USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=21 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 -150:sc= 0.324 USER MOD Set 1.2: A 425 CYS SG : rot -120:sc= 0.317 USER MOD Set 1.3: A 438 HIS : no HE2:sc= -2.19! X(o=-2.8!,f=-3.2) USER MOD Set 1.4: A 443 HIS : no HE2:sc= -1.26 K(o=-2.8,f=-4.3) USER MOD Set 2.1: A 392 CYS SG : rot -152:sc= -0.379 USER MOD Set 2.2: A 395 CYS SG : rot 137:sc= 0.479 USER MOD Set 2.3: A 408 HIS : no HE2:sc= -0.259 K(o=-0.41,f=-3.2) USER MOD Set 2.4: A 412 HIS : no HD1:sc= -0.252 K(o=-0.41,f=-9.4!) USER MOD Set 3.1: A 364 CYS SG : rot 174:sc= -1.01 USER MOD Set 3.2: A 367 CYS SG : rot -41:sc= 1.14 USER MOD Set 3.3: A 380 HIS : no HD1:sc= -0.0782 K(o=0.057,f=-4!) 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 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.565 K(o=-0.57,f=-1.4) USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 78:sc= 0.27 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 -165:sc= -1.25 (180deg=-1.6) USER MOD Single : A 406 SER OG : rot 180:sc= -0.548 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 420 TYR OH : rot 180:sc= 0 USER MOD Single : A 423 GLN : amide:sc= -0.201 K(o=-0.2,f=-2.1!) USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 427 LYS NZ :NH3+ 153:sc= -0.141 (180deg=-1.02) USER MOD Single : A 430 SER OG : rot 180:sc= 0 USER MOD Single : A 434 HIS :FLIP no HD1:sc= -0.0208 F(o=-0.55,f=-0.021) USER MOD Single : A 436 ASN : amide:sc= -0.399 X(o=-0.4,f=-0.039) USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 66 N VAL A 362 -12.706 -21.984 -19.212 1.00 0.00 N ATOM 67 CA VAL A 362 -11.536 -21.322 -18.646 1.00 0.00 C ATOM 68 C VAL A 362 -11.940 -20.302 -17.588 1.00 0.00 C ATOM 69 O VAL A 362 -13.013 -19.704 -17.665 1.00 0.00 O ATOM 70 CB VAL A 362 -10.710 -20.614 -19.736 1.00 0.00 C ATOM 71 CG1 VAL A 362 -10.103 -21.630 -20.691 1.00 0.00 C ATOM 72 CG2 VAL A 362 -11.571 -19.611 -20.489 1.00 0.00 C ATOM 0 HA VAL A 362 -10.926 -22.098 -18.184 1.00 0.00 H new ATOM 0 HB VAL A 362 -9.896 -20.072 -19.255 1.00 0.00 H new ATOM 0 HG11 VAL A 362 -9.523 -21.111 -21.454 1.00 0.00 H new ATOM 0 HG12 VAL A 362 -9.451 -22.306 -20.137 1.00 0.00 H new ATOM 0 HG13 VAL A 362 -10.899 -22.203 -21.167 1.00 0.00 H new ATOM 0 HG21 VAL A 362 -10.971 -19.120 -21.255 1.00 0.00 H new ATOM 0 HG22 VAL A 362 -12.407 -20.129 -20.959 1.00 0.00 H new ATOM 0 HG23 VAL A 362 -11.953 -18.864 -19.793 1.00 0.00 H new ATOM 82 N ALA A 363 -11.073 -20.107 -16.599 1.00 0.00 N ATOM 83 CA ALA A 363 -11.338 -19.158 -15.526 1.00 0.00 C ATOM 84 C ALA A 363 -10.345 -18.001 -15.559 1.00 0.00 C ATOM 85 O ALA A 363 -9.138 -18.202 -15.424 1.00 0.00 O ATOM 86 CB ALA A 363 -11.290 -19.859 -14.177 1.00 0.00 C ATOM 0 H ALA A 363 -10.181 -20.595 -16.520 1.00 0.00 H new ATOM 0 HA ALA A 363 -12.337 -18.749 -15.675 1.00 0.00 H new ATOM 0 HB1 ALA A 363 -11.490 -19.138 -13.385 1.00 0.00 H new ATOM 0 HB2 ALA A 363 -12.043 -20.646 -14.149 1.00 0.00 H new ATOM 0 HB3 ALA A 363 -10.303 -20.296 -14.029 1.00 0.00 H new ATOM 92 N CYS A 364 -10.861 -16.790 -15.739 1.00 0.00 N ATOM 93 CA CYS A 364 -10.020 -15.600 -15.791 1.00 0.00 C ATOM 94 C CYS A 364 -9.109 -15.524 -14.569 1.00 0.00 C ATOM 95 O CYS A 364 -9.557 -15.708 -13.438 1.00 0.00 O ATOM 96 CB CYS A 364 -10.885 -14.341 -15.875 1.00 0.00 C ATOM 97 SG CYS A 364 -9.947 -12.814 -16.201 1.00 0.00 S ATOM 0 H CYS A 364 -11.858 -16.607 -15.851 1.00 0.00 H new ATOM 0 HA CYS A 364 -9.397 -15.665 -16.683 1.00 0.00 H new ATOM 0 HB2 CYS A 364 -11.626 -14.474 -16.663 1.00 0.00 H new ATOM 0 HB3 CYS A 364 -11.432 -14.226 -14.939 1.00 0.00 H new ATOM 0 HG CYS A 364 -10.774 -11.827 -16.382 1.00 0.00 H new ATOM 102 N GLU A 365 -7.830 -15.250 -14.806 1.00 0.00 N ATOM 103 CA GLU A 365 -6.858 -15.150 -13.725 1.00 0.00 C ATOM 104 C GLU A 365 -6.661 -13.697 -13.303 1.00 0.00 C ATOM 105 O GLU A 365 -5.578 -13.309 -12.863 1.00 0.00 O ATOM 106 CB GLU A 365 -5.519 -15.754 -14.155 1.00 0.00 C ATOM 107 CG GLU A 365 -4.806 -14.949 -15.229 1.00 0.00 C ATOM 108 CD GLU A 365 -4.192 -15.825 -16.303 1.00 0.00 C ATOM 109 OE1 GLU A 365 -3.424 -16.745 -15.951 1.00 0.00 O ATOM 110 OE2 GLU A 365 -4.478 -15.590 -17.496 1.00 0.00 O ATOM 0 H GLU A 365 -7.444 -15.093 -15.737 1.00 0.00 H new ATOM 0 HA GLU A 365 -7.243 -15.709 -12.872 1.00 0.00 H new ATOM 0 HB2 GLU A 365 -4.870 -15.836 -13.283 1.00 0.00 H new ATOM 0 HB3 GLU A 365 -5.688 -16.766 -14.523 1.00 0.00 H new ATOM 0 HG2 GLU A 365 -5.512 -14.258 -15.689 1.00 0.00 H new ATOM 0 HG3 GLU A 365 -4.025 -14.346 -14.767 1.00 0.00 H new ATOM 117 N ILE A 366 -7.714 -12.899 -13.441 1.00 0.00 N ATOM 118 CA ILE A 366 -7.657 -11.489 -13.075 1.00 0.00 C ATOM 119 C ILE A 366 -8.845 -11.100 -12.202 1.00 0.00 C ATOM 120 O ILE A 366 -8.704 -10.337 -11.246 1.00 0.00 O ATOM 121 CB ILE A 366 -7.632 -10.584 -14.320 1.00 0.00 C ATOM 122 CG1 ILE A 366 -6.429 -10.927 -15.203 1.00 0.00 C ATOM 123 CG2 ILE A 366 -7.593 -9.119 -13.910 1.00 0.00 C ATOM 124 CD1 ILE A 366 -6.811 -11.543 -16.530 1.00 0.00 C ATOM 0 H ILE A 366 -8.617 -13.205 -13.804 1.00 0.00 H new ATOM 0 HA ILE A 366 -6.733 -11.346 -12.514 1.00 0.00 H new ATOM 0 HB ILE A 366 -8.542 -10.757 -14.894 1.00 0.00 H new ATOM 0 HG12 ILE A 366 -5.852 -10.021 -15.385 1.00 0.00 H new ATOM 0 HG13 ILE A 366 -5.778 -11.617 -14.665 1.00 0.00 H new ATOM 0 HG21 ILE A 366 -7.576 -8.492 -14.801 1.00 0.00 H new ATOM 0 HG22 ILE A 366 -8.477 -8.883 -13.318 1.00 0.00 H new ATOM 0 HG23 ILE A 366 -6.698 -8.931 -13.317 1.00 0.00 H new ATOM 0 HD11 ILE A 366 -5.910 -11.760 -17.103 1.00 0.00 H new ATOM 0 HD12 ILE A 366 -7.362 -12.467 -16.357 1.00 0.00 H new ATOM 0 HD13 ILE A 366 -7.437 -10.846 -17.088 1.00 0.00 H new ATOM 136 N CYS A 367 -10.017 -11.631 -12.535 1.00 0.00 N ATOM 137 CA CYS A 367 -11.231 -11.342 -11.782 1.00 0.00 C ATOM 138 C CYS A 367 -11.847 -12.624 -11.229 1.00 0.00 C ATOM 139 O CYS A 367 -12.395 -12.637 -10.128 1.00 0.00 O ATOM 140 CB CYS A 367 -12.245 -10.616 -12.668 1.00 0.00 C ATOM 141 SG CYS A 367 -12.643 -11.494 -14.215 1.00 0.00 S ATOM 0 H CYS A 367 -10.151 -12.265 -13.323 1.00 0.00 H new ATOM 0 HA CYS A 367 -10.964 -10.698 -10.944 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -13.164 -10.465 -12.102 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -11.856 -9.628 -12.913 1.00 0.00 H new ATOM 0 HG CYS A 367 -11.556 -11.999 -14.719 1.00 0.00 H new ATOM 146 N GLY A 368 -11.751 -13.701 -12.002 1.00 0.00 N ATOM 147 CA GLY A 368 -12.303 -14.973 -11.573 1.00 0.00 C ATOM 148 C GLY A 368 -13.576 -15.332 -12.313 1.00 0.00 C ATOM 149 O GLY A 368 -14.406 -16.088 -11.807 1.00 0.00 O ATOM 0 H GLY A 368 -11.301 -13.716 -12.917 1.00 0.00 H new ATOM 0 HA2 GLY A 368 -11.563 -15.758 -11.728 1.00 0.00 H new ATOM 0 HA3 GLY A 368 -12.507 -14.935 -10.503 1.00 0.00 H new ATOM 153 N LYS A 369 -13.733 -14.788 -13.515 1.00 0.00 N ATOM 154 CA LYS A 369 -14.915 -15.054 -14.327 1.00 0.00 C ATOM 155 C LYS A 369 -14.667 -16.214 -15.285 1.00 0.00 C ATOM 156 O LYS A 369 -13.592 -16.324 -15.877 1.00 0.00 O ATOM 157 CB LYS A 369 -15.309 -13.803 -15.116 1.00 0.00 C ATOM 158 CG LYS A 369 -15.969 -12.730 -14.266 1.00 0.00 C ATOM 159 CD LYS A 369 -15.957 -11.381 -14.963 1.00 0.00 C ATOM 160 CE LYS A 369 -17.349 -10.983 -15.430 1.00 0.00 C ATOM 161 NZ LYS A 369 -17.301 -10.087 -16.618 1.00 0.00 N ATOM 0 H LYS A 369 -13.056 -14.160 -13.949 1.00 0.00 H new ATOM 0 HA LYS A 369 -15.731 -15.326 -13.658 1.00 0.00 H new ATOM 0 HB2 LYS A 369 -14.419 -13.385 -15.587 1.00 0.00 H new ATOM 0 HB3 LYS A 369 -15.989 -14.089 -15.918 1.00 0.00 H new ATOM 0 HG2 LYS A 369 -16.997 -13.019 -14.048 1.00 0.00 H new ATOM 0 HG3 LYS A 369 -15.450 -12.651 -13.310 1.00 0.00 H new ATOM 0 HD2 LYS A 369 -15.569 -10.622 -14.283 1.00 0.00 H new ATOM 0 HD3 LYS A 369 -15.282 -11.418 -15.818 1.00 0.00 H new ATOM 0 HE2 LYS A 369 -17.920 -11.879 -15.674 1.00 0.00 H new ATOM 0 HE3 LYS A 369 -17.875 -10.481 -14.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 369 -18.269 -9.839 -16.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 369 -16.778 -9.221 -16.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 369 -16.822 -10.575 -17.402 1.00 0.00 H new ATOM 175 N ILE A 370 -15.667 -17.076 -15.434 1.00 0.00 N ATOM 176 CA ILE A 370 -15.557 -18.227 -16.323 1.00 0.00 C ATOM 177 C ILE A 370 -15.939 -17.856 -17.751 1.00 0.00 C ATOM 178 O ILE A 370 -16.845 -17.053 -17.975 1.00 0.00 O ATOM 179 CB ILE A 370 -16.448 -19.391 -15.850 1.00 0.00 C ATOM 180 CG1 ILE A 370 -16.128 -19.749 -14.397 1.00 0.00 C ATOM 181 CG2 ILE A 370 -16.262 -20.601 -16.753 1.00 0.00 C ATOM 182 CD1 ILE A 370 -14.689 -20.160 -14.179 1.00 0.00 C ATOM 0 H ILE A 370 -16.562 -17.000 -14.951 1.00 0.00 H new ATOM 0 HA ILE A 370 -14.515 -18.546 -16.300 1.00 0.00 H new ATOM 0 HB ILE A 370 -17.490 -19.077 -15.906 1.00 0.00 H new ATOM 0 HG12 ILE A 370 -16.353 -18.892 -13.762 1.00 0.00 H new ATOM 0 HG13 ILE A 370 -16.782 -20.561 -14.079 1.00 0.00 H new ATOM 0 HG21 ILE A 370 -16.898 -21.415 -16.406 1.00 0.00 H new ATOM 0 HG22 ILE A 370 -16.535 -20.338 -17.775 1.00 0.00 H new ATOM 0 HG23 ILE A 370 -15.220 -20.918 -16.726 1.00 0.00 H new ATOM 0 HD11 ILE A 370 -14.534 -20.399 -13.127 1.00 0.00 H new ATOM 0 HD12 ILE A 370 -14.465 -21.036 -14.787 1.00 0.00 H new ATOM 0 HD13 ILE A 370 -14.029 -19.341 -14.465 1.00 0.00 H new ATOM 194 N PHE A 371 -15.244 -18.449 -18.717 1.00 0.00 N ATOM 195 CA PHE A 371 -15.511 -18.182 -20.125 1.00 0.00 C ATOM 196 C PHE A 371 -15.650 -19.484 -20.909 1.00 0.00 C ATOM 197 O PHE A 371 -14.795 -20.366 -20.823 1.00 0.00 O ATOM 198 CB PHE A 371 -14.392 -17.329 -20.726 1.00 0.00 C ATOM 199 CG PHE A 371 -14.348 -15.930 -20.182 1.00 0.00 C ATOM 200 CD1 PHE A 371 -13.881 -15.685 -18.900 1.00 0.00 C ATOM 201 CD2 PHE A 371 -14.773 -14.859 -20.952 1.00 0.00 C ATOM 202 CE1 PHE A 371 -13.838 -14.398 -18.397 1.00 0.00 C ATOM 203 CE2 PHE A 371 -14.732 -13.570 -20.454 1.00 0.00 C ATOM 204 CZ PHE A 371 -14.266 -13.340 -19.174 1.00 0.00 C ATOM 0 H PHE A 371 -14.492 -19.117 -18.550 1.00 0.00 H new ATOM 0 HA PHE A 371 -16.451 -17.635 -20.193 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -13.434 -17.814 -20.537 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -14.520 -17.286 -21.808 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -13.547 -16.509 -18.287 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -15.140 -15.033 -21.953 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -13.470 -14.220 -17.397 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -15.064 -12.744 -21.065 1.00 0.00 H new ATOM 0 HZ PHE A 371 -14.237 -12.334 -18.782 1.00 0.00 H new ATOM 214 N ARG A 372 -16.732 -19.597 -21.672 1.00 0.00 N ATOM 215 CA ARG A 372 -16.984 -20.791 -22.469 1.00 0.00 C ATOM 216 C ARG A 372 -15.857 -21.024 -23.471 1.00 0.00 C ATOM 217 O ARG A 372 -15.524 -22.165 -23.791 1.00 0.00 O ATOM 218 CB ARG A 372 -18.318 -20.665 -23.207 1.00 0.00 C ATOM 219 CG ARG A 372 -18.476 -19.354 -23.960 1.00 0.00 C ATOM 220 CD ARG A 372 -19.652 -18.547 -23.433 1.00 0.00 C ATOM 221 NE ARG A 372 -20.270 -17.734 -24.477 1.00 0.00 N ATOM 222 CZ ARG A 372 -20.969 -18.241 -25.486 1.00 0.00 C ATOM 223 NH1 ARG A 372 -21.138 -19.552 -25.587 1.00 0.00 N ATOM 224 NH2 ARG A 372 -21.501 -17.436 -26.397 1.00 0.00 N ATOM 0 H ARG A 372 -17.448 -18.876 -21.755 1.00 0.00 H new ATOM 0 HA ARG A 372 -17.029 -21.645 -21.793 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -18.414 -21.492 -23.910 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -19.132 -20.762 -22.488 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -17.561 -18.768 -23.869 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -18.619 -19.558 -25.021 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -20.396 -19.223 -23.012 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -19.314 -17.901 -22.623 1.00 0.00 H new ATOM 0 HE ARG A 372 -20.159 -16.721 -24.429 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -20.731 -20.174 -24.889 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -21.675 -19.939 -26.363 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -21.373 -16.427 -26.323 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -22.038 -17.826 -27.172 1.00 0.00 H new ATOM 238 N ASP A 373 -15.274 -19.935 -23.961 1.00 0.00 N ATOM 239 CA ASP A 373 -14.183 -20.021 -24.926 1.00 0.00 C ATOM 240 C ASP A 373 -13.004 -19.157 -24.490 1.00 0.00 C ATOM 241 O ASP A 373 -13.179 -18.144 -23.814 1.00 0.00 O ATOM 242 CB ASP A 373 -14.665 -19.588 -26.311 1.00 0.00 C ATOM 243 CG ASP A 373 -15.447 -20.677 -27.019 1.00 0.00 C ATOM 244 OD1 ASP A 373 -14.911 -21.796 -27.160 1.00 0.00 O ATOM 245 OD2 ASP A 373 -16.594 -20.409 -27.432 1.00 0.00 O ATOM 0 H ASP A 373 -15.538 -18.983 -23.706 1.00 0.00 H new ATOM 0 HA ASP A 373 -13.852 -21.058 -24.973 1.00 0.00 H new ATOM 0 HB2 ASP A 373 -15.290 -18.701 -26.214 1.00 0.00 H new ATOM 0 HB3 ASP A 373 -13.806 -19.307 -26.920 1.00 0.00 H new ATOM 250 N VAL A 374 -11.801 -19.565 -24.882 1.00 0.00 N ATOM 251 CA VAL A 374 -10.592 -18.829 -24.533 1.00 0.00 C ATOM 252 C VAL A 374 -10.407 -17.616 -25.437 1.00 0.00 C ATOM 253 O VAL A 374 -9.964 -16.557 -24.990 1.00 0.00 O ATOM 254 CB VAL A 374 -9.342 -19.724 -24.630 1.00 0.00 C ATOM 255 CG1 VAL A 374 -8.097 -18.948 -24.228 1.00 0.00 C ATOM 256 CG2 VAL A 374 -9.508 -20.966 -23.768 1.00 0.00 C ATOM 0 H VAL A 374 -11.638 -20.402 -25.442 1.00 0.00 H new ATOM 0 HA VAL A 374 -10.711 -18.495 -23.502 1.00 0.00 H new ATOM 0 HB VAL A 374 -9.224 -20.042 -25.666 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -7.224 -19.597 -24.303 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -7.971 -18.093 -24.892 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -8.202 -18.598 -23.201 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -8.616 -21.587 -23.849 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -9.652 -20.671 -22.729 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -10.375 -21.532 -24.108 1.00 0.00 H new ATOM 266 N TYR A 375 -10.749 -17.777 -26.710 1.00 0.00 N ATOM 267 CA TYR A 375 -10.619 -16.695 -27.679 1.00 0.00 C ATOM 268 C TYR A 375 -11.325 -15.435 -27.188 1.00 0.00 C ATOM 269 O TYR A 375 -10.911 -14.317 -27.494 1.00 0.00 O ATOM 270 CB TYR A 375 -11.193 -17.121 -29.031 1.00 0.00 C ATOM 271 CG TYR A 375 -10.137 -17.443 -30.064 1.00 0.00 C ATOM 272 CD1 TYR A 375 -9.319 -18.558 -29.924 1.00 0.00 C ATOM 273 CD2 TYR A 375 -9.956 -16.634 -31.178 1.00 0.00 C ATOM 274 CE1 TYR A 375 -8.352 -18.857 -30.865 1.00 0.00 C ATOM 275 CE2 TYR A 375 -8.993 -16.925 -32.124 1.00 0.00 C ATOM 276 CZ TYR A 375 -8.193 -18.037 -31.963 1.00 0.00 C ATOM 277 OH TYR A 375 -7.231 -18.331 -32.902 1.00 0.00 O ATOM 0 H TYR A 375 -11.118 -18.646 -27.095 1.00 0.00 H new ATOM 0 HA TYR A 375 -9.558 -16.472 -27.796 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -11.827 -17.996 -28.887 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -11.831 -16.324 -29.413 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -9.441 -19.202 -29.065 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -10.580 -15.762 -31.307 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -7.725 -19.727 -30.742 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -8.867 -16.285 -32.985 1.00 0.00 H new ATOM 0 HH TYR A 375 -7.250 -17.656 -33.612 1.00 0.00 H new ATOM 287 N HIS A 376 -12.395 -15.625 -26.423 1.00 0.00 N ATOM 288 CA HIS A 376 -13.161 -14.505 -25.886 1.00 0.00 C ATOM 289 C HIS A 376 -12.464 -13.905 -24.668 1.00 0.00 C ATOM 290 O HIS A 376 -12.484 -12.691 -24.465 1.00 0.00 O ATOM 291 CB HIS A 376 -14.572 -14.958 -25.510 1.00 0.00 C ATOM 292 CG HIS A 376 -15.652 -14.221 -26.240 1.00 0.00 C ATOM 293 ND1 HIS A 376 -16.175 -13.023 -25.800 1.00 0.00 N ATOM 294 CD2 HIS A 376 -16.307 -14.517 -27.387 1.00 0.00 C ATOM 295 CE1 HIS A 376 -17.106 -12.616 -26.644 1.00 0.00 C ATOM 296 NE2 HIS A 376 -17.205 -13.505 -27.616 1.00 0.00 N ATOM 0 H HIS A 376 -12.752 -16.544 -26.161 1.00 0.00 H new ATOM 0 HA HIS A 376 -13.228 -13.739 -26.658 1.00 0.00 H new ATOM 0 HB2 HIS A 376 -14.669 -16.024 -25.715 1.00 0.00 H new ATOM 0 HB3 HIS A 376 -14.714 -14.825 -24.437 1.00 0.00 H new ATOM 0 HD2 HIS A 376 -16.152 -15.388 -28.007 1.00 0.00 H new ATOM 0 HE1 HIS A 376 -17.687 -11.710 -26.555 1.00 0.00 H new ATOM 0 HE2 HIS A 376 -17.845 -13.448 -28.408 1.00 0.00 H new ATOM 304 N LEU A 377 -11.850 -14.764 -23.862 1.00 0.00 N ATOM 305 CA LEU A 377 -11.148 -14.319 -22.663 1.00 0.00 C ATOM 306 C LEU A 377 -10.061 -13.307 -23.012 1.00 0.00 C ATOM 307 O LEU A 377 -9.818 -12.360 -22.266 1.00 0.00 O ATOM 308 CB LEU A 377 -10.532 -15.515 -21.935 1.00 0.00 C ATOM 309 CG LEU A 377 -9.855 -15.211 -20.598 1.00 0.00 C ATOM 310 CD1 LEU A 377 -10.883 -14.772 -19.567 1.00 0.00 C ATOM 311 CD2 LEU A 377 -9.084 -16.426 -20.102 1.00 0.00 C ATOM 0 H LEU A 377 -11.824 -15.772 -24.017 1.00 0.00 H new ATOM 0 HA LEU A 377 -11.872 -13.835 -22.007 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -11.315 -16.253 -21.763 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -9.798 -15.977 -22.594 1.00 0.00 H new ATOM 0 HG LEU A 377 -9.149 -14.394 -20.747 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -10.383 -14.560 -18.622 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -11.390 -13.874 -19.919 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -11.614 -15.567 -19.420 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -8.609 -16.191 -19.150 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -9.770 -17.263 -19.969 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -8.320 -16.695 -20.832 1.00 0.00 H new ATOM 323 N ASN A 378 -9.412 -13.515 -24.153 1.00 0.00 N ATOM 324 CA ASN A 378 -8.351 -12.620 -24.603 1.00 0.00 C ATOM 325 C ASN A 378 -8.825 -11.170 -24.599 1.00 0.00 C ATOM 326 O ASN A 378 -8.213 -10.308 -23.967 1.00 0.00 O ATOM 327 CB ASN A 378 -7.886 -13.012 -26.007 1.00 0.00 C ATOM 328 CG ASN A 378 -6.509 -12.468 -26.332 1.00 0.00 C ATOM 329 OD1 ASN A 378 -6.373 -11.499 -27.080 1.00 0.00 O ATOM 330 ND2 ASN A 378 -5.479 -13.090 -25.771 1.00 0.00 N ATOM 0 H ASN A 378 -9.602 -14.295 -24.783 1.00 0.00 H new ATOM 0 HA ASN A 378 -7.514 -12.712 -23.911 1.00 0.00 H new ATOM 0 HB2 ASN A 378 -7.874 -14.099 -26.093 1.00 0.00 H new ATOM 0 HB3 ASN A 378 -8.602 -12.642 -26.741 1.00 0.00 H new ATOM 0 HD21 ASN A 378 -4.528 -12.769 -25.953 1.00 0.00 H new ATOM 0 HD22 ASN A 378 -5.638 -13.889 -25.158 1.00 0.00 H new ATOM 337 N ARG A 379 -9.919 -10.908 -25.307 1.00 0.00 N ATOM 338 CA ARG A 379 -10.475 -9.563 -25.385 1.00 0.00 C ATOM 339 C ARG A 379 -10.830 -9.040 -23.996 1.00 0.00 C ATOM 340 O ARG A 379 -10.710 -7.845 -23.722 1.00 0.00 O ATOM 341 CB ARG A 379 -11.717 -9.552 -26.278 1.00 0.00 C ATOM 342 CG ARG A 379 -11.466 -10.096 -27.676 1.00 0.00 C ATOM 343 CD ARG A 379 -12.616 -9.768 -28.615 1.00 0.00 C ATOM 344 NE ARG A 379 -12.255 -9.975 -30.015 1.00 0.00 N ATOM 345 CZ ARG A 379 -13.079 -9.737 -31.030 1.00 0.00 C ATOM 346 NH1 ARG A 379 -14.304 -9.284 -30.801 1.00 0.00 N ATOM 347 NH2 ARG A 379 -12.677 -9.950 -32.276 1.00 0.00 N ATOM 0 H ARG A 379 -10.438 -11.610 -25.835 1.00 0.00 H new ATOM 0 HA ARG A 379 -9.718 -8.909 -25.819 1.00 0.00 H new ATOM 0 HB2 ARG A 379 -12.501 -10.142 -25.803 1.00 0.00 H new ATOM 0 HB3 ARG A 379 -12.089 -8.531 -26.356 1.00 0.00 H new ATOM 0 HG2 ARG A 379 -10.541 -9.676 -28.071 1.00 0.00 H new ATOM 0 HG3 ARG A 379 -11.330 -11.176 -27.628 1.00 0.00 H new ATOM 0 HD2 ARG A 379 -13.476 -10.390 -28.366 1.00 0.00 H new ATOM 0 HD3 ARG A 379 -12.920 -8.731 -28.468 1.00 0.00 H new ATOM 0 HE ARG A 379 -11.319 -10.321 -30.225 1.00 0.00 H new ATOM 0 HH11 ARG A 379 -14.616 -9.117 -29.844 1.00 0.00 H new ATOM 0 HH12 ARG A 379 -14.935 -9.102 -31.582 1.00 0.00 H new ATOM 0 HH21 ARG A 379 -11.735 -10.297 -32.456 1.00 0.00 H new ATOM 0 HH22 ARG A 379 -13.310 -9.767 -33.054 1.00 0.00 H new ATOM 361 N HIS A 380 -11.269 -9.942 -23.124 1.00 0.00 N ATOM 362 CA HIS A 380 -11.642 -9.571 -21.763 1.00 0.00 C ATOM 363 C HIS A 380 -10.419 -9.122 -20.968 1.00 0.00 C ATOM 364 O HIS A 380 -10.363 -7.993 -20.481 1.00 0.00 O ATOM 365 CB HIS A 380 -12.319 -10.747 -21.059 1.00 0.00 C ATOM 366 CG HIS A 380 -12.568 -10.510 -19.602 1.00 0.00 C ATOM 367 ND1 HIS A 380 -13.515 -9.624 -19.135 1.00 0.00 N ATOM 368 CD2 HIS A 380 -11.988 -11.051 -18.505 1.00 0.00 C ATOM 369 CE1 HIS A 380 -13.506 -9.628 -17.813 1.00 0.00 C ATOM 370 NE2 HIS A 380 -12.588 -10.486 -17.406 1.00 0.00 N ATOM 0 H HIS A 380 -11.375 -10.934 -23.335 1.00 0.00 H new ATOM 0 HA HIS A 380 -12.343 -8.738 -21.819 1.00 0.00 H new ATOM 0 HB2 HIS A 380 -13.268 -10.957 -21.552 1.00 0.00 H new ATOM 0 HB3 HIS A 380 -11.697 -11.635 -21.173 1.00 0.00 H new ATOM 0 HD2 HIS A 380 -11.200 -11.790 -18.496 1.00 0.00 H new ATOM 0 HE1 HIS A 380 -14.141 -9.031 -17.175 1.00 0.00 H new ATOM 0 HE2 HIS A 380 -12.361 -10.695 -16.434 1.00 0.00 H new ATOM 378 N LYS A 381 -9.443 -10.014 -20.840 1.00 0.00 N ATOM 379 CA LYS A 381 -8.221 -9.711 -20.105 1.00 0.00 C ATOM 380 C LYS A 381 -7.563 -8.444 -20.642 1.00 0.00 C ATOM 381 O LYS A 381 -6.882 -7.727 -19.908 1.00 0.00 O ATOM 382 CB LYS A 381 -7.242 -10.884 -20.196 1.00 0.00 C ATOM 383 CG LYS A 381 -7.808 -12.190 -19.666 1.00 0.00 C ATOM 384 CD LYS A 381 -6.743 -13.273 -19.600 1.00 0.00 C ATOM 385 CE LYS A 381 -6.169 -13.575 -20.975 1.00 0.00 C ATOM 386 NZ LYS A 381 -4.705 -13.306 -21.036 1.00 0.00 N ATOM 0 H LYS A 381 -9.475 -10.953 -21.236 1.00 0.00 H new ATOM 0 HA LYS A 381 -8.487 -9.547 -19.061 1.00 0.00 H new ATOM 0 HB2 LYS A 381 -6.948 -11.021 -21.237 1.00 0.00 H new ATOM 0 HB3 LYS A 381 -6.338 -10.636 -19.639 1.00 0.00 H new ATOM 0 HG2 LYS A 381 -8.227 -12.030 -18.673 1.00 0.00 H new ATOM 0 HG3 LYS A 381 -8.625 -12.520 -20.307 1.00 0.00 H new ATOM 0 HD2 LYS A 381 -5.942 -12.957 -18.932 1.00 0.00 H new ATOM 0 HD3 LYS A 381 -7.172 -14.181 -19.176 1.00 0.00 H new ATOM 0 HE2 LYS A 381 -6.357 -14.619 -21.226 1.00 0.00 H new ATOM 0 HE3 LYS A 381 -6.681 -12.970 -21.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 -4.351 -13.524 -21.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 -4.527 -12.304 -20.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 -4.213 -13.902 -20.340 1.00 0.00 H new ATOM 400 N LEU A 382 -7.772 -8.173 -21.925 1.00 0.00 N ATOM 401 CA LEU A 382 -7.200 -6.990 -22.560 1.00 0.00 C ATOM 402 C LEU A 382 -7.859 -5.718 -22.036 1.00 0.00 C ATOM 403 O LEU A 382 -7.235 -4.659 -21.985 1.00 0.00 O ATOM 404 CB LEU A 382 -7.363 -7.074 -24.079 1.00 0.00 C ATOM 405 CG LEU A 382 -6.432 -8.048 -24.801 1.00 0.00 C ATOM 406 CD1 LEU A 382 -7.069 -8.537 -26.093 1.00 0.00 C ATOM 407 CD2 LEU A 382 -5.088 -7.392 -25.083 1.00 0.00 C ATOM 0 H LEU A 382 -8.333 -8.756 -22.546 1.00 0.00 H new ATOM 0 HA LEU A 382 -6.138 -6.954 -22.316 1.00 0.00 H new ATOM 0 HB2 LEU A 382 -8.393 -7.356 -24.299 1.00 0.00 H new ATOM 0 HB3 LEU A 382 -7.209 -6.079 -24.496 1.00 0.00 H new ATOM 0 HG LEU A 382 -6.265 -8.909 -24.153 1.00 0.00 H new ATOM 0 HD11 LEU A 382 -6.392 -9.229 -26.593 1.00 0.00 H new ATOM 0 HD12 LEU A 382 -8.006 -9.046 -25.867 1.00 0.00 H new ATOM 0 HD13 LEU A 382 -7.266 -7.687 -26.746 1.00 0.00 H new ATOM 0 HD21 LEU A 382 -4.438 -8.100 -25.597 1.00 0.00 H new ATOM 0 HD22 LEU A 382 -5.237 -6.514 -25.711 1.00 0.00 H new ATOM 0 HD23 LEU A 382 -4.625 -7.092 -24.143 1.00 0.00 H new ATOM 480 N LYS A 388 -4.380 3.186 -18.983 1.00 0.00 N ATOM 481 CA LYS A 388 -4.138 3.912 -17.742 1.00 0.00 C ATOM 482 C LYS A 388 -2.718 4.469 -17.706 1.00 0.00 C ATOM 483 O LYS A 388 -1.827 4.008 -18.419 1.00 0.00 O ATOM 484 CB LYS A 388 -4.368 2.996 -16.538 1.00 0.00 C ATOM 485 CG LYS A 388 -3.989 1.547 -16.795 1.00 0.00 C ATOM 486 CD LYS A 388 -3.860 0.767 -15.497 1.00 0.00 C ATOM 487 CE LYS A 388 -4.502 -0.608 -15.608 1.00 0.00 C ATOM 488 NZ LYS A 388 -4.872 -1.157 -14.274 1.00 0.00 N ATOM 0 HA LYS A 388 -4.838 4.746 -17.696 1.00 0.00 H new ATOM 0 HB2 LYS A 388 -3.790 3.369 -15.692 1.00 0.00 H new ATOM 0 HB3 LYS A 388 -5.419 3.043 -16.252 1.00 0.00 H new ATOM 0 HG2 LYS A 388 -4.743 1.079 -17.428 1.00 0.00 H new ATOM 0 HG3 LYS A 388 -3.046 1.508 -17.340 1.00 0.00 H new ATOM 0 HD2 LYS A 388 -2.806 0.658 -15.240 1.00 0.00 H new ATOM 0 HD3 LYS A 388 -4.330 1.325 -14.687 1.00 0.00 H new ATOM 0 HE2 LYS A 388 -5.392 -0.544 -16.234 1.00 0.00 H new ATOM 0 HE3 LYS A 388 -3.813 -1.292 -16.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 -5.306 -2.095 -14.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 -4.019 -1.242 -13.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 -5.549 -0.518 -13.811 1.00 0.00 H new ATOM 502 N PRO A 389 -2.502 5.484 -16.856 1.00 0.00 N ATOM 503 CA PRO A 389 -3.556 6.041 -16.004 1.00 0.00 C ATOM 504 C PRO A 389 -4.605 6.806 -16.803 1.00 0.00 C ATOM 505 O PRO A 389 -5.804 6.681 -16.552 1.00 0.00 O ATOM 506 CB PRO A 389 -2.795 6.990 -15.074 1.00 0.00 C ATOM 507 CG PRO A 389 -1.573 7.369 -15.837 1.00 0.00 C ATOM 508 CD PRO A 389 -1.211 6.166 -16.663 1.00 0.00 C ATOM 0 HA PRO A 389 -4.111 5.262 -15.481 1.00 0.00 H new ATOM 0 HB2 PRO A 389 -3.394 7.866 -14.826 1.00 0.00 H new ATOM 0 HB3 PRO A 389 -2.539 6.502 -14.134 1.00 0.00 H new ATOM 0 HG2 PRO A 389 -1.762 8.235 -16.471 1.00 0.00 H new ATOM 0 HG3 PRO A 389 -0.760 7.639 -15.163 1.00 0.00 H new ATOM 0 HD2 PRO A 389 -0.761 6.452 -17.614 1.00 0.00 H new ATOM 0 HD3 PRO A 389 -0.492 5.528 -16.150 1.00 0.00 H new ATOM 516 N TYR A 390 -4.146 7.597 -17.767 1.00 0.00 N ATOM 517 CA TYR A 390 -5.045 8.384 -18.602 1.00 0.00 C ATOM 518 C TYR A 390 -4.820 8.082 -20.080 1.00 0.00 C ATOM 519 O TYR A 390 -3.883 8.592 -20.694 1.00 0.00 O ATOM 520 CB TYR A 390 -4.844 9.878 -18.339 1.00 0.00 C ATOM 521 CG TYR A 390 -4.774 10.230 -16.870 1.00 0.00 C ATOM 522 CD1 TYR A 390 -5.928 10.492 -16.143 1.00 0.00 C ATOM 523 CD2 TYR A 390 -3.553 10.300 -16.210 1.00 0.00 C ATOM 524 CE1 TYR A 390 -5.869 10.815 -14.801 1.00 0.00 C ATOM 525 CE2 TYR A 390 -3.485 10.621 -14.868 1.00 0.00 C ATOM 526 CZ TYR A 390 -4.645 10.878 -14.168 1.00 0.00 C ATOM 527 OH TYR A 390 -4.582 11.198 -12.831 1.00 0.00 O ATOM 0 H TYR A 390 -3.157 7.710 -17.989 1.00 0.00 H new ATOM 0 HA TYR A 390 -6.069 8.111 -18.346 1.00 0.00 H new ATOM 0 HB2 TYR A 390 -3.925 10.204 -18.826 1.00 0.00 H new ATOM 0 HB3 TYR A 390 -5.662 10.433 -18.798 1.00 0.00 H new ATOM 0 HD1 TYR A 390 -6.888 10.442 -16.635 1.00 0.00 H new ATOM 0 HD2 TYR A 390 -2.642 10.100 -16.755 1.00 0.00 H new ATOM 0 HE1 TYR A 390 -6.776 11.017 -14.251 1.00 0.00 H new ATOM 0 HE2 TYR A 390 -2.528 10.670 -14.370 1.00 0.00 H new ATOM 0 HH TYR A 390 -3.647 11.198 -12.538 1.00 0.00 H new ATOM 537 N SER A 391 -5.688 7.248 -20.646 1.00 0.00 N ATOM 538 CA SER A 391 -5.583 6.874 -22.051 1.00 0.00 C ATOM 539 C SER A 391 -6.766 7.418 -22.848 1.00 0.00 C ATOM 540 O SER A 391 -7.829 7.695 -22.292 1.00 0.00 O ATOM 541 CB SER A 391 -5.516 5.352 -22.192 1.00 0.00 C ATOM 542 OG SER A 391 -6.206 4.916 -23.350 1.00 0.00 O ATOM 0 H SER A 391 -6.471 6.819 -20.153 1.00 0.00 H new ATOM 0 HA SER A 391 -4.667 7.310 -22.450 1.00 0.00 H new ATOM 0 HB2 SER A 391 -4.475 5.034 -22.244 1.00 0.00 H new ATOM 0 HB3 SER A 391 -5.949 4.882 -21.309 1.00 0.00 H new ATOM 0 HG SER A 391 -5.653 5.082 -24.142 1.00 0.00 H new ATOM 548 N CYS A 392 -6.572 7.569 -24.153 1.00 0.00 N ATOM 549 CA CYS A 392 -7.620 8.080 -25.028 1.00 0.00 C ATOM 550 C CYS A 392 -8.585 6.968 -25.428 1.00 0.00 C ATOM 551 O CYS A 392 -8.184 5.897 -25.883 1.00 0.00 O ATOM 552 CB CYS A 392 -7.006 8.711 -26.280 1.00 0.00 C ATOM 553 SG CYS A 392 -8.177 9.700 -27.265 1.00 0.00 S ATOM 0 H CYS A 392 -5.698 7.345 -24.629 1.00 0.00 H new ATOM 0 HA CYS A 392 -8.176 8.841 -24.481 1.00 0.00 H new ATOM 0 HB2 CYS A 392 -6.172 9.346 -25.982 1.00 0.00 H new ATOM 0 HB3 CYS A 392 -6.596 7.920 -26.909 1.00 0.00 H new ATOM 0 HG CYS A 392 -7.802 9.703 -28.510 1.00 0.00 H new ATOM 558 N PRO A 393 -9.890 7.227 -25.254 1.00 0.00 N ATOM 559 CA PRO A 393 -10.940 6.261 -25.590 1.00 0.00 C ATOM 560 C PRO A 393 -11.081 6.058 -27.095 1.00 0.00 C ATOM 561 O PRO A 393 -11.635 5.056 -27.547 1.00 0.00 O ATOM 562 CB PRO A 393 -12.207 6.900 -25.016 1.00 0.00 C ATOM 563 CG PRO A 393 -11.915 8.360 -24.986 1.00 0.00 C ATOM 564 CD PRO A 393 -10.440 8.482 -24.715 1.00 0.00 C ATOM 0 HA PRO A 393 -10.726 5.271 -25.188 1.00 0.00 H new ATOM 0 HB2 PRO A 393 -13.076 6.683 -25.637 1.00 0.00 H new ATOM 0 HB3 PRO A 393 -12.425 6.519 -24.018 1.00 0.00 H new ATOM 0 HG2 PRO A 393 -12.178 8.830 -25.934 1.00 0.00 H new ATOM 0 HG3 PRO A 393 -12.497 8.859 -24.211 1.00 0.00 H new ATOM 0 HD2 PRO A 393 -10.011 9.354 -25.209 1.00 0.00 H new ATOM 0 HD3 PRO A 393 -10.234 8.586 -23.650 1.00 0.00 H new ATOM 572 N VAL A 394 -10.575 7.016 -27.866 1.00 0.00 N ATOM 573 CA VAL A 394 -10.643 6.941 -29.321 1.00 0.00 C ATOM 574 C VAL A 394 -9.385 6.302 -29.898 1.00 0.00 C ATOM 575 O VAL A 394 -9.433 5.206 -30.457 1.00 0.00 O ATOM 576 CB VAL A 394 -10.830 8.336 -29.946 1.00 0.00 C ATOM 577 CG1 VAL A 394 -10.879 8.240 -31.463 1.00 0.00 C ATOM 578 CG2 VAL A 394 -12.087 8.999 -29.404 1.00 0.00 C ATOM 0 H VAL A 394 -10.114 7.852 -27.508 1.00 0.00 H new ATOM 0 HA VAL A 394 -11.506 6.322 -29.566 1.00 0.00 H new ATOM 0 HB VAL A 394 -9.975 8.954 -29.673 1.00 0.00 H new ATOM 0 HG11 VAL A 394 -11.012 9.236 -31.886 1.00 0.00 H new ATOM 0 HG12 VAL A 394 -9.947 7.810 -31.831 1.00 0.00 H new ATOM 0 HG13 VAL A 394 -11.713 7.605 -31.761 1.00 0.00 H new ATOM 0 HG21 VAL A 394 -12.203 9.984 -29.857 1.00 0.00 H new ATOM 0 HG22 VAL A 394 -12.955 8.385 -29.644 1.00 0.00 H new ATOM 0 HG23 VAL A 394 -12.005 9.104 -28.322 1.00 0.00 H new ATOM 588 N CYS A 395 -8.259 6.993 -29.757 1.00 0.00 N ATOM 589 CA CYS A 395 -6.987 6.494 -30.264 1.00 0.00 C ATOM 590 C CYS A 395 -6.568 5.225 -29.527 1.00 0.00 C ATOM 591 O CYS A 395 -6.569 4.134 -30.097 1.00 0.00 O ATOM 592 CB CYS A 395 -5.902 7.562 -30.119 1.00 0.00 C ATOM 593 SG CYS A 395 -6.380 9.200 -30.759 1.00 0.00 S ATOM 0 H CYS A 395 -8.202 7.901 -29.295 1.00 0.00 H new ATOM 0 HA CYS A 395 -7.114 6.255 -31.320 1.00 0.00 H new ATOM 0 HB2 CYS A 395 -5.640 7.658 -29.065 1.00 0.00 H new ATOM 0 HB3 CYS A 395 -5.006 7.227 -30.641 1.00 0.00 H new ATOM 0 HG CYS A 395 -5.994 10.121 -29.926 1.00 0.00 H new ATOM 598 N GLY A 396 -6.210 5.376 -28.255 1.00 0.00 N ATOM 599 CA GLY A 396 -5.794 4.235 -27.461 1.00 0.00 C ATOM 600 C GLY A 396 -4.484 4.478 -26.739 1.00 0.00 C ATOM 601 O GLY A 396 -4.097 3.705 -25.862 1.00 0.00 O ATOM 0 H GLY A 396 -6.201 6.268 -27.761 1.00 0.00 H new ATOM 0 HA2 GLY A 396 -6.570 4.002 -26.731 1.00 0.00 H new ATOM 0 HA3 GLY A 396 -5.693 3.364 -28.108 1.00 0.00 H new ATOM 605 N LEU A 397 -3.798 5.555 -27.107 1.00 0.00 N ATOM 606 CA LEU A 397 -2.522 5.897 -26.489 1.00 0.00 C ATOM 607 C LEU A 397 -2.656 5.976 -24.971 1.00 0.00 C ATOM 608 O LEU A 397 -3.760 5.906 -24.431 1.00 0.00 O ATOM 609 CB LEU A 397 -2.009 7.231 -27.037 1.00 0.00 C ATOM 610 CG LEU A 397 -0.921 7.143 -28.107 1.00 0.00 C ATOM 611 CD1 LEU A 397 -1.327 7.924 -29.347 1.00 0.00 C ATOM 612 CD2 LEU A 397 0.405 7.654 -27.563 1.00 0.00 C ATOM 0 H LEU A 397 -4.104 6.206 -27.830 1.00 0.00 H new ATOM 0 HA LEU A 397 -1.806 5.112 -26.732 1.00 0.00 H new ATOM 0 HB2 LEU A 397 -2.855 7.780 -27.451 1.00 0.00 H new ATOM 0 HB3 LEU A 397 -1.625 7.819 -26.204 1.00 0.00 H new ATOM 0 HG LEU A 397 -0.797 6.097 -28.386 1.00 0.00 H new ATOM 0 HD11 LEU A 397 -0.540 7.850 -30.098 1.00 0.00 H new ATOM 0 HD12 LEU A 397 -2.252 7.512 -29.750 1.00 0.00 H new ATOM 0 HD13 LEU A 397 -1.480 8.971 -29.084 1.00 0.00 H new ATOM 0 HD21 LEU A 397 1.168 7.584 -28.339 1.00 0.00 H new ATOM 0 HD22 LEU A 397 0.295 8.694 -27.255 1.00 0.00 H new ATOM 0 HD23 LEU A 397 0.703 7.051 -26.705 1.00 0.00 H new ATOM 624 N ARG A 398 -1.524 6.123 -24.290 1.00 0.00 N ATOM 625 CA ARG A 398 -1.515 6.212 -22.835 1.00 0.00 C ATOM 626 C ARG A 398 -0.713 7.424 -22.369 1.00 0.00 C ATOM 627 O ARG A 398 0.380 7.688 -22.870 1.00 0.00 O ATOM 628 CB ARG A 398 -0.929 4.936 -22.228 1.00 0.00 C ATOM 629 CG ARG A 398 -1.834 3.723 -22.368 1.00 0.00 C ATOM 630 CD ARG A 398 -1.146 2.598 -23.125 1.00 0.00 C ATOM 631 NE ARG A 398 -1.953 1.381 -23.148 1.00 0.00 N ATOM 632 CZ ARG A 398 -1.653 0.314 -23.881 1.00 0.00 C ATOM 633 NH1 ARG A 398 -0.570 0.315 -24.646 1.00 0.00 N ATOM 634 NH2 ARG A 398 -2.436 -0.756 -23.849 1.00 0.00 N ATOM 0 H ARG A 398 -0.602 6.183 -24.722 1.00 0.00 H new ATOM 0 HA ARG A 398 -2.545 6.327 -22.497 1.00 0.00 H new ATOM 0 HB2 ARG A 398 0.027 4.722 -22.706 1.00 0.00 H new ATOM 0 HB3 ARG A 398 -0.726 5.107 -21.171 1.00 0.00 H new ATOM 0 HG2 ARG A 398 -2.128 3.371 -21.379 1.00 0.00 H new ATOM 0 HG3 ARG A 398 -2.748 4.008 -22.889 1.00 0.00 H new ATOM 0 HD2 ARG A 398 -0.945 2.919 -24.147 1.00 0.00 H new ATOM 0 HD3 ARG A 398 -0.182 2.385 -22.662 1.00 0.00 H new ATOM 0 HE ARG A 398 -2.793 1.348 -22.570 1.00 0.00 H new ATOM 0 HH11 ARG A 398 0.035 1.136 -24.673 1.00 0.00 H new ATOM 0 HH12 ARG A 398 -0.342 -0.505 -25.208 1.00 0.00 H new ATOM 0 HH21 ARG A 398 -3.270 -0.761 -23.261 1.00 0.00 H new ATOM 0 HH22 ARG A 398 -2.205 -1.574 -24.412 1.00 0.00 H new ATOM 648 N PHE A 399 -1.265 8.158 -21.408 1.00 0.00 N ATOM 649 CA PHE A 399 -0.602 9.343 -20.876 1.00 0.00 C ATOM 650 C PHE A 399 -0.422 9.232 -19.365 1.00 0.00 C ATOM 651 O PHE A 399 -1.249 8.642 -18.670 1.00 0.00 O ATOM 652 CB PHE A 399 -1.408 10.599 -21.214 1.00 0.00 C ATOM 653 CG PHE A 399 -1.634 10.788 -22.687 1.00 0.00 C ATOM 654 CD1 PHE A 399 -2.643 10.098 -23.340 1.00 0.00 C ATOM 655 CD2 PHE A 399 -0.838 11.654 -23.418 1.00 0.00 C ATOM 656 CE1 PHE A 399 -2.854 10.270 -24.696 1.00 0.00 C ATOM 657 CE2 PHE A 399 -1.044 11.830 -24.773 1.00 0.00 C ATOM 658 CZ PHE A 399 -2.053 11.136 -25.413 1.00 0.00 C ATOM 0 H PHE A 399 -2.169 7.953 -20.982 1.00 0.00 H new ATOM 0 HA PHE A 399 0.383 9.417 -21.338 1.00 0.00 H new ATOM 0 HB2 PHE A 399 -2.373 10.548 -20.710 1.00 0.00 H new ATOM 0 HB3 PHE A 399 -0.888 11.472 -20.819 1.00 0.00 H new ATOM 0 HD1 PHE A 399 -3.272 9.418 -22.784 1.00 0.00 H new ATOM 0 HD2 PHE A 399 -0.047 12.198 -22.923 1.00 0.00 H new ATOM 0 HE1 PHE A 399 -3.644 9.727 -25.193 1.00 0.00 H new ATOM 0 HE2 PHE A 399 -0.417 12.509 -25.331 1.00 0.00 H new ATOM 0 HZ PHE A 399 -2.215 11.271 -26.472 1.00 0.00 H new ATOM 668 N LYS A 400 0.667 9.804 -18.862 1.00 0.00 N ATOM 669 CA LYS A 400 0.959 9.772 -17.434 1.00 0.00 C ATOM 670 C LYS A 400 0.628 11.110 -16.780 1.00 0.00 C ATOM 671 O LYS A 400 1.158 11.441 -15.719 1.00 0.00 O ATOM 672 CB LYS A 400 2.432 9.428 -17.200 1.00 0.00 C ATOM 673 CG LYS A 400 2.645 8.338 -16.164 1.00 0.00 C ATOM 674 CD LYS A 400 3.368 8.869 -14.938 1.00 0.00 C ATOM 675 CE LYS A 400 4.854 8.546 -14.983 1.00 0.00 C ATOM 676 NZ LYS A 400 5.606 9.512 -15.830 1.00 0.00 N ATOM 0 H LYS A 400 1.362 10.296 -19.423 1.00 0.00 H new ATOM 0 HA LYS A 400 0.336 9.002 -16.979 1.00 0.00 H new ATOM 0 HB2 LYS A 400 2.877 9.113 -18.144 1.00 0.00 H new ATOM 0 HB3 LYS A 400 2.960 10.327 -16.883 1.00 0.00 H new ATOM 0 HG2 LYS A 400 1.682 7.923 -15.868 1.00 0.00 H new ATOM 0 HG3 LYS A 400 3.222 7.524 -16.604 1.00 0.00 H new ATOM 0 HD2 LYS A 400 3.231 9.948 -14.873 1.00 0.00 H new ATOM 0 HD3 LYS A 400 2.928 8.437 -14.039 1.00 0.00 H new ATOM 0 HE2 LYS A 400 5.259 8.558 -13.971 1.00 0.00 H new ATOM 0 HE3 LYS A 400 4.995 7.537 -15.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 6.614 9.258 -15.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 5.237 9.482 -16.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 5.493 10.472 -15.446 1.00 0.00 H new ATOM 690 N ARG A 401 -0.251 11.875 -17.420 1.00 0.00 N ATOM 691 CA ARG A 401 -0.651 13.177 -16.901 1.00 0.00 C ATOM 692 C ARG A 401 -2.059 13.537 -17.364 1.00 0.00 C ATOM 693 O ARG A 401 -2.554 13.003 -18.357 1.00 0.00 O ATOM 694 CB ARG A 401 0.337 14.255 -17.350 1.00 0.00 C ATOM 695 CG ARG A 401 0.728 14.150 -18.815 1.00 0.00 C ATOM 696 CD ARG A 401 2.177 13.719 -18.975 1.00 0.00 C ATOM 697 NE ARG A 401 3.107 14.815 -18.719 1.00 0.00 N ATOM 698 CZ ARG A 401 4.426 14.667 -18.684 1.00 0.00 C ATOM 699 NH1 ARG A 401 4.969 13.475 -18.888 1.00 0.00 N ATOM 700 NH2 ARG A 401 5.206 15.714 -18.444 1.00 0.00 N ATOM 0 H ARG A 401 -0.699 11.615 -18.299 1.00 0.00 H new ATOM 0 HA ARG A 401 -0.648 13.123 -15.812 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -0.102 15.236 -17.169 1.00 0.00 H new ATOM 0 HB3 ARG A 401 1.236 14.190 -16.737 1.00 0.00 H new ATOM 0 HG2 ARG A 401 0.077 13.434 -19.316 1.00 0.00 H new ATOM 0 HG3 ARG A 401 0.578 15.113 -19.303 1.00 0.00 H new ATOM 0 HD2 ARG A 401 2.388 12.897 -18.290 1.00 0.00 H new ATOM 0 HD3 ARG A 401 2.333 13.340 -19.985 1.00 0.00 H new ATOM 0 HE ARG A 401 2.722 15.746 -18.558 1.00 0.00 H new ATOM 0 HH11 ARG A 401 4.373 12.668 -19.073 1.00 0.00 H new ATOM 0 HH12 ARG A 401 5.983 13.365 -18.860 1.00 0.00 H new ATOM 0 HH21 ARG A 401 4.792 16.633 -18.286 1.00 0.00 H new ATOM 0 HH22 ARG A 401 6.219 15.600 -18.417 1.00 0.00 H new ATOM 714 N LYS A 402 -2.701 14.447 -16.638 1.00 0.00 N ATOM 715 CA LYS A 402 -4.052 14.880 -16.974 1.00 0.00 C ATOM 716 C LYS A 402 -4.020 16.064 -17.936 1.00 0.00 C ATOM 717 O LYS A 402 -4.990 16.323 -18.648 1.00 0.00 O ATOM 718 CB LYS A 402 -4.818 15.260 -15.705 1.00 0.00 C ATOM 719 CG LYS A 402 -6.304 14.951 -15.776 1.00 0.00 C ATOM 720 CD LYS A 402 -6.824 14.412 -14.454 1.00 0.00 C ATOM 721 CE LYS A 402 -7.941 13.401 -14.665 1.00 0.00 C ATOM 722 NZ LYS A 402 -9.236 14.064 -14.984 1.00 0.00 N ATOM 0 H LYS A 402 -2.307 14.899 -15.813 1.00 0.00 H new ATOM 0 HA LYS A 402 -4.562 14.050 -17.464 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -4.385 14.729 -14.857 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -4.686 16.325 -15.516 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -6.852 15.854 -16.043 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -6.488 14.222 -16.565 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -6.007 13.944 -13.904 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -7.189 15.237 -13.842 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -7.670 12.724 -15.475 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -8.055 12.793 -13.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -9.971 13.342 -15.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -9.508 14.691 -14.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -9.134 14.623 -15.855 1.00 0.00 H new ATOM 736 N ASP A 403 -2.900 16.778 -17.951 1.00 0.00 N ATOM 737 CA ASP A 403 -2.742 17.933 -18.827 1.00 0.00 C ATOM 738 C ASP A 403 -2.603 17.497 -20.282 1.00 0.00 C ATOM 739 O ASP A 403 -3.040 18.198 -21.195 1.00 0.00 O ATOM 740 CB ASP A 403 -1.520 18.753 -18.409 1.00 0.00 C ATOM 741 CG ASP A 403 -1.646 20.215 -18.789 1.00 0.00 C ATOM 742 OD1 ASP A 403 -2.772 20.750 -18.719 1.00 0.00 O ATOM 743 OD2 ASP A 403 -0.619 20.824 -19.156 1.00 0.00 O ATOM 0 H ASP A 403 -2.088 16.577 -17.367 1.00 0.00 H new ATOM 0 HA ASP A 403 -3.635 18.552 -18.736 1.00 0.00 H new ATOM 0 HB2 ASP A 403 -1.383 18.671 -17.331 1.00 0.00 H new ATOM 0 HB3 ASP A 403 -0.628 18.335 -18.876 1.00 0.00 H new ATOM 748 N ARG A 404 -1.992 16.335 -20.491 1.00 0.00 N ATOM 749 CA ARG A 404 -1.795 15.807 -21.835 1.00 0.00 C ATOM 750 C ARG A 404 -3.076 15.166 -22.361 1.00 0.00 C ATOM 751 O ARG A 404 -3.615 15.585 -23.385 1.00 0.00 O ATOM 752 CB ARG A 404 -0.660 14.781 -21.841 1.00 0.00 C ATOM 753 CG ARG A 404 0.726 15.406 -21.861 1.00 0.00 C ATOM 754 CD ARG A 404 0.967 16.184 -23.145 1.00 0.00 C ATOM 755 NE ARG A 404 1.159 17.609 -22.894 1.00 0.00 N ATOM 756 CZ ARG A 404 2.259 18.118 -22.349 1.00 0.00 C ATOM 757 NH1 ARG A 404 3.260 17.322 -22.000 1.00 0.00 N ATOM 758 NH2 ARG A 404 2.359 19.427 -22.152 1.00 0.00 N ATOM 0 H ARG A 404 -1.625 15.742 -19.747 1.00 0.00 H new ATOM 0 HA ARG A 404 -1.530 16.638 -22.489 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -0.751 14.146 -20.959 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -0.770 14.135 -22.712 1.00 0.00 H new ATOM 0 HG2 ARG A 404 0.839 16.071 -21.005 1.00 0.00 H new ATOM 0 HG3 ARG A 404 1.480 14.625 -21.760 1.00 0.00 H new ATOM 0 HD2 ARG A 404 1.845 15.784 -23.652 1.00 0.00 H new ATOM 0 HD3 ARG A 404 0.120 16.045 -23.817 1.00 0.00 H new ATOM 0 HE ARG A 404 0.408 18.249 -23.151 1.00 0.00 H new ATOM 0 HH11 ARG A 404 3.187 16.316 -22.150 1.00 0.00 H new ATOM 0 HH12 ARG A 404 4.103 17.716 -21.582 1.00 0.00 H new ATOM 0 HH21 ARG A 404 1.591 20.043 -22.419 1.00 0.00 H new ATOM 0 HH22 ARG A 404 3.204 19.817 -21.734 1.00 0.00 H new ATOM 772 N MET A 405 -3.557 14.149 -21.654 1.00 0.00 N ATOM 773 CA MET A 405 -4.774 13.451 -22.050 1.00 0.00 C ATOM 774 C MET A 405 -5.914 14.438 -22.283 1.00 0.00 C ATOM 775 O MET A 405 -6.776 14.215 -23.134 1.00 0.00 O ATOM 776 CB MET A 405 -5.176 12.434 -20.980 1.00 0.00 C ATOM 777 CG MET A 405 -5.533 13.066 -19.644 1.00 0.00 C ATOM 778 SD MET A 405 -7.299 13.394 -19.481 1.00 0.00 S ATOM 779 CE MET A 405 -7.948 11.726 -19.411 1.00 0.00 C ATOM 0 H MET A 405 -3.122 13.790 -20.804 1.00 0.00 H new ATOM 0 HA MET A 405 -4.574 12.925 -22.984 1.00 0.00 H new ATOM 0 HB2 MET A 405 -6.029 11.858 -21.340 1.00 0.00 H new ATOM 0 HB3 MET A 405 -4.356 11.731 -20.833 1.00 0.00 H new ATOM 0 HG2 MET A 405 -5.214 12.406 -18.837 1.00 0.00 H new ATOM 0 HG3 MET A 405 -4.982 13.999 -19.529 1.00 0.00 H new ATOM 0 HE1 MET A 405 -9.025 11.747 -19.578 1.00 0.00 H new ATOM 0 HE2 MET A 405 -7.473 11.118 -20.181 1.00 0.00 H new ATOM 0 HE3 MET A 405 -7.741 11.296 -18.431 1.00 0.00 H new ATOM 789 N SER A 406 -5.913 15.528 -21.523 1.00 0.00 N ATOM 790 CA SER A 406 -6.949 16.546 -21.645 1.00 0.00 C ATOM 791 C SER A 406 -6.862 17.252 -22.995 1.00 0.00 C ATOM 792 O SER A 406 -7.867 17.422 -23.686 1.00 0.00 O ATOM 793 CB SER A 406 -6.825 17.568 -20.514 1.00 0.00 C ATOM 794 OG SER A 406 -5.552 18.190 -20.525 1.00 0.00 O ATOM 0 H SER A 406 -5.206 15.729 -20.816 1.00 0.00 H new ATOM 0 HA SER A 406 -7.918 16.052 -21.575 1.00 0.00 H new ATOM 0 HB2 SER A 406 -7.603 18.324 -20.616 1.00 0.00 H new ATOM 0 HB3 SER A 406 -6.984 17.075 -19.555 1.00 0.00 H new ATOM 0 HG SER A 406 -5.499 18.839 -19.793 1.00 0.00 H new ATOM 800 N TYR A 407 -5.653 17.661 -23.364 1.00 0.00 N ATOM 801 CA TYR A 407 -5.433 18.350 -24.630 1.00 0.00 C ATOM 802 C TYR A 407 -5.475 17.371 -25.798 1.00 0.00 C ATOM 803 O TYR A 407 -5.658 17.767 -26.950 1.00 0.00 O ATOM 804 CB TYR A 407 -4.089 19.080 -24.610 1.00 0.00 C ATOM 805 CG TYR A 407 -4.157 20.458 -23.991 1.00 0.00 C ATOM 806 CD1 TYR A 407 -5.086 21.393 -24.431 1.00 0.00 C ATOM 807 CD2 TYR A 407 -3.293 20.825 -22.967 1.00 0.00 C ATOM 808 CE1 TYR A 407 -5.151 22.654 -23.869 1.00 0.00 C ATOM 809 CE2 TYR A 407 -3.352 22.083 -22.398 1.00 0.00 C ATOM 810 CZ TYR A 407 -4.283 22.994 -22.853 1.00 0.00 C ATOM 811 OH TYR A 407 -4.346 24.248 -22.290 1.00 0.00 O ATOM 0 H TYR A 407 -4.811 17.527 -22.804 1.00 0.00 H new ATOM 0 HA TYR A 407 -6.233 19.078 -24.762 1.00 0.00 H new ATOM 0 HB2 TYR A 407 -3.367 18.478 -24.058 1.00 0.00 H new ATOM 0 HB3 TYR A 407 -3.717 19.168 -25.631 1.00 0.00 H new ATOM 0 HD1 TYR A 407 -5.769 21.130 -25.225 1.00 0.00 H new ATOM 0 HD2 TYR A 407 -2.562 20.115 -22.609 1.00 0.00 H new ATOM 0 HE1 TYR A 407 -5.878 23.369 -24.224 1.00 0.00 H new ATOM 0 HE2 TYR A 407 -2.673 22.351 -21.602 1.00 0.00 H new ATOM 0 HH TYR A 407 -3.667 24.326 -21.587 1.00 0.00 H new ATOM 821 N HIS A 408 -5.305 16.088 -25.493 1.00 0.00 N ATOM 822 CA HIS A 408 -5.325 15.050 -26.517 1.00 0.00 C ATOM 823 C HIS A 408 -6.756 14.626 -26.834 1.00 0.00 C ATOM 824 O HIS A 408 -7.179 14.643 -27.990 1.00 0.00 O ATOM 825 CB HIS A 408 -4.511 13.839 -26.061 1.00 0.00 C ATOM 826 CG HIS A 408 -4.564 12.687 -27.017 1.00 0.00 C ATOM 827 ND1 HIS A 408 -3.741 12.584 -28.119 1.00 0.00 N ATOM 828 CD2 HIS A 408 -5.348 11.583 -27.030 1.00 0.00 C ATOM 829 CE1 HIS A 408 -4.017 11.468 -28.769 1.00 0.00 C ATOM 830 NE2 HIS A 408 -4.989 10.842 -28.129 1.00 0.00 N ATOM 0 H HIS A 408 -5.152 15.743 -24.545 1.00 0.00 H new ATOM 0 HA HIS A 408 -4.877 15.459 -27.423 1.00 0.00 H new ATOM 0 HB2 HIS A 408 -3.472 14.140 -25.925 1.00 0.00 H new ATOM 0 HB3 HIS A 408 -4.878 13.511 -25.088 1.00 0.00 H new ATOM 0 HD1 HIS A 408 -3.030 13.264 -28.390 1.00 0.00 H new ATOM 0 HD2 HIS A 408 -6.113 11.332 -26.310 1.00 0.00 H new ATOM 0 HE1 HIS A 408 -3.531 11.125 -29.670 1.00 0.00 H new ATOM 838 N VAL A 409 -7.498 14.245 -25.799 1.00 0.00 N ATOM 839 CA VAL A 409 -8.881 13.816 -25.966 1.00 0.00 C ATOM 840 C VAL A 409 -9.733 14.931 -26.562 1.00 0.00 C ATOM 841 O VAL A 409 -10.313 14.776 -27.637 1.00 0.00 O ATOM 842 CB VAL A 409 -9.498 13.375 -24.625 1.00 0.00 C ATOM 843 CG1 VAL A 409 -10.953 12.973 -24.813 1.00 0.00 C ATOM 844 CG2 VAL A 409 -8.696 12.233 -24.020 1.00 0.00 C ATOM 0 H VAL A 409 -7.164 14.225 -24.835 1.00 0.00 H new ATOM 0 HA VAL A 409 -8.869 12.966 -26.649 1.00 0.00 H new ATOM 0 HB VAL A 409 -9.465 14.218 -23.935 1.00 0.00 H new ATOM 0 HG11 VAL A 409 -11.372 12.665 -23.855 1.00 0.00 H new ATOM 0 HG12 VAL A 409 -11.518 13.821 -25.200 1.00 0.00 H new ATOM 0 HG13 VAL A 409 -11.013 12.145 -25.519 1.00 0.00 H new ATOM 0 HG21 VAL A 409 -9.146 11.934 -23.073 1.00 0.00 H new ATOM 0 HG22 VAL A 409 -8.696 11.385 -24.705 1.00 0.00 H new ATOM 0 HG23 VAL A 409 -7.671 12.560 -23.847 1.00 0.00 H new ATOM 854 N ARG A 410 -9.804 16.056 -25.858 1.00 0.00 N ATOM 855 CA ARG A 410 -10.586 17.197 -26.317 1.00 0.00 C ATOM 856 C ARG A 410 -10.216 17.569 -27.750 1.00 0.00 C ATOM 857 O ARG A 410 -11.077 17.933 -28.550 1.00 0.00 O ATOM 858 CB ARG A 410 -10.367 18.397 -25.394 1.00 0.00 C ATOM 859 CG ARG A 410 -10.672 18.107 -23.934 1.00 0.00 C ATOM 860 CD ARG A 410 -12.057 18.598 -23.546 1.00 0.00 C ATOM 861 NE ARG A 410 -12.538 17.969 -22.319 1.00 0.00 N ATOM 862 CZ ARG A 410 -12.179 18.363 -21.102 1.00 0.00 C ATOM 863 NH1 ARG A 410 -11.341 19.379 -20.951 1.00 0.00 N ATOM 864 NH2 ARG A 410 -12.659 17.739 -20.033 1.00 0.00 N ATOM 0 H ARG A 410 -9.329 16.201 -24.967 1.00 0.00 H new ATOM 0 HA ARG A 410 -11.639 16.917 -26.293 1.00 0.00 H new ATOM 0 HB2 ARG A 410 -9.332 18.727 -25.481 1.00 0.00 H new ATOM 0 HB3 ARG A 410 -10.995 19.222 -25.730 1.00 0.00 H new ATOM 0 HG2 ARG A 410 -10.601 17.035 -23.752 1.00 0.00 H new ATOM 0 HG3 ARG A 410 -9.924 18.587 -23.303 1.00 0.00 H new ATOM 0 HD2 ARG A 410 -12.034 19.680 -23.414 1.00 0.00 H new ATOM 0 HD3 ARG A 410 -12.755 18.391 -24.357 1.00 0.00 H new ATOM 0 HE ARG A 410 -13.185 17.185 -22.401 1.00 0.00 H new ATOM 0 HH11 ARG A 410 -10.970 19.860 -21.770 1.00 0.00 H new ATOM 0 HH12 ARG A 410 -11.067 19.679 -20.016 1.00 0.00 H new ATOM 0 HH21 ARG A 410 -13.304 16.957 -20.146 1.00 0.00 H new ATOM 0 HH22 ARG A 410 -12.383 18.042 -19.099 1.00 0.00 H new ATOM 878 N SER A 411 -8.928 17.474 -28.066 1.00 0.00 N ATOM 879 CA SER A 411 -8.443 17.805 -29.401 1.00 0.00 C ATOM 880 C SER A 411 -9.236 17.057 -30.468 1.00 0.00 C ATOM 881 O SER A 411 -9.403 17.541 -31.588 1.00 0.00 O ATOM 882 CB SER A 411 -6.956 17.466 -29.524 1.00 0.00 C ATOM 883 OG SER A 411 -6.664 16.905 -30.792 1.00 0.00 O ATOM 0 H SER A 411 -8.202 17.171 -27.416 1.00 0.00 H new ATOM 0 HA SER A 411 -8.579 18.875 -29.555 1.00 0.00 H new ATOM 0 HB2 SER A 411 -6.361 18.367 -29.376 1.00 0.00 H new ATOM 0 HB3 SER A 411 -6.674 16.765 -28.739 1.00 0.00 H new ATOM 0 HG SER A 411 -5.707 16.699 -30.846 1.00 0.00 H new ATOM 889 N HIS A 412 -9.725 15.873 -30.112 1.00 0.00 N ATOM 890 CA HIS A 412 -10.502 15.057 -31.038 1.00 0.00 C ATOM 891 C HIS A 412 -11.967 15.484 -31.042 1.00 0.00 C ATOM 892 O HIS A 412 -12.624 15.472 -32.082 1.00 0.00 O ATOM 893 CB HIS A 412 -10.391 13.578 -30.665 1.00 0.00 C ATOM 894 CG HIS A 412 -8.982 13.120 -30.446 1.00 0.00 C ATOM 895 ND1 HIS A 412 -7.964 13.361 -31.344 1.00 0.00 N ATOM 896 CD2 HIS A 412 -8.424 12.433 -29.423 1.00 0.00 C ATOM 897 CE1 HIS A 412 -6.841 12.841 -30.883 1.00 0.00 C ATOM 898 NE2 HIS A 412 -7.092 12.272 -29.718 1.00 0.00 N ATOM 0 H HIS A 412 -9.597 15.458 -29.189 1.00 0.00 H new ATOM 0 HA HIS A 412 -10.097 15.203 -32.039 1.00 0.00 H new ATOM 0 HB2 HIS A 412 -10.969 13.396 -29.759 1.00 0.00 H new ATOM 0 HB3 HIS A 412 -10.841 12.978 -31.456 1.00 0.00 H new ATOM 0 HD2 HIS A 412 -8.931 12.077 -28.539 1.00 0.00 H new ATOM 0 HE1 HIS A 412 -5.880 12.875 -31.375 1.00 0.00 H new ATOM 0 HE2 HIS A 412 -6.409 11.791 -29.133 1.00 0.00 H new ATOM 959 N LYS A 418 -20.934 19.720 -41.859 1.00 0.00 N ATOM 960 CA LYS A 418 -21.573 20.337 -43.015 1.00 0.00 C ATOM 961 C LYS A 418 -21.068 21.761 -43.221 1.00 0.00 C ATOM 962 O LYS A 418 -20.572 22.409 -42.299 1.00 0.00 O ATOM 963 CB LYS A 418 -23.094 20.345 -42.839 1.00 0.00 C ATOM 964 CG LYS A 418 -23.741 18.992 -43.078 1.00 0.00 C ATOM 965 CD LYS A 418 -23.522 18.514 -44.504 1.00 0.00 C ATOM 966 CE LYS A 418 -24.518 17.430 -44.887 1.00 0.00 C ATOM 967 NZ LYS A 418 -24.222 16.139 -44.206 1.00 0.00 N ATOM 0 HA LYS A 418 -21.318 19.749 -43.896 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -23.333 20.679 -41.829 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -23.527 21.072 -43.526 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -23.329 18.262 -42.381 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -24.810 19.058 -42.875 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -23.617 19.356 -45.190 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -22.507 18.131 -44.609 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -25.526 17.755 -44.628 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -24.498 17.284 -45.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -24.923 15.426 -44.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -23.270 15.816 -44.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -24.266 16.272 -43.175 1.00 0.00 H new ATOM 981 N PRO A 419 -21.195 22.262 -44.459 1.00 0.00 N ATOM 982 CA PRO A 419 -20.759 23.615 -44.814 1.00 0.00 C ATOM 983 C PRO A 419 -21.635 24.692 -44.182 1.00 0.00 C ATOM 984 O PRO A 419 -21.131 25.647 -43.590 1.00 0.00 O ATOM 985 CB PRO A 419 -20.894 23.643 -46.339 1.00 0.00 C ATOM 986 CG PRO A 419 -21.934 22.622 -46.646 1.00 0.00 C ATOM 987 CD PRO A 419 -21.777 21.546 -45.607 1.00 0.00 C ATOM 0 HA PRO A 419 -19.750 23.824 -44.458 1.00 0.00 H new ATOM 0 HB2 PRO A 419 -21.192 24.630 -46.692 1.00 0.00 H new ATOM 0 HB3 PRO A 419 -19.948 23.403 -46.825 1.00 0.00 H new ATOM 0 HG2 PRO A 419 -22.932 23.058 -46.608 1.00 0.00 H new ATOM 0 HG3 PRO A 419 -21.800 22.218 -47.650 1.00 0.00 H new ATOM 0 HD2 PRO A 419 -22.734 21.090 -45.353 1.00 0.00 H new ATOM 0 HD3 PRO A 419 -21.124 20.745 -45.954 1.00 0.00 H new ATOM 995 N TYR A 420 -22.947 24.531 -44.311 1.00 0.00 N ATOM 996 CA TYR A 420 -23.893 25.490 -43.754 1.00 0.00 C ATOM 997 C TYR A 420 -24.762 24.839 -42.682 1.00 0.00 C ATOM 998 O TYR A 420 -25.228 23.711 -42.846 1.00 0.00 O ATOM 999 CB TYR A 420 -24.777 26.068 -44.861 1.00 0.00 C ATOM 1000 CG TYR A 420 -23.996 26.717 -45.982 1.00 0.00 C ATOM 1001 CD1 TYR A 420 -23.369 27.943 -45.799 1.00 0.00 C ATOM 1002 CD2 TYR A 420 -23.888 26.105 -47.224 1.00 0.00 C ATOM 1003 CE1 TYR A 420 -22.655 28.540 -46.820 1.00 0.00 C ATOM 1004 CE2 TYR A 420 -23.175 26.694 -48.251 1.00 0.00 C ATOM 1005 CZ TYR A 420 -22.561 27.911 -48.044 1.00 0.00 C ATOM 1006 OH TYR A 420 -21.852 28.502 -49.065 1.00 0.00 O ATOM 0 H TYR A 420 -23.380 23.745 -44.797 1.00 0.00 H new ATOM 0 HA TYR A 420 -23.324 26.297 -43.294 1.00 0.00 H new ATOM 0 HB2 TYR A 420 -25.395 25.271 -45.274 1.00 0.00 H new ATOM 0 HB3 TYR A 420 -25.454 26.804 -44.427 1.00 0.00 H new ATOM 0 HD1 TYR A 420 -23.441 28.438 -44.842 1.00 0.00 H new ATOM 0 HD2 TYR A 420 -24.369 25.153 -47.390 1.00 0.00 H new ATOM 0 HE1 TYR A 420 -22.173 29.493 -46.661 1.00 0.00 H new ATOM 0 HE2 TYR A 420 -23.099 26.204 -49.210 1.00 0.00 H new ATOM 0 HH TYR A 420 -21.883 27.929 -49.859 1.00 0.00 H new ATOM 1016 N ILE A 421 -24.975 25.558 -41.586 1.00 0.00 N ATOM 1017 CA ILE A 421 -25.789 25.052 -40.487 1.00 0.00 C ATOM 1018 C ILE A 421 -26.896 26.036 -40.125 1.00 0.00 C ATOM 1019 O ILE A 421 -26.719 27.251 -40.222 1.00 0.00 O ATOM 1020 CB ILE A 421 -24.935 24.774 -39.236 1.00 0.00 C ATOM 1021 CG1 ILE A 421 -24.116 26.012 -38.865 1.00 0.00 C ATOM 1022 CG2 ILE A 421 -24.022 23.580 -39.472 1.00 0.00 C ATOM 1023 CD1 ILE A 421 -22.775 26.081 -39.561 1.00 0.00 C ATOM 0 H ILE A 421 -24.596 26.493 -41.435 1.00 0.00 H new ATOM 0 HA ILE A 421 -26.234 24.117 -40.828 1.00 0.00 H new ATOM 0 HB ILE A 421 -25.601 24.539 -38.405 1.00 0.00 H new ATOM 0 HG12 ILE A 421 -24.690 26.905 -39.112 1.00 0.00 H new ATOM 0 HG13 ILE A 421 -23.957 26.023 -37.787 1.00 0.00 H new ATOM 0 HG21 ILE A 421 -23.425 23.396 -38.579 1.00 0.00 H new ATOM 0 HG22 ILE A 421 -24.625 22.699 -39.693 1.00 0.00 H new ATOM 0 HG23 ILE A 421 -23.361 23.788 -40.314 1.00 0.00 H new ATOM 0 HD11 ILE A 421 -22.250 26.984 -39.250 1.00 0.00 H new ATOM 0 HD12 ILE A 421 -22.181 25.206 -39.295 1.00 0.00 H new ATOM 0 HD13 ILE A 421 -22.926 26.102 -40.640 1.00 0.00 H new ATOM 1035 N CYS A 422 -28.039 25.504 -39.705 1.00 0.00 N ATOM 1036 CA CYS A 422 -29.176 26.334 -39.326 1.00 0.00 C ATOM 1037 C CYS A 422 -28.758 27.402 -38.319 1.00 0.00 C ATOM 1038 O CYS A 422 -27.739 27.266 -37.644 1.00 0.00 O ATOM 1039 CB CYS A 422 -30.291 25.469 -38.737 1.00 0.00 C ATOM 1040 SG CYS A 422 -31.930 26.265 -38.740 1.00 0.00 S ATOM 0 H CYS A 422 -28.202 24.501 -39.619 1.00 0.00 H new ATOM 0 HA CYS A 422 -29.547 26.831 -40.222 1.00 0.00 H new ATOM 0 HB2 CYS A 422 -30.350 24.538 -39.301 1.00 0.00 H new ATOM 0 HB3 CYS A 422 -30.029 25.205 -37.712 1.00 0.00 H new ATOM 0 HG CYS A 422 -32.628 25.825 -37.735 1.00 0.00 H new ATOM 1045 N GLN A 423 -29.555 28.462 -38.225 1.00 0.00 N ATOM 1046 CA GLN A 423 -29.267 29.552 -37.300 1.00 0.00 C ATOM 1047 C GLN A 423 -29.967 29.331 -35.963 1.00 0.00 C ATOM 1048 O GLN A 423 -29.756 30.081 -35.010 1.00 0.00 O ATOM 1049 CB GLN A 423 -29.704 30.888 -37.903 1.00 0.00 C ATOM 1050 CG GLN A 423 -31.197 30.976 -38.171 1.00 0.00 C ATOM 1051 CD GLN A 423 -31.734 32.387 -38.032 1.00 0.00 C ATOM 1052 OE1 GLN A 423 -31.161 33.214 -37.322 1.00 0.00 O ATOM 1053 NE2 GLN A 423 -32.839 32.671 -38.711 1.00 0.00 N ATOM 0 H GLN A 423 -30.403 28.589 -38.777 1.00 0.00 H new ATOM 0 HA GLN A 423 -28.191 29.574 -37.126 1.00 0.00 H new ATOM 0 HB2 GLN A 423 -29.417 31.693 -37.227 1.00 0.00 H new ATOM 0 HB3 GLN A 423 -29.166 31.049 -38.837 1.00 0.00 H new ATOM 0 HG2 GLN A 423 -31.404 30.610 -39.177 1.00 0.00 H new ATOM 0 HG3 GLN A 423 -31.726 30.321 -37.479 1.00 0.00 H new ATOM 0 HE21 GLN A 423 -33.281 31.955 -39.288 1.00 0.00 H new ATOM 0 HE22 GLN A 423 -33.245 33.605 -38.656 1.00 0.00 H new ATOM 1062 N SER A 424 -30.801 28.298 -35.901 1.00 0.00 N ATOM 1063 CA SER A 424 -31.536 27.981 -34.682 1.00 0.00 C ATOM 1064 C SER A 424 -31.011 26.696 -34.050 1.00 0.00 C ATOM 1065 O SER A 424 -30.295 26.730 -33.049 1.00 0.00 O ATOM 1066 CB SER A 424 -33.029 27.842 -34.983 1.00 0.00 C ATOM 1067 OG SER A 424 -33.726 29.036 -34.670 1.00 0.00 O ATOM 0 H SER A 424 -30.985 27.666 -36.681 1.00 0.00 H new ATOM 0 HA SER A 424 -31.390 28.799 -33.976 1.00 0.00 H new ATOM 0 HB2 SER A 424 -33.170 27.601 -36.037 1.00 0.00 H new ATOM 0 HB3 SER A 424 -33.444 27.014 -34.408 1.00 0.00 H new ATOM 0 HG SER A 424 -34.678 28.922 -34.873 1.00 0.00 H new ATOM 1073 N CYS A 425 -31.371 25.563 -34.643 1.00 0.00 N ATOM 1074 CA CYS A 425 -30.938 24.264 -34.140 1.00 0.00 C ATOM 1075 C CYS A 425 -29.482 23.996 -34.509 1.00 0.00 C ATOM 1076 O CYS A 425 -28.835 23.123 -33.932 1.00 0.00 O ATOM 1077 CB CYS A 425 -31.830 23.154 -34.699 1.00 0.00 C ATOM 1078 SG CYS A 425 -31.790 23.011 -36.515 1.00 0.00 S ATOM 0 H CYS A 425 -31.962 25.518 -35.473 1.00 0.00 H new ATOM 0 HA CYS A 425 -31.023 24.276 -33.053 1.00 0.00 H new ATOM 0 HB2 CYS A 425 -31.524 22.203 -34.264 1.00 0.00 H new ATOM 0 HB3 CYS A 425 -32.857 23.334 -34.382 1.00 0.00 H new ATOM 0 HG CYS A 425 -32.984 23.202 -36.992 1.00 0.00 H new ATOM 1083 N GLY A 426 -28.973 24.754 -35.476 1.00 0.00 N ATOM 1084 CA GLY A 426 -27.597 24.584 -35.905 1.00 0.00 C ATOM 1085 C GLY A 426 -27.249 23.133 -36.172 1.00 0.00 C ATOM 1086 O GLY A 426 -26.377 22.564 -35.515 1.00 0.00 O ATOM 0 H GLY A 426 -29.489 25.482 -35.970 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -27.427 25.168 -36.810 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -26.929 24.980 -35.140 1.00 0.00 H new ATOM 1090 N LYS A 427 -27.933 22.529 -37.138 1.00 0.00 N ATOM 1091 CA LYS A 427 -27.692 21.135 -37.491 1.00 0.00 C ATOM 1092 C LYS A 427 -26.606 21.023 -38.556 1.00 0.00 C ATOM 1093 O LYS A 427 -25.467 20.666 -38.260 1.00 0.00 O ATOM 1094 CB LYS A 427 -28.983 20.485 -37.994 1.00 0.00 C ATOM 1095 CG LYS A 427 -28.804 19.045 -38.443 1.00 0.00 C ATOM 1096 CD LYS A 427 -30.140 18.334 -38.580 1.00 0.00 C ATOM 1097 CE LYS A 427 -30.544 17.652 -37.282 1.00 0.00 C ATOM 1098 NZ LYS A 427 -31.252 18.585 -36.363 1.00 0.00 N ATOM 0 H LYS A 427 -28.659 22.984 -37.691 1.00 0.00 H new ATOM 0 HA LYS A 427 -27.354 20.613 -36.596 1.00 0.00 H new ATOM 0 HB2 LYS A 427 -29.730 20.519 -37.201 1.00 0.00 H new ATOM 0 HB3 LYS A 427 -29.374 21.070 -38.826 1.00 0.00 H new ATOM 0 HG2 LYS A 427 -28.279 19.023 -39.398 1.00 0.00 H new ATOM 0 HG3 LYS A 427 -28.180 18.514 -37.724 1.00 0.00 H new ATOM 0 HD2 LYS A 427 -30.907 19.052 -38.869 1.00 0.00 H new ATOM 0 HD3 LYS A 427 -30.079 17.594 -39.378 1.00 0.00 H new ATOM 0 HE2 LYS A 427 -31.189 16.802 -37.504 1.00 0.00 H new ATOM 0 HE3 LYS A 427 -29.656 17.258 -36.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 427 -31.890 18.045 -35.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 427 -30.556 19.095 -35.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 427 -31.806 19.267 -36.920 1.00 0.00 H new ATOM 1112 N GLY A 428 -26.968 21.332 -39.798 1.00 0.00 N ATOM 1113 CA GLY A 428 -26.012 21.260 -40.888 1.00 0.00 C ATOM 1114 C GLY A 428 -26.601 20.632 -42.135 1.00 0.00 C ATOM 1115 O GLY A 428 -27.302 19.623 -42.059 1.00 0.00 O ATOM 0 H GLY A 428 -27.905 21.631 -40.068 1.00 0.00 H new ATOM 0 HA2 GLY A 428 -25.657 22.264 -41.123 1.00 0.00 H new ATOM 0 HA3 GLY A 428 -25.145 20.682 -40.569 1.00 0.00 H new ATOM 1119 N PHE A 429 -26.317 21.229 -43.288 1.00 0.00 N ATOM 1120 CA PHE A 429 -26.826 20.723 -44.557 1.00 0.00 C ATOM 1121 C PHE A 429 -25.763 20.822 -45.647 1.00 0.00 C ATOM 1122 O PHE A 429 -25.025 21.804 -45.723 1.00 0.00 O ATOM 1123 CB PHE A 429 -28.076 21.500 -44.976 1.00 0.00 C ATOM 1124 CG PHE A 429 -29.260 21.254 -44.086 1.00 0.00 C ATOM 1125 CD1 PHE A 429 -29.397 21.937 -42.888 1.00 0.00 C ATOM 1126 CD2 PHE A 429 -30.237 20.341 -44.446 1.00 0.00 C ATOM 1127 CE1 PHE A 429 -30.485 21.714 -42.066 1.00 0.00 C ATOM 1128 CE2 PHE A 429 -31.329 20.114 -43.629 1.00 0.00 C ATOM 1129 CZ PHE A 429 -31.452 20.801 -42.437 1.00 0.00 C ATOM 0 H PHE A 429 -25.737 22.064 -43.369 1.00 0.00 H new ATOM 0 HA PHE A 429 -27.087 19.673 -44.423 1.00 0.00 H new ATOM 0 HB2 PHE A 429 -27.848 22.566 -44.978 1.00 0.00 H new ATOM 0 HB3 PHE A 429 -28.337 21.228 -45.999 1.00 0.00 H new ATOM 0 HD1 PHE A 429 -28.644 22.653 -42.593 1.00 0.00 H new ATOM 0 HD2 PHE A 429 -30.145 19.800 -45.376 1.00 0.00 H new ATOM 0 HE1 PHE A 429 -30.579 22.253 -41.135 1.00 0.00 H new ATOM 0 HE2 PHE A 429 -32.085 19.401 -43.922 1.00 0.00 H new ATOM 0 HZ PHE A 429 -32.303 20.624 -41.796 1.00 0.00 H new ATOM 1139 N SER A 430 -25.691 19.796 -46.490 1.00 0.00 N ATOM 1140 CA SER A 430 -24.716 19.764 -47.574 1.00 0.00 C ATOM 1141 C SER A 430 -24.831 21.011 -48.445 1.00 0.00 C ATOM 1142 O SER A 430 -23.863 21.749 -48.624 1.00 0.00 O ATOM 1143 CB SER A 430 -24.912 18.511 -48.428 1.00 0.00 C ATOM 1144 OG SER A 430 -23.669 17.999 -48.877 1.00 0.00 O ATOM 0 H SER A 430 -26.296 18.976 -46.443 1.00 0.00 H new ATOM 0 HA SER A 430 -23.720 19.741 -47.133 1.00 0.00 H new ATOM 0 HB2 SER A 430 -25.434 17.750 -47.848 1.00 0.00 H new ATOM 0 HB3 SER A 430 -25.543 18.747 -49.285 1.00 0.00 H new ATOM 0 HG SER A 430 -23.822 17.197 -49.419 1.00 0.00 H new ATOM 1150 N ARG A 431 -26.024 21.239 -48.986 1.00 0.00 N ATOM 1151 CA ARG A 431 -26.267 22.395 -49.840 1.00 0.00 C ATOM 1152 C ARG A 431 -26.981 23.501 -49.068 1.00 0.00 C ATOM 1153 O ARG A 431 -27.591 23.269 -48.024 1.00 0.00 O ATOM 1154 CB ARG A 431 -27.100 21.990 -51.058 1.00 0.00 C ATOM 1155 CG ARG A 431 -26.265 21.668 -52.287 1.00 0.00 C ATOM 1156 CD ARG A 431 -26.034 20.172 -52.427 1.00 0.00 C ATOM 1157 NE ARG A 431 -24.656 19.863 -52.801 1.00 0.00 N ATOM 1158 CZ ARG A 431 -24.199 19.934 -54.047 1.00 0.00 C ATOM 1159 NH1 ARG A 431 -25.006 20.302 -55.032 1.00 0.00 N ATOM 1160 NH2 ARG A 431 -22.933 19.638 -54.308 1.00 0.00 N ATOM 0 H ARG A 431 -26.837 20.638 -48.848 1.00 0.00 H new ATOM 0 HA ARG A 431 -25.303 22.775 -50.177 1.00 0.00 H new ATOM 0 HB2 ARG A 431 -27.704 21.120 -50.801 1.00 0.00 H new ATOM 0 HB3 ARG A 431 -27.791 22.798 -51.300 1.00 0.00 H new ATOM 0 HG2 ARG A 431 -26.767 22.045 -53.178 1.00 0.00 H new ATOM 0 HG3 ARG A 431 -25.305 22.181 -52.221 1.00 0.00 H new ATOM 0 HD2 ARG A 431 -26.273 19.679 -51.485 1.00 0.00 H new ATOM 0 HD3 ARG A 431 -26.713 19.769 -53.179 1.00 0.00 H new ATOM 0 HE ARG A 431 -24.009 19.577 -52.066 1.00 0.00 H new ATOM 0 HH11 ARG A 431 -25.980 20.531 -54.835 1.00 0.00 H new ATOM 0 HH12 ARG A 431 -24.653 20.356 -55.987 1.00 0.00 H new ATOM 0 HH21 ARG A 431 -22.309 19.356 -53.552 1.00 0.00 H new ATOM 0 HH22 ARG A 431 -22.583 19.693 -55.265 1.00 0.00 H new ATOM 1174 N PRO A 432 -26.904 24.733 -49.592 1.00 0.00 N ATOM 1175 CA PRO A 432 -27.536 25.899 -48.968 1.00 0.00 C ATOM 1176 C PRO A 432 -29.058 25.851 -49.058 1.00 0.00 C ATOM 1177 O PRO A 432 -29.754 26.063 -48.065 1.00 0.00 O ATOM 1178 CB PRO A 432 -26.990 27.076 -49.782 1.00 0.00 C ATOM 1179 CG PRO A 432 -26.643 26.492 -51.107 1.00 0.00 C ATOM 1180 CD PRO A 432 -26.194 25.083 -50.834 1.00 0.00 C ATOM 0 HA PRO A 432 -27.316 25.960 -47.902 1.00 0.00 H new ATOM 0 HB2 PRO A 432 -27.733 27.867 -49.881 1.00 0.00 H new ATOM 0 HB3 PRO A 432 -26.116 27.517 -49.303 1.00 0.00 H new ATOM 0 HG2 PRO A 432 -27.503 26.505 -51.776 1.00 0.00 H new ATOM 0 HG3 PRO A 432 -25.853 27.066 -51.592 1.00 0.00 H new ATOM 0 HD2 PRO A 432 -26.459 24.412 -51.651 1.00 0.00 H new ATOM 0 HD3 PRO A 432 -25.113 25.023 -50.709 1.00 0.00 H new ATOM 1188 N ASP A 433 -29.567 25.569 -50.252 1.00 0.00 N ATOM 1189 CA ASP A 433 -31.007 25.490 -50.470 1.00 0.00 C ATOM 1190 C ASP A 433 -31.654 24.524 -49.483 1.00 0.00 C ATOM 1191 O ASP A 433 -32.766 24.757 -49.008 1.00 0.00 O ATOM 1192 CB ASP A 433 -31.303 25.049 -51.904 1.00 0.00 C ATOM 1193 CG ASP A 433 -31.593 26.221 -52.822 1.00 0.00 C ATOM 1194 OD1 ASP A 433 -30.757 27.146 -52.886 1.00 0.00 O ATOM 1195 OD2 ASP A 433 -32.656 26.212 -53.477 1.00 0.00 O ATOM 0 H ASP A 433 -29.004 25.391 -51.084 1.00 0.00 H new ATOM 0 HA ASP A 433 -31.429 26.482 -50.309 1.00 0.00 H new ATOM 0 HB2 ASP A 433 -30.452 24.489 -52.292 1.00 0.00 H new ATOM 0 HB3 ASP A 433 -32.157 24.371 -51.904 1.00 0.00 H new ATOM 1200 N HIS A 434 -30.951 23.437 -49.180 1.00 0.00 N ATOM 1201 CA HIS A 434 -31.458 22.434 -48.250 1.00 0.00 C ATOM 1202 C HIS A 434 -31.729 23.050 -46.881 1.00 0.00 C ATOM 1203 O HIS A 434 -32.563 22.557 -46.120 1.00 0.00 O ATOM 1204 CB HIS A 434 -30.460 21.283 -48.115 1.00 0.00 C ATOM 1205 CG HIS A 434 -30.306 20.474 -49.366 1.00 0.00 C ATOM 1206 ND1 HIS A 434 -30.414 20.828 -50.668 1.00 0.00 N flip ATOM 1207 CD2 HIS A 434 -30.007 19.128 -49.360 1.00 0.00 C flip ATOM 1208 CE1 HIS A 434 -30.178 19.702 -51.417 1.00 0.00 C flip ATOM 1209 NE2 HIS A 434 -29.935 18.690 -50.604 1.00 0.00 N flip ATOM 0 H HIS A 434 -30.030 23.228 -49.565 1.00 0.00 H new ATOM 0 HA HIS A 434 -32.397 22.047 -48.647 1.00 0.00 H new ATOM 0 HB2 HIS A 434 -29.488 21.687 -47.831 1.00 0.00 H new ATOM 0 HB3 HIS A 434 -30.781 20.628 -47.305 1.00 0.00 H new ATOM 0 HD2 HIS A 434 -29.855 18.526 -48.476 1.00 0.00 H new ATOM 0 HE1 HIS A 434 -30.189 19.652 -52.496 1.00 0.00 H new ATOM 0 HE2 HIS A 434 -29.727 17.733 -50.888 1.00 0.00 H new ATOM 1217 N LEU A 435 -31.020 24.130 -46.573 1.00 0.00 N ATOM 1218 CA LEU A 435 -31.184 24.814 -45.295 1.00 0.00 C ATOM 1219 C LEU A 435 -32.308 25.843 -45.367 1.00 0.00 C ATOM 1220 O LEU A 435 -33.056 26.027 -44.409 1.00 0.00 O ATOM 1221 CB LEU A 435 -29.877 25.498 -44.889 1.00 0.00 C ATOM 1222 CG LEU A 435 -29.908 26.279 -43.574 1.00 0.00 C ATOM 1223 CD1 LEU A 435 -30.159 25.342 -42.403 1.00 0.00 C ATOM 1224 CD2 LEU A 435 -28.608 27.045 -43.378 1.00 0.00 C ATOM 0 H LEU A 435 -30.326 24.551 -47.191 1.00 0.00 H new ATOM 0 HA LEU A 435 -31.446 24.069 -44.544 1.00 0.00 H new ATOM 0 HB2 LEU A 435 -29.099 24.738 -44.819 1.00 0.00 H new ATOM 0 HB3 LEU A 435 -29.584 26.181 -45.687 1.00 0.00 H new ATOM 0 HG LEU A 435 -30.726 26.998 -43.619 1.00 0.00 H new ATOM 0 HD11 LEU A 435 -30.178 25.915 -41.476 1.00 0.00 H new ATOM 0 HD12 LEU A 435 -31.117 24.839 -42.538 1.00 0.00 H new ATOM 0 HD13 LEU A 435 -29.363 24.599 -42.354 1.00 0.00 H new ATOM 0 HD21 LEU A 435 -28.648 27.595 -42.438 1.00 0.00 H new ATOM 0 HD22 LEU A 435 -27.773 26.345 -43.354 1.00 0.00 H new ATOM 0 HD23 LEU A 435 -28.470 27.745 -44.202 1.00 0.00 H new ATOM 1236 N ASN A 436 -32.421 26.508 -46.513 1.00 0.00 N ATOM 1237 CA ASN A 436 -33.456 27.517 -46.711 1.00 0.00 C ATOM 1238 C ASN A 436 -34.840 26.938 -46.435 1.00 0.00 C ATOM 1239 O ASN A 436 -35.701 27.606 -45.864 1.00 0.00 O ATOM 1240 CB ASN A 436 -33.395 28.065 -48.138 1.00 0.00 C ATOM 1241 CG ASN A 436 -34.666 28.793 -48.532 1.00 0.00 C ATOM 1242 OD1 ASN A 436 -34.776 30.007 -48.365 1.00 0.00 O ATOM 1243 ND2 ASN A 436 -35.634 28.051 -49.059 1.00 0.00 N ATOM 0 H ASN A 436 -31.810 26.367 -47.317 1.00 0.00 H new ATOM 0 HA ASN A 436 -33.276 28.330 -46.008 1.00 0.00 H new ATOM 0 HB2 ASN A 436 -32.548 28.745 -48.228 1.00 0.00 H new ATOM 0 HB3 ASN A 436 -33.220 27.244 -48.833 1.00 0.00 H new ATOM 0 HD21 ASN A 436 -36.512 28.485 -49.344 1.00 0.00 H new ATOM 0 HD22 ASN A 436 -35.499 27.047 -49.179 1.00 0.00 H new ATOM 1250 N GLY A 437 -35.046 25.690 -46.844 1.00 0.00 N ATOM 1251 CA GLY A 437 -36.327 25.041 -46.632 1.00 0.00 C ATOM 1252 C GLY A 437 -36.534 24.624 -45.189 1.00 0.00 C ATOM 1253 O GLY A 437 -37.623 24.788 -44.638 1.00 0.00 O ATOM 0 H GLY A 437 -34.349 25.117 -47.319 1.00 0.00 H new ATOM 0 HA2 GLY A 437 -37.128 25.718 -46.930 1.00 0.00 H new ATOM 0 HA3 GLY A 437 -36.397 24.163 -47.274 1.00 0.00 H new ATOM 1257 N HIS A 438 -35.487 24.082 -44.576 1.00 0.00 N ATOM 1258 CA HIS A 438 -35.559 23.639 -43.188 1.00 0.00 C ATOM 1259 C HIS A 438 -36.098 24.749 -42.290 1.00 0.00 C ATOM 1260 O HIS A 438 -37.007 24.526 -41.490 1.00 0.00 O ATOM 1261 CB HIS A 438 -34.179 23.197 -42.699 1.00 0.00 C ATOM 1262 CG HIS A 438 -34.103 23.003 -41.216 1.00 0.00 C ATOM 1263 ND1 HIS A 438 -34.191 21.766 -40.613 1.00 0.00 N ATOM 1264 CD2 HIS A 438 -33.944 23.898 -40.213 1.00 0.00 C ATOM 1265 CE1 HIS A 438 -34.091 21.908 -39.304 1.00 0.00 C ATOM 1266 NE2 HIS A 438 -33.940 23.193 -39.035 1.00 0.00 N ATOM 0 H HIS A 438 -34.579 23.939 -45.018 1.00 0.00 H new ATOM 0 HA HIS A 438 -36.243 22.791 -43.139 1.00 0.00 H new ATOM 0 HB2 HIS A 438 -33.909 22.264 -43.194 1.00 0.00 H new ATOM 0 HB3 HIS A 438 -33.441 23.941 -42.998 1.00 0.00 H new ATOM 0 HD1 HIS A 438 -34.314 20.879 -41.102 1.00 0.00 H new ATOM 0 HD2 HIS A 438 -33.840 24.968 -40.320 1.00 0.00 H new ATOM 0 HE1 HIS A 438 -34.127 21.110 -38.577 1.00 0.00 H new ATOM 1274 N ILE A 439 -35.531 25.942 -42.429 1.00 0.00 N ATOM 1275 CA ILE A 439 -35.956 27.086 -41.631 1.00 0.00 C ATOM 1276 C ILE A 439 -37.459 27.311 -41.749 1.00 0.00 C ATOM 1277 O ILE A 439 -38.098 27.814 -40.824 1.00 0.00 O ATOM 1278 CB ILE A 439 -35.220 28.371 -42.053 1.00 0.00 C ATOM 1279 CG1 ILE A 439 -33.708 28.192 -41.907 1.00 0.00 C ATOM 1280 CG2 ILE A 439 -35.702 29.554 -41.226 1.00 0.00 C ATOM 1281 CD1 ILE A 439 -32.901 29.205 -42.688 1.00 0.00 C ATOM 0 H ILE A 439 -34.777 26.142 -43.086 1.00 0.00 H new ATOM 0 HA ILE A 439 -35.706 26.858 -40.595 1.00 0.00 H new ATOM 0 HB ILE A 439 -35.443 28.571 -43.101 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -33.442 28.263 -40.852 1.00 0.00 H new ATOM 0 HG13 ILE A 439 -33.435 27.190 -42.238 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -35.172 30.455 -41.536 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -36.772 29.692 -41.378 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -35.507 29.364 -40.171 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -31.838 29.017 -42.537 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -33.138 29.119 -43.748 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -33.145 30.209 -42.342 1.00 0.00 H new ATOM 1293 N LYS A 440 -38.020 26.935 -42.893 1.00 0.00 N ATOM 1294 CA LYS A 440 -39.450 27.092 -43.133 1.00 0.00 C ATOM 1295 C LYS A 440 -40.212 25.838 -42.718 1.00 0.00 C ATOM 1296 O LYS A 440 -41.418 25.886 -42.475 1.00 0.00 O ATOM 1297 CB LYS A 440 -39.709 27.394 -44.610 1.00 0.00 C ATOM 1298 CG LYS A 440 -39.877 28.874 -44.908 1.00 0.00 C ATOM 1299 CD LYS A 440 -40.832 29.105 -46.067 1.00 0.00 C ATOM 1300 CE LYS A 440 -40.725 30.524 -46.603 1.00 0.00 C ATOM 1301 NZ LYS A 440 -39.727 30.628 -47.703 1.00 0.00 N ATOM 0 H LYS A 440 -37.506 26.519 -43.669 1.00 0.00 H new ATOM 0 HA LYS A 440 -39.805 27.927 -42.530 1.00 0.00 H new ATOM 0 HB2 LYS A 440 -38.881 27.004 -45.202 1.00 0.00 H new ATOM 0 HB3 LYS A 440 -40.606 26.864 -44.929 1.00 0.00 H new ATOM 0 HG2 LYS A 440 -40.251 29.385 -44.020 1.00 0.00 H new ATOM 0 HG3 LYS A 440 -38.906 29.311 -45.142 1.00 0.00 H new ATOM 0 HD2 LYS A 440 -40.615 28.396 -46.866 1.00 0.00 H new ATOM 0 HD3 LYS A 440 -41.854 28.914 -45.741 1.00 0.00 H new ATOM 0 HE2 LYS A 440 -41.700 30.850 -46.965 1.00 0.00 H new ATOM 0 HE3 LYS A 440 -40.445 31.198 -45.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 440 -39.684 31.611 -48.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 440 -38.791 30.342 -47.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 440 -40.008 30.004 -48.487 1.00 0.00 H new ATOM 1315 N GLN A 441 -39.501 24.718 -42.638 1.00 0.00 N ATOM 1316 CA GLN A 441 -40.112 23.451 -42.251 1.00 0.00 C ATOM 1317 C GLN A 441 -40.179 23.320 -40.733 1.00 0.00 C ATOM 1318 O GLN A 441 -41.261 23.315 -40.147 1.00 0.00 O ATOM 1319 CB GLN A 441 -39.326 22.280 -42.843 1.00 0.00 C ATOM 1320 CG GLN A 441 -40.099 21.496 -43.891 1.00 0.00 C ATOM 1321 CD GLN A 441 -39.251 20.440 -44.573 1.00 0.00 C ATOM 1322 OE1 GLN A 441 -38.022 20.508 -44.555 1.00 0.00 O ATOM 1323 NE2 GLN A 441 -39.905 19.456 -45.179 1.00 0.00 N ATOM 0 H GLN A 441 -38.502 24.662 -42.836 1.00 0.00 H new ATOM 0 HA GLN A 441 -41.129 23.432 -42.643 1.00 0.00 H new ATOM 0 HB2 GLN A 441 -38.407 22.659 -43.290 1.00 0.00 H new ATOM 0 HB3 GLN A 441 -39.035 21.605 -42.038 1.00 0.00 H new ATOM 0 HG2 GLN A 441 -40.959 21.018 -43.421 1.00 0.00 H new ATOM 0 HG3 GLN A 441 -40.488 22.185 -44.641 1.00 0.00 H new ATOM 0 HE21 GLN A 441 -40.925 19.439 -45.169 1.00 0.00 H new ATOM 0 HE22 GLN A 441 -39.388 18.717 -45.655 1.00 0.00 H new ATOM 1332 N VAL A 442 -39.014 23.214 -40.102 1.00 0.00 N ATOM 1333 CA VAL A 442 -38.939 23.083 -38.652 1.00 0.00 C ATOM 1334 C VAL A 442 -39.269 24.403 -37.963 1.00 0.00 C ATOM 1335 O VAL A 442 -40.165 24.469 -37.120 1.00 0.00 O ATOM 1336 CB VAL A 442 -37.542 22.617 -38.201 1.00 0.00 C ATOM 1337 CG1 VAL A 442 -37.474 22.522 -36.684 1.00 0.00 C ATOM 1338 CG2 VAL A 442 -37.194 21.283 -38.843 1.00 0.00 C ATOM 0 H VAL A 442 -38.109 23.216 -40.572 1.00 0.00 H new ATOM 0 HA VAL A 442 -39.675 22.332 -38.364 1.00 0.00 H new ATOM 0 HB VAL A 442 -36.809 23.354 -38.528 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -36.480 22.191 -36.384 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -37.678 23.500 -36.249 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -38.216 21.806 -36.331 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -36.204 20.968 -38.514 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -37.929 20.534 -38.548 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -37.199 21.389 -39.928 1.00 0.00 H new ATOM 1348 N HIS A 443 -38.540 25.453 -38.328 1.00 0.00 N ATOM 1349 CA HIS A 443 -38.756 26.773 -37.746 1.00 0.00 C ATOM 1350 C HIS A 443 -39.753 27.576 -38.576 1.00 0.00 C ATOM 1351 O HIS A 443 -39.527 28.750 -38.870 1.00 0.00 O ATOM 1352 CB HIS A 443 -37.432 27.531 -37.645 1.00 0.00 C ATOM 1353 CG HIS A 443 -36.316 26.713 -37.071 1.00 0.00 C ATOM 1354 ND1 HIS A 443 -36.330 26.218 -35.784 1.00 0.00 N ATOM 1355 CD2 HIS A 443 -35.147 26.304 -37.617 1.00 0.00 C ATOM 1356 CE1 HIS A 443 -35.218 25.540 -35.563 1.00 0.00 C ATOM 1357 NE2 HIS A 443 -34.483 25.577 -36.660 1.00 0.00 N ATOM 0 H HIS A 443 -37.795 25.415 -39.024 1.00 0.00 H new ATOM 0 HA HIS A 443 -39.167 26.639 -36.745 1.00 0.00 H new ATOM 0 HB2 HIS A 443 -37.144 27.877 -38.638 1.00 0.00 H new ATOM 0 HB3 HIS A 443 -37.576 28.418 -37.028 1.00 0.00 H new ATOM 0 HD1 HIS A 443 -37.082 26.354 -35.108 1.00 0.00 H new ATOM 0 HD2 HIS A 443 -34.801 26.511 -38.619 1.00 0.00 H new ATOM 0 HE1 HIS A 443 -34.955 25.041 -34.642 1.00 0.00 H new