USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 592 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 422 CYS SG : rot -154:sc= 0.1 USER MOD Set 1.2: A 425 CYS SG : rot 180:sc= 0.241 USER MOD Set 1.3: A 438 HIS : no HD1:sc= -0.549 K(o=-1.1,f=-2.9) USER MOD Set 1.4: A 443 HIS : no HE2:sc= -0.938 K(o=-1.1,f=-2.2) USER MOD Set 2.1: A 392 CYS SG : rot -152:sc= -0.275 USER MOD Set 2.2: A 395 CYS SG : rot 144:sc= 0.652 USER MOD Set 2.3: A 408 HIS : no HE2:sc= 0.277 K(o=-0.065,f=-3.7) USER MOD Set 2.4: A 412 HIS : no HD1:sc= -0.719 K(o=-0.065,f=-7.8!) USER MOD Set 3.1: A 364 CYS SG : rot -155:sc= -0.372 USER MOD Set 3.2: A 367 CYS SG : rot -128:sc= 0.298 USER MOD Set 3.3: A 380 HIS : no HE2:sc= 0.204 K(o=0.13,f=-0.38) USER MOD Single : A 369 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 HIS : no HD1:sc= -0.0141 X(o=-0.014,f=-0.11) USER MOD Single : A 378 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 381 LYS NZ :NH3+ 140:sc= -2.21 (180deg=-5.39!) USER MOD Single : A 388 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 TYR OH : rot 180:sc= 0 USER MOD Single : A 391 SER OG : rot 77:sc= 0.282 USER MOD Single : A 400 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 MET CE :methyl -158:sc= -1.57 (180deg=-2.3!) USER MOD Single : A 406 SER OG : rot 180:sc= 0 USER MOD Single : A 407 TYR OH : rot 180:sc= 0 USER MOD Single : A 411 SER OG : rot 180:sc= 0 USER MOD Single : A 418 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00011) USER MOD Single : A 420 TYR OH : rot 180:sc= 0 USER MOD Single : A 423 GLN : amide:sc= -0.0144 X(o=-0.014,f=-0.14) USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 427 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 SER OG : rot 180:sc= 0 USER MOD Single : A 434 HIS :FLIP no HD1:sc= -0.0368 F(o=-0.56,f=-0.037) USER MOD Single : A 436 ASN : amide:sc= -0.337 X(o=-0.34,f=-0.016) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 66 N VAL A 362 -12.543 -21.437 -19.459 1.00 0.00 N ATOM 67 CA VAL A 362 -11.363 -20.821 -18.863 1.00 0.00 C ATOM 68 C VAL A 362 -11.745 -19.923 -17.692 1.00 0.00 C ATOM 69 O VAL A 362 -12.724 -19.181 -17.759 1.00 0.00 O ATOM 70 CB VAL A 362 -10.580 -19.992 -19.897 1.00 0.00 C ATOM 71 CG1 VAL A 362 -9.261 -19.513 -19.310 1.00 0.00 C ATOM 72 CG2 VAL A 362 -10.346 -20.803 -21.163 1.00 0.00 C ATOM 0 HA VAL A 362 -10.729 -21.632 -18.504 1.00 0.00 H new ATOM 0 HB VAL A 362 -11.173 -19.116 -20.158 1.00 0.00 H new ATOM 0 HG11 VAL A 362 -8.722 -18.929 -20.056 1.00 0.00 H new ATOM 0 HG12 VAL A 362 -9.456 -18.893 -18.435 1.00 0.00 H new ATOM 0 HG13 VAL A 362 -8.659 -20.373 -19.018 1.00 0.00 H new ATOM 0 HG21 VAL A 362 -9.791 -20.202 -21.883 1.00 0.00 H new ATOM 0 HG22 VAL A 362 -9.774 -21.699 -20.921 1.00 0.00 H new ATOM 0 HG23 VAL A 362 -11.305 -21.091 -21.593 1.00 0.00 H new ATOM 82 N ALA A 363 -10.964 -19.995 -16.619 1.00 0.00 N ATOM 83 CA ALA A 363 -11.218 -19.186 -15.433 1.00 0.00 C ATOM 84 C ALA A 363 -10.212 -18.046 -15.320 1.00 0.00 C ATOM 85 O ALA A 363 -9.023 -18.273 -15.097 1.00 0.00 O ATOM 86 CB ALA A 363 -11.178 -20.054 -14.184 1.00 0.00 C ATOM 0 H ALA A 363 -10.150 -20.605 -16.547 1.00 0.00 H new ATOM 0 HA ALA A 363 -12.212 -18.750 -15.527 1.00 0.00 H new ATOM 0 HB1 ALA A 363 -11.369 -19.437 -13.306 1.00 0.00 H new ATOM 0 HB2 ALA A 363 -11.940 -20.830 -14.255 1.00 0.00 H new ATOM 0 HB3 ALA A 363 -10.196 -20.518 -14.095 1.00 0.00 H new ATOM 92 N CYS A 364 -10.696 -16.818 -15.476 1.00 0.00 N ATOM 93 CA CYS A 364 -9.840 -15.641 -15.393 1.00 0.00 C ATOM 94 C CYS A 364 -9.057 -15.630 -14.083 1.00 0.00 C ATOM 95 O CYS A 364 -9.617 -15.863 -13.012 1.00 0.00 O ATOM 96 CB CYS A 364 -10.677 -14.366 -15.511 1.00 0.00 C ATOM 97 SG CYS A 364 -9.746 -12.919 -16.108 1.00 0.00 S ATOM 0 H CYS A 364 -11.678 -16.612 -15.661 1.00 0.00 H new ATOM 0 HA CYS A 364 -9.131 -15.679 -16.220 1.00 0.00 H new ATOM 0 HB2 CYS A 364 -11.511 -14.553 -16.188 1.00 0.00 H new ATOM 0 HB3 CYS A 364 -11.104 -14.133 -14.536 1.00 0.00 H new ATOM 0 HG CYS A 364 -10.320 -11.831 -15.689 1.00 0.00 H new ATOM 102 N GLU A 365 -7.760 -15.356 -14.177 1.00 0.00 N ATOM 103 CA GLU A 365 -6.901 -15.314 -13.000 1.00 0.00 C ATOM 104 C GLU A 365 -6.731 -13.883 -12.500 1.00 0.00 C ATOM 105 O GLU A 365 -5.704 -13.535 -11.916 1.00 0.00 O ATOM 106 CB GLU A 365 -5.532 -15.921 -13.318 1.00 0.00 C ATOM 107 CG GLU A 365 -4.679 -15.054 -14.228 1.00 0.00 C ATOM 108 CD GLU A 365 -3.556 -15.830 -14.889 1.00 0.00 C ATOM 109 OE1 GLU A 365 -3.010 -16.748 -14.242 1.00 0.00 O ATOM 110 OE2 GLU A 365 -3.224 -15.519 -16.052 1.00 0.00 O ATOM 0 H GLU A 365 -7.281 -15.160 -15.056 1.00 0.00 H new ATOM 0 HA GLU A 365 -7.377 -15.900 -12.214 1.00 0.00 H new ATOM 0 HB2 GLU A 365 -4.995 -16.093 -12.385 1.00 0.00 H new ATOM 0 HB3 GLU A 365 -5.676 -16.894 -13.787 1.00 0.00 H new ATOM 0 HG2 GLU A 365 -5.311 -14.610 -14.997 1.00 0.00 H new ATOM 0 HG3 GLU A 365 -4.256 -14.233 -13.649 1.00 0.00 H new ATOM 117 N ILE A 366 -7.745 -13.057 -12.735 1.00 0.00 N ATOM 118 CA ILE A 366 -7.709 -11.663 -12.308 1.00 0.00 C ATOM 119 C ILE A 366 -8.999 -11.272 -11.596 1.00 0.00 C ATOM 120 O ILE A 366 -8.972 -10.615 -10.555 1.00 0.00 O ATOM 121 CB ILE A 366 -7.487 -10.715 -13.501 1.00 0.00 C ATOM 122 CG1 ILE A 366 -6.195 -11.079 -14.236 1.00 0.00 C ATOM 123 CG2 ILE A 366 -7.444 -9.270 -13.029 1.00 0.00 C ATOM 124 CD1 ILE A 366 -6.408 -11.440 -15.690 1.00 0.00 C ATOM 0 H ILE A 366 -8.601 -13.328 -13.218 1.00 0.00 H new ATOM 0 HA ILE A 366 -6.872 -11.567 -11.616 1.00 0.00 H new ATOM 0 HB ILE A 366 -8.321 -10.826 -14.194 1.00 0.00 H new ATOM 0 HG12 ILE A 366 -5.503 -10.239 -14.176 1.00 0.00 H new ATOM 0 HG13 ILE A 366 -5.721 -11.919 -13.727 1.00 0.00 H new ATOM 0 HG21 ILE A 366 -7.286 -8.613 -13.884 1.00 0.00 H new ATOM 0 HG22 ILE A 366 -8.388 -9.017 -12.546 1.00 0.00 H new ATOM 0 HG23 ILE A 366 -6.627 -9.143 -12.319 1.00 0.00 H new ATOM 0 HD11 ILE A 366 -5.450 -11.687 -16.148 1.00 0.00 H new ATOM 0 HD12 ILE A 366 -7.074 -12.300 -15.758 1.00 0.00 H new ATOM 0 HD13 ILE A 366 -6.853 -10.594 -16.214 1.00 0.00 H new ATOM 136 N CYS A 367 -10.129 -11.682 -12.163 1.00 0.00 N ATOM 137 CA CYS A 367 -11.431 -11.377 -11.583 1.00 0.00 C ATOM 138 C CYS A 367 -12.135 -12.651 -11.125 1.00 0.00 C ATOM 139 O CYS A 367 -12.880 -12.644 -10.147 1.00 0.00 O ATOM 140 CB CYS A 367 -12.304 -10.636 -12.598 1.00 0.00 C ATOM 141 SG CYS A 367 -12.506 -11.510 -14.183 1.00 0.00 S ATOM 0 H CYS A 367 -10.169 -12.227 -13.024 1.00 0.00 H new ATOM 0 HA CYS A 367 -11.273 -10.738 -10.714 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -13.288 -10.467 -12.160 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -11.868 -9.655 -12.789 1.00 0.00 H new ATOM 0 HG CYS A 367 -12.205 -10.709 -15.162 1.00 0.00 H new ATOM 146 N GLY A 368 -11.891 -13.745 -11.840 1.00 0.00 N ATOM 147 CA GLY A 368 -12.508 -15.012 -11.492 1.00 0.00 C ATOM 148 C GLY A 368 -13.738 -15.307 -12.328 1.00 0.00 C ATOM 149 O GLY A 368 -14.691 -15.921 -11.849 1.00 0.00 O ATOM 0 H GLY A 368 -11.277 -13.777 -12.654 1.00 0.00 H new ATOM 0 HA2 GLY A 368 -11.782 -15.814 -11.624 1.00 0.00 H new ATOM 0 HA3 GLY A 368 -12.783 -15.001 -10.437 1.00 0.00 H new ATOM 153 N LYS A 369 -13.719 -14.866 -13.581 1.00 0.00 N ATOM 154 CA LYS A 369 -14.840 -15.085 -14.487 1.00 0.00 C ATOM 155 C LYS A 369 -14.597 -16.306 -15.369 1.00 0.00 C ATOM 156 O LYS A 369 -13.473 -16.553 -15.805 1.00 0.00 O ATOM 157 CB LYS A 369 -15.067 -13.849 -15.360 1.00 0.00 C ATOM 158 CG LYS A 369 -15.869 -12.757 -14.672 1.00 0.00 C ATOM 159 CD LYS A 369 -15.924 -11.492 -15.512 1.00 0.00 C ATOM 160 CE LYS A 369 -17.339 -11.200 -15.988 1.00 0.00 C ATOM 161 NZ LYS A 369 -17.359 -10.180 -17.073 1.00 0.00 N ATOM 0 H LYS A 369 -12.939 -14.354 -13.993 1.00 0.00 H new ATOM 0 HA LYS A 369 -15.731 -15.265 -13.885 1.00 0.00 H new ATOM 0 HB2 LYS A 369 -14.101 -13.444 -15.660 1.00 0.00 H new ATOM 0 HB3 LYS A 369 -15.584 -14.148 -16.272 1.00 0.00 H new ATOM 0 HG2 LYS A 369 -16.882 -13.113 -14.482 1.00 0.00 H new ATOM 0 HG3 LYS A 369 -15.423 -12.532 -13.703 1.00 0.00 H new ATOM 0 HD2 LYS A 369 -15.555 -10.649 -14.927 1.00 0.00 H new ATOM 0 HD3 LYS A 369 -15.264 -11.597 -16.373 1.00 0.00 H new ATOM 0 HE2 LYS A 369 -17.799 -12.121 -16.347 1.00 0.00 H new ATOM 0 HE3 LYS A 369 -17.940 -10.849 -15.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 369 -18.341 -10.009 -17.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 369 -16.943 -9.293 -16.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 369 -16.807 -10.525 -17.884 1.00 0.00 H new ATOM 175 N ILE A 370 -15.658 -17.063 -15.629 1.00 0.00 N ATOM 176 CA ILE A 370 -15.559 -18.255 -16.461 1.00 0.00 C ATOM 177 C ILE A 370 -15.968 -17.957 -17.900 1.00 0.00 C ATOM 178 O ILE A 370 -17.008 -17.347 -18.147 1.00 0.00 O ATOM 179 CB ILE A 370 -16.437 -19.397 -15.916 1.00 0.00 C ATOM 180 CG1 ILE A 370 -16.032 -19.741 -14.481 1.00 0.00 C ATOM 181 CG2 ILE A 370 -16.328 -20.623 -16.811 1.00 0.00 C ATOM 182 CD1 ILE A 370 -14.585 -20.164 -14.346 1.00 0.00 C ATOM 0 H ILE A 370 -16.595 -16.872 -15.275 1.00 0.00 H new ATOM 0 HA ILE A 370 -14.515 -18.568 -16.440 1.00 0.00 H new ATOM 0 HB ILE A 370 -17.476 -19.066 -15.911 1.00 0.00 H new ATOM 0 HG12 ILE A 370 -16.210 -18.874 -13.844 1.00 0.00 H new ATOM 0 HG13 ILE A 370 -16.672 -20.543 -14.114 1.00 0.00 H new ATOM 0 HG21 ILE A 370 -16.954 -21.421 -16.412 1.00 0.00 H new ATOM 0 HG22 ILE A 370 -16.660 -20.369 -17.818 1.00 0.00 H new ATOM 0 HG23 ILE A 370 -15.291 -20.958 -16.845 1.00 0.00 H new ATOM 0 HD11 ILE A 370 -14.369 -20.392 -13.302 1.00 0.00 H new ATOM 0 HD12 ILE A 370 -14.406 -21.050 -14.956 1.00 0.00 H new ATOM 0 HD13 ILE A 370 -13.937 -19.355 -14.682 1.00 0.00 H new ATOM 194 N PHE A 371 -15.143 -18.393 -18.846 1.00 0.00 N ATOM 195 CA PHE A 371 -15.418 -18.174 -20.261 1.00 0.00 C ATOM 196 C PHE A 371 -15.602 -19.501 -20.991 1.00 0.00 C ATOM 197 O PHE A 371 -14.796 -20.420 -20.842 1.00 0.00 O ATOM 198 CB PHE A 371 -14.283 -17.377 -20.906 1.00 0.00 C ATOM 199 CG PHE A 371 -14.124 -15.995 -20.340 1.00 0.00 C ATOM 200 CD1 PHE A 371 -13.534 -15.803 -19.101 1.00 0.00 C ATOM 201 CD2 PHE A 371 -14.565 -14.887 -21.046 1.00 0.00 C ATOM 202 CE1 PHE A 371 -13.387 -14.532 -18.577 1.00 0.00 C ATOM 203 CE2 PHE A 371 -14.421 -13.614 -20.528 1.00 0.00 C ATOM 204 CZ PHE A 371 -13.830 -13.436 -19.292 1.00 0.00 C ATOM 0 H PHE A 371 -14.278 -18.900 -18.658 1.00 0.00 H new ATOM 0 HA PHE A 371 -16.344 -17.604 -20.341 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -13.348 -17.923 -20.778 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -14.465 -17.303 -21.978 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -13.185 -16.656 -18.538 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -15.027 -15.020 -22.013 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -12.926 -14.396 -17.610 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -14.770 -12.759 -21.089 1.00 0.00 H new ATOM 0 HZ PHE A 371 -13.715 -12.442 -18.886 1.00 0.00 H new ATOM 214 N ARG A 372 -16.667 -19.594 -21.780 1.00 0.00 N ATOM 215 CA ARG A 372 -16.958 -20.808 -22.532 1.00 0.00 C ATOM 216 C ARG A 372 -15.829 -21.127 -23.508 1.00 0.00 C ATOM 217 O ARG A 372 -15.616 -22.284 -23.870 1.00 0.00 O ATOM 218 CB ARG A 372 -18.277 -20.659 -23.293 1.00 0.00 C ATOM 219 CG ARG A 372 -18.337 -19.420 -24.170 1.00 0.00 C ATOM 220 CD ARG A 372 -19.355 -19.578 -25.289 1.00 0.00 C ATOM 221 NE ARG A 372 -18.717 -19.815 -26.581 1.00 0.00 N ATOM 222 CZ ARG A 372 -19.353 -20.314 -27.634 1.00 0.00 C ATOM 223 NH1 ARG A 372 -20.639 -20.627 -27.550 1.00 0.00 N ATOM 224 NH2 ARG A 372 -18.703 -20.502 -28.776 1.00 0.00 N ATOM 0 H ARG A 372 -17.343 -18.842 -21.915 1.00 0.00 H new ATOM 0 HA ARG A 372 -17.046 -21.631 -21.823 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -18.430 -21.541 -23.914 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -19.098 -20.627 -22.577 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -18.596 -18.554 -23.561 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -17.353 -19.227 -24.597 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -20.023 -20.408 -25.057 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -19.971 -18.680 -25.348 1.00 0.00 H new ATOM 0 HE ARG A 372 -17.728 -19.584 -26.680 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -21.142 -20.484 -26.674 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -21.125 -21.010 -28.361 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -17.714 -20.263 -28.845 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -19.193 -20.885 -29.584 1.00 0.00 H new ATOM 238 N ASP A 373 -15.110 -20.093 -23.931 1.00 0.00 N ATOM 239 CA ASP A 373 -14.002 -20.262 -24.864 1.00 0.00 C ATOM 240 C ASP A 373 -12.831 -19.361 -24.487 1.00 0.00 C ATOM 241 O ASP A 373 -12.946 -18.514 -23.601 1.00 0.00 O ATOM 242 CB ASP A 373 -14.459 -19.955 -26.291 1.00 0.00 C ATOM 243 CG ASP A 373 -14.507 -21.195 -27.163 1.00 0.00 C ATOM 244 OD1 ASP A 373 -15.104 -22.202 -26.729 1.00 0.00 O ATOM 245 OD2 ASP A 373 -13.948 -21.158 -28.279 1.00 0.00 O ATOM 0 H ASP A 373 -15.275 -19.129 -23.642 1.00 0.00 H new ATOM 0 HA ASP A 373 -13.670 -21.299 -24.811 1.00 0.00 H new ATOM 0 HB2 ASP A 373 -15.447 -19.496 -26.262 1.00 0.00 H new ATOM 0 HB3 ASP A 373 -13.782 -19.226 -26.737 1.00 0.00 H new ATOM 250 N VAL A 374 -11.703 -19.550 -25.164 1.00 0.00 N ATOM 251 CA VAL A 374 -10.510 -18.755 -24.900 1.00 0.00 C ATOM 252 C VAL A 374 -10.522 -17.462 -25.708 1.00 0.00 C ATOM 253 O VAL A 374 -10.077 -16.417 -25.233 1.00 0.00 O ATOM 254 CB VAL A 374 -9.227 -19.541 -25.229 1.00 0.00 C ATOM 255 CG1 VAL A 374 -7.995 -18.689 -24.962 1.00 0.00 C ATOM 256 CG2 VAL A 374 -9.175 -20.834 -24.429 1.00 0.00 C ATOM 0 H VAL A 374 -11.590 -20.247 -25.900 1.00 0.00 H new ATOM 0 HA VAL A 374 -10.518 -18.516 -23.837 1.00 0.00 H new ATOM 0 HB VAL A 374 -9.240 -19.796 -26.289 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -7.098 -19.261 -25.200 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -8.030 -17.794 -25.583 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -7.973 -18.401 -23.911 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -8.262 -21.377 -24.674 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -9.186 -20.603 -23.364 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -10.040 -21.449 -24.676 1.00 0.00 H new ATOM 266 N TYR A 375 -11.034 -17.540 -26.931 1.00 0.00 N ATOM 267 CA TYR A 375 -11.102 -16.376 -27.806 1.00 0.00 C ATOM 268 C TYR A 375 -11.874 -15.240 -27.143 1.00 0.00 C ATOM 269 O TYR A 375 -11.648 -14.065 -27.437 1.00 0.00 O ATOM 270 CB TYR A 375 -11.763 -16.749 -29.134 1.00 0.00 C ATOM 271 CG TYR A 375 -10.777 -17.117 -30.220 1.00 0.00 C ATOM 272 CD1 TYR A 375 -10.205 -18.382 -30.265 1.00 0.00 C ATOM 273 CD2 TYR A 375 -10.417 -16.200 -31.199 1.00 0.00 C ATOM 274 CE1 TYR A 375 -9.302 -18.723 -31.254 1.00 0.00 C ATOM 275 CE2 TYR A 375 -9.517 -16.532 -32.192 1.00 0.00 C ATOM 276 CZ TYR A 375 -8.962 -17.795 -32.216 1.00 0.00 C ATOM 277 OH TYR A 375 -8.064 -18.130 -33.203 1.00 0.00 O ATOM 0 H TYR A 375 -11.408 -18.397 -27.339 1.00 0.00 H new ATOM 0 HA TYR A 375 -10.084 -16.036 -27.996 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -12.440 -17.588 -28.970 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -12.371 -15.911 -29.476 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -10.471 -19.112 -29.514 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -10.849 -15.210 -31.183 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -8.865 -19.710 -31.273 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -9.249 -15.807 -32.946 1.00 0.00 H new ATOM 0 HH TYR A 375 -7.935 -17.364 -33.801 1.00 0.00 H new ATOM 287 N HIS A 376 -12.786 -15.598 -26.244 1.00 0.00 N ATOM 288 CA HIS A 376 -13.591 -14.609 -25.536 1.00 0.00 C ATOM 289 C HIS A 376 -12.835 -14.053 -24.334 1.00 0.00 C ATOM 290 O HIS A 376 -13.084 -12.928 -23.896 1.00 0.00 O ATOM 291 CB HIS A 376 -14.913 -15.228 -25.081 1.00 0.00 C ATOM 292 CG HIS A 376 -16.115 -14.628 -25.742 1.00 0.00 C ATOM 293 ND1 HIS A 376 -16.369 -13.273 -25.755 1.00 0.00 N ATOM 294 CD2 HIS A 376 -17.135 -15.207 -26.418 1.00 0.00 C ATOM 295 CE1 HIS A 376 -17.494 -13.045 -26.409 1.00 0.00 C ATOM 296 NE2 HIS A 376 -17.979 -14.202 -26.821 1.00 0.00 N ATOM 0 H HIS A 376 -12.986 -16.565 -25.989 1.00 0.00 H new ATOM 0 HA HIS A 376 -13.800 -13.788 -26.222 1.00 0.00 H new ATOM 0 HB2 HIS A 376 -14.893 -16.298 -25.286 1.00 0.00 H new ATOM 0 HB3 HIS A 376 -15.006 -15.112 -24.001 1.00 0.00 H new ATOM 0 HD2 HIS A 376 -17.261 -16.263 -26.605 1.00 0.00 H new ATOM 0 HE1 HIS A 376 -17.941 -12.077 -26.578 1.00 0.00 H new ATOM 0 HE2 HIS A 376 -18.841 -14.328 -27.352 1.00 0.00 H new ATOM 304 N LEU A 377 -11.912 -14.847 -23.802 1.00 0.00 N ATOM 305 CA LEU A 377 -11.120 -14.434 -22.649 1.00 0.00 C ATOM 306 C LEU A 377 -9.997 -13.491 -23.069 1.00 0.00 C ATOM 307 O LEU A 377 -9.530 -12.674 -22.277 1.00 0.00 O ATOM 308 CB LEU A 377 -10.535 -15.659 -21.943 1.00 0.00 C ATOM 309 CG LEU A 377 -9.584 -15.373 -20.781 1.00 0.00 C ATOM 310 CD1 LEU A 377 -10.364 -14.973 -19.538 1.00 0.00 C ATOM 311 CD2 LEU A 377 -8.709 -16.585 -20.496 1.00 0.00 C ATOM 0 H LEU A 377 -11.694 -15.780 -24.151 1.00 0.00 H new ATOM 0 HA LEU A 377 -11.776 -13.903 -21.960 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -11.359 -16.267 -21.570 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -10.004 -16.260 -22.681 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.938 -14.542 -21.063 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -9.670 -14.773 -18.722 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -10.946 -14.076 -19.747 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -11.036 -15.783 -19.254 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -8.039 -16.363 -19.666 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -9.339 -17.436 -20.236 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -8.122 -16.826 -21.382 1.00 0.00 H new ATOM 323 N ASN A 378 -9.569 -13.610 -24.322 1.00 0.00 N ATOM 324 CA ASN A 378 -8.502 -12.766 -24.848 1.00 0.00 C ATOM 325 C ASN A 378 -8.927 -11.301 -24.870 1.00 0.00 C ATOM 326 O ASN A 378 -8.212 -10.430 -24.375 1.00 0.00 O ATOM 327 CB ASN A 378 -8.115 -13.218 -26.258 1.00 0.00 C ATOM 328 CG ASN A 378 -6.613 -13.279 -26.454 1.00 0.00 C ATOM 329 OD1 ASN A 378 -5.900 -13.916 -25.679 1.00 0.00 O ATOM 330 ND2 ASN A 378 -6.124 -12.615 -27.495 1.00 0.00 N ATOM 0 H ASN A 378 -9.944 -14.282 -24.991 1.00 0.00 H new ATOM 0 HA ASN A 378 -7.638 -12.865 -24.191 1.00 0.00 H new ATOM 0 HB2 ASN A 378 -8.544 -14.201 -26.452 1.00 0.00 H new ATOM 0 HB3 ASN A 378 -8.546 -12.532 -26.987 1.00 0.00 H new ATOM 0 HD21 ASN A 378 -5.120 -12.620 -27.678 1.00 0.00 H new ATOM 0 HD22 ASN A 378 -6.752 -12.100 -28.112 1.00 0.00 H new ATOM 337 N ARG A 379 -10.095 -11.038 -25.446 1.00 0.00 N ATOM 338 CA ARG A 379 -10.615 -9.679 -25.532 1.00 0.00 C ATOM 339 C ARG A 379 -10.886 -9.111 -24.142 1.00 0.00 C ATOM 340 O ARG A 379 -10.853 -7.896 -23.939 1.00 0.00 O ATOM 341 CB ARG A 379 -11.899 -9.653 -26.364 1.00 0.00 C ATOM 342 CG ARG A 379 -13.106 -10.225 -25.638 1.00 0.00 C ATOM 343 CD ARG A 379 -13.992 -9.123 -25.077 1.00 0.00 C ATOM 344 NE ARG A 379 -14.863 -9.611 -24.011 1.00 0.00 N ATOM 345 CZ ARG A 379 -15.956 -8.974 -23.606 1.00 0.00 C ATOM 346 NH1 ARG A 379 -16.310 -7.830 -24.175 1.00 0.00 N ATOM 347 NH2 ARG A 379 -16.699 -9.481 -22.630 1.00 0.00 N ATOM 0 H ARG A 379 -10.699 -11.748 -25.860 1.00 0.00 H new ATOM 0 HA ARG A 379 -9.862 -9.059 -26.018 1.00 0.00 H new ATOM 0 HB2 ARG A 379 -12.114 -8.624 -26.654 1.00 0.00 H new ATOM 0 HB3 ARG A 379 -11.738 -10.216 -27.283 1.00 0.00 H new ATOM 0 HG2 ARG A 379 -13.684 -10.845 -26.323 1.00 0.00 H new ATOM 0 HG3 ARG A 379 -12.771 -10.873 -24.828 1.00 0.00 H new ATOM 0 HD2 ARG A 379 -13.368 -8.316 -24.694 1.00 0.00 H new ATOM 0 HD3 ARG A 379 -14.600 -8.703 -25.878 1.00 0.00 H new ATOM 0 HE ARG A 379 -14.619 -10.489 -23.553 1.00 0.00 H new ATOM 0 HH11 ARG A 379 -15.743 -7.437 -24.926 1.00 0.00 H new ATOM 0 HH12 ARG A 379 -17.150 -7.343 -23.862 1.00 0.00 H new ATOM 0 HH21 ARG A 379 -16.431 -10.361 -22.190 1.00 0.00 H new ATOM 0 HH22 ARG A 379 -17.538 -8.990 -22.320 1.00 0.00 H new ATOM 361 N HIS A 380 -11.153 -9.997 -23.188 1.00 0.00 N ATOM 362 CA HIS A 380 -11.430 -9.584 -21.817 1.00 0.00 C ATOM 363 C HIS A 380 -10.164 -9.066 -21.140 1.00 0.00 C ATOM 364 O HIS A 380 -10.133 -7.944 -20.633 1.00 0.00 O ATOM 365 CB HIS A 380 -12.009 -10.751 -21.017 1.00 0.00 C ATOM 366 CG HIS A 380 -12.151 -10.462 -19.554 1.00 0.00 C ATOM 367 ND1 HIS A 380 -13.171 -9.693 -19.034 1.00 0.00 N ATOM 368 CD2 HIS A 380 -11.396 -10.846 -18.498 1.00 0.00 C ATOM 369 CE1 HIS A 380 -13.036 -9.615 -17.723 1.00 0.00 C ATOM 370 NE2 HIS A 380 -11.967 -10.307 -17.372 1.00 0.00 N ATOM 0 H HIS A 380 -11.183 -11.005 -23.339 1.00 0.00 H new ATOM 0 HA HIS A 380 -12.162 -8.777 -21.848 1.00 0.00 H new ATOM 0 HB2 HIS A 380 -12.986 -11.011 -21.424 1.00 0.00 H new ATOM 0 HB3 HIS A 380 -11.368 -11.623 -21.146 1.00 0.00 H new ATOM 0 HD1 HIS A 380 -13.914 -9.253 -19.577 1.00 0.00 H new ATOM 0 HD2 HIS A 380 -10.509 -11.462 -18.535 1.00 0.00 H new ATOM 0 HE1 HIS A 380 -13.689 -9.077 -17.052 1.00 0.00 H new ATOM 378 N LYS A 381 -9.122 -9.890 -21.135 1.00 0.00 N ATOM 379 CA LYS A 381 -7.853 -9.516 -20.521 1.00 0.00 C ATOM 380 C LYS A 381 -7.352 -8.186 -21.075 1.00 0.00 C ATOM 381 O LYS A 381 -6.706 -7.412 -20.368 1.00 0.00 O ATOM 382 CB LYS A 381 -6.807 -10.607 -20.761 1.00 0.00 C ATOM 383 CG LYS A 381 -7.210 -11.967 -20.216 1.00 0.00 C ATOM 384 CD LYS A 381 -6.466 -13.091 -20.917 1.00 0.00 C ATOM 385 CE LYS A 381 -5.844 -14.055 -19.919 1.00 0.00 C ATOM 386 NZ LYS A 381 -6.837 -14.534 -18.918 1.00 0.00 N ATOM 0 H LYS A 381 -9.131 -10.822 -21.549 1.00 0.00 H new ATOM 0 HA LYS A 381 -8.015 -9.405 -19.449 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -6.624 -10.694 -21.832 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -5.867 -10.305 -20.300 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -7.006 -12.006 -19.146 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -8.284 -12.107 -20.341 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -7.152 -13.632 -21.568 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -5.687 -12.672 -21.553 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -5.424 -14.909 -20.452 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -5.018 -13.563 -19.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -6.683 -15.546 -18.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -6.724 -13.999 -18.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -7.799 -14.393 -19.288 1.00 0.00 H new ATOM 400 N LEU A 382 -7.655 -7.926 -22.342 1.00 0.00 N ATOM 401 CA LEU A 382 -7.236 -6.688 -22.990 1.00 0.00 C ATOM 402 C LEU A 382 -7.902 -5.480 -22.338 1.00 0.00 C ATOM 403 O LEU A 382 -7.334 -4.388 -22.305 1.00 0.00 O ATOM 404 CB LEU A 382 -7.577 -6.729 -24.481 1.00 0.00 C ATOM 405 CG LEU A 382 -6.679 -7.610 -25.350 1.00 0.00 C ATOM 406 CD1 LEU A 382 -7.380 -7.966 -26.652 1.00 0.00 C ATOM 407 CD2 LEU A 382 -5.355 -6.914 -25.628 1.00 0.00 C ATOM 0 H LEU A 382 -8.189 -8.556 -22.941 1.00 0.00 H new ATOM 0 HA LEU A 382 -6.157 -6.593 -22.873 1.00 0.00 H new ATOM 0 HB2 LEU A 382 -8.605 -7.074 -24.589 1.00 0.00 H new ATOM 0 HB3 LEU A 382 -7.540 -5.711 -24.870 1.00 0.00 H new ATOM 0 HG LEU A 382 -6.474 -8.533 -24.807 1.00 0.00 H new ATOM 0 HD11 LEU A 382 -6.726 -8.593 -27.258 1.00 0.00 H new ATOM 0 HD12 LEU A 382 -8.301 -8.507 -26.433 1.00 0.00 H new ATOM 0 HD13 LEU A 382 -7.616 -7.053 -27.199 1.00 0.00 H new ATOM 0 HD21 LEU A 382 -4.729 -7.556 -26.248 1.00 0.00 H new ATOM 0 HD22 LEU A 382 -5.540 -5.975 -26.150 1.00 0.00 H new ATOM 0 HD23 LEU A 382 -4.846 -6.711 -24.686 1.00 0.00 H new ATOM 480 N LYS A 388 -5.208 2.796 -18.670 1.00 0.00 N ATOM 481 CA LYS A 388 -5.906 3.385 -17.534 1.00 0.00 C ATOM 482 C LYS A 388 -4.962 3.572 -16.352 1.00 0.00 C ATOM 483 O LYS A 388 -3.912 2.936 -16.258 1.00 0.00 O ATOM 484 CB LYS A 388 -7.088 2.503 -17.123 1.00 0.00 C ATOM 485 CG LYS A 388 -6.838 1.019 -17.323 1.00 0.00 C ATOM 486 CD LYS A 388 -8.008 0.184 -16.830 1.00 0.00 C ATOM 487 CE LYS A 388 -8.819 -0.378 -17.987 1.00 0.00 C ATOM 488 NZ LYS A 388 -9.693 0.657 -18.606 1.00 0.00 N ATOM 0 HA LYS A 388 -6.278 4.364 -17.836 1.00 0.00 H new ATOM 0 HB2 LYS A 388 -7.319 2.686 -16.074 1.00 0.00 H new ATOM 0 HB3 LYS A 388 -7.966 2.796 -17.698 1.00 0.00 H new ATOM 0 HG2 LYS A 388 -6.666 0.817 -18.380 1.00 0.00 H new ATOM 0 HG3 LYS A 388 -5.932 0.727 -16.792 1.00 0.00 H new ATOM 0 HD2 LYS A 388 -7.638 -0.634 -16.213 1.00 0.00 H new ATOM 0 HD3 LYS A 388 -8.651 0.795 -16.197 1.00 0.00 H new ATOM 0 HE2 LYS A 388 -8.144 -0.782 -18.741 1.00 0.00 H new ATOM 0 HE3 LYS A 388 -9.432 -1.206 -17.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 -10.229 0.234 -19.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 -10.355 1.024 -17.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 -9.106 1.436 -18.968 1.00 0.00 H new ATOM 502 N PRO A 389 -5.342 4.464 -15.425 1.00 0.00 N ATOM 503 CA PRO A 389 -6.589 5.227 -15.525 1.00 0.00 C ATOM 504 C PRO A 389 -6.547 6.262 -16.645 1.00 0.00 C ATOM 505 O PRO A 389 -7.490 6.383 -17.427 1.00 0.00 O ATOM 506 CB PRO A 389 -6.693 5.917 -14.163 1.00 0.00 C ATOM 507 CG PRO A 389 -5.288 6.015 -13.679 1.00 0.00 C ATOM 508 CD PRO A 389 -4.583 4.796 -14.207 1.00 0.00 C ATOM 0 HA PRO A 389 -7.440 4.588 -15.760 1.00 0.00 H new ATOM 0 HB2 PRO A 389 -7.150 6.902 -14.252 1.00 0.00 H new ATOM 0 HB3 PRO A 389 -7.310 5.341 -13.473 1.00 0.00 H new ATOM 0 HG2 PRO A 389 -4.813 6.927 -14.040 1.00 0.00 H new ATOM 0 HG3 PRO A 389 -5.251 6.046 -12.590 1.00 0.00 H new ATOM 0 HD2 PRO A 389 -3.536 5.002 -14.430 1.00 0.00 H new ATOM 0 HD3 PRO A 389 -4.601 3.978 -13.487 1.00 0.00 H new ATOM 516 N TYR A 390 -5.448 7.005 -16.716 1.00 0.00 N ATOM 517 CA TYR A 390 -5.284 8.031 -17.739 1.00 0.00 C ATOM 518 C TYR A 390 -4.075 7.733 -18.620 1.00 0.00 C ATOM 519 O TYR A 390 -2.938 8.032 -18.256 1.00 0.00 O ATOM 520 CB TYR A 390 -5.130 9.407 -17.091 1.00 0.00 C ATOM 521 CG TYR A 390 -6.128 9.672 -15.986 1.00 0.00 C ATOM 522 CD1 TYR A 390 -7.395 10.165 -16.271 1.00 0.00 C ATOM 523 CD2 TYR A 390 -5.804 9.427 -14.657 1.00 0.00 C ATOM 524 CE1 TYR A 390 -8.310 10.408 -15.265 1.00 0.00 C ATOM 525 CE2 TYR A 390 -6.713 9.667 -13.645 1.00 0.00 C ATOM 526 CZ TYR A 390 -7.964 10.158 -13.954 1.00 0.00 C ATOM 527 OH TYR A 390 -8.873 10.398 -12.949 1.00 0.00 O ATOM 0 H TYR A 390 -4.658 6.916 -16.077 1.00 0.00 H new ATOM 0 HA TYR A 390 -6.176 8.030 -18.365 1.00 0.00 H new ATOM 0 HB2 TYR A 390 -4.121 9.498 -16.688 1.00 0.00 H new ATOM 0 HB3 TYR A 390 -5.237 10.174 -17.858 1.00 0.00 H new ATOM 0 HD1 TYR A 390 -7.669 10.362 -17.297 1.00 0.00 H new ATOM 0 HD2 TYR A 390 -4.825 9.043 -14.411 1.00 0.00 H new ATOM 0 HE1 TYR A 390 -9.291 10.792 -15.504 1.00 0.00 H new ATOM 0 HE2 TYR A 390 -6.445 9.471 -12.617 1.00 0.00 H new ATOM 0 HH TYR A 390 -8.473 10.169 -12.084 1.00 0.00 H new ATOM 537 N SER A 391 -4.330 7.141 -19.783 1.00 0.00 N ATOM 538 CA SER A 391 -3.263 6.799 -20.717 1.00 0.00 C ATOM 539 C SER A 391 -3.362 7.639 -21.986 1.00 0.00 C ATOM 540 O SER A 391 -4.430 8.152 -22.324 1.00 0.00 O ATOM 541 CB SER A 391 -3.323 5.311 -21.070 1.00 0.00 C ATOM 542 OG SER A 391 -3.014 5.099 -22.436 1.00 0.00 O ATOM 0 H SER A 391 -5.266 6.888 -20.101 1.00 0.00 H new ATOM 0 HA SER A 391 -2.309 7.012 -20.235 1.00 0.00 H new ATOM 0 HB2 SER A 391 -2.622 4.757 -20.445 1.00 0.00 H new ATOM 0 HB3 SER A 391 -4.318 4.923 -20.854 1.00 0.00 H new ATOM 0 HG SER A 391 -2.045 5.166 -22.566 1.00 0.00 H new ATOM 548 N CYS A 392 -2.241 7.775 -22.687 1.00 0.00 N ATOM 549 CA CYS A 392 -2.199 8.553 -23.919 1.00 0.00 C ATOM 550 C CYS A 392 -2.690 7.724 -25.103 1.00 0.00 C ATOM 551 O CYS A 392 -2.242 6.601 -25.334 1.00 0.00 O ATOM 552 CB CYS A 392 -0.777 9.049 -24.185 1.00 0.00 C ATOM 553 SG CYS A 392 -0.663 10.318 -25.488 1.00 0.00 S ATOM 0 H CYS A 392 -1.349 7.356 -22.422 1.00 0.00 H new ATOM 0 HA CYS A 392 -2.860 9.411 -23.800 1.00 0.00 H new ATOM 0 HB2 CYS A 392 -0.366 9.455 -23.260 1.00 0.00 H new ATOM 0 HB3 CYS A 392 -0.154 8.200 -24.465 1.00 0.00 H new ATOM 0 HG CYS A 392 0.510 10.263 -26.046 1.00 0.00 H new ATOM 558 N PRO A 393 -3.633 8.289 -25.871 1.00 0.00 N ATOM 559 CA PRO A 393 -4.205 7.621 -27.043 1.00 0.00 C ATOM 560 C PRO A 393 -3.205 7.503 -28.188 1.00 0.00 C ATOM 561 O PRO A 393 -3.342 6.644 -29.060 1.00 0.00 O ATOM 562 CB PRO A 393 -5.367 8.535 -27.441 1.00 0.00 C ATOM 563 CG PRO A 393 -4.990 9.877 -26.917 1.00 0.00 C ATOM 564 CD PRO A 393 -4.213 9.625 -25.654 1.00 0.00 C ATOM 0 HA PRO A 393 -4.506 6.597 -26.822 1.00 0.00 H new ATOM 0 HB2 PRO A 393 -5.502 8.556 -28.522 1.00 0.00 H new ATOM 0 HB3 PRO A 393 -6.307 8.191 -27.009 1.00 0.00 H new ATOM 0 HG2 PRO A 393 -4.388 10.424 -27.643 1.00 0.00 H new ATOM 0 HG3 PRO A 393 -5.875 10.481 -26.717 1.00 0.00 H new ATOM 0 HD2 PRO A 393 -3.440 10.378 -25.500 1.00 0.00 H new ATOM 0 HD3 PRO A 393 -4.857 9.645 -24.775 1.00 0.00 H new ATOM 572 N VAL A 394 -2.197 8.370 -28.180 1.00 0.00 N ATOM 573 CA VAL A 394 -1.172 8.361 -29.217 1.00 0.00 C ATOM 574 C VAL A 394 -0.011 7.451 -28.835 1.00 0.00 C ATOM 575 O VAL A 394 0.202 6.406 -29.451 1.00 0.00 O ATOM 576 CB VAL A 394 -0.633 9.779 -29.484 1.00 0.00 C ATOM 577 CG1 VAL A 394 0.453 9.745 -30.549 1.00 0.00 C ATOM 578 CG2 VAL A 394 -1.763 10.711 -29.894 1.00 0.00 C ATOM 0 H VAL A 394 -2.069 9.088 -27.467 1.00 0.00 H new ATOM 0 HA VAL A 394 -1.642 7.982 -30.124 1.00 0.00 H new ATOM 0 HB VAL A 394 -0.194 10.161 -28.562 1.00 0.00 H new ATOM 0 HG11 VAL A 394 0.822 10.755 -30.725 1.00 0.00 H new ATOM 0 HG12 VAL A 394 1.274 9.112 -30.211 1.00 0.00 H new ATOM 0 HG13 VAL A 394 0.042 9.343 -31.475 1.00 0.00 H new ATOM 0 HG21 VAL A 394 -1.363 11.708 -30.078 1.00 0.00 H new ATOM 0 HG22 VAL A 394 -2.233 10.335 -30.802 1.00 0.00 H new ATOM 0 HG23 VAL A 394 -2.503 10.759 -29.095 1.00 0.00 H new ATOM 588 N CYS A 395 0.738 7.854 -27.814 1.00 0.00 N ATOM 589 CA CYS A 395 1.879 7.075 -27.348 1.00 0.00 C ATOM 590 C CYS A 395 1.431 5.712 -26.826 1.00 0.00 C ATOM 591 O CYS A 395 1.702 4.681 -27.440 1.00 0.00 O ATOM 592 CB CYS A 395 2.626 7.833 -26.249 1.00 0.00 C ATOM 593 SG CYS A 395 3.036 9.555 -26.680 1.00 0.00 S ATOM 0 H CYS A 395 0.575 8.716 -27.293 1.00 0.00 H new ATOM 0 HA CYS A 395 2.550 6.919 -28.193 1.00 0.00 H new ATOM 0 HB2 CYS A 395 2.019 7.831 -25.344 1.00 0.00 H new ATOM 0 HB3 CYS A 395 3.547 7.299 -26.016 1.00 0.00 H new ATOM 0 HG CYS A 395 2.926 10.305 -25.624 1.00 0.00 H new ATOM 598 N GLY A 396 0.742 5.717 -25.689 1.00 0.00 N ATOM 599 CA GLY A 396 0.267 4.477 -25.104 1.00 0.00 C ATOM 600 C GLY A 396 0.608 4.362 -23.632 1.00 0.00 C ATOM 601 O GLY A 396 0.091 3.489 -22.933 1.00 0.00 O ATOM 0 H GLY A 396 0.504 6.558 -25.163 1.00 0.00 H new ATOM 0 HA2 GLY A 396 -0.814 4.410 -25.230 1.00 0.00 H new ATOM 0 HA3 GLY A 396 0.703 3.635 -25.642 1.00 0.00 H new ATOM 605 N LEU A 397 1.482 5.244 -23.158 1.00 0.00 N ATOM 606 CA LEU A 397 1.894 5.237 -21.759 1.00 0.00 C ATOM 607 C LEU A 397 0.681 5.292 -20.834 1.00 0.00 C ATOM 608 O LEU A 397 -0.440 5.537 -21.279 1.00 0.00 O ATOM 609 CB LEU A 397 2.820 6.420 -21.474 1.00 0.00 C ATOM 610 CG LEU A 397 4.320 6.140 -21.583 1.00 0.00 C ATOM 611 CD1 LEU A 397 5.004 7.211 -22.417 1.00 0.00 C ATOM 612 CD2 LEU A 397 4.948 6.056 -20.199 1.00 0.00 C ATOM 0 H LEU A 397 1.919 5.973 -23.722 1.00 0.00 H new ATOM 0 HA LEU A 397 2.432 4.308 -21.569 1.00 0.00 H new ATOM 0 HB2 LEU A 397 2.570 7.226 -22.164 1.00 0.00 H new ATOM 0 HB3 LEU A 397 2.611 6.785 -20.468 1.00 0.00 H new ATOM 0 HG LEU A 397 4.456 5.180 -22.081 1.00 0.00 H new ATOM 0 HD11 LEU A 397 6.070 6.995 -22.483 1.00 0.00 H new ATOM 0 HD12 LEU A 397 4.573 7.223 -23.418 1.00 0.00 H new ATOM 0 HD13 LEU A 397 4.860 8.184 -21.948 1.00 0.00 H new ATOM 0 HD21 LEU A 397 6.015 5.856 -20.295 1.00 0.00 H new ATOM 0 HD22 LEU A 397 4.801 7.000 -19.675 1.00 0.00 H new ATOM 0 HD23 LEU A 397 4.478 5.251 -19.634 1.00 0.00 H new ATOM 624 N ARG A 398 0.915 5.064 -19.546 1.00 0.00 N ATOM 625 CA ARG A 398 -0.157 5.088 -18.559 1.00 0.00 C ATOM 626 C ARG A 398 0.189 6.022 -17.403 1.00 0.00 C ATOM 627 O ARG A 398 1.288 5.962 -16.851 1.00 0.00 O ATOM 628 CB ARG A 398 -0.423 3.678 -18.028 1.00 0.00 C ATOM 629 CG ARG A 398 -0.941 2.717 -19.085 1.00 0.00 C ATOM 630 CD ARG A 398 0.110 1.687 -19.466 1.00 0.00 C ATOM 631 NE ARG A 398 -0.040 1.235 -20.846 1.00 0.00 N ATOM 632 CZ ARG A 398 0.928 0.640 -21.535 1.00 0.00 C ATOM 633 NH1 ARG A 398 2.110 0.427 -20.974 1.00 0.00 N ATOM 634 NH2 ARG A 398 0.714 0.258 -22.787 1.00 0.00 N ATOM 0 H ARG A 398 1.838 4.861 -19.162 1.00 0.00 H new ATOM 0 HA ARG A 398 -1.058 5.460 -19.047 1.00 0.00 H new ATOM 0 HB2 ARG A 398 0.499 3.278 -17.606 1.00 0.00 H new ATOM 0 HB3 ARG A 398 -1.147 3.736 -17.215 1.00 0.00 H new ATOM 0 HG2 ARG A 398 -1.831 2.209 -18.712 1.00 0.00 H new ATOM 0 HG3 ARG A 398 -1.241 3.277 -19.971 1.00 0.00 H new ATOM 0 HD2 ARG A 398 1.103 2.116 -19.331 1.00 0.00 H new ATOM 0 HD3 ARG A 398 0.039 0.831 -18.795 1.00 0.00 H new ATOM 0 HE ARG A 398 -0.938 1.384 -21.307 1.00 0.00 H new ATOM 0 HH11 ARG A 398 2.278 0.720 -20.012 1.00 0.00 H new ATOM 0 HH12 ARG A 398 2.852 -0.030 -21.505 1.00 0.00 H new ATOM 0 HH21 ARG A 398 -0.194 0.421 -23.222 1.00 0.00 H new ATOM 0 HH22 ARG A 398 1.458 -0.199 -23.315 1.00 0.00 H new ATOM 648 N PHE A 399 -0.755 6.884 -17.042 1.00 0.00 N ATOM 649 CA PHE A 399 -0.549 7.832 -15.953 1.00 0.00 C ATOM 650 C PHE A 399 -1.589 7.631 -14.854 1.00 0.00 C ATOM 651 O PHE A 399 -2.753 7.339 -15.129 1.00 0.00 O ATOM 652 CB PHE A 399 -0.617 9.267 -16.478 1.00 0.00 C ATOM 653 CG PHE A 399 0.347 9.542 -17.597 1.00 0.00 C ATOM 654 CD1 PHE A 399 0.029 9.202 -18.902 1.00 0.00 C ATOM 655 CD2 PHE A 399 1.570 10.142 -17.344 1.00 0.00 C ATOM 656 CE1 PHE A 399 0.914 9.453 -19.933 1.00 0.00 C ATOM 657 CE2 PHE A 399 2.459 10.396 -18.371 1.00 0.00 C ATOM 658 CZ PHE A 399 2.130 10.052 -19.667 1.00 0.00 C ATOM 0 H PHE A 399 -1.670 6.946 -17.487 1.00 0.00 H new ATOM 0 HA PHE A 399 0.440 7.653 -15.531 1.00 0.00 H new ATOM 0 HB2 PHE A 399 -1.630 9.471 -16.824 1.00 0.00 H new ATOM 0 HB3 PHE A 399 -0.415 9.956 -15.658 1.00 0.00 H new ATOM 0 HD1 PHE A 399 -0.921 8.736 -19.116 1.00 0.00 H new ATOM 0 HD2 PHE A 399 1.832 10.414 -16.332 1.00 0.00 H new ATOM 0 HE1 PHE A 399 0.655 9.181 -20.946 1.00 0.00 H new ATOM 0 HE2 PHE A 399 3.410 10.863 -18.160 1.00 0.00 H new ATOM 0 HZ PHE A 399 2.822 10.251 -20.472 1.00 0.00 H new ATOM 668 N LYS A 400 -1.160 7.789 -13.606 1.00 0.00 N ATOM 669 CA LYS A 400 -2.051 7.626 -12.464 1.00 0.00 C ATOM 670 C LYS A 400 -2.559 8.978 -11.973 1.00 0.00 C ATOM 671 O LYS A 400 -2.920 9.130 -10.806 1.00 0.00 O ATOM 672 CB LYS A 400 -1.330 6.898 -11.328 1.00 0.00 C ATOM 673 CG LYS A 400 -2.143 5.770 -10.715 1.00 0.00 C ATOM 674 CD LYS A 400 -1.436 4.433 -10.857 1.00 0.00 C ATOM 675 CE LYS A 400 -1.818 3.479 -9.735 1.00 0.00 C ATOM 676 NZ LYS A 400 -1.527 2.062 -10.089 1.00 0.00 N ATOM 0 H LYS A 400 -0.200 8.030 -13.360 1.00 0.00 H new ATOM 0 HA LYS A 400 -2.906 7.030 -12.784 1.00 0.00 H new ATOM 0 HB2 LYS A 400 -0.391 6.494 -11.705 1.00 0.00 H new ATOM 0 HB3 LYS A 400 -1.078 7.618 -10.549 1.00 0.00 H new ATOM 0 HG2 LYS A 400 -2.320 5.979 -9.660 1.00 0.00 H new ATOM 0 HG3 LYS A 400 -3.119 5.720 -11.198 1.00 0.00 H new ATOM 0 HD2 LYS A 400 -1.690 3.986 -11.818 1.00 0.00 H new ATOM 0 HD3 LYS A 400 -0.357 4.588 -10.853 1.00 0.00 H new ATOM 0 HE2 LYS A 400 -1.273 3.746 -8.830 1.00 0.00 H new ATOM 0 HE3 LYS A 400 -2.879 3.587 -9.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 -1.801 1.444 -9.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 -2.066 1.799 -10.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 -0.510 1.953 -10.277 1.00 0.00 H new ATOM 690 N ARG A 401 -2.586 9.957 -12.872 1.00 0.00 N ATOM 691 CA ARG A 401 -3.050 11.296 -12.530 1.00 0.00 C ATOM 692 C ARG A 401 -3.621 12.003 -13.755 1.00 0.00 C ATOM 693 O ARG A 401 -3.308 11.649 -14.892 1.00 0.00 O ATOM 694 CB ARG A 401 -1.905 12.121 -11.939 1.00 0.00 C ATOM 695 CG ARG A 401 -0.602 11.994 -12.712 1.00 0.00 C ATOM 696 CD ARG A 401 0.414 11.150 -11.957 1.00 0.00 C ATOM 697 NE ARG A 401 0.930 11.840 -10.778 1.00 0.00 N ATOM 698 CZ ARG A 401 2.007 11.445 -10.108 1.00 0.00 C ATOM 699 NH1 ARG A 401 2.678 10.371 -10.500 1.00 0.00 N ATOM 700 NH2 ARG A 401 2.415 12.125 -9.044 1.00 0.00 N ATOM 0 H ARG A 401 -2.292 9.848 -13.843 1.00 0.00 H new ATOM 0 HA ARG A 401 -3.841 11.200 -11.786 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -2.201 13.170 -11.911 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -1.738 11.809 -10.908 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -0.798 11.545 -13.686 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -0.188 12.986 -12.895 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -0.049 10.211 -11.654 1.00 0.00 H new ATOM 0 HD3 ARG A 401 1.241 10.898 -12.621 1.00 0.00 H new ATOM 0 HE ARG A 401 0.437 12.671 -10.451 1.00 0.00 H new ATOM 0 HH11 ARG A 401 2.368 9.846 -11.318 1.00 0.00 H new ATOM 0 HH12 ARG A 401 3.505 10.070 -9.984 1.00 0.00 H new ATOM 0 HH21 ARG A 401 1.902 12.952 -8.740 1.00 0.00 H new ATOM 0 HH22 ARG A 401 3.242 11.821 -8.531 1.00 0.00 H new ATOM 714 N LYS A 402 -4.460 13.005 -13.516 1.00 0.00 N ATOM 715 CA LYS A 402 -5.075 13.764 -14.599 1.00 0.00 C ATOM 716 C LYS A 402 -4.201 14.948 -14.998 1.00 0.00 C ATOM 717 O LYS A 402 -4.292 15.450 -16.119 1.00 0.00 O ATOM 718 CB LYS A 402 -6.461 14.258 -14.180 1.00 0.00 C ATOM 719 CG LYS A 402 -7.600 13.570 -14.913 1.00 0.00 C ATOM 720 CD LYS A 402 -8.413 14.557 -15.732 1.00 0.00 C ATOM 721 CE LYS A 402 -8.944 13.919 -17.007 1.00 0.00 C ATOM 722 NZ LYS A 402 -10.360 13.482 -16.861 1.00 0.00 N ATOM 0 H LYS A 402 -4.730 13.311 -12.581 1.00 0.00 H new ATOM 0 HA LYS A 402 -5.176 13.103 -15.460 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -6.584 14.103 -13.108 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -6.523 15.332 -14.356 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -7.198 12.797 -15.568 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -8.249 13.072 -14.193 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -9.246 14.928 -15.135 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -7.794 15.418 -15.985 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -8.867 14.631 -17.829 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -8.325 13.061 -17.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -10.684 13.053 -17.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -10.430 12.783 -16.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -10.956 14.304 -16.636 1.00 0.00 H new ATOM 736 N ASP A 403 -3.353 15.390 -14.076 1.00 0.00 N ATOM 737 CA ASP A 403 -2.460 16.514 -14.333 1.00 0.00 C ATOM 738 C ASP A 403 -1.389 16.135 -15.351 1.00 0.00 C ATOM 739 O ASP A 403 -1.214 16.812 -16.364 1.00 0.00 O ATOM 740 CB ASP A 403 -1.804 16.979 -13.032 1.00 0.00 C ATOM 741 CG ASP A 403 -1.026 18.269 -13.205 1.00 0.00 C ATOM 742 OD1 ASP A 403 -0.954 18.769 -14.347 1.00 0.00 O ATOM 743 OD2 ASP A 403 -0.489 18.778 -12.199 1.00 0.00 O ATOM 0 H ASP A 403 -3.265 14.987 -13.143 1.00 0.00 H new ATOM 0 HA ASP A 403 -3.053 17.331 -14.744 1.00 0.00 H new ATOM 0 HB2 ASP A 403 -2.572 17.120 -12.272 1.00 0.00 H new ATOM 0 HB3 ASP A 403 -1.134 16.200 -12.668 1.00 0.00 H new ATOM 748 N ARG A 404 -0.674 15.050 -15.074 1.00 0.00 N ATOM 749 CA ARG A 404 0.382 14.582 -15.964 1.00 0.00 C ATOM 750 C ARG A 404 -0.162 14.332 -17.367 1.00 0.00 C ATOM 751 O ARG A 404 0.279 14.952 -18.334 1.00 0.00 O ATOM 752 CB ARG A 404 1.013 13.302 -15.414 1.00 0.00 C ATOM 753 CG ARG A 404 1.947 13.539 -14.239 1.00 0.00 C ATOM 754 CD ARG A 404 3.149 14.378 -14.644 1.00 0.00 C ATOM 755 NE ARG A 404 3.306 15.556 -13.795 1.00 0.00 N ATOM 756 CZ ARG A 404 4.055 16.603 -14.122 1.00 0.00 C ATOM 757 NH1 ARG A 404 4.712 16.618 -15.273 1.00 0.00 N ATOM 758 NH2 ARG A 404 4.148 17.637 -13.296 1.00 0.00 N ATOM 0 H ARG A 404 -0.807 14.478 -14.240 1.00 0.00 H new ATOM 0 HA ARG A 404 1.145 15.358 -16.021 1.00 0.00 H new ATOM 0 HB2 ARG A 404 0.221 12.620 -15.105 1.00 0.00 H new ATOM 0 HB3 ARG A 404 1.566 12.808 -16.213 1.00 0.00 H new ATOM 0 HG2 ARG A 404 1.405 14.041 -13.437 1.00 0.00 H new ATOM 0 HG3 ARG A 404 2.287 12.582 -13.844 1.00 0.00 H new ATOM 0 HD2 ARG A 404 4.051 13.769 -14.589 1.00 0.00 H new ATOM 0 HD3 ARG A 404 3.039 14.692 -15.682 1.00 0.00 H new ATOM 0 HE ARG A 404 2.813 15.576 -12.902 1.00 0.00 H new ATOM 0 HH11 ARG A 404 4.643 15.824 -15.910 1.00 0.00 H new ATOM 0 HH12 ARG A 404 5.287 17.423 -15.522 1.00 0.00 H new ATOM 0 HH21 ARG A 404 3.644 17.628 -12.409 1.00 0.00 H new ATOM 0 HH22 ARG A 404 4.723 18.441 -13.548 1.00 0.00 H new ATOM 772 N MET A 405 -1.121 13.418 -17.470 1.00 0.00 N ATOM 773 CA MET A 405 -1.725 13.086 -18.756 1.00 0.00 C ATOM 774 C MET A 405 -2.204 14.345 -19.472 1.00 0.00 C ATOM 775 O MET A 405 -2.157 14.428 -20.700 1.00 0.00 O ATOM 776 CB MET A 405 -2.896 12.121 -18.559 1.00 0.00 C ATOM 777 CG MET A 405 -4.041 12.710 -17.752 1.00 0.00 C ATOM 778 SD MET A 405 -5.316 13.448 -18.791 1.00 0.00 S ATOM 779 CE MET A 405 -5.988 11.991 -19.587 1.00 0.00 C ATOM 0 H MET A 405 -1.497 12.894 -16.679 1.00 0.00 H new ATOM 0 HA MET A 405 -0.966 12.604 -19.373 1.00 0.00 H new ATOM 0 HB2 MET A 405 -3.271 11.814 -19.535 1.00 0.00 H new ATOM 0 HB3 MET A 405 -2.535 11.222 -18.059 1.00 0.00 H new ATOM 0 HG2 MET A 405 -4.487 11.928 -17.137 1.00 0.00 H new ATOM 0 HG3 MET A 405 -3.649 13.466 -17.072 1.00 0.00 H new ATOM 0 HE1 MET A 405 -6.487 12.279 -20.512 1.00 0.00 H new ATOM 0 HE2 MET A 405 -5.181 11.294 -19.812 1.00 0.00 H new ATOM 0 HE3 MET A 405 -6.706 11.512 -18.922 1.00 0.00 H new ATOM 789 N SER A 406 -2.665 15.323 -18.698 1.00 0.00 N ATOM 790 CA SER A 406 -3.156 16.575 -19.260 1.00 0.00 C ATOM 791 C SER A 406 -2.029 17.342 -19.946 1.00 0.00 C ATOM 792 O SER A 406 -2.244 18.013 -20.956 1.00 0.00 O ATOM 793 CB SER A 406 -3.782 17.439 -18.164 1.00 0.00 C ATOM 794 OG SER A 406 -3.613 18.818 -18.443 1.00 0.00 O ATOM 0 H SER A 406 -2.708 15.272 -17.680 1.00 0.00 H new ATOM 0 HA SER A 406 -3.916 16.337 -20.004 1.00 0.00 H new ATOM 0 HB2 SER A 406 -4.844 17.210 -18.078 1.00 0.00 H new ATOM 0 HB3 SER A 406 -3.326 17.200 -17.203 1.00 0.00 H new ATOM 0 HG SER A 406 -4.023 19.349 -17.729 1.00 0.00 H new ATOM 800 N TYR A 407 -0.827 17.237 -19.390 1.00 0.00 N ATOM 801 CA TYR A 407 0.334 17.922 -19.945 1.00 0.00 C ATOM 802 C TYR A 407 1.030 17.055 -20.990 1.00 0.00 C ATOM 803 O TYR A 407 1.773 17.556 -21.835 1.00 0.00 O ATOM 804 CB TYR A 407 1.317 18.288 -18.832 1.00 0.00 C ATOM 805 CG TYR A 407 2.579 18.953 -19.333 1.00 0.00 C ATOM 806 CD1 TYR A 407 2.522 20.120 -20.084 1.00 0.00 C ATOM 807 CD2 TYR A 407 3.830 18.414 -19.055 1.00 0.00 C ATOM 808 CE1 TYR A 407 3.672 20.731 -20.545 1.00 0.00 C ATOM 809 CE2 TYR A 407 4.985 19.019 -19.510 1.00 0.00 C ATOM 810 CZ TYR A 407 4.901 20.177 -20.255 1.00 0.00 C ATOM 811 OH TYR A 407 6.050 20.782 -20.711 1.00 0.00 O ATOM 0 H TYR A 407 -0.631 16.684 -18.555 1.00 0.00 H new ATOM 0 HA TYR A 407 -0.012 18.835 -20.429 1.00 0.00 H new ATOM 0 HB2 TYR A 407 0.821 18.954 -18.126 1.00 0.00 H new ATOM 0 HB3 TYR A 407 1.585 17.385 -18.284 1.00 0.00 H new ATOM 0 HD1 TYR A 407 1.561 20.558 -20.312 1.00 0.00 H new ATOM 0 HD2 TYR A 407 3.900 17.507 -18.473 1.00 0.00 H new ATOM 0 HE1 TYR A 407 3.609 21.637 -21.129 1.00 0.00 H new ATOM 0 HE2 TYR A 407 5.949 18.588 -19.284 1.00 0.00 H new ATOM 0 HH TYR A 407 6.830 20.265 -20.419 1.00 0.00 H new ATOM 821 N HIS A 408 0.783 15.750 -20.926 1.00 0.00 N ATOM 822 CA HIS A 408 1.384 14.811 -21.866 1.00 0.00 C ATOM 823 C HIS A 408 0.597 14.772 -23.173 1.00 0.00 C ATOM 824 O HIS A 408 1.173 14.842 -24.259 1.00 0.00 O ATOM 825 CB HIS A 408 1.448 13.412 -21.253 1.00 0.00 C ATOM 826 CG HIS A 408 2.052 12.387 -22.161 1.00 0.00 C ATOM 827 ND1 HIS A 408 3.412 12.225 -22.315 1.00 0.00 N ATOM 828 CD2 HIS A 408 1.472 11.466 -22.966 1.00 0.00 C ATOM 829 CE1 HIS A 408 3.643 11.250 -23.176 1.00 0.00 C ATOM 830 NE2 HIS A 408 2.482 10.772 -23.586 1.00 0.00 N ATOM 0 H HIS A 408 0.171 15.319 -20.233 1.00 0.00 H new ATOM 0 HA HIS A 408 2.397 15.150 -22.082 1.00 0.00 H new ATOM 0 HB2 HIS A 408 2.027 13.455 -20.331 1.00 0.00 H new ATOM 0 HB3 HIS A 408 0.440 13.097 -20.982 1.00 0.00 H new ATOM 0 HD1 HIS A 408 4.129 12.773 -21.838 1.00 0.00 H new ATOM 0 HD2 HIS A 408 0.412 11.307 -23.096 1.00 0.00 H new ATOM 0 HE1 HIS A 408 4.616 10.903 -23.491 1.00 0.00 H new ATOM 838 N VAL A 409 -0.723 14.658 -23.059 1.00 0.00 N ATOM 839 CA VAL A 409 -1.589 14.609 -24.231 1.00 0.00 C ATOM 840 C VAL A 409 -1.489 15.896 -25.042 1.00 0.00 C ATOM 841 O VAL A 409 -1.229 15.864 -26.245 1.00 0.00 O ATOM 842 CB VAL A 409 -3.059 14.379 -23.833 1.00 0.00 C ATOM 843 CG1 VAL A 409 -3.950 14.365 -25.066 1.00 0.00 C ATOM 844 CG2 VAL A 409 -3.201 13.084 -23.047 1.00 0.00 C ATOM 0 H VAL A 409 -1.215 14.598 -22.168 1.00 0.00 H new ATOM 0 HA VAL A 409 -1.250 13.771 -24.841 1.00 0.00 H new ATOM 0 HB VAL A 409 -3.378 15.202 -23.194 1.00 0.00 H new ATOM 0 HG11 VAL A 409 -4.985 14.201 -24.765 1.00 0.00 H new ATOM 0 HG12 VAL A 409 -3.869 15.321 -25.584 1.00 0.00 H new ATOM 0 HG13 VAL A 409 -3.635 13.563 -25.733 1.00 0.00 H new ATOM 0 HG21 VAL A 409 -4.246 12.937 -22.774 1.00 0.00 H new ATOM 0 HG22 VAL A 409 -2.865 12.248 -23.660 1.00 0.00 H new ATOM 0 HG23 VAL A 409 -2.594 13.138 -22.143 1.00 0.00 H new ATOM 854 N ARG A 410 -1.697 17.026 -24.376 1.00 0.00 N ATOM 855 CA ARG A 410 -1.631 18.325 -25.036 1.00 0.00 C ATOM 856 C ARG A 410 -0.232 18.584 -25.588 1.00 0.00 C ATOM 857 O ARG A 410 -0.071 19.249 -26.611 1.00 0.00 O ATOM 858 CB ARG A 410 -2.019 19.437 -24.059 1.00 0.00 C ATOM 859 CG ARG A 410 -3.347 19.198 -23.361 1.00 0.00 C ATOM 860 CD ARG A 410 -4.517 19.357 -24.320 1.00 0.00 C ATOM 861 NE ARG A 410 -5.742 18.764 -23.791 1.00 0.00 N ATOM 862 CZ ARG A 410 -6.875 18.682 -24.479 1.00 0.00 C ATOM 863 NH1 ARG A 410 -6.938 19.151 -25.717 1.00 0.00 N ATOM 864 NH2 ARG A 410 -7.949 18.128 -23.929 1.00 0.00 N ATOM 0 H ARG A 410 -1.913 17.069 -23.380 1.00 0.00 H new ATOM 0 HA ARG A 410 -2.336 18.318 -25.868 1.00 0.00 H new ATOM 0 HB2 ARG A 410 -1.236 19.538 -23.307 1.00 0.00 H new ATOM 0 HB3 ARG A 410 -2.067 20.383 -24.599 1.00 0.00 H new ATOM 0 HG2 ARG A 410 -3.359 18.195 -22.933 1.00 0.00 H new ATOM 0 HG3 ARG A 410 -3.456 19.899 -22.533 1.00 0.00 H new ATOM 0 HD2 ARG A 410 -4.683 20.416 -24.517 1.00 0.00 H new ATOM 0 HD3 ARG A 410 -4.270 18.890 -25.273 1.00 0.00 H new ATOM 0 HE ARG A 410 -5.727 18.392 -22.841 1.00 0.00 H new ATOM 0 HH11 ARG A 410 -6.115 19.576 -26.144 1.00 0.00 H new ATOM 0 HH12 ARG A 410 -7.810 19.087 -26.243 1.00 0.00 H new ATOM 0 HH21 ARG A 410 -7.905 17.765 -22.977 1.00 0.00 H new ATOM 0 HH22 ARG A 410 -8.819 18.066 -24.459 1.00 0.00 H new ATOM 878 N SER A 411 0.777 18.054 -24.903 1.00 0.00 N ATOM 879 CA SER A 411 2.162 18.231 -25.323 1.00 0.00 C ATOM 880 C SER A 411 2.351 17.791 -26.772 1.00 0.00 C ATOM 881 O SER A 411 3.231 18.289 -27.474 1.00 0.00 O ATOM 882 CB SER A 411 3.099 17.437 -24.411 1.00 0.00 C ATOM 883 OG SER A 411 4.147 16.839 -25.153 1.00 0.00 O ATOM 0 H SER A 411 0.661 17.499 -24.055 1.00 0.00 H new ATOM 0 HA SER A 411 2.406 19.291 -25.249 1.00 0.00 H new ATOM 0 HB2 SER A 411 3.518 18.097 -23.651 1.00 0.00 H new ATOM 0 HB3 SER A 411 2.534 16.666 -23.887 1.00 0.00 H new ATOM 0 HG SER A 411 4.733 16.339 -24.547 1.00 0.00 H new ATOM 889 N HIS A 412 1.518 16.853 -27.212 1.00 0.00 N ATOM 890 CA HIS A 412 1.592 16.345 -28.577 1.00 0.00 C ATOM 891 C HIS A 412 0.734 17.186 -29.518 1.00 0.00 C ATOM 892 O HIS A 412 1.093 17.401 -30.675 1.00 0.00 O ATOM 893 CB HIS A 412 1.142 14.884 -28.626 1.00 0.00 C ATOM 894 CG HIS A 412 1.749 14.034 -27.553 1.00 0.00 C ATOM 895 ND1 HIS A 412 3.107 13.979 -27.315 1.00 0.00 N ATOM 896 CD2 HIS A 412 1.177 13.204 -26.651 1.00 0.00 C ATOM 897 CE1 HIS A 412 3.342 13.150 -26.314 1.00 0.00 C ATOM 898 NE2 HIS A 412 2.187 12.666 -25.893 1.00 0.00 N ATOM 0 H HIS A 412 0.785 16.430 -26.643 1.00 0.00 H new ATOM 0 HA HIS A 412 2.629 16.409 -28.906 1.00 0.00 H new ATOM 0 HB2 HIS A 412 0.056 14.844 -28.539 1.00 0.00 H new ATOM 0 HB3 HIS A 412 1.400 14.465 -29.599 1.00 0.00 H new ATOM 0 HD2 HIS A 412 0.121 13.002 -26.547 1.00 0.00 H new ATOM 0 HE1 HIS A 412 4.313 12.909 -25.908 1.00 0.00 H new ATOM 0 HE2 HIS A 412 2.066 12.001 -25.129 1.00 0.00 H new ATOM 959 N LYS A 418 -8.997 18.757 -34.903 1.00 0.00 N ATOM 960 CA LYS A 418 -10.437 18.725 -35.128 1.00 0.00 C ATOM 961 C LYS A 418 -10.789 19.320 -36.488 1.00 0.00 C ATOM 962 O LYS A 418 -10.009 20.059 -37.089 1.00 0.00 O ATOM 963 CB LYS A 418 -11.165 19.491 -34.021 1.00 0.00 C ATOM 964 CG LYS A 418 -11.574 18.620 -32.846 1.00 0.00 C ATOM 965 CD LYS A 418 -10.379 17.897 -32.246 1.00 0.00 C ATOM 966 CE LYS A 418 -10.776 17.087 -31.021 1.00 0.00 C ATOM 967 NZ LYS A 418 -10.979 17.953 -29.826 1.00 0.00 N ATOM 0 HA LYS A 418 -10.758 17.684 -35.112 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -10.520 20.293 -33.661 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -12.054 19.961 -34.441 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -12.048 19.237 -32.083 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -12.315 17.891 -33.173 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -9.939 17.237 -32.993 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -9.613 18.623 -31.971 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -11.693 16.537 -31.231 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -10.003 16.349 -30.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -11.232 17.362 -29.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -10.102 18.472 -29.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -11.746 18.630 -30.014 1.00 0.00 H new ATOM 981 N PRO A 419 -11.991 18.992 -36.985 1.00 0.00 N ATOM 982 CA PRO A 419 -12.473 19.485 -38.279 1.00 0.00 C ATOM 983 C PRO A 419 -12.783 20.978 -38.251 1.00 0.00 C ATOM 984 O PRO A 419 -12.421 21.714 -39.170 1.00 0.00 O ATOM 985 CB PRO A 419 -13.753 18.678 -38.511 1.00 0.00 C ATOM 986 CG PRO A 419 -14.216 18.300 -37.147 1.00 0.00 C ATOM 987 CD PRO A 419 -12.971 18.115 -36.323 1.00 0.00 C ATOM 0 HA PRO A 419 -11.728 19.364 -39.065 1.00 0.00 H new ATOM 0 HB2 PRO A 419 -14.504 19.270 -39.034 1.00 0.00 H new ATOM 0 HB3 PRO A 419 -13.560 17.796 -39.122 1.00 0.00 H new ATOM 0 HG2 PRO A 419 -14.853 19.076 -36.722 1.00 0.00 H new ATOM 0 HG3 PRO A 419 -14.805 17.383 -37.175 1.00 0.00 H new ATOM 0 HD2 PRO A 419 -13.130 18.403 -35.284 1.00 0.00 H new ATOM 0 HD3 PRO A 419 -12.642 17.076 -36.319 1.00 0.00 H new ATOM 995 N TYR A 420 -13.453 21.418 -37.193 1.00 0.00 N ATOM 996 CA TYR A 420 -13.813 22.824 -37.047 1.00 0.00 C ATOM 997 C TYR A 420 -13.072 23.457 -35.873 1.00 0.00 C ATOM 998 O TYR A 420 -12.954 22.859 -34.803 1.00 0.00 O ATOM 999 CB TYR A 420 -15.323 22.967 -36.848 1.00 0.00 C ATOM 1000 CG TYR A 420 -16.142 22.331 -37.948 1.00 0.00 C ATOM 1001 CD1 TYR A 420 -16.184 22.887 -39.221 1.00 0.00 C ATOM 1002 CD2 TYR A 420 -16.872 21.172 -37.715 1.00 0.00 C ATOM 1003 CE1 TYR A 420 -16.932 22.309 -40.228 1.00 0.00 C ATOM 1004 CE2 TYR A 420 -17.621 20.586 -38.717 1.00 0.00 C ATOM 1005 CZ TYR A 420 -17.648 21.158 -39.972 1.00 0.00 C ATOM 1006 OH TYR A 420 -18.392 20.579 -40.974 1.00 0.00 O ATOM 0 H TYR A 420 -13.758 20.822 -36.423 1.00 0.00 H new ATOM 0 HA TYR A 420 -13.522 23.344 -37.960 1.00 0.00 H new ATOM 0 HB2 TYR A 420 -15.599 22.517 -35.894 1.00 0.00 H new ATOM 0 HB3 TYR A 420 -15.574 24.026 -36.786 1.00 0.00 H new ATOM 0 HD1 TYR A 420 -15.622 23.786 -39.426 1.00 0.00 H new ATOM 0 HD2 TYR A 420 -16.854 20.721 -36.734 1.00 0.00 H new ATOM 0 HE1 TYR A 420 -16.956 22.756 -41.211 1.00 0.00 H new ATOM 0 HE2 TYR A 420 -18.182 19.685 -38.519 1.00 0.00 H new ATOM 0 HH TYR A 420 -18.835 19.775 -40.630 1.00 0.00 H new ATOM 1016 N ILE A 421 -12.575 24.671 -36.082 1.00 0.00 N ATOM 1017 CA ILE A 421 -11.847 25.387 -35.041 1.00 0.00 C ATOM 1018 C ILE A 421 -12.366 26.813 -34.889 1.00 0.00 C ATOM 1019 O ILE A 421 -12.765 27.448 -35.866 1.00 0.00 O ATOM 1020 CB ILE A 421 -10.337 25.432 -35.340 1.00 0.00 C ATOM 1021 CG1 ILE A 421 -10.089 25.979 -36.748 1.00 0.00 C ATOM 1022 CG2 ILE A 421 -9.726 24.046 -35.190 1.00 0.00 C ATOM 1023 CD1 ILE A 421 -10.096 24.913 -37.820 1.00 0.00 C ATOM 0 H ILE A 421 -12.663 25.179 -36.962 1.00 0.00 H new ATOM 0 HA ILE A 421 -12.009 24.842 -34.111 1.00 0.00 H new ATOM 0 HB ILE A 421 -9.859 26.099 -34.622 1.00 0.00 H new ATOM 0 HG12 ILE A 421 -10.853 26.721 -36.980 1.00 0.00 H new ATOM 0 HG13 ILE A 421 -9.128 26.494 -36.765 1.00 0.00 H new ATOM 0 HG21 ILE A 421 -8.658 24.094 -35.405 1.00 0.00 H new ATOM 0 HG22 ILE A 421 -9.876 23.691 -34.170 1.00 0.00 H new ATOM 0 HG23 ILE A 421 -10.206 23.359 -35.888 1.00 0.00 H new ATOM 0 HD11 ILE A 421 -9.914 25.373 -38.791 1.00 0.00 H new ATOM 0 HD12 ILE A 421 -9.314 24.183 -37.612 1.00 0.00 H new ATOM 0 HD13 ILE A 421 -11.065 24.414 -37.831 1.00 0.00 H new ATOM 1035 N CYS A 422 -12.356 27.312 -33.658 1.00 0.00 N ATOM 1036 CA CYS A 422 -12.824 28.664 -33.376 1.00 0.00 C ATOM 1037 C CYS A 422 -12.138 29.678 -34.286 1.00 0.00 C ATOM 1038 O CYS A 422 -11.071 29.409 -34.837 1.00 0.00 O ATOM 1039 CB CYS A 422 -12.566 29.020 -31.911 1.00 0.00 C ATOM 1040 SG CYS A 422 -13.572 30.409 -31.295 1.00 0.00 S ATOM 0 H CYS A 422 -12.029 26.800 -32.839 1.00 0.00 H new ATOM 0 HA CYS A 422 -13.896 28.698 -33.568 1.00 0.00 H new ATOM 0 HB2 CYS A 422 -12.762 28.142 -31.295 1.00 0.00 H new ATOM 0 HB3 CYS A 422 -11.511 29.267 -31.788 1.00 0.00 H new ATOM 0 HG CYS A 422 -12.953 30.990 -30.310 1.00 0.00 H new ATOM 1045 N GLN A 423 -12.758 30.844 -34.438 1.00 0.00 N ATOM 1046 CA GLN A 423 -12.206 31.898 -35.281 1.00 0.00 C ATOM 1047 C GLN A 423 -11.337 32.849 -34.465 1.00 0.00 C ATOM 1048 O GLN A 423 -10.686 33.737 -35.016 1.00 0.00 O ATOM 1049 CB GLN A 423 -13.333 32.676 -35.963 1.00 0.00 C ATOM 1050 CG GLN A 423 -14.240 33.412 -34.990 1.00 0.00 C ATOM 1051 CD GLN A 423 -15.707 33.103 -35.212 1.00 0.00 C ATOM 1052 OE1 GLN A 423 -16.096 31.942 -35.340 1.00 0.00 O ATOM 1053 NE2 GLN A 423 -16.531 34.143 -35.258 1.00 0.00 N ATOM 0 H GLN A 423 -13.642 31.082 -33.989 1.00 0.00 H new ATOM 0 HA GLN A 423 -11.583 31.430 -36.043 1.00 0.00 H new ATOM 0 HB2 GLN A 423 -12.898 33.396 -36.657 1.00 0.00 H new ATOM 0 HB3 GLN A 423 -13.934 31.985 -36.555 1.00 0.00 H new ATOM 0 HG2 GLN A 423 -13.966 33.143 -33.970 1.00 0.00 H new ATOM 0 HG3 GLN A 423 -14.079 34.485 -35.091 1.00 0.00 H new ATOM 0 HE21 GLN A 423 -16.165 35.089 -35.147 1.00 0.00 H new ATOM 0 HE22 GLN A 423 -17.530 33.996 -35.404 1.00 0.00 H new ATOM 1062 N SER A 424 -11.331 32.656 -33.150 1.00 0.00 N ATOM 1063 CA SER A 424 -10.544 33.500 -32.258 1.00 0.00 C ATOM 1064 C SER A 424 -9.386 32.715 -31.650 1.00 0.00 C ATOM 1065 O SER A 424 -8.233 32.876 -32.052 1.00 0.00 O ATOM 1066 CB SER A 424 -11.429 34.067 -31.147 1.00 0.00 C ATOM 1067 OG SER A 424 -11.982 35.317 -31.523 1.00 0.00 O ATOM 0 H SER A 424 -11.862 31.923 -32.679 1.00 0.00 H new ATOM 0 HA SER A 424 -10.135 34.323 -32.843 1.00 0.00 H new ATOM 0 HB2 SER A 424 -12.231 33.364 -30.922 1.00 0.00 H new ATOM 0 HB3 SER A 424 -10.843 34.184 -30.235 1.00 0.00 H new ATOM 0 HG SER A 424 -12.545 35.657 -30.797 1.00 0.00 H new ATOM 1073 N CYS A 425 -9.700 31.865 -30.678 1.00 0.00 N ATOM 1074 CA CYS A 425 -8.687 31.055 -30.013 1.00 0.00 C ATOM 1075 C CYS A 425 -8.239 29.903 -30.907 1.00 0.00 C ATOM 1076 O CYS A 425 -7.198 29.290 -30.672 1.00 0.00 O ATOM 1077 CB CYS A 425 -9.229 30.508 -28.691 1.00 0.00 C ATOM 1078 SG CYS A 425 -10.742 29.508 -28.864 1.00 0.00 S ATOM 0 H CYS A 425 -10.649 31.719 -30.333 1.00 0.00 H new ATOM 0 HA CYS A 425 -7.825 31.690 -29.810 1.00 0.00 H new ATOM 0 HB2 CYS A 425 -8.457 29.901 -28.218 1.00 0.00 H new ATOM 0 HB3 CYS A 425 -9.433 31.343 -28.021 1.00 0.00 H new ATOM 0 HG CYS A 425 -11.122 29.090 -27.693 1.00 0.00 H new ATOM 1083 N GLY A 426 -9.033 29.614 -31.933 1.00 0.00 N ATOM 1084 CA GLY A 426 -8.701 28.536 -32.847 1.00 0.00 C ATOM 1085 C GLY A 426 -8.342 27.253 -32.125 1.00 0.00 C ATOM 1086 O GLY A 426 -7.352 26.601 -32.457 1.00 0.00 O ATOM 0 H GLY A 426 -9.900 30.107 -32.148 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -9.547 28.352 -33.509 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -7.865 28.842 -33.476 1.00 0.00 H new ATOM 1090 N LYS A 427 -9.146 26.890 -31.131 1.00 0.00 N ATOM 1091 CA LYS A 427 -8.908 25.677 -30.358 1.00 0.00 C ATOM 1092 C LYS A 427 -9.205 24.434 -31.191 1.00 0.00 C ATOM 1093 O LYS A 427 -8.291 23.756 -31.660 1.00 0.00 O ATOM 1094 CB LYS A 427 -9.772 25.675 -29.095 1.00 0.00 C ATOM 1095 CG LYS A 427 -9.618 24.418 -28.255 1.00 0.00 C ATOM 1096 CD LYS A 427 -10.235 24.590 -26.877 1.00 0.00 C ATOM 1097 CE LYS A 427 -9.665 23.590 -25.883 1.00 0.00 C ATOM 1098 NZ LYS A 427 -8.926 24.264 -24.780 1.00 0.00 N ATOM 0 H LYS A 427 -9.969 27.419 -30.842 1.00 0.00 H new ATOM 0 HA LYS A 427 -7.856 25.659 -30.072 1.00 0.00 H new ATOM 0 HB2 LYS A 427 -9.514 26.542 -28.487 1.00 0.00 H new ATOM 0 HB3 LYS A 427 -10.818 25.785 -29.380 1.00 0.00 H new ATOM 0 HG2 LYS A 427 -10.091 23.578 -28.764 1.00 0.00 H new ATOM 0 HG3 LYS A 427 -8.560 24.174 -28.153 1.00 0.00 H new ATOM 0 HD2 LYS A 427 -10.053 25.604 -26.520 1.00 0.00 H new ATOM 0 HD3 LYS A 427 -11.316 24.464 -26.943 1.00 0.00 H new ATOM 0 HE2 LYS A 427 -10.475 22.992 -25.465 1.00 0.00 H new ATOM 0 HE3 LYS A 427 -8.996 22.903 -26.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 427 -8.553 23.548 -24.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 427 -8.138 24.815 -25.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 427 -9.570 24.900 -24.268 1.00 0.00 H new ATOM 1112 N GLY A 428 -10.489 24.141 -31.372 1.00 0.00 N ATOM 1113 CA GLY A 428 -10.883 22.981 -32.150 1.00 0.00 C ATOM 1114 C GLY A 428 -11.849 22.083 -31.403 1.00 0.00 C ATOM 1115 O GLY A 428 -11.536 21.585 -30.322 1.00 0.00 O ATOM 0 H GLY A 428 -11.264 24.686 -30.994 1.00 0.00 H new ATOM 0 HA2 GLY A 428 -11.344 23.311 -33.081 1.00 0.00 H new ATOM 0 HA3 GLY A 428 -9.995 22.409 -32.420 1.00 0.00 H new ATOM 1119 N PHE A 429 -13.028 21.876 -31.980 1.00 0.00 N ATOM 1120 CA PHE A 429 -14.045 21.034 -31.360 1.00 0.00 C ATOM 1121 C PHE A 429 -14.447 19.893 -32.291 1.00 0.00 C ATOM 1122 O PHE A 429 -14.546 20.073 -33.504 1.00 0.00 O ATOM 1123 CB PHE A 429 -15.275 21.868 -30.996 1.00 0.00 C ATOM 1124 CG PHE A 429 -15.053 22.784 -29.826 1.00 0.00 C ATOM 1125 CD1 PHE A 429 -14.450 24.019 -30.002 1.00 0.00 C ATOM 1126 CD2 PHE A 429 -15.447 22.409 -28.552 1.00 0.00 C ATOM 1127 CE1 PHE A 429 -14.245 24.865 -28.928 1.00 0.00 C ATOM 1128 CE2 PHE A 429 -15.244 23.251 -27.474 1.00 0.00 C ATOM 1129 CZ PHE A 429 -14.642 24.479 -27.662 1.00 0.00 C ATOM 0 H PHE A 429 -13.303 22.279 -32.876 1.00 0.00 H new ATOM 0 HA PHE A 429 -13.623 20.606 -30.451 1.00 0.00 H new ATOM 0 HB2 PHE A 429 -15.571 22.462 -31.861 1.00 0.00 H new ATOM 0 HB3 PHE A 429 -16.105 21.198 -30.771 1.00 0.00 H new ATOM 0 HD1 PHE A 429 -14.137 24.324 -30.989 1.00 0.00 H new ATOM 0 HD2 PHE A 429 -15.918 21.449 -28.399 1.00 0.00 H new ATOM 0 HE1 PHE A 429 -13.775 25.826 -29.078 1.00 0.00 H new ATOM 0 HE2 PHE A 429 -15.556 22.948 -26.486 1.00 0.00 H new ATOM 0 HZ PHE A 429 -14.482 25.137 -26.821 1.00 0.00 H new ATOM 1139 N SER A 430 -14.678 18.719 -31.712 1.00 0.00 N ATOM 1140 CA SER A 430 -15.065 17.547 -32.489 1.00 0.00 C ATOM 1141 C SER A 430 -16.264 17.858 -33.380 1.00 0.00 C ATOM 1142 O SER A 430 -16.204 17.697 -34.599 1.00 0.00 O ATOM 1143 CB SER A 430 -15.396 16.379 -31.558 1.00 0.00 C ATOM 1144 OG SER A 430 -15.052 15.140 -32.153 1.00 0.00 O ATOM 0 H SER A 430 -14.604 18.554 -30.708 1.00 0.00 H new ATOM 0 HA SER A 430 -14.225 17.269 -33.125 1.00 0.00 H new ATOM 0 HB2 SER A 430 -14.858 16.496 -30.617 1.00 0.00 H new ATOM 0 HB3 SER A 430 -16.460 16.389 -31.321 1.00 0.00 H new ATOM 0 HG SER A 430 -15.272 14.409 -31.538 1.00 0.00 H new ATOM 1150 N ARG A 431 -17.353 18.304 -32.761 1.00 0.00 N ATOM 1151 CA ARG A 431 -18.567 18.636 -33.497 1.00 0.00 C ATOM 1152 C ARG A 431 -18.651 20.137 -33.756 1.00 0.00 C ATOM 1153 O ARG A 431 -17.995 20.944 -33.098 1.00 0.00 O ATOM 1154 CB ARG A 431 -19.802 18.172 -32.721 1.00 0.00 C ATOM 1155 CG ARG A 431 -20.382 16.862 -33.229 1.00 0.00 C ATOM 1156 CD ARG A 431 -19.731 15.665 -32.553 1.00 0.00 C ATOM 1157 NE ARG A 431 -20.581 14.478 -32.605 1.00 0.00 N ATOM 1158 CZ ARG A 431 -20.282 13.333 -32.002 1.00 0.00 C ATOM 1159 NH1 ARG A 431 -19.160 13.221 -31.304 1.00 0.00 N ATOM 1160 NH2 ARG A 431 -21.106 12.298 -32.096 1.00 0.00 N ATOM 0 H ARG A 431 -17.419 18.444 -31.753 1.00 0.00 H new ATOM 0 HA ARG A 431 -18.534 18.120 -34.456 1.00 0.00 H new ATOM 0 HB2 ARG A 431 -19.539 18.060 -31.669 1.00 0.00 H new ATOM 0 HB3 ARG A 431 -20.568 18.945 -32.777 1.00 0.00 H new ATOM 0 HG2 ARG A 431 -21.457 16.844 -33.047 1.00 0.00 H new ATOM 0 HG3 ARG A 431 -20.240 16.794 -34.308 1.00 0.00 H new ATOM 0 HD2 ARG A 431 -18.778 15.450 -33.036 1.00 0.00 H new ATOM 0 HD3 ARG A 431 -19.513 15.910 -31.513 1.00 0.00 H new ATOM 0 HE ARG A 431 -21.452 14.531 -33.133 1.00 0.00 H new ATOM 0 HH11 ARG A 431 -18.524 14.015 -31.229 1.00 0.00 H new ATOM 0 HH12 ARG A 431 -18.933 12.341 -30.842 1.00 0.00 H new ATOM 0 HH21 ARG A 431 -21.970 12.381 -32.632 1.00 0.00 H new ATOM 0 HH22 ARG A 431 -20.876 11.419 -31.633 1.00 0.00 H new ATOM 1174 N PRO A 432 -19.478 20.522 -34.740 1.00 0.00 N ATOM 1175 CA PRO A 432 -19.668 21.928 -35.110 1.00 0.00 C ATOM 1176 C PRO A 432 -20.418 22.713 -34.039 1.00 0.00 C ATOM 1177 O PRO A 432 -19.997 23.801 -33.644 1.00 0.00 O ATOM 1178 CB PRO A 432 -20.498 21.848 -36.394 1.00 0.00 C ATOM 1179 CG PRO A 432 -21.217 20.547 -36.300 1.00 0.00 C ATOM 1180 CD PRO A 432 -20.292 19.615 -35.566 1.00 0.00 C ATOM 0 HA PRO A 432 -18.718 22.449 -35.232 1.00 0.00 H new ATOM 0 HB2 PRO A 432 -21.196 22.682 -36.467 1.00 0.00 H new ATOM 0 HB3 PRO A 432 -19.863 21.886 -37.279 1.00 0.00 H new ATOM 0 HG2 PRO A 432 -22.161 20.660 -35.767 1.00 0.00 H new ATOM 0 HG3 PRO A 432 -21.455 20.160 -37.291 1.00 0.00 H new ATOM 0 HD2 PRO A 432 -20.843 18.901 -34.954 1.00 0.00 H new ATOM 0 HD3 PRO A 432 -19.676 19.036 -36.254 1.00 0.00 H new ATOM 1188 N ASP A 433 -21.529 22.155 -33.572 1.00 0.00 N ATOM 1189 CA ASP A 433 -22.337 22.802 -32.545 1.00 0.00 C ATOM 1190 C ASP A 433 -21.485 23.171 -31.335 1.00 0.00 C ATOM 1191 O ASP A 433 -21.686 24.216 -30.715 1.00 0.00 O ATOM 1192 CB ASP A 433 -23.485 21.887 -32.117 1.00 0.00 C ATOM 1193 CG ASP A 433 -24.824 22.342 -32.663 1.00 0.00 C ATOM 1194 OD1 ASP A 433 -24.885 22.707 -33.856 1.00 0.00 O ATOM 1195 OD2 ASP A 433 -25.811 22.332 -31.898 1.00 0.00 O ATOM 0 H ASP A 433 -21.891 21.255 -33.888 1.00 0.00 H new ATOM 0 HA ASP A 433 -22.751 23.718 -32.967 1.00 0.00 H new ATOM 0 HB2 ASP A 433 -23.283 20.872 -32.459 1.00 0.00 H new ATOM 0 HB3 ASP A 433 -23.532 21.854 -31.029 1.00 0.00 H new ATOM 1200 N HIS A 434 -20.532 22.305 -31.003 1.00 0.00 N ATOM 1201 CA HIS A 434 -19.649 22.540 -29.866 1.00 0.00 C ATOM 1202 C HIS A 434 -18.917 23.871 -30.012 1.00 0.00 C ATOM 1203 O HIS A 434 -18.556 24.504 -29.020 1.00 0.00 O ATOM 1204 CB HIS A 434 -18.638 21.400 -29.736 1.00 0.00 C ATOM 1205 CG HIS A 434 -19.257 20.090 -29.356 1.00 0.00 C ATOM 1206 ND1 HIS A 434 -20.480 19.578 -29.626 1.00 0.00 N flip ATOM 1207 CD2 HIS A 434 -18.601 19.138 -28.605 1.00 0.00 C flip ATOM 1208 CE1 HIS A 434 -20.541 18.337 -29.041 1.00 0.00 C flip ATOM 1209 NE2 HIS A 434 -19.394 18.095 -28.431 1.00 0.00 N flip ATOM 0 H HIS A 434 -20.352 21.435 -31.505 1.00 0.00 H new ATOM 0 HA HIS A 434 -20.260 22.579 -28.964 1.00 0.00 H new ATOM 0 HB2 HIS A 434 -18.112 21.282 -30.683 1.00 0.00 H new ATOM 0 HB3 HIS A 434 -17.892 21.670 -28.988 1.00 0.00 H new ATOM 0 HD2 HIS A 434 -17.596 19.230 -28.219 1.00 0.00 H new ATOM 0 HE1 HIS A 434 -21.388 17.668 -29.074 1.00 0.00 H new ATOM 0 HE2 HIS A 434 -19.160 17.247 -27.914 1.00 0.00 H new ATOM 1217 N LEU A 435 -18.701 24.288 -31.254 1.00 0.00 N ATOM 1218 CA LEU A 435 -18.011 25.544 -31.530 1.00 0.00 C ATOM 1219 C LEU A 435 -18.992 26.712 -31.544 1.00 0.00 C ATOM 1220 O LEU A 435 -18.667 27.814 -31.104 1.00 0.00 O ATOM 1221 CB LEU A 435 -17.279 25.462 -32.871 1.00 0.00 C ATOM 1222 CG LEU A 435 -16.419 26.672 -33.241 1.00 0.00 C ATOM 1223 CD1 LEU A 435 -15.234 26.794 -32.296 1.00 0.00 C ATOM 1224 CD2 LEU A 435 -15.946 26.568 -34.683 1.00 0.00 C ATOM 0 H LEU A 435 -18.993 23.776 -32.086 1.00 0.00 H new ATOM 0 HA LEU A 435 -17.284 25.713 -30.736 1.00 0.00 H new ATOM 0 HB2 LEU A 435 -16.642 24.578 -32.861 1.00 0.00 H new ATOM 0 HB3 LEU A 435 -18.019 25.313 -33.658 1.00 0.00 H new ATOM 0 HG LEU A 435 -17.028 27.571 -33.143 1.00 0.00 H new ATOM 0 HD11 LEU A 435 -14.634 27.660 -32.575 1.00 0.00 H new ATOM 0 HD12 LEU A 435 -15.594 26.916 -31.274 1.00 0.00 H new ATOM 0 HD13 LEU A 435 -14.623 25.894 -32.360 1.00 0.00 H new ATOM 0 HD21 LEU A 435 -15.336 27.437 -34.929 1.00 0.00 H new ATOM 0 HD22 LEU A 435 -15.354 25.661 -34.807 1.00 0.00 H new ATOM 0 HD23 LEU A 435 -16.809 26.531 -35.347 1.00 0.00 H new ATOM 1236 N ASN A 436 -20.195 26.462 -32.051 1.00 0.00 N ATOM 1237 CA ASN A 436 -21.224 27.493 -32.121 1.00 0.00 C ATOM 1238 C ASN A 436 -21.412 28.167 -30.765 1.00 0.00 C ATOM 1239 O ASN A 436 -21.240 29.378 -30.633 1.00 0.00 O ATOM 1240 CB ASN A 436 -22.549 26.889 -32.591 1.00 0.00 C ATOM 1241 CG ASN A 436 -23.213 27.721 -33.671 1.00 0.00 C ATOM 1242 OD1 ASN A 436 -23.762 27.185 -34.634 1.00 0.00 O ATOM 1243 ND2 ASN A 436 -23.166 29.039 -33.515 1.00 0.00 N ATOM 0 H ASN A 436 -20.481 25.555 -32.419 1.00 0.00 H new ATOM 0 HA ASN A 436 -20.900 28.246 -32.839 1.00 0.00 H new ATOM 0 HB2 ASN A 436 -22.372 25.882 -32.969 1.00 0.00 H new ATOM 0 HB3 ASN A 436 -23.225 26.796 -31.741 1.00 0.00 H new ATOM 0 HD21 ASN A 436 -23.596 29.650 -34.209 1.00 0.00 H new ATOM 0 HD22 ASN A 436 -22.700 29.440 -32.701 1.00 0.00 H new ATOM 1250 N GLY A 437 -21.765 27.372 -29.759 1.00 0.00 N ATOM 1251 CA GLY A 437 -21.969 27.909 -28.426 1.00 0.00 C ATOM 1252 C GLY A 437 -20.707 28.515 -27.845 1.00 0.00 C ATOM 1253 O GLY A 437 -20.754 29.556 -27.189 1.00 0.00 O ATOM 0 H GLY A 437 -21.913 26.366 -29.843 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -22.751 28.668 -28.459 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -22.323 27.115 -27.768 1.00 0.00 H new ATOM 1257 N HIS A 438 -19.574 27.862 -28.085 1.00 0.00 N ATOM 1258 CA HIS A 438 -18.293 28.342 -27.580 1.00 0.00 C ATOM 1259 C HIS A 438 -18.076 29.805 -27.952 1.00 0.00 C ATOM 1260 O HIS A 438 -17.589 30.596 -27.143 1.00 0.00 O ATOM 1261 CB HIS A 438 -17.151 27.488 -28.132 1.00 0.00 C ATOM 1262 CG HIS A 438 -15.795 28.084 -27.907 1.00 0.00 C ATOM 1263 ND1 HIS A 438 -14.953 27.677 -26.893 1.00 0.00 N ATOM 1264 CD2 HIS A 438 -15.136 29.061 -28.573 1.00 0.00 C ATOM 1265 CE1 HIS A 438 -13.835 28.379 -26.944 1.00 0.00 C ATOM 1266 NE2 HIS A 438 -13.920 29.225 -27.955 1.00 0.00 N ATOM 0 H HIS A 438 -19.517 26.999 -28.626 1.00 0.00 H new ATOM 0 HA HIS A 438 -18.305 28.260 -26.493 1.00 0.00 H new ATOM 0 HB2 HIS A 438 -17.188 26.503 -27.667 1.00 0.00 H new ATOM 0 HB3 HIS A 438 -17.302 27.342 -29.202 1.00 0.00 H new ATOM 0 HD2 HIS A 438 -15.498 29.609 -29.430 1.00 0.00 H new ATOM 0 HE1 HIS A 438 -12.995 28.278 -26.273 1.00 0.00 H new ATOM 0 HE2 HIS A 438 -13.200 29.892 -28.232 1.00 0.00 H new ATOM 1274 N ILE A 439 -18.440 30.159 -29.180 1.00 0.00 N ATOM 1275 CA ILE A 439 -18.286 31.527 -29.658 1.00 0.00 C ATOM 1276 C ILE A 439 -18.961 32.518 -28.716 1.00 0.00 C ATOM 1277 O ILE A 439 -18.417 33.583 -28.422 1.00 0.00 O ATOM 1278 CB ILE A 439 -18.871 31.699 -31.072 1.00 0.00 C ATOM 1279 CG1 ILE A 439 -18.163 30.767 -32.057 1.00 0.00 C ATOM 1280 CG2 ILE A 439 -18.749 33.147 -31.523 1.00 0.00 C ATOM 1281 CD1 ILE A 439 -19.085 30.181 -33.104 1.00 0.00 C ATOM 0 H ILE A 439 -18.844 29.517 -29.862 1.00 0.00 H new ATOM 0 HA ILE A 439 -17.216 31.731 -29.690 1.00 0.00 H new ATOM 0 HB ILE A 439 -19.928 31.435 -31.047 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -17.364 31.317 -32.555 1.00 0.00 H new ATOM 0 HG13 ILE A 439 -17.693 29.955 -31.502 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -19.167 33.253 -32.524 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -19.294 33.790 -30.832 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -17.698 33.437 -31.536 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -18.515 29.531 -33.768 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -19.870 29.603 -32.616 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -19.535 30.986 -33.684 1.00 0.00 H new ATOM 1293 N LYS A 440 -20.151 32.160 -28.244 1.00 0.00 N ATOM 1294 CA LYS A 440 -20.901 33.015 -27.332 1.00 0.00 C ATOM 1295 C LYS A 440 -20.538 32.715 -25.882 1.00 0.00 C ATOM 1296 O LYS A 440 -20.926 33.448 -24.972 1.00 0.00 O ATOM 1297 CB LYS A 440 -22.405 32.824 -27.543 1.00 0.00 C ATOM 1298 CG LYS A 440 -23.075 33.994 -28.241 1.00 0.00 C ATOM 1299 CD LYS A 440 -24.011 33.525 -29.343 1.00 0.00 C ATOM 1300 CE LYS A 440 -24.843 34.673 -29.894 1.00 0.00 C ATOM 1301 NZ LYS A 440 -26.278 34.548 -29.517 1.00 0.00 N ATOM 0 H LYS A 440 -20.616 31.283 -28.478 1.00 0.00 H new ATOM 0 HA LYS A 440 -20.639 34.051 -27.546 1.00 0.00 H new ATOM 0 HB2 LYS A 440 -22.569 31.920 -28.129 1.00 0.00 H new ATOM 0 HB3 LYS A 440 -22.882 32.668 -26.575 1.00 0.00 H new ATOM 0 HG2 LYS A 440 -23.634 34.581 -27.513 1.00 0.00 H new ATOM 0 HG3 LYS A 440 -22.314 34.651 -28.663 1.00 0.00 H new ATOM 0 HD2 LYS A 440 -23.430 33.076 -30.149 1.00 0.00 H new ATOM 0 HD3 LYS A 440 -24.671 32.749 -28.955 1.00 0.00 H new ATOM 0 HE2 LYS A 440 -24.450 35.618 -29.520 1.00 0.00 H new ATOM 0 HE3 LYS A 440 -24.754 34.698 -30.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 440 -26.812 35.349 -29.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 440 -26.660 33.658 -29.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 440 -26.366 34.550 -28.481 1.00 0.00 H new ATOM 1315 N GLN A 441 -19.791 31.636 -25.674 1.00 0.00 N ATOM 1316 CA GLN A 441 -19.376 31.241 -24.334 1.00 0.00 C ATOM 1317 C GLN A 441 -18.318 32.194 -23.789 1.00 0.00 C ATOM 1318 O GLN A 441 -18.439 32.701 -22.673 1.00 0.00 O ATOM 1319 CB GLN A 441 -18.833 29.810 -24.346 1.00 0.00 C ATOM 1320 CG GLN A 441 -18.916 29.117 -22.995 1.00 0.00 C ATOM 1321 CD GLN A 441 -18.293 27.735 -23.010 1.00 0.00 C ATOM 1322 OE1 GLN A 441 -18.785 26.827 -23.680 1.00 0.00 O ATOM 1323 NE2 GLN A 441 -17.204 27.568 -22.268 1.00 0.00 N ATOM 0 H GLN A 441 -19.461 31.020 -26.417 1.00 0.00 H new ATOM 0 HA GLN A 441 -20.249 31.285 -23.683 1.00 0.00 H new ATOM 0 HB2 GLN A 441 -19.388 29.226 -25.080 1.00 0.00 H new ATOM 0 HB3 GLN A 441 -17.793 29.827 -24.673 1.00 0.00 H new ATOM 0 HG2 GLN A 441 -18.415 29.729 -22.245 1.00 0.00 H new ATOM 0 HG3 GLN A 441 -19.961 29.037 -22.695 1.00 0.00 H new ATOM 0 HE21 GLN A 441 -16.830 28.348 -21.728 1.00 0.00 H new ATOM 0 HE22 GLN A 441 -16.742 26.659 -22.238 1.00 0.00 H new ATOM 1332 N VAL A 442 -17.279 32.434 -24.583 1.00 0.00 N ATOM 1333 CA VAL A 442 -16.199 33.327 -24.181 1.00 0.00 C ATOM 1334 C VAL A 442 -16.162 34.574 -25.058 1.00 0.00 C ATOM 1335 O VAL A 442 -16.126 35.698 -24.556 1.00 0.00 O ATOM 1336 CB VAL A 442 -14.832 32.622 -24.251 1.00 0.00 C ATOM 1337 CG1 VAL A 442 -13.736 33.525 -23.706 1.00 0.00 C ATOM 1338 CG2 VAL A 442 -14.873 31.303 -23.494 1.00 0.00 C ATOM 0 H VAL A 442 -17.163 32.022 -25.509 1.00 0.00 H new ATOM 0 HA VAL A 442 -16.396 33.618 -23.149 1.00 0.00 H new ATOM 0 HB VAL A 442 -14.607 32.408 -25.296 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -12.777 33.009 -23.764 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -13.692 34.440 -24.296 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -13.952 33.773 -22.667 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -13.898 30.819 -23.554 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -15.121 31.491 -22.449 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -15.629 30.653 -23.935 1.00 0.00 H new ATOM 1348 N HIS A 443 -16.170 34.367 -26.371 1.00 0.00 N ATOM 1349 CA HIS A 443 -16.138 35.475 -27.319 1.00 0.00 C ATOM 1350 C HIS A 443 -17.520 36.103 -27.468 1.00 0.00 C ATOM 1351 O HIS A 443 -18.076 36.151 -28.565 1.00 0.00 O ATOM 1352 CB HIS A 443 -15.634 34.994 -28.680 1.00 0.00 C ATOM 1353 CG HIS A 443 -14.422 34.118 -28.595 1.00 0.00 C ATOM 1354 ND1 HIS A 443 -13.243 34.519 -28.003 1.00 0.00 N ATOM 1355 CD2 HIS A 443 -14.212 32.854 -29.030 1.00 0.00 C ATOM 1356 CE1 HIS A 443 -12.360 33.541 -28.079 1.00 0.00 C ATOM 1357 NE2 HIS A 443 -12.922 32.518 -28.698 1.00 0.00 N ATOM 0 H HIS A 443 -16.198 33.443 -26.802 1.00 0.00 H new ATOM 0 HA HIS A 443 -15.455 36.232 -26.933 1.00 0.00 H new ATOM 0 HB2 HIS A 443 -16.433 34.447 -29.181 1.00 0.00 H new ATOM 0 HB3 HIS A 443 -15.403 35.861 -29.300 1.00 0.00 H new ATOM 0 HD1 HIS A 443 -13.079 35.429 -27.573 1.00 0.00 H new ATOM 0 HD2 HIS A 443 -14.926 32.226 -29.543 1.00 0.00 H new ATOM 0 HE1 HIS A 443 -11.349 33.572 -27.700 1.00 0.00 H new