.00 0.00 H new ATOM 845 N ALA A 120 -1.660 8.169 9.247 1.00 0.00 N ATOM 846 CA ALA A 120 -0.442 7.384 9.410 1.00 0.00 C ATOM 847 C ALA A 120 0.149 7.003 8.057 1.00 0.00 C ATOM 848 O ALA A 120 -0.540 7.028 7.037 1.00 0.00 O ATOM 849 CB ALA A 120 -0.724 6.138 10.236 1.00 0.00 C ATOM 0 H ALA A 120 -2.515 7.615 9.193 1.00 0.00 H new ATOM 0 HA ALA A 120 0.289 7.997 9.937 1.00 0.00 H new ATOM 0 HB1 ALA A 120 0.194 5.561 10.350 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -1.094 6.429 11.219 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.475 5.529 9.732 1.00 0.00 H new ATOM 855 N VAL A 121 1.431 6.650 8.055 1.00 0.00 N ATOM 856 CA VAL A 121 2.116 6.263 6.828 1.00 0.00 C ATOM 857 C VAL A 121 3.042 5.076 7.066 1.00 0.00 C ATOM 858 O VAL A 121 3.717 4.997 8.093 1.00 0.00 O ATOM 859 CB VAL A 121 2.935 7.432 6.249 1.00 0.00 C ATOM 860 CG1 VAL A 121 3.511 7.060 4.891 1.00 0.00 C ATOM 861 CG2 VAL A 121 2.078 8.685 6.150 1.00 0.00 C ATOM 0 H VAL A 121 2.016 6.624 8.890 1.00 0.00 H new ATOM 0 HA VAL A 121 1.345 5.980 6.111 1.00 0.00 H new ATOM 0 HB VAL A 121 3.765 7.640 6.923 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.086 7.898 4.498 1.00 0.00 H new ATOM 0 HG12 VAL A 121 4.161 6.192 4.997 1.00 0.00 H new ATOM 0 HG13 VAL A 121 2.699 6.823 4.204 1.00 0.00 H new ATOM 0 HG21 VAL A 121 2.673 9.501 5.739 1.00 0.00 H new ATOM 0 HG22 VAL A 121 1.226 8.493 5.498 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.720 8.961 7.142 1.00 0.00 H new ATOM 871 N VAL A 122 3.071 4.153 6.110 1.00 0.00 N ATOM 872 CA VAL A 122 3.916 2.970 6.214 1.00 0.00 C ATOM 873 C VAL A 122 4.337 2.471 4.836 1.00 0.00 C ATOM 874 O VAL A 122 3.699 2.782 3.831 1.00 0.00 O ATOM 875 CB VAL A 122 3.197 1.831 6.962 1.00 0.00 C ATOM 876 CG1 VAL A 122 2.758 2.293 8.343 1.00 0.00 C ATOM 877 CG2 VAL A 122 2.009 1.331 6.155 1.00 0.00 C ATOM 0 H VAL A 122 2.518 4.202 5.254 1.00 0.00 H new ATOM 0 HA VAL A 122 4.802 3.263 6.777 1.00 0.00 H new ATOM 0 HB VAL A 122 3.896 1.004 7.087 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.252 1.475 8.856 1.00 0.00 H new ATOM 0 HG12 VAL A 122 3.631 2.598 8.919 1.00 0.00 H new ATOM 0 HG13 VAL A 122 2.075 3.137 8.244 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.513 0.527 6.698 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.306 2.149 5.997 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.355 0.958 5.191 1.00 0.00 H new ATOM 887 N ASN A 123 5.415 1.695 4.798 1.00 0.00 N ATOM 888 CA ASN A 123 5.922 1.153 3.542 1.00 0.00 C ATOM 889 C ASN A 123 5.801 -0.367 3.518 1.00 0.00 C ATOM 890 O ASN A 123 6.328 -1.057 4.392 1.00 0.00 O ATOM 891 CB ASN A 123 7.382 1.563 3.338 1.00 0.00 C ATOM 892 CG ASN A 123 7.526 3.030 2.981 1.00 0.00 C ATOM 893 OD1 ASN A 123 6.551 3.692 2.624 1.00 0.00 O ATOM 894 ND2 ASN A 123 8.746 3.546 3.077 1.00 0.00 N ATOM 0 H ASN A 123 5.954 1.427 5.621 1.00 0.00 H new ATOM 0 HA ASN A 123 5.320 1.561 2.730 1.00 0.00 H new ATOM 0 HB2 ASN A 123 7.945 1.356 4.248 1.00 0.00 H new ATOM 0 HB3 ASN A 123 7.820 0.955 2.547 1.00 0.00 H new ATOM 0 HD21 ASN A 123 8.904 4.528 2.851 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.525 2.960 3.377 1.00 0.00 H new ATOM 901 N VAL A 124 5.105 -0.884 2.511 1.00 0.00 N ATOM 902 CA VAL A 124 4.916 -2.323 2.372 1.00 0.00 C ATOM 903 C VAL A 124 5.914 -2.915 1.383 1.00 0.00 C ATOM 904 O VAL A 124 6.022 -2.459 0.244 1.00 0.00 O ATOM 905 CB VAL A 124 3.487 -2.659 1.905 1.00 0.00 C ATOM 906 CG1 VAL A 124 3.305 -4.164 1.781 1.00 0.00 C ATOM 907 CG2 VAL A 124 2.462 -2.068 2.861 1.00 0.00 C ATOM 0 H VAL A 124 4.663 -0.328 1.779 1.00 0.00 H new ATOM 0 HA VAL A 124 5.081 -2.761 3.357 1.00 0.00 H new ATOM 0 HB VAL A 124 3.332 -2.216 0.921 1.00 0.00 H new ATOM 0 HG11 VAL A 124 2.290 -4.382 1.450 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.016 -4.558 1.054 1.00 0.00 H new ATOM 0 HG13 VAL A 124 3.479 -4.633 2.750 1.00 0.00 H new ATOM 0 HG21 VAL A 124 1.458 -2.315 2.516 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.615 -2.480 3.858 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.578 -0.985 2.895 1.00 0.00 H new ATOM 917 N THR A 125 6.642 -3.936 1.825 1.00 0.00 N ATOM 918 CA THR A 125 7.632 -4.591 0.979 1.00 0.00 C ATOM 919 C THR A 125 7.279 -6.056 0.752 1.00 0.00 C ATOM 920 O THR A 125 7.580 -6.913 1.582 1.00 0.00 O ATOM 921 CB THR A 125 9.042 -4.504 1.594 1.00 0.00 C ATOM 922 OG1 THR A 125 9.265 -3.193 2.126 1.00 0.00 O ATOM 923 CG2 THR A 125 10.106 -4.823 0.556 1.00 0.00 C ATOM 0 H THR A 125 6.564 -4.327 2.764 1.00 0.00 H new ATOM 0 HA THR A 125 7.627 -4.067 0.023 1.00 0.00 H new ATOM 0 HB THR A 125 9.109 -5.238 2.397 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.163 -3.147 2.516 1.00 0.00 H new ATOM 0 HG21 THR A 125 11.093 -4.755 1.014 1.00 0.00 H new ATOM 0 HG22 THR A 125 9.951 -5.832 0.175 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.038 -4.110 -0.266 1.00 0.00 H new ATOM 931 N TYR A 126 6.638 -6.336 -0.378 1.00 0.00 N ATOM 932 CA TYR A 126 6.242 -7.699 -0.713 1.00 0.00 C ATOM 933 C TYR A 126 7.404 -8.467 -1.335 1.00 0.00 C ATOM 934 O TYR A 126 8.394 -7.876 -1.767 1.00 0.00 O ATOM 935 CB TYR A 126 5.053 -7.684 -1.675 1.00 0.00 C ATOM 936 CG TYR A 126 3.748 -7.295 -1.019 1.00 0.00 C ATOM 937 CD1 TYR A 126 3.165 -8.104 -0.052 1.00 0.00 C ATOM 938 CD2 TYR A 126 3.097 -6.117 -1.366 1.00 0.00 C ATOM 939 CE1 TYR A 126 1.972 -7.752 0.550 1.00 0.00 C ATOM 940 CE2 TYR A 126 1.905 -5.757 -0.769 1.00 0.00 C ATOM 941 CZ TYR A 126 1.346 -6.578 0.188 1.00 0.00 C ATOM 942 OH TYR A 126 0.158 -6.223 0.786 1.00 0.00 O ATOM 0 H TYR A 126 6.382 -5.638 -1.076 1.00 0.00 H new ATOM 0 HA TYR A 126 5.950 -8.203 0.209 1.00 0.00 H new ATOM 0 HB2 TYR A 126 5.263 -6.989 -2.488 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.945 -8.673 -2.121 1.00 0.00 H new ATOM 0 HD1 TYR A 126 3.653 -9.024 0.234 1.00 0.00 H new ATOM 0 HD2 TYR A 126 3.531 -5.472 -2.116 1.00 0.00 H new ATOM 0 HE1 TYR A 126 1.532 -8.393 1.300 1.00 0.00 H new ATOM 0 HE2 TYR A 126 1.413 -4.837 -1.050 1.00 0.00 H new ATOM 0 HH TYR A 126 -0.267 -7.019 1.167 1.00 0.00 H new ATOM 952 N SER A 127 7.276 -9.789 -1.376 1.00 0.00 N ATOM 953 CA SER A 127 8.316 -10.641 -1.942 1.00 0.00 C ATOM 954 C SER A 127 8.204 -10.699 -3.462 1.00 0.00 C ATOM 955 O SER A 127 9.199 -10.567 -4.175 1.00 0.00 O ATOM 956 CB SER A 127 8.223 -12.052 -1.358 1.00 0.00 C ATOM 957 OG SER A 127 9.243 -12.887 -1.878 1.00 0.00 O ATOM 0 H SER A 127 6.463 -10.294 -1.024 1.00 0.00 H new ATOM 0 HA SER A 127 9.284 -10.211 -1.683 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.305 -12.006 -0.272 1.00 0.00 H new ATOM 0 HB3 SER A 127 7.247 -12.480 -1.586 1.00 0.00 H new ATOM 0 HG SER A 127 9.163 -13.783 -1.488 1.00 0.00 H new ATOM 963 N SER A 128 6.984 -10.897 -3.952 1.00 0.00 N ATOM 964 CA SER A 128 6.741 -10.976 -5.388 1.00 0.00 C ATOM 965 C SER A 128 6.244 -9.639 -5.929 1.00 0.00 C ATOM 966 O SER A 128 5.901 -8.735 -5.166 1.00 0.00 O ATOM 967 CB SER A 128 5.720 -12.074 -5.693 1.00 0.00 C ATOM 968 OG SER A 128 5.855 -12.540 -7.025 1.00 0.00 O ATOM 0 H SER A 128 6.149 -11.006 -3.376 1.00 0.00 H new ATOM 0 HA SER A 128 7.683 -11.219 -5.879 1.00 0.00 H new ATOM 0 HB2 SER A 128 5.855 -12.903 -4.999 1.00 0.00 H new ATOM 0 HB3 SER A 128 4.711 -11.690 -5.539 1.00 0.00 H new ATOM 0 HG SER A 128 5.054 -12.303 -7.537 1.00 0.00 H new ATOM 974 N LYS A 129 6.208 -9.520 -7.252 1.00 0.00 N ATOM 975 CA LYS A 129 5.752 -8.295 -7.899 1.00 0.00 C ATOM 976 C LYS A 129 4.230 -8.260 -7.987 1.00 0.00 C ATOM 977 O LYS A 129 3.596 -7.298 -7.554 1.00 0.00 O ATOM 978 CB LYS A 129 6.358 -8.178 -9.299 1.00 0.00 C ATOM 979 CG LYS A 129 6.600 -6.745 -9.739 1.00 0.00 C ATOM 980 CD LYS A 129 5.294 -6.016 -10.008 1.00 0.00 C ATOM 981 CE LYS A 129 4.771 -6.306 -11.406 1.00 0.00 C ATOM 982 NZ LYS A 129 3.902 -7.515 -11.434 1.00 0.00 N ATOM 0 H LYS A 129 6.489 -10.258 -7.898 1.00 0.00 H new ATOM 0 HA LYS A 129 6.082 -7.450 -7.295 1.00 0.00 H new ATOM 0 HB2 LYS A 129 7.303 -8.721 -9.323 1.00 0.00 H new ATOM 0 HB3 LYS A 129 5.694 -8.662 -10.015 1.00 0.00 H new ATOM 0 HG2 LYS A 129 7.161 -6.216 -8.968 1.00 0.00 H new ATOM 0 HG3 LYS A 129 7.213 -6.739 -10.640 1.00 0.00 H new ATOM 0 HD2 LYS A 129 4.550 -6.317 -9.270 1.00 0.00 H new ATOM 0 HD3 LYS A 129 5.444 -4.943 -9.890 1.00 0.00 H new ATOM 0 HE2 LYS A 129 4.208 -5.446 -11.769 1.00 0.00 H new ATOM 0 HE3 LYS A 129 5.611 -6.447 -12.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 3.140 -7.379 -12.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 4.470 -8.344 -11.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 3.489 -7.667 -10.492 1.00 0.00 H new ATOM 996 N ASP A 130 3.650 -9.316 -8.548 1.00 0.00 N ATOM 997 CA ASP A 130 2.202 -9.407 -8.691 1.00 0.00 C ATOM 998 C ASP A 130 1.508 -9.159 -7.355 1.00 0.00 C ATOM 999 O ASP A 130 0.552 -8.388 -7.276 1.00 0.00 O ATOM 1000 CB ASP A 130 1.807 -10.779 -9.238 1.00 0.00 C ATOM 1001 CG ASP A 130 2.674 -11.894 -8.687 1.00 0.00 C ATOM 1002 OD1 ASP A 130 3.762 -12.133 -9.251 1.00 0.00 O ATOM 1003 OD2 ASP A 130 2.264 -12.527 -7.692 1.00 0.00 O ATOM 0 H ASP A 130 4.161 -10.121 -8.911 1.00 0.00 H new ATOM 0 HA ASP A 130 1.882 -8.639 -9.395 1.00 0.00 H new ATOM 0 HB2 ASP A 130 0.764 -10.978 -8.992 1.00 0.00 H new ATOM 0 HB3 ASP A 130 1.881 -10.768 -10.325 1.00 0.00 H new ATOM 1008 N GLN A 131 1.995 -9.819 -6.310 1.00 0.00 N ATOM 1009 CA GLN A 131 1.420 -9.672 -4.978 1.00 0.00 C ATOM 1010 C GLN A 131 1.247 -8.200 -4.620 1.00 0.00 C ATOM 1011 O GLN A 131 0.259 -7.815 -3.995 1.00 0.00 O ATOM 1012 CB GLN A 131 2.304 -10.361 -3.938 1.00 0.00 C ATOM 1013 CG GLN A 131 2.099 -11.866 -3.866 1.00 0.00 C ATOM 1014 CD GLN A 131 3.329 -12.599 -3.368 1.00 0.00 C ATOM 1015 OE1 GLN A 131 3.507 -13.788 -3.634 1.00 0.00 O ATOM 1016 NE2 GLN A 131 4.185 -11.893 -2.639 1.00 0.00 N ATOM 0 H GLN A 131 2.786 -10.461 -6.359 1.00 0.00 H new ATOM 0 HA GLN A 131 0.438 -10.145 -4.980 1.00 0.00 H new ATOM 0 HB2 GLN A 131 3.349 -10.156 -4.169 1.00 0.00 H new ATOM 0 HB3 GLN A 131 2.103 -9.928 -2.958 1.00 0.00 H new ATOM 0 HG2 GLN A 131 1.259 -12.083 -3.206 1.00 0.00 H new ATOM 0 HG3 GLN A 131 1.833 -12.240 -4.854 1.00 0.00 H new ATOM 0 HE21 GLN A 131 3.998 -10.910 -2.443 1.00 0.00 H new ATOM 0 HE22 GLN A 131 5.030 -12.334 -2.275 1.00 0.00 H new ATOM 1025 N ALA A 132 2.214 -7.381 -5.020 1.00 0.00 N ATOM 1026 CA ALA A 132 2.167 -5.951 -4.743 1.00 0.00 C ATOM 1027 C ALA A 132 1.148 -5.251 -5.636 1.00 0.00 C ATOM 1028 O ALA A 132 0.418 -4.368 -5.186 1.00 0.00 O ATOM 1029 CB ALA A 132 3.545 -5.332 -4.926 1.00 0.00 C ATOM 0 H ALA A 132 3.040 -7.684 -5.537 1.00 0.00 H new ATOM 0 HA ALA A 132 1.855 -5.818 -3.707 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.495 -4.264 -4.716 1.00 0.00 H new ATOM 0 HB2 ALA A 132 4.250 -5.804 -4.241 1.00 0.00 H new ATOM 0 HB3 ALA A 132 3.879 -5.485 -5.952 1.00 0.00 H new ATOM 1035 N ARG A 133 1.106 -5.651 -6.902 1.00 0.00 N ATOM 1036 CA ARG A 133 0.177 -5.060 -7.859 1.00 0.00 C ATOM 1037 C ARG A 133 -1.229 -4.979 -7.273 1.00 0.00 C ATOM 1038 O ARG A 133 -1.866 -3.927 -7.308 1.00 0.00 O ATOM 1039 CB ARG A 133 0.156 -5.877 -9.152 1.00 0.00 C ATOM 1040 CG ARG A 133 -0.725 -5.278 -10.237 1.00 0.00 C ATOM 1041 CD ARG A 133 -0.584 -6.034 -11.549 1.00 0.00 C ATOM 1042 NE ARG A 133 -1.701 -5.772 -12.453 1.00 0.00 N ATOM 1043 CZ ARG A 133 -2.909 -6.304 -12.302 1.00 0.00 C ATOM 1044 NH1 ARG A 133 -3.155 -7.122 -11.288 1.00 0.00 N ATOM 1045 NH2 ARG A 133 -3.874 -6.018 -13.167 1.00 0.00 N ATOM 0 H ARG A 133 1.704 -6.381 -7.289 1.00 0.00 H new ATOM 0 HA ARG A 133 0.518 -4.049 -8.081 1.00 0.00 H new ATOM 0 HB2 ARG A 133 1.174 -5.968 -9.531 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -0.192 -6.886 -8.929 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -1.766 -5.298 -9.914 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.458 -4.232 -10.388 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.350 -5.748 -12.034 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -0.524 -7.103 -11.347 1.00 0.00 H new ATOM 0 HE ARG A 133 -1.545 -5.146 -13.243 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -2.416 -7.344 -10.621 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -4.083 -7.529 -11.175 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -3.689 -5.389 -13.949 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -4.801 -6.427 -13.050 1.00 0.00 H new ATOM 1059 N GLN A 134 -1.706 -6.097 -6.736 1.00 0.00 N ATOM 1060 CA GLN A 134 -3.037 -6.152 -6.143 1.00 0.00 C ATOM 1061 C GLN A 134 -3.132 -5.233 -4.930 1.00 0.00 C ATOM 1062 O GLN A 134 -3.912 -4.281 -4.920 1.00 0.00 O ATOM 1063 CB GLN A 134 -3.379 -7.587 -5.738 1.00 0.00 C ATOM 1064 CG GLN A 134 -4.865 -7.901 -5.806 1.00 0.00 C ATOM 1065 CD GLN A 134 -5.635 -7.341 -4.626 1.00 0.00 C ATOM 1066 OE1 GLN A 134 -5.289 -6.290 -4.087 1.00 0.00 O ATOM 1067 NE2 GLN A 134 -6.686 -8.042 -4.219 1.00 0.00 N ATOM 0 H GLN A 134 -1.191 -6.977 -6.699 1.00 0.00 H new ATOM 0 HA GLN A 134 -3.754 -5.812 -6.890 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -2.840 -8.277 -6.387 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -3.025 -7.763 -4.722 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -5.276 -7.494 -6.730 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.003 -8.982 -5.845 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -6.937 -8.908 -4.695 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -7.243 -7.714 -3.430 1.00 0.00 H new ATOM 1076 N ALA A 135 -2.333 -5.524 -3.909 1.00 0.00 N ATOM 1077 CA ALA A 135 -2.325 -4.722 -2.692 1.00 0.00 C ATOM 1078 C ALA A 135 -2.590 -3.252 -3.001 1.00 0.00 C ATOM 1079 O ALA A 135 -3.432 -2.616 -2.366 1.00 0.00 O ATOM 1080 CB ALA A 135 -0.998 -4.880 -1.964 1.00 0.00 C ATOM 0 H ALA A 135 -1.683 -6.310 -3.901 1.00 0.00 H new ATOM 0 HA ALA A 135 -3.126 -5.080 -2.045 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -1.006 -4.275 -1.057 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.850 -5.927 -1.701 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -0.186 -4.551 -2.612 1.00 0.00 H new ATOM 1086 N LEU A 136 -1.866 -2.719 -3.979 1.00 0.00 N ATOM 1087 CA LEU A 136 -2.023 -1.323 -4.372 1.00 0.00 C ATOM 1088 C LEU A 136 -3.304 -1.123 -5.175 1.00 0.00 C ATOM 1089 O LEU A 136 -4.122 -0.261 -4.853 1.00 0.00 O ATOM 1090 CB LEU A 136 -0.816 -0.866 -5.194 1.00 0.00 C ATOM 1091 CG LEU A 136 -0.974 0.462 -5.936 1.00 0.00 C ATOM 1092 CD1 LEU A 136 0.387 1.038 -6.294 1.00 0.00 C ATOM 1093 CD2 LEU A 136 -1.821 0.276 -7.187 1.00 0.00 C ATOM 0 H LEU A 136 -1.165 -3.232 -4.514 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.087 -0.721 -3.465 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.043 -0.787 -4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.584 -1.642 -5.924 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.483 1.166 -5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.255 1.983 -6.821 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.961 1.208 -5.383 1.00 0.00 H new ATOM 0 HD13 LEU A 136 0.922 0.337 -6.934 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -1.923 1.231 -7.703 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -1.339 -0.444 -7.849 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.808 -0.092 -6.907 1.00 0.00 H new ATOM 1105 N ASP A 137 -3.473 -1.927 -6.219 1.00 0.00 N ATOM 1106 CA ASP A 137 -4.657 -1.841 -7.066 1.00 0.00 C ATOM 1107 C ASP A 137 -5.925 -1.758 -6.221 1.00 0.00 C ATOM 1108 O ASP A 137 -6.934 -1.198 -6.650 1.00 0.00 O ATOM 1109 CB ASP A 137 -4.730 -3.050 -8.000 1.00 0.00 C ATOM 1110 CG ASP A 137 -3.972 -2.828 -9.294 1.00 0.00 C ATOM 1111 OD1 ASP A 137 -3.960 -1.680 -9.785 1.00 0.00 O ATOM 1112 OD2 ASP A 137 -3.391 -3.803 -9.816 1.00 0.00 O ATOM 0 H ASP A 137 -2.805 -2.645 -6.499 1.00 0.00 H new ATOM 0 HA ASP A 137 -4.581 -0.933 -7.664 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -4.325 -3.924 -7.490 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -5.774 -3.268 -8.226 1.00 0.00 H new ATOM 1117 N LYS A 138 -5.866 -2.320 -5.019 1.00 0.00 N ATOM 1118 CA LYS A 138 -7.009 -2.310 -4.113 1.00 0.00 C ATOM 1119 C LYS A 138 -6.841 -1.241 -3.038 1.00 0.00 C ATOM 1120 O LYS A 138 -7.662 -0.330 -2.920 1.00 0.00 O ATOM 1121 CB LYS A 138 -7.179 -3.683 -3.459 1.00 0.00 C ATOM 1122 CG LYS A 138 -7.511 -4.790 -4.446 1.00 0.00 C ATOM 1123 CD LYS A 138 -8.926 -4.654 -4.981 1.00 0.00 C ATOM 1124 CE LYS A 138 -9.932 -5.352 -4.078 1.00 0.00 C ATOM 1125 NZ LYS A 138 -10.384 -4.470 -2.966 1.00 0.00 N ATOM 0 H LYS A 138 -5.039 -2.788 -4.649 1.00 0.00 H new ATOM 0 HA LYS A 138 -7.901 -2.078 -4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.261 -3.941 -2.932 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.970 -3.625 -2.712 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -6.804 -4.764 -5.275 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -7.396 -5.759 -3.960 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -9.184 -3.598 -5.067 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -8.980 -5.078 -5.984 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -10.794 -5.664 -4.668 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -9.484 -6.256 -3.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -11.410 -4.576 -2.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -9.893 -4.737 -2.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -10.165 -3.480 -3.197 1.00 0.00 H new ATOM 1139 N LEU A 139 -5.773 -1.357 -2.256 1.00 0.00 N ATOM 1140 CA LEU A 139 -5.497 -0.399 -1.191 1.00 0.00 C ATOM 1141 C LEU A 139 -5.612 1.033 -1.703 1.00 0.00 C ATOM 1142 O LEU A 139 -6.241 1.880 -1.071 1.00 0.00 O ATOM 1143 CB LEU A 139 -4.100 -0.636 -0.615 1.00 0.00 C ATOM 1144 CG LEU A 139 -3.903 -1.945 0.152 1.00 0.00 C ATOM 1145 CD1 LEU A 139 -2.424 -2.280 0.265 1.00 0.00 C ATOM 1146 CD2 LEU A 139 -4.538 -1.855 1.532 1.00 0.00 C ATOM 0 H LEU A 139 -5.084 -2.105 -2.339 1.00 0.00 H new ATOM 0 HA LEU A 139 -6.237 -0.544 -0.404 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -3.381 -0.606 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -3.858 0.192 0.051 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.395 -2.745 -0.401 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -2.303 -3.214 0.814 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -1.998 -2.387 -0.733 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.909 -1.479 0.795 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -4.388 -2.795 2.063 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -4.075 -1.043 2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.606 -1.663 1.429 1.00 0.00 H new ATOM 1158 N ASN A 140 -5.001 1.295 -2.854 1.00 0.00 N ATOM 1159 CA ASN A 140 -5.036 2.624 -3.453 1.00 0.00 C ATOM 1160 C ASN A 140 -6.438 3.221 -3.372 1.00 0.00 C ATOM 1161 O ASN A 140 -6.609 4.438 -3.416 1.00 0.00 O ATOM 1162 CB ASN A 140 -4.580 2.561 -4.912 1.00 0.00 C ATOM 1163 CG ASN A 140 -4.747 3.888 -5.628 1.00 0.00 C ATOM 1164 OD1 ASN A 140 -5.829 4.208 -6.120 1.00 0.00 O ATOM 1165 ND2 ASN A 140 -3.673 4.667 -5.689 1.00 0.00 N ATOM 0 H ASN A 140 -4.476 0.604 -3.390 1.00 0.00 H new ATOM 0 HA ASN A 140 -4.355 3.265 -2.894 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -3.533 2.260 -4.950 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -5.151 1.794 -5.436 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -3.725 5.571 -6.158 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -2.796 4.361 -5.267 1.00 0.00 H new ATOM 1172 N GLY A 141 -7.438 2.353 -3.251 1.00 0.00 N ATOM 1173 CA GLY A 141 -8.812 2.813 -3.164 1.00 0.00 C ATOM 1174 C GLY A 141 -9.549 2.217 -1.981 1.00 0.00 C ATOM 1175 O GLY A 141 -10.709 2.547 -1.733 1.00 0.00 O ATOM 0 H GLY A 141 -7.321 1.340 -3.212 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.824 3.900 -3.085 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.337 2.554 -4.083 1.00 0.00 H new ATOM 1179 N PHE A 142 -8.875 1.337 -1.248 1.00 0.00 N ATOM 1180 CA PHE A 142 -9.475 0.692 -0.086 1.00 0.00 C ATOM 1181 C PHE A 142 -9.844 1.722 0.978 1.00 0.00 C ATOM 1182 O PHE A 142 -8.982 2.210 1.708 1.00 0.00 O ATOM 1183 CB PHE A 142 -8.513 -0.343 0.502 1.00 0.00 C ATOM 1184 CG PHE A 142 -9.131 -1.195 1.573 1.00 0.00 C ATOM 1185 CD1 PHE A 142 -9.567 -0.630 2.761 1.00 0.00 C ATOM 1186 CD2 PHE A 142 -9.276 -2.561 1.392 1.00 0.00 C ATOM 1187 CE1 PHE A 142 -10.135 -1.413 3.748 1.00 0.00 C ATOM 1188 CE2 PHE A 142 -9.844 -3.349 2.376 1.00 0.00 C ATOM 1189 CZ PHE A 142 -10.275 -2.773 3.555 1.00 0.00 C ATOM 0 H PHE A 142 -7.914 1.054 -1.438 1.00 0.00 H new ATOM 0 HA PHE A 142 -10.386 0.189 -0.411 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -8.151 -0.987 -0.299 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.645 0.172 0.914 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -9.462 0.433 2.917 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -8.941 -3.016 0.471 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -10.469 -0.961 4.670 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -9.950 -4.413 2.223 1.00 0.00 H new ATOM 0 HZ PHE A 142 -10.721 -3.385 4.325 1.00 0.00 H new ATOM 1199 N GLN A 143 -11.130 2.046 1.057 1.00 0.00 N ATOM 1200 CA GLN A 143 -11.613 3.019 2.030 1.00 0.00 C ATOM 1201 C GLN A 143 -11.701 2.400 3.421 1.00 0.00 C ATOM 1202 O GLN A 143 -12.535 1.529 3.673 1.00 0.00 O ATOM 1203 CB GLN A 143 -12.983 3.555 1.609 1.00 0.00 C ATOM 1204 CG GLN A 143 -13.257 4.970 2.093 1.00 0.00 C ATOM 1205 CD GLN A 143 -14.692 5.399 1.860 1.00 0.00 C ATOM 1206 OE1 GLN A 143 -15.488 4.656 1.285 1.00 0.00 O ATOM 1207 NE2 GLN A 143 -15.030 6.603 2.306 1.00 0.00 N ATOM 0 H GLN A 143 -11.856 1.650 0.460 1.00 0.00 H new ATOM 0 HA GLN A 143 -10.902 3.845 2.065 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -13.055 3.531 0.522 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -13.758 2.892 1.994 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -13.030 5.036 3.157 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -12.588 5.661 1.581 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -14.338 7.185 2.777 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -15.982 6.946 2.178 1.00 0.00 H new ATOM 1216 N LEU A 144 -10.836 2.854 4.321 1.00 0.00 N ATOM 1217 CA LEU A 144 -10.816 2.344 5.688 1.00 0.00 C ATOM 1218 C LEU A 144 -11.146 3.450 6.686 1.00 0.00 C ATOM 1219 O LEU A 144 -10.494 4.493 6.708 1.00 0.00 O ATOM 1220 CB LEU A 144 -9.446 1.744 6.009 1.00 0.00 C ATOM 1221 CG LEU A 144 -9.403 0.756 7.175 1.00 0.00 C ATOM 1222 CD1 LEU A 144 -8.172 -0.131 7.078 1.00 0.00 C ATOM 1223 CD2 LEU A 144 -9.423 1.499 8.503 1.00 0.00 C ATOM 0 H LEU A 144 -10.139 3.574 4.129 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.575 1.566 5.771 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.075 1.239 5.117 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.756 2.560 6.224 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.288 0.122 7.122 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.158 -0.828 7.916 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -8.199 -0.690 6.142 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.275 0.487 7.106 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.392 0.781 9.322 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.557 2.157 8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.335 2.092 8.575 1.00 0.00 H new ATOM 1235 N GLU A 145 -12.160 3.211 7.511 1.00 0.00 N ATOM 1236 CA GLU A 145 -12.575 4.186 8.513 1.00 0.00 C ATOM 1237 C GLU A 145 -12.815 5.552 7.875 1.00 0.00 C ATOM 1238 O GLU A 145 -12.540 6.588 8.480 1.00 0.00 O ATOM 1239 CB GLU A 145 -11.517 4.303 9.612 1.00 0.00 C ATOM 1240 CG GLU A 145 -11.538 3.151 10.602 1.00 0.00 C ATOM 1241 CD GLU A 145 -11.071 3.561 11.985 1.00 0.00 C ATOM 1242 OE1 GLU A 145 -11.540 4.606 12.483 1.00 0.00 O ATOM 1243 OE2 GLU A 145 -10.237 2.838 12.569 1.00 0.00 O ATOM 0 H GLU A 145 -12.709 2.351 7.506 1.00 0.00 H new ATOM 0 HA GLU A 145 -13.510 3.840 8.954 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -10.531 4.357 9.151 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -11.668 5.238 10.152 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -12.550 2.752 10.668 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -10.902 2.347 10.232 1.00 0.00 H new ATOM 1250 N ASN A 146 -13.329 5.545 6.650 1.00 0.00 N ATOM 1251 CA ASN A 146 -13.605 6.782 5.929 1.00 0.00 C ATOM 1252 C ASN A 146 -12.311 7.441 5.464 1.00 0.00 C ATOM 1253 O ASN A 146 -12.217 8.667 5.389 1.00 0.00 O ATOM 1254 CB ASN A 146 -14.393 7.749 6.817 1.00 0.00 C ATOM 1255 CG ASN A 146 -15.487 7.052 7.601 1.00 0.00 C ATOM 1256 OD1 ASN A 146 -15.213 6.216 8.462 1.00 0.00 O ATOM 1257 ND2 ASN A 146 -16.736 7.394 7.306 1.00 0.00 N ATOM 0 H ASN A 146 -13.563 4.696 6.135 1.00 0.00 H new ATOM 0 HA ASN A 146 -14.202 6.536 5.051 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -13.710 8.240 7.510 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -14.835 8.529 6.197 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -17.514 6.959 7.801 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -16.917 8.092 6.585 1.00 0.00 H new ATOM 1264 N PHE A 147 -11.314 6.620 5.152 1.00 0.00 N ATOM 1265 CA PHE A 147 -10.024 7.122 4.694 1.00 0.00 C ATOM 1266 C PHE A 147 -9.496 6.286 3.532 1.00 0.00 C ATOM 1267 O PHE A 147 -9.034 5.160 3.721 1.00 0.00 O ATOM 1268 CB PHE A 147 -9.013 7.115 5.843 1.00 0.00 C ATOM 1269 CG PHE A 147 -9.088 8.336 6.715 1.00 0.00 C ATOM 1270 CD1 PHE A 147 -8.596 9.552 6.270 1.00 0.00 C ATOM 1271 CD2 PHE A 147 -9.651 8.267 7.979 1.00 0.00 C ATOM 1272 CE1 PHE A 147 -8.664 10.678 7.070 1.00 0.00 C ATOM 1273 CE2 PHE A 147 -9.722 9.389 8.783 1.00 0.00 C ATOM 1274 CZ PHE A 147 -9.227 10.596 8.328 1.00 0.00 C ATOM 0 H PHE A 147 -11.375 5.603 5.208 1.00 0.00 H new ATOM 0 HA PHE A 147 -10.163 8.146 4.348 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -9.178 6.229 6.457 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -8.007 7.034 5.431 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -8.154 9.622 5.287 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -10.039 7.326 8.340 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -8.277 11.620 6.711 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -10.164 9.322 9.766 1.00 0.00 H new ATOM 0 HZ PHE A 147 -9.280 11.474 8.955 1.00 0.00 H new ATOM 1284 N THR A 148 -9.568 6.844 2.328 1.00 0.00 N ATOM 1285 CA THR A 148 -9.100 6.151 1.134 1.00 0.00 C ATOM 1286 C THR A 148 -7.588 5.957 1.169 1.00 0.00 C ATOM 1287 O THR A 148 -6.826 6.893 0.927 1.00 0.00 O ATOM 1288 CB THR A 148 -9.478 6.919 -0.146 1.00 0.00 C ATOM 1289 OG1 THR A 148 -10.873 7.243 -0.129 1.00 0.00 O ATOM 1290 CG2 THR A 148 -9.158 6.096 -1.385 1.00 0.00 C ATOM 0 H THR A 148 -9.946 7.775 2.154 1.00 0.00 H new ATOM 0 HA THR A 148 -9.589 5.177 1.122 1.00 0.00 H new ATOM 0 HB THR A 148 -8.893 7.838 -0.179 1.00 0.00 H new ATOM 0 HG1 THR A 148 -11.105 7.733 -0.946 1.00 0.00 H new ATOM 0 HG21 THR A 148 -9.434 6.659 -2.277 1.00 0.00 H new ATOM 0 HG22 THR A 148 -8.091 5.876 -1.410 1.00 0.00 H new ATOM 0 HG23 THR A 148 -9.720 5.163 -1.357 1.00 0.00 H new ATOM 1298 N LEU A 149 -7.160 4.736 1.470 1.00 0.00 N ATOM 1299 CA LEU A 149 -5.738 4.418 1.536 1.00 0.00 C ATOM 1300 C LEU A 149 -5.048 4.732 0.212 1.00 0.00 C ATOM 1301 O LEU A 149 -5.340 4.119 -0.814 1.00 0.00 O ATOM 1302 CB LEU A 149 -5.540 2.943 1.889 1.00 0.00 C ATOM 1303 CG LEU A 149 -6.207 2.466 3.180 1.00 0.00 C ATOM 1304 CD1 LEU A 149 -6.125 0.952 3.296 1.00 0.00 C ATOM 1305 CD2 LEU A 149 -5.565 3.132 4.388 1.00 0.00 C ATOM 0 H LEU A 149 -7.778 3.950 1.672 1.00 0.00 H new ATOM 0 HA LEU A 149 -5.289 5.035 2.315 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -5.918 2.339 1.064 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -4.470 2.748 1.963 1.00 0.00 H new ATOM 0 HG LEU A 149 -7.259 2.750 3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -6.605 0.631 4.221 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -6.632 0.494 2.447 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -5.080 0.644 3.304 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -6.052 2.781 5.298 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -4.505 2.879 4.423 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -5.678 4.213 4.310 1.00 0.00 H new ATOM 1317 N LYS A 150 -4.129 5.692 0.243 1.00 0.00 N ATOM 1318 CA LYS A 150 -3.394 6.087 -0.952 1.00 0.00 C ATOM 1319 C LYS A 150 -2.111 5.274 -1.095 1.00 0.00 C ATOM 1320 O LYS A 150 -1.186 5.409 -0.293 1.00 0.00 O ATOM 1321 CB LYS A 150 -3.062 7.580 -0.902 1.00 0.00 C ATOM 1322 CG LYS A 150 -4.289 8.475 -0.864 1.00 0.00 C ATOM 1323 CD LYS A 150 -3.930 9.925 -1.140 1.00 0.00 C ATOM 1324 CE LYS A 150 -5.121 10.701 -1.681 1.00 0.00 C ATOM 1325 NZ LYS A 150 -4.697 11.843 -2.538 1.00 0.00 N ATOM 0 H LYS A 150 -3.876 6.211 1.084 1.00 0.00 H new ATOM 0 HA LYS A 150 -4.026 5.891 -1.818 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -2.451 7.778 -0.022 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -2.460 7.839 -1.773 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -5.014 8.132 -1.602 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -4.767 8.397 0.112 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -3.575 10.394 -0.222 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -3.110 9.968 -1.857 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -5.759 10.031 -2.258 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -5.719 11.074 -0.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -5.538 12.346 -2.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -4.109 12.496 -1.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -4.148 11.486 -3.345 1.00 0.00 H new ATOM 1339 N VAL A 151 -2.060 4.432 -2.122 1.00 0.00 N ATOM 1340 CA VAL A 151 -0.889 3.599 -2.371 1.00 0.00 C ATOM 1341 C VAL A 151 -0.201 3.995 -3.673 1.00 0.00 C ATOM 1342 O VAL A 151 -0.857 4.227 -4.688 1.00 0.00 O ATOM 1343 CB VAL A 151 -1.264 2.107 -2.434 1.00 0.00 C ATOM 1344 CG1 VAL A 151 -0.013 1.242 -2.440 1.00 0.00 C ATOM 1345 CG2 VAL A 151 -2.173 1.737 -1.271 1.00 0.00 C ATOM 0 H VAL A 151 -2.816 4.308 -2.795 1.00 0.00 H new ATOM 0 HA VAL A 151 -0.204 3.758 -1.538 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.807 1.925 -3.362 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -0.298 0.191 -2.485 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.597 1.490 -3.309 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.560 1.424 -1.531 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -2.428 0.679 -1.331 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.659 1.933 -0.330 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -3.084 2.333 -1.317 1.00 0.00 H new ATOM 1355 N ALA A 152 1.125 4.068 -3.636 1.00 0.00 N ATOM 1356 CA ALA A 152 1.903 4.433 -4.814 1.00 0.00 C ATOM 1357 C ALA A 152 3.220 3.665 -4.861 1.00 0.00 C ATOM 1358 O ALA A 152 3.830 3.396 -3.826 1.00 0.00 O ATOM 1359 CB ALA A 152 2.163 5.932 -4.831 1.00 0.00 C ATOM 0 H ALA A 152 1.683 3.879 -2.803 1.00 0.00 H new ATOM 0 HA ALA A 152 1.325 4.166 -5.698 1.00 0.00 H new ATOM 0 HB1 ALA A 152 2.745 6.190 -5.716 1.00 0.00 H new ATOM 0 HB2 ALA A 152 1.213 6.466 -4.853 1.00 0.00 H new ATOM 0 HB3 ALA A 152 2.718 6.215 -3.937 1.00 0.00 H new ATOM 1365 N TYR A 153 3.652 3.315 -6.067 1.00 0.00 N ATOM 1366 CA TYR A 153 4.895 2.576 -6.249 1.00 0.00 C ATOM 1367 C TYR A 153 6.102 3.453 -5.932 1.00 0.00 C ATOM 1368 O TYR A 153 6.490 4.307 -6.731 1.00 0.00 O ATOM 1369 CB TYR A 153 4.995 2.049 -7.682 1.00 0.00 C ATOM 1370 CG TYR A 153 4.386 0.678 -7.867 1.00 0.00 C ATOM 1371 CD1 TYR A 153 4.987 -0.451 -7.323 1.00 0.00 C ATOM 1372 CD2 TYR A 153 3.208 0.511 -8.585 1.00 0.00 C ATOM 1373 CE1 TYR A 153 4.434 -1.705 -7.491 1.00 0.00 C ATOM 1374 CE2 TYR A 153 2.647 -0.740 -8.756 1.00 0.00 C ATOM 1375 CZ TYR A 153 3.263 -1.845 -8.207 1.00 0.00 C ATOM 1376 OH TYR A 153 2.709 -3.093 -8.375 1.00 0.00 O ATOM 0 H TYR A 153 3.159 3.531 -6.934 1.00 0.00 H new ATOM 0 HA TYR A 153 4.891 1.733 -5.559 1.00 0.00 H new ATOM 0 HB2 TYR A 153 4.500 2.751 -8.354 1.00 0.00 H new ATOM 0 HB3 TYR A 153 6.044 2.014 -7.975 1.00 0.00 H new ATOM 0 HD1 TYR A 153 5.902 -0.346 -6.759 1.00 0.00 H new ATOM 0 HD2 TYR A 153 2.723 1.374 -9.017 1.00 0.00 H new ATOM 0 HE1 TYR A 153 4.916 -2.572 -7.064 1.00 0.00 H new ATOM 0 HE2 TYR A 153 1.731 -0.852 -9.317 1.00 0.00 H new ATOM 0 HH TYR A 153 2.932 -3.656 -7.605 1.00 0.00 H new ATOM 1386 N ILE A 154 6.693 3.236 -4.762 1.00 0.00 N ATOM 1387 CA ILE A 154 7.857 4.005 -4.340 1.00 0.00 C ATOM 1388 C ILE A 154 8.936 4.005 -5.417 1.00 0.00 C ATOM 1389 O ILE A 154 9.220 2.986 -6.047 1.00 0.00 O ATOM 1390 CB ILE A 154 8.453 3.451 -3.032 1.00 0.00 C ATOM 1391 CG1 ILE A 154 7.396 3.446 -1.926 1.00 0.00 C ATOM 1392 CG2 ILE A 154 9.663 4.272 -2.612 1.00 0.00 C ATOM 1393 CD1 ILE A 154 7.901 2.899 -0.609 1.00 0.00 C ATOM 0 H ILE A 154 6.385 2.534 -4.089 1.00 0.00 H new ATOM 0 HA ILE A 154 7.516 5.026 -4.171 1.00 0.00 H new ATOM 0 HB ILE A 154 8.777 2.424 -3.204 1.00 0.00 H new ATOM 0 HG12 ILE A 154 7.037 4.464 -1.773 1.00 0.00 H new ATOM 0 HG13 ILE A 154 6.542 2.852 -2.253 1.00 0.00 H new ATOM 0 HG21 ILE A 154 10.073 3.868 -1.686 1.00 0.00 H new ATOM 0 HG22 ILE A 154 10.421 4.229 -3.394 1.00 0.00 H new ATOM 0 HG23 ILE A 154 9.363 5.308 -2.455 1.00 0.00 H new ATOM 0 HD11 ILE A 154 7.098 2.926 0.128 1.00 0.00 H new ATOM 0 HD12 ILE A 154 8.234 1.870 -0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 154 8.736 3.506 -0.259 1.00 0.00 H new