USER MOD reduce.3.24.130724 H: found=0, std=0, add=537, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 538 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 391 THR OG1 : rot -54:sc= 1.17 USER MOD Set 1.2: A 393 HIS : no HD1:sc= -0.758 X(o=0.41,f=0.49) USER MOD Set 2.1: A 378 ASN : amide:sc= -5.66! K(o=-5.5!,f=-3) USER MOD Set 2.2: A 383 TYR OH : rot 180:sc= 0.156 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 381 LYS NZ :NH3+ 166:sc= -0.0635 (180deg=-0.297) USER MOD Single : A 396 GLN : amide:sc= -0.0583 X(o=-0.058,f=-0.026) USER MOD Single : A 399 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 400 SER OG : rot 180:sc= 0 USER MOD Single : A 402 THR OG1 : rot -160:sc= -0.0141 USER MOD Single : A 403 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 405 ASN : amide:sc= -3.2! K(o=-3.2!,f=-1.3) USER MOD Single : A 412 TYR OH : rot 180:sc= 0 USER MOD Single : A 413 TYR OH : rot 180:sc= 0 USER MOD Single : A 415 HIS : no HE2:sc= -0.441 K(o=-0.44,f=-4!) USER MOD Single : A 416 TYR OH : rot 30:sc= 0.121 USER MOD Single : A 420 ASN : amide:sc= -0.186 K(o=-0.19,f=-3.2!) USER MOD Single : A 430 HIS : no HD1:sc= -3.17! K(o=-3.2!,f=-0.49) USER MOD Single : A 433 SER OG : rot -14:sc= 0.695 USER MOD Single : A 435 ASN : amide:sc= -0.395 X(o=-0.4,f=-0.67) USER MOD ----------------------------------------------------------------- ATOM 157 N ILE A 373 -6.646 -8.140 5.490 1.00 1.42 N ATOM 158 CA ILE A 373 -6.987 -6.877 6.136 1.00 1.22 C ATOM 159 C ILE A 373 -8.498 -6.662 6.197 1.00 1.13 C ATOM 160 O ILE A 373 -9.164 -6.538 5.169 1.00 1.20 O ATOM 161 CB ILE A 373 -6.337 -5.687 5.408 1.00 1.16 C ATOM 162 CG1 ILE A 373 -4.812 -5.768 5.508 1.00 1.40 C ATOM 163 CG2 ILE A 373 -6.848 -4.368 5.974 1.00 1.26 C ATOM 164 CD1 ILE A 373 -4.096 -4.641 4.793 1.00 1.48 C ATOM 0 HA ILE A 373 -6.600 -6.933 7.153 1.00 1.22 H new ATOM 0 HB ILE A 373 -6.613 -5.733 4.355 1.00 1.16 H new ATOM 0 HG12 ILE A 373 -4.524 -5.761 6.559 1.00 1.40 H new ATOM 0 HG13 ILE A 373 -4.479 -6.719 5.093 1.00 1.40 H new ATOM 0 HG21 ILE A 373 -6.377 -3.539 5.446 1.00 1.26 H new ATOM 0 HG22 ILE A 373 -7.929 -4.312 5.846 1.00 1.26 H new ATOM 0 HG23 ILE A 373 -6.604 -4.308 7.035 1.00 1.26 H new ATOM 0 HD11 ILE A 373 -3.019 -4.764 4.907 1.00 1.48 H new ATOM 0 HD12 ILE A 373 -4.354 -4.660 3.734 1.00 1.48 H new ATOM 0 HD13 ILE A 373 -4.399 -3.686 5.223 1.00 1.48 H new ATOM 176 N ASP A 374 -9.028 -6.600 7.414 1.00 1.16 N ATOM 177 CA ASP A 374 -10.454 -6.381 7.621 1.00 1.17 C ATOM 178 C ASP A 374 -10.752 -4.889 7.713 1.00 1.03 C ATOM 179 O ASP A 374 -10.946 -4.357 8.804 1.00 1.25 O ATOM 180 CB ASP A 374 -10.926 -7.089 8.894 1.00 1.40 C ATOM 181 CG ASP A 374 -10.692 -8.585 8.845 1.00 1.77 C ATOM 182 OD1 ASP A 374 -11.249 -9.245 7.942 1.00 2.04 O ATOM 183 OD2 ASP A 374 -9.950 -9.099 9.709 1.00 2.17 O ATOM 0 H ASP A 374 -8.489 -6.699 8.274 1.00 1.16 H new ATOM 0 HA ASP A 374 -10.993 -6.797 6.770 1.00 1.17 H new ATOM 0 HB2 ASP A 374 -10.403 -6.670 9.754 1.00 1.40 H new ATOM 0 HB3 ASP A 374 -11.988 -6.895 9.041 1.00 1.40 H new ATOM 188 N ILE A 375 -10.772 -4.219 6.562 1.00 0.84 N ATOM 189 CA ILE A 375 -11.031 -2.782 6.507 1.00 0.76 C ATOM 190 C ILE A 375 -12.165 -2.371 7.439 1.00 0.76 C ATOM 191 O ILE A 375 -12.125 -1.297 8.035 1.00 0.79 O ATOM 192 CB ILE A 375 -11.378 -2.326 5.077 1.00 0.77 C ATOM 193 CG1 ILE A 375 -10.190 -2.563 4.142 1.00 0.82 C ATOM 194 CG2 ILE A 375 -11.784 -0.858 5.077 1.00 0.84 C ATOM 195 CD1 ILE A 375 -10.472 -2.211 2.696 1.00 0.92 C ATOM 0 H ILE A 375 -10.611 -4.651 5.652 1.00 0.84 H new ATOM 0 HA ILE A 375 -10.111 -2.296 6.831 1.00 0.76 H new ATOM 0 HB ILE A 375 -12.221 -2.914 4.713 1.00 0.77 H new ATOM 0 HG12 ILE A 375 -9.342 -1.974 4.491 1.00 0.82 H new ATOM 0 HG13 ILE A 375 -9.896 -3.611 4.201 1.00 0.82 H new ATOM 0 HG21 ILE A 375 -12.027 -0.548 4.061 1.00 0.84 H new ATOM 0 HG22 ILE A 375 -12.656 -0.722 5.716 1.00 0.84 H new ATOM 0 HG23 ILE A 375 -10.960 -0.253 5.454 1.00 0.84 H new ATOM 0 HD11 ILE A 375 -9.584 -2.405 2.094 1.00 0.92 H new ATOM 0 HD12 ILE A 375 -11.299 -2.818 2.328 1.00 0.92 H new ATOM 0 HD13 ILE A 375 -10.736 -1.156 2.623 1.00 0.92 H new ATOM 207 N SER A 376 -13.174 -3.227 7.547 1.00 0.79 N ATOM 208 CA SER A 376 -14.327 -2.955 8.399 1.00 0.87 C ATOM 209 C SER A 376 -13.953 -3.002 9.877 1.00 0.96 C ATOM 210 O SER A 376 -14.374 -3.901 10.608 1.00 1.54 O ATOM 211 CB SER A 376 -15.442 -3.953 8.109 1.00 0.95 C ATOM 212 OG SER A 376 -16.577 -3.703 8.919 1.00 1.71 O ATOM 0 H SER A 376 -13.218 -4.119 7.054 1.00 0.79 H new ATOM 0 HA SER A 376 -14.678 -1.948 8.174 1.00 0.87 H new ATOM 0 HB2 SER A 376 -15.722 -3.894 7.057 1.00 0.95 H new ATOM 0 HB3 SER A 376 -15.082 -4.966 8.286 1.00 0.95 H new ATOM 0 HG SER A 376 -17.277 -4.356 8.711 1.00 1.71 H new ATOM 218 N GLU A 377 -13.167 -2.026 10.309 1.00 0.93 N ATOM 219 CA GLU A 377 -12.734 -1.938 11.695 1.00 1.03 C ATOM 220 C GLU A 377 -11.980 -0.639 11.924 1.00 0.87 C ATOM 221 O GLU A 377 -11.941 -0.115 13.038 1.00 0.93 O ATOM 222 CB GLU A 377 -11.839 -3.125 12.065 1.00 1.18 C ATOM 223 CG GLU A 377 -10.473 -3.094 11.400 1.00 1.28 C ATOM 224 CD GLU A 377 -9.616 -4.288 11.772 1.00 1.54 C ATOM 225 OE1 GLU A 377 -10.030 -5.430 11.478 1.00 1.92 O ATOM 226 OE2 GLU A 377 -8.532 -4.083 12.357 1.00 1.90 O ATOM 0 H GLU A 377 -12.814 -1.278 9.713 1.00 0.93 H new ATOM 0 HA GLU A 377 -13.620 -1.960 12.329 1.00 1.03 H new ATOM 0 HB2 GLU A 377 -11.706 -3.144 13.147 1.00 1.18 H new ATOM 0 HB3 GLU A 377 -12.346 -4.050 11.790 1.00 1.18 H new ATOM 0 HG2 GLU A 377 -10.600 -3.066 10.318 1.00 1.28 H new ATOM 0 HG3 GLU A 377 -9.956 -2.178 11.684 1.00 1.28 H new ATOM 233 N ASN A 378 -11.377 -0.129 10.857 1.00 0.71 N ATOM 234 CA ASN A 378 -10.611 1.112 10.937 1.00 0.61 C ATOM 235 C ASN A 378 -10.371 1.726 9.555 1.00 0.58 C ATOM 236 O ASN A 378 -9.228 1.947 9.160 1.00 0.59 O ATOM 237 CB ASN A 378 -9.272 0.864 11.647 1.00 0.62 C ATOM 238 CG ASN A 378 -8.457 -0.257 11.019 1.00 1.15 C ATOM 239 OD1 ASN A 378 -7.494 -0.740 11.614 1.00 1.16 O ATOM 240 ND2 ASN A 378 -8.817 -0.660 9.805 1.00 2.14 N ATOM 0 H ASN A 378 -11.402 -0.552 9.929 1.00 0.71 H new ATOM 0 HA ASN A 378 -11.200 1.824 11.515 1.00 0.61 H new ATOM 0 HB2 ASN A 378 -8.685 1.783 11.633 1.00 0.62 H new ATOM 0 HB3 ASN A 378 -9.462 0.624 12.693 1.00 0.62 H new ATOM 0 HD21 ASN A 378 -8.289 -1.394 9.334 1.00 2.14 H new ATOM 0 HD22 ASN A 378 -9.622 -0.235 9.344 1.00 2.14 H new ATOM 247 N PRO A 379 -11.447 2.025 8.801 1.00 0.62 N ATOM 248 CA PRO A 379 -11.322 2.630 7.471 1.00 0.65 C ATOM 249 C PRO A 379 -10.488 3.904 7.522 1.00 0.61 C ATOM 250 O PRO A 379 -9.728 4.205 6.601 1.00 0.62 O ATOM 251 CB PRO A 379 -12.768 2.947 7.079 1.00 0.77 C ATOM 252 CG PRO A 379 -13.598 2.011 7.890 1.00 0.85 C ATOM 253 CD PRO A 379 -12.857 1.818 9.184 1.00 0.75 C ATOM 0 HA PRO A 379 -10.821 1.974 6.759 1.00 0.65 H new ATOM 0 HB2 PRO A 379 -13.018 3.986 7.296 1.00 0.77 H new ATOM 0 HB3 PRO A 379 -12.930 2.796 6.012 1.00 0.77 H new ATOM 0 HG2 PRO A 379 -14.592 2.423 8.067 1.00 0.85 H new ATOM 0 HG3 PRO A 379 -13.734 1.061 7.373 1.00 0.85 H new ATOM 0 HD2 PRO A 379 -13.177 2.533 9.942 1.00 0.75 H new ATOM 0 HD3 PRO A 379 -13.020 0.822 9.596 1.00 0.75 H new ATOM 261 N ASP A 380 -10.636 4.640 8.619 1.00 0.62 N ATOM 262 CA ASP A 380 -9.902 5.881 8.824 1.00 0.64 C ATOM 263 C ASP A 380 -8.405 5.613 8.963 1.00 0.55 C ATOM 264 O ASP A 380 -7.581 6.432 8.554 1.00 0.55 O ATOM 265 CB ASP A 380 -10.420 6.598 10.070 1.00 0.75 C ATOM 266 CG ASP A 380 -11.893 6.944 9.969 1.00 0.86 C ATOM 267 OD1 ASP A 380 -12.266 7.689 9.038 1.00 1.21 O ATOM 268 OD2 ASP A 380 -12.673 6.471 10.822 1.00 1.20 O ATOM 0 H ASP A 380 -11.263 4.394 9.385 1.00 0.62 H new ATOM 0 HA ASP A 380 -10.058 6.517 7.952 1.00 0.64 H new ATOM 0 HB2 ASP A 380 -10.257 5.966 10.943 1.00 0.75 H new ATOM 0 HB3 ASP A 380 -9.845 7.511 10.226 1.00 0.75 H new ATOM 273 N LYS A 381 -8.064 4.466 9.552 1.00 0.51 N ATOM 274 CA LYS A 381 -6.667 4.090 9.757 1.00 0.47 C ATOM 275 C LYS A 381 -5.842 4.306 8.493 1.00 0.39 C ATOM 276 O LYS A 381 -6.235 3.894 7.402 1.00 0.37 O ATOM 277 CB LYS A 381 -6.560 2.632 10.196 1.00 0.50 C ATOM 278 CG LYS A 381 -5.125 2.175 10.374 1.00 0.52 C ATOM 279 CD LYS A 381 -5.048 0.752 10.887 1.00 0.59 C ATOM 280 CE LYS A 381 -3.608 0.296 11.030 1.00 0.67 C ATOM 281 NZ LYS A 381 -2.815 1.212 11.894 1.00 1.66 N ATOM 0 H LYS A 381 -8.738 3.782 9.895 1.00 0.51 H new ATOM 0 HA LYS A 381 -6.269 4.732 10.543 1.00 0.47 H new ATOM 0 HB2 LYS A 381 -7.098 2.500 11.135 1.00 0.50 H new ATOM 0 HB3 LYS A 381 -7.049 1.998 9.457 1.00 0.50 H new ATOM 0 HG2 LYS A 381 -4.600 2.247 9.422 1.00 0.52 H new ATOM 0 HG3 LYS A 381 -4.615 2.841 11.070 1.00 0.52 H new ATOM 0 HD2 LYS A 381 -5.551 0.683 11.851 1.00 0.59 H new ATOM 0 HD3 LYS A 381 -5.576 0.087 10.203 1.00 0.59 H new ATOM 0 HE2 LYS A 381 -3.586 -0.709 11.452 1.00 0.67 H new ATOM 0 HE3 LYS A 381 -3.147 0.238 10.044 1.00 0.67 H new ATOM 0 HZ1 LYS A 381 -1.921 0.752 12.159 1.00 1.66 H new ATOM 0 HZ2 LYS A 381 -2.612 2.090 11.375 1.00 1.66 H new ATOM 0 HZ3 LYS A 381 -3.357 1.435 12.753 1.00 1.66 H new ATOM 295 N ILE A 382 -4.695 4.959 8.653 1.00 0.40 N ATOM 296 CA ILE A 382 -3.805 5.238 7.533 1.00 0.35 C ATOM 297 C ILE A 382 -2.862 4.067 7.270 1.00 0.34 C ATOM 298 O ILE A 382 -2.150 3.620 8.170 1.00 0.41 O ATOM 299 CB ILE A 382 -2.962 6.504 7.793 1.00 0.37 C ATOM 300 CG1 ILE A 382 -3.862 7.689 8.159 1.00 0.38 C ATOM 301 CG2 ILE A 382 -2.109 6.833 6.575 1.00 0.41 C ATOM 302 CD1 ILE A 382 -4.846 8.070 7.073 1.00 0.37 C ATOM 0 H ILE A 382 -4.360 5.306 9.552 1.00 0.40 H new ATOM 0 HA ILE A 382 -4.437 5.396 6.659 1.00 0.35 H new ATOM 0 HB ILE A 382 -2.299 6.309 8.636 1.00 0.37 H new ATOM 0 HG12 ILE A 382 -4.414 7.447 9.067 1.00 0.38 H new ATOM 0 HG13 ILE A 382 -3.236 8.551 8.387 1.00 0.38 H new ATOM 0 HG21 ILE A 382 -1.520 7.728 6.774 1.00 0.41 H new ATOM 0 HG22 ILE A 382 -1.440 5.999 6.363 1.00 0.41 H new ATOM 0 HG23 ILE A 382 -2.755 7.008 5.715 1.00 0.41 H new ATOM 0 HD11 ILE A 382 -5.447 8.916 7.407 1.00 0.37 H new ATOM 0 HD12 ILE A 382 -4.302 8.345 6.169 1.00 0.37 H new ATOM 0 HD13 ILE A 382 -5.499 7.223 6.860 1.00 0.37 H new ATOM 314 N TYR A 383 -2.847 3.585 6.031 1.00 0.30 N ATOM 315 CA TYR A 383 -1.972 2.479 5.654 1.00 0.30 C ATOM 316 C TYR A 383 -0.776 2.997 4.860 1.00 0.28 C ATOM 317 O TYR A 383 -0.899 3.950 4.095 1.00 0.25 O ATOM 318 CB TYR A 383 -2.738 1.423 4.849 1.00 0.32 C ATOM 319 CG TYR A 383 -3.783 0.687 5.660 1.00 0.36 C ATOM 320 CD1 TYR A 383 -4.902 1.351 6.148 1.00 0.40 C ATOM 321 CD2 TYR A 383 -3.651 -0.668 5.937 1.00 0.48 C ATOM 322 CE1 TYR A 383 -5.861 0.685 6.887 1.00 0.48 C ATOM 323 CE2 TYR A 383 -4.606 -1.340 6.677 1.00 0.55 C ATOM 324 CZ TYR A 383 -5.699 -0.671 7.149 1.00 0.52 C ATOM 325 OH TYR A 383 -6.663 -1.327 7.883 1.00 0.63 O ATOM 0 H TYR A 383 -3.429 3.941 5.273 1.00 0.30 H new ATOM 0 HA TYR A 383 -1.607 2.006 6.566 1.00 0.30 H new ATOM 0 HB2 TYR A 383 -3.222 1.905 4.000 1.00 0.32 H new ATOM 0 HB3 TYR A 383 -2.029 0.701 4.444 1.00 0.32 H new ATOM 0 HD1 TYR A 383 -5.024 2.405 5.946 1.00 0.40 H new ATOM 0 HD2 TYR A 383 -2.789 -1.205 5.569 1.00 0.48 H new ATOM 0 HE1 TYR A 383 -6.728 1.212 7.257 1.00 0.48 H new ATOM 0 HE2 TYR A 383 -4.488 -2.394 6.882 1.00 0.55 H new ATOM 0 HH TYR A 383 -6.413 -2.269 7.983 1.00 0.63 H new ATOM 335 N PHE A 384 0.383 2.378 5.062 1.00 0.31 N ATOM 336 CA PHE A 384 1.602 2.793 4.372 1.00 0.30 C ATOM 337 C PHE A 384 1.723 2.139 2.998 1.00 0.28 C ATOM 338 O PHE A 384 1.552 0.929 2.858 1.00 0.33 O ATOM 339 CB PHE A 384 2.836 2.456 5.213 1.00 0.40 C ATOM 340 CG PHE A 384 2.930 3.226 6.506 1.00 0.48 C ATOM 341 CD1 PHE A 384 1.887 3.195 7.418 1.00 0.83 C ATOM 342 CD2 PHE A 384 4.056 3.977 6.808 1.00 0.57 C ATOM 343 CE1 PHE A 384 1.966 3.896 8.607 1.00 0.96 C ATOM 344 CE2 PHE A 384 4.139 4.680 7.996 1.00 0.64 C ATOM 345 CZ PHE A 384 3.111 4.654 8.885 1.00 0.74 C ATOM 0 H PHE A 384 0.505 1.589 5.696 1.00 0.31 H new ATOM 0 HA PHE A 384 1.543 3.872 4.231 1.00 0.30 H new ATOM 0 HB2 PHE A 384 2.829 1.389 5.438 1.00 0.40 H new ATOM 0 HB3 PHE A 384 3.730 2.651 4.621 1.00 0.40 H new ATOM 0 HD1 PHE A 384 1.002 2.616 7.197 1.00 0.83 H new ATOM 0 HD2 PHE A 384 4.877 4.013 6.108 1.00 0.57 H new ATOM 0 HE1 PHE A 384 1.152 3.860 9.316 1.00 0.96 H new ATOM 0 HE2 PHE A 384 5.027 5.254 8.219 1.00 0.64 H new ATOM 0 HZ PHE A 384 3.177 5.217 9.804 1.00 0.74 H new ATOM 355 N ILE A 385 2.035 2.950 1.989 1.00 0.26 N ATOM 356 CA ILE A 385 2.201 2.454 0.625 1.00 0.27 C ATOM 357 C ILE A 385 3.651 2.612 0.180 1.00 0.24 C ATOM 358 O ILE A 385 4.171 3.724 0.115 1.00 0.30 O ATOM 359 CB ILE A 385 1.286 3.187 -0.384 1.00 0.33 C ATOM 360 CG1 ILE A 385 -0.195 2.956 -0.060 1.00 0.32 C ATOM 361 CG2 ILE A 385 1.589 2.727 -1.804 1.00 0.49 C ATOM 362 CD1 ILE A 385 -0.646 3.587 1.237 1.00 0.32 C ATOM 0 H ILE A 385 2.178 3.955 2.091 1.00 0.26 H new ATOM 0 HA ILE A 385 1.919 1.401 0.637 1.00 0.27 H new ATOM 0 HB ILE A 385 1.488 4.255 -0.305 1.00 0.33 H new ATOM 0 HG12 ILE A 385 -0.801 3.352 -0.875 1.00 0.32 H new ATOM 0 HG13 ILE A 385 -0.384 1.883 -0.015 1.00 0.32 H new ATOM 0 HG21 ILE A 385 0.937 3.251 -2.503 1.00 0.49 H new ATOM 0 HG22 ILE A 385 2.630 2.946 -2.043 1.00 0.49 H new ATOM 0 HG23 ILE A 385 1.417 1.654 -1.883 1.00 0.49 H new ATOM 0 HD11 ILE A 385 -1.704 3.379 1.394 1.00 0.32 H new ATOM 0 HD12 ILE A 385 -0.068 3.173 2.063 1.00 0.32 H new ATOM 0 HD13 ILE A 385 -0.492 4.665 1.190 1.00 0.32 H new ATOM 374 N ARG A 386 4.298 1.494 -0.122 1.00 0.29 N ATOM 375 CA ARG A 386 5.689 1.509 -0.554 1.00 0.30 C ATOM 376 C ARG A 386 5.791 1.739 -2.060 1.00 0.33 C ATOM 377 O ARG A 386 5.363 0.901 -2.854 1.00 0.42 O ATOM 378 CB ARG A 386 6.362 0.186 -0.156 1.00 0.38 C ATOM 379 CG ARG A 386 7.844 0.103 -0.495 1.00 0.50 C ATOM 380 CD ARG A 386 8.071 -0.375 -1.919 1.00 1.02 C ATOM 381 NE ARG A 386 9.489 -0.381 -2.279 1.00 1.40 N ATOM 382 CZ ARG A 386 10.400 -1.156 -1.697 1.00 1.86 C ATOM 383 NH1 ARG A 386 10.044 -2.009 -0.746 1.00 2.42 N ATOM 384 NH2 ARG A 386 11.669 -1.082 -2.073 1.00 2.39 N ATOM 0 H ARG A 386 3.881 0.564 -0.076 1.00 0.29 H new ATOM 0 HA ARG A 386 6.204 2.333 -0.061 1.00 0.30 H new ATOM 0 HB2 ARG A 386 6.239 0.039 0.917 1.00 0.38 H new ATOM 0 HB3 ARG A 386 5.843 -0.634 -0.651 1.00 0.38 H new ATOM 0 HG2 ARG A 386 8.302 1.083 -0.363 1.00 0.50 H new ATOM 0 HG3 ARG A 386 8.338 -0.576 0.200 1.00 0.50 H new ATOM 0 HD2 ARG A 386 7.665 -1.380 -2.033 1.00 1.02 H new ATOM 0 HD3 ARG A 386 7.525 0.269 -2.608 1.00 1.02 H new ATOM 0 HE ARG A 386 9.798 0.247 -3.021 1.00 1.40 H new ATOM 0 HH11 ARG A 386 9.068 -2.073 -0.458 1.00 2.42 H new ATOM 0 HH12 ARG A 386 10.747 -2.601 -0.303 1.00 2.42 H new ATOM 0 HH21 ARG A 386 11.946 -0.431 -2.808 1.00 2.39 H new ATOM 0 HH22 ARG A 386 12.368 -1.676 -1.627 1.00 2.39 H new ATOM 398 N ARG A 387 6.369 2.875 -2.449 1.00 0.41 N ATOM 399 CA ARG A 387 6.534 3.199 -3.863 1.00 0.51 C ATOM 400 C ARG A 387 7.520 2.238 -4.509 1.00 0.49 C ATOM 401 O ARG A 387 8.397 1.694 -3.841 1.00 0.47 O ATOM 402 CB ARG A 387 7.034 4.630 -4.047 1.00 0.63 C ATOM 403 CG ARG A 387 6.125 5.692 -3.444 1.00 0.84 C ATOM 404 CD ARG A 387 4.834 5.840 -4.232 1.00 0.94 C ATOM 405 NE ARG A 387 5.088 6.193 -5.627 1.00 1.32 N ATOM 406 CZ ARG A 387 4.129 6.381 -6.529 1.00 1.79 C ATOM 407 NH1 ARG A 387 2.855 6.247 -6.186 1.00 2.30 N ATOM 408 NH2 ARG A 387 4.446 6.705 -7.775 1.00 2.25 N ATOM 0 H ARG A 387 6.729 3.582 -1.808 1.00 0.41 H new ATOM 0 HA ARG A 387 5.559 3.105 -4.341 1.00 0.51 H new ATOM 0 HB2 ARG A 387 8.023 4.718 -3.598 1.00 0.63 H new ATOM 0 HB3 ARG A 387 7.149 4.829 -5.113 1.00 0.63 H new ATOM 0 HG2 ARG A 387 5.893 5.429 -2.412 1.00 0.84 H new ATOM 0 HG3 ARG A 387 6.648 6.648 -3.420 1.00 0.84 H new ATOM 0 HD2 ARG A 387 4.273 4.906 -4.190 1.00 0.94 H new ATOM 0 HD3 ARG A 387 4.212 6.607 -3.770 1.00 0.94 H new ATOM 0 HE ARG A 387 6.057 6.302 -5.926 1.00 1.32 H new ATOM 0 HH11 ARG A 387 2.608 5.999 -5.228 1.00 2.30 H new ATOM 0 HH12 ARG A 387 2.122 6.392 -6.880 1.00 2.30 H new ATOM 0 HH21 ARG A 387 5.425 6.810 -8.041 1.00 2.25 H new ATOM 0 HH22 ARG A 387 3.711 6.849 -8.467 1.00 2.25 H new ATOM 422 N GLU A 388 7.377 2.040 -5.810 1.00 0.64 N ATOM 423 CA GLU A 388 8.262 1.145 -6.545 1.00 0.69 C ATOM 424 C GLU A 388 9.721 1.514 -6.306 1.00 0.61 C ATOM 425 O GLU A 388 10.578 0.640 -6.163 1.00 0.63 O ATOM 426 CB GLU A 388 7.942 1.181 -8.042 1.00 0.88 C ATOM 427 CG GLU A 388 8.037 2.569 -8.655 1.00 1.58 C ATOM 428 CD GLU A 388 7.707 2.578 -10.136 1.00 2.20 C ATOM 429 OE1 GLU A 388 7.404 1.495 -10.682 1.00 2.65 O ATOM 430 OE2 GLU A 388 7.749 3.664 -10.750 1.00 2.82 O ATOM 0 H GLU A 388 6.658 2.486 -6.380 1.00 0.64 H new ATOM 0 HA GLU A 388 8.099 0.131 -6.180 1.00 0.69 H new ATOM 0 HB2 GLU A 388 8.626 0.514 -8.567 1.00 0.88 H new ATOM 0 HB3 GLU A 388 6.936 0.793 -8.199 1.00 0.88 H new ATOM 0 HG2 GLU A 388 7.357 3.241 -8.131 1.00 1.58 H new ATOM 0 HG3 GLU A 388 9.045 2.958 -8.509 1.00 1.58 H new ATOM 437 N ASP A 389 9.995 2.813 -6.252 1.00 0.65 N ATOM 438 CA ASP A 389 11.348 3.295 -6.016 1.00 0.69 C ATOM 439 C ASP A 389 11.834 2.892 -4.625 1.00 0.64 C ATOM 440 O ASP A 389 13.013 2.588 -4.437 1.00 0.91 O ATOM 441 CB ASP A 389 11.409 4.815 -6.192 1.00 0.81 C ATOM 442 CG ASP A 389 10.311 5.534 -5.434 1.00 0.80 C ATOM 443 OD1 ASP A 389 10.263 5.403 -4.193 1.00 1.23 O ATOM 444 OD2 ASP A 389 9.500 6.226 -6.078 1.00 1.06 O ATOM 0 H ASP A 389 9.298 3.549 -6.368 1.00 0.65 H new ATOM 0 HA ASP A 389 12.010 2.835 -6.750 1.00 0.69 H new ATOM 0 HB2 ASP A 389 12.379 5.178 -5.851 1.00 0.81 H new ATOM 0 HB3 ASP A 389 11.333 5.058 -7.252 1.00 0.81 H new ATOM 449 N GLY A 390 10.922 2.882 -3.653 1.00 0.55 N ATOM 450 CA GLY A 390 11.289 2.503 -2.298 1.00 0.53 C ATOM 451 C GLY A 390 10.711 3.431 -1.244 1.00 0.55 C ATOM 452 O GLY A 390 10.358 2.994 -0.148 1.00 1.03 O ATOM 0 H GLY A 390 9.940 3.128 -3.779 1.00 0.55 H new ATOM 0 HA2 GLY A 390 10.946 1.486 -2.106 1.00 0.53 H new ATOM 0 HA3 GLY A 390 12.375 2.495 -2.211 1.00 0.53 H new ATOM 456 N THR A 391 10.630 4.715 -1.574 1.00 0.57 N ATOM 457 CA THR A 391 10.111 5.721 -0.653 1.00 0.54 C ATOM 458 C THR A 391 8.680 5.415 -0.219 1.00 0.41 C ATOM 459 O THR A 391 7.747 5.478 -1.019 1.00 0.44 O ATOM 460 CB THR A 391 10.147 7.126 -1.281 1.00 0.71 C ATOM 461 OG1 THR A 391 9.325 7.160 -2.453 1.00 0.98 O ATOM 462 CG2 THR A 391 11.571 7.521 -1.644 1.00 0.88 C ATOM 0 H THR A 391 10.919 5.086 -2.479 1.00 0.57 H new ATOM 0 HA THR A 391 10.759 5.694 0.223 1.00 0.54 H new ATOM 0 HB THR A 391 9.765 7.837 -0.548 1.00 0.71 H new ATOM 0 HG1 THR A 391 9.602 6.449 -3.068 1.00 0.98 H new ATOM 0 HG21 THR A 391 11.571 8.517 -2.086 1.00 0.88 H new ATOM 0 HG22 THR A 391 12.188 7.523 -0.746 1.00 0.88 H new ATOM 0 HG23 THR A 391 11.975 6.806 -2.361 1.00 0.88 H new ATOM 470 N VAL A 392 8.517 5.092 1.061 1.00 0.37 N ATOM 471 CA VAL A 392 7.204 4.787 1.620 1.00 0.33 C ATOM 472 C VAL A 392 6.383 6.063 1.799 1.00 0.32 C ATOM 473 O VAL A 392 6.923 7.113 2.150 1.00 0.41 O ATOM 474 CB VAL A 392 7.328 4.070 2.978 1.00 0.45 C ATOM 475 CG1 VAL A 392 5.955 3.714 3.530 1.00 0.55 C ATOM 476 CG2 VAL A 392 8.194 2.826 2.847 1.00 0.52 C ATOM 0 H VAL A 392 9.282 5.035 1.733 1.00 0.37 H new ATOM 0 HA VAL A 392 6.698 4.126 0.917 1.00 0.33 H new ATOM 0 HB VAL A 392 7.808 4.751 3.681 1.00 0.45 H new ATOM 0 HG11 VAL A 392 6.068 3.209 4.489 1.00 0.55 H new ATOM 0 HG12 VAL A 392 5.370 4.624 3.666 1.00 0.55 H new ATOM 0 HG13 VAL A 392 5.442 3.054 2.831 1.00 0.55 H new ATOM 0 HG21 VAL A 392 8.271 2.332 3.816 1.00 0.52 H new ATOM 0 HG22 VAL A 392 7.744 2.143 2.126 1.00 0.52 H new ATOM 0 HG23 VAL A 392 9.189 3.110 2.505 1.00 0.52 H new ATOM 486 N HIS A 393 5.078 5.968 1.557 1.00 0.29 N ATOM 487 CA HIS A 393 4.185 7.116 1.691 1.00 0.31 C ATOM 488 C HIS A 393 2.795 6.681 2.149 1.00 0.27 C ATOM 489 O HIS A 393 2.227 5.727 1.622 1.00 0.26 O ATOM 490 CB HIS A 393 4.082 7.870 0.363 1.00 0.37 C ATOM 491 CG HIS A 393 5.356 8.541 -0.045 1.00 0.92 C ATOM 492 ND1 HIS A 393 5.999 9.476 0.738 1.00 1.92 N ATOM 493 CD2 HIS A 393 6.108 8.411 -1.164 1.00 0.94 C ATOM 494 CE1 HIS A 393 7.089 9.893 0.119 1.00 2.43 C ATOM 495 NE2 HIS A 393 7.178 9.261 -1.036 1.00 1.82 N ATOM 0 H HIS A 393 4.615 5.107 1.267 1.00 0.29 H new ATOM 0 HA HIS A 393 4.605 7.779 2.447 1.00 0.31 H new ATOM 0 HB2 HIS A 393 3.782 7.172 -0.419 1.00 0.37 H new ATOM 0 HB3 HIS A 393 3.295 8.620 0.441 1.00 0.37 H new ATOM 0 HD2 HIS A 393 5.904 7.760 -2.001 1.00 0.94 H new ATOM 0 HE1 HIS A 393 7.788 10.626 0.494 1.00 2.43 H new ATOM 0 HE2 HIS A 393 7.922 9.384 -1.723 1.00 1.82 H new ATOM 504 N ARG A 394 2.260 7.392 3.138 1.00 0.29 N ATOM 505 CA ARG A 394 0.939 7.091 3.686 1.00 0.28 C ATOM 506 C ARG A 394 -0.140 7.099 2.608 1.00 0.26 C ATOM 507 O ARG A 394 0.003 7.743 1.570 1.00 0.32 O ATOM 508 CB ARG A 394 0.575 8.091 4.784 1.00 0.35 C ATOM 509 CG ARG A 394 1.439 7.975 6.027 1.00 0.42 C ATOM 510 CD ARG A 394 0.991 8.951 7.102 1.00 0.52 C ATOM 511 NE ARG A 394 1.145 10.340 6.676 1.00 1.34 N ATOM 512 CZ ARG A 394 0.777 11.383 7.413 1.00 2.01 C ATOM 513 NH1 ARG A 394 0.220 11.197 8.603 1.00 2.41 N ATOM 514 NH2 ARG A 394 0.963 12.615 6.959 1.00 2.96 N ATOM 0 H ARG A 394 2.724 8.186 3.579 1.00 0.29 H new ATOM 0 HA ARG A 394 0.987 6.087 4.108 1.00 0.28 H new ATOM 0 HB2 ARG A 394 0.661 9.102 4.385 1.00 0.35 H new ATOM 0 HB3 ARG A 394 -0.469 7.946 5.063 1.00 0.35 H new ATOM 0 HG2 ARG A 394 1.390 6.957 6.413 1.00 0.42 H new ATOM 0 HG3 ARG A 394 2.480 8.168 5.768 1.00 0.42 H new ATOM 0 HD2 ARG A 394 -0.053 8.762 7.352 1.00 0.52 H new ATOM 0 HD3 ARG A 394 1.571 8.783 8.009 1.00 0.52 H new ATOM 0 HE ARG A 394 1.558 10.519 5.761 1.00 1.34 H new ATOM 0 HH11 ARG A 394 0.073 10.251 8.955 1.00 2.41 H new ATOM 0 HH12 ARG A 394 -0.061 12.000 9.166 1.00 2.41 H new ATOM 0 HH21 ARG A 394 1.389 12.762 6.044 1.00 2.96 H new ATOM 0 HH22 ARG A 394 0.680 13.415 7.525 1.00 2.96 H new ATOM 528 N GLY A 395 -1.223 6.373 2.875 1.00 0.23 N ATOM 529 CA GLY A 395 -2.327 6.295 1.938 1.00 0.25 C ATOM 530 C GLY A 395 -3.527 5.575 2.528 1.00 0.23 C ATOM 531 O GLY A 395 -3.390 4.492 3.097 1.00 0.26 O ATOM 0 H GLY A 395 -1.354 5.834 3.731 1.00 0.23 H new ATOM 0 HA2 GLY A 395 -2.620 7.301 1.639 1.00 0.25 H new ATOM 0 HA3 GLY A 395 -2.001 5.776 1.036 1.00 0.25 H new ATOM 535 N GLN A 396 -4.702 6.184 2.405 1.00 0.29 N ATOM 536 CA GLN A 396 -5.928 5.602 2.943 1.00 0.34 C ATOM 537 C GLN A 396 -6.518 4.551 2.008 1.00 0.35 C ATOM 538 O GLN A 396 -7.037 4.878 0.941 1.00 0.46 O ATOM 539 CB GLN A 396 -6.967 6.695 3.193 1.00 0.43 C ATOM 540 CG GLN A 396 -6.503 7.771 4.158 1.00 0.50 C ATOM 541 CD GLN A 396 -7.551 8.834 4.397 1.00 0.64 C ATOM 542 OE1 GLN A 396 -8.105 9.406 3.458 1.00 1.28 O ATOM 543 NE2 GLN A 396 -7.810 9.117 5.663 1.00 0.61 N ATOM 0 H GLN A 396 -4.832 7.081 1.937 1.00 0.29 H new ATOM 0 HA GLN A 396 -5.668 5.114 3.882 1.00 0.34 H new ATOM 0 HB2 GLN A 396 -7.227 7.160 2.242 1.00 0.43 H new ATOM 0 HB3 GLN A 396 -7.876 6.237 3.583 1.00 0.43 H new ATOM 0 HG2 GLN A 396 -6.236 7.310 5.109 1.00 0.50 H new ATOM 0 HG3 GLN A 396 -5.600 8.239 3.766 1.00 0.50 H new ATOM 0 HE21 GLN A 396 -7.325 8.616 6.407 1.00 0.61 H new ATOM 0 HE22 GLN A 396 -8.495 9.837 5.895 1.00 0.61 H new ATOM 552 N VAL A 397 -6.461 3.292 2.428 1.00 0.33 N ATOM 553 CA VAL A 397 -7.021 2.201 1.642 1.00 0.33 C ATOM 554 C VAL A 397 -8.526 2.106 1.883 1.00 0.33 C ATOM 555 O VAL A 397 -8.985 2.154 3.024 1.00 0.37 O ATOM 556 CB VAL A 397 -6.323 0.860 1.966 1.00 0.38 C ATOM 557 CG1 VAL A 397 -7.322 -0.264 2.183 1.00 0.73 C ATOM 558 CG2 VAL A 397 -5.356 0.493 0.857 1.00 0.83 C ATOM 0 H VAL A 397 -6.033 3.003 3.307 1.00 0.33 H new ATOM 0 HA VAL A 397 -6.847 2.411 0.587 1.00 0.33 H new ATOM 0 HB VAL A 397 -5.773 0.994 2.897 1.00 0.38 H new ATOM 0 HG11 VAL A 397 -6.788 -1.187 2.408 1.00 0.73 H new ATOM 0 HG12 VAL A 397 -7.978 -0.012 3.016 1.00 0.73 H new ATOM 0 HG13 VAL A 397 -7.918 -0.400 1.281 1.00 0.73 H new ATOM 0 HG21 VAL A 397 -4.870 -0.453 1.096 1.00 0.83 H new ATOM 0 HG22 VAL A 397 -5.900 0.394 -0.082 1.00 0.83 H new ATOM 0 HG23 VAL A 397 -4.602 1.274 0.759 1.00 0.83 H new ATOM 568 N LEU A 398 -9.295 2.004 0.802 1.00 0.36 N ATOM 569 CA LEU A 398 -10.749 1.942 0.909 1.00 0.40 C ATOM 570 C LEU A 398 -11.322 0.663 0.302 1.00 0.41 C ATOM 571 O LEU A 398 -12.348 0.160 0.763 1.00 0.47 O ATOM 572 CB LEU A 398 -11.369 3.158 0.219 1.00 0.46 C ATOM 573 CG LEU A 398 -10.851 4.515 0.703 1.00 0.49 C ATOM 574 CD1 LEU A 398 -11.356 5.630 -0.198 1.00 1.16 C ATOM 575 CD2 LEU A 398 -11.270 4.765 2.144 1.00 1.45 C ATOM 0 H LEU A 398 -8.938 1.963 -0.153 1.00 0.36 H new ATOM 0 HA LEU A 398 -10.997 1.942 1.970 1.00 0.40 H new ATOM 0 HB2 LEU A 398 -11.188 3.079 -0.853 1.00 0.46 H new ATOM 0 HB3 LEU A 398 -12.449 3.127 0.363 1.00 0.46 H new ATOM 0 HG LEU A 398 -9.762 4.502 0.659 1.00 0.49 H new ATOM 0 HD11 LEU A 398 -10.978 6.587 0.161 1.00 1.16 H new ATOM 0 HD12 LEU A 398 -11.007 5.461 -1.217 1.00 1.16 H new ATOM 0 HD13 LEU A 398 -12.446 5.643 -0.185 1.00 1.16 H new ATOM 0 HD21 LEU A 398 -10.892 5.734 2.470 1.00 1.45 H new ATOM 0 HD22 LEU A 398 -12.358 4.757 2.213 1.00 1.45 H new ATOM 0 HD23 LEU A 398 -10.860 3.983 2.783 1.00 1.45 H new ATOM 587 N GLN A 399 -10.680 0.151 -0.744 1.00 0.39 N ATOM 588 CA GLN A 399 -11.168 -1.055 -1.415 1.00 0.43 C ATOM 589 C GLN A 399 -10.027 -1.983 -1.819 1.00 0.38 C ATOM 590 O GLN A 399 -8.854 -1.664 -1.633 1.00 0.35 O ATOM 591 CB GLN A 399 -11.989 -0.674 -2.650 1.00 0.49 C ATOM 592 CG GLN A 399 -13.223 0.154 -2.330 1.00 0.60 C ATOM 593 CD GLN A 399 -14.006 0.537 -3.570 1.00 1.36 C ATOM 594 OE1 GLN A 399 -14.469 -0.325 -4.316 1.00 2.08 O ATOM 595 NE2 GLN A 399 -14.159 1.837 -3.795 1.00 2.04 N ATOM 0 H GLN A 399 -9.829 0.546 -1.144 1.00 0.39 H new ATOM 0 HA GLN A 399 -11.798 -1.592 -0.706 1.00 0.43 H new ATOM 0 HB2 GLN A 399 -11.355 -0.115 -3.339 1.00 0.49 H new ATOM 0 HB3 GLN A 399 -12.296 -1.584 -3.166 1.00 0.49 H new ATOM 0 HG2 GLN A 399 -13.869 -0.409 -1.656 1.00 0.60 H new ATOM 0 HG3 GLN A 399 -12.922 1.058 -1.801 1.00 0.60 H new ATOM 0 HE21 GLN A 399 -13.758 2.517 -3.149 1.00 2.04 H new ATOM 0 HE22 GLN A 399 -14.678 2.155 -4.613 1.00 2.04 H new ATOM 604 N SER A 400 -10.390 -3.141 -2.368 1.00 0.42 N ATOM 605 CA SER A 400 -9.411 -4.133 -2.801 1.00 0.41 C ATOM 606 C SER A 400 -10.062 -5.174 -3.710 1.00 0.47 C ATOM 607 O SER A 400 -11.251 -5.466 -3.580 1.00 0.54 O ATOM 608 CB SER A 400 -8.776 -4.820 -1.592 1.00 0.47 C ATOM 609 OG SER A 400 -9.745 -5.528 -0.840 1.00 0.56 O ATOM 0 H SER A 400 -11.360 -3.415 -2.523 1.00 0.42 H new ATOM 0 HA SER A 400 -8.633 -3.618 -3.364 1.00 0.41 H new ATOM 0 HB2 SER A 400 -7.998 -5.507 -1.927 1.00 0.47 H new ATOM 0 HB3 SER A 400 -8.293 -4.076 -0.959 1.00 0.47 H new ATOM 0 HG SER A 400 -9.313 -5.960 -0.074 1.00 0.56 H new ATOM 615 N ARG A 401 -9.278 -5.727 -4.636 1.00 0.51 N ATOM 616 CA ARG A 401 -9.790 -6.730 -5.569 1.00 0.60 C ATOM 617 C ARG A 401 -8.669 -7.636 -6.071 1.00 0.73 C ATOM 618 O ARG A 401 -7.573 -7.171 -6.382 1.00 0.86 O ATOM 619 CB ARG A 401 -10.461 -6.050 -6.765 1.00 0.65 C ATOM 620 CG ARG A 401 -9.476 -5.356 -7.693 1.00 0.72 C ATOM 621 CD ARG A 401 -10.169 -4.751 -8.902 1.00 0.91 C ATOM 622 NE ARG A 401 -9.208 -4.214 -9.860 1.00 1.02 N ATOM 623 CZ ARG A 401 -9.551 -3.626 -11.001 1.00 1.25 C ATOM 624 NH1 ARG A 401 -10.830 -3.485 -11.322 1.00 1.55 N ATOM 625 NH2 ARG A 401 -8.611 -3.179 -11.823 1.00 1.43 N ATOM 0 H ARG A 401 -8.292 -5.499 -4.760 1.00 0.51 H new ATOM 0 HA ARG A 401 -10.521 -7.337 -5.035 1.00 0.60 H new ATOM 0 HB2 ARG A 401 -11.020 -6.795 -7.331 1.00 0.65 H new ATOM 0 HB3 ARG A 401 -11.183 -5.319 -6.401 1.00 0.65 H new ATOM 0 HG2 ARG A 401 -8.951 -4.573 -7.146 1.00 0.72 H new ATOM 0 HG3 ARG A 401 -8.724 -6.072 -8.026 1.00 0.72 H new ATOM 0 HD2 ARG A 401 -10.782 -5.510 -9.388 1.00 0.91 H new ATOM 0 HD3 ARG A 401 -10.842 -3.957 -8.577 1.00 0.91 H new ATOM 0 HE ARG A 401 -8.215 -4.295 -9.641 1.00 1.02 H new ATOM 0 HH11 ARG A 401 -11.555 -3.829 -10.692 1.00 1.55 H new ATOM 0 HH12 ARG A 401 -11.089 -3.033 -12.199 1.00 1.55 H new ATOM 0 HH21 ARG A 401 -7.627 -3.287 -11.579 1.00 1.43 H new ATOM 0 HH22 ARG A 401 -8.873 -2.727 -12.699 1.00 1.43 H new ATOM 639 N THR A 402 -8.950 -8.931 -6.159 1.00 0.82 N ATOM 640 CA THR A 402 -7.966 -9.896 -6.634 1.00 0.99 C ATOM 641 C THR A 402 -7.703 -9.719 -8.134 1.00 1.16 C ATOM 642 O THR A 402 -7.487 -8.599 -8.598 1.00 1.79 O ATOM 643 CB THR A 402 -8.413 -11.341 -6.334 1.00 1.14 C ATOM 644 OG1 THR A 402 -9.676 -11.609 -6.952 1.00 1.38 O ATOM 645 CG2 THR A 402 -8.515 -11.565 -4.833 1.00 1.29 C ATOM 0 H THR A 402 -9.851 -9.337 -5.908 1.00 0.82 H new ATOM 0 HA THR A 402 -7.036 -9.709 -6.097 1.00 0.99 H new ATOM 0 HB THR A 402 -7.667 -12.023 -6.742 1.00 1.14 H new ATOM 0 HG1 THR A 402 -10.097 -12.379 -6.515 1.00 1.38 H new ATOM 0 HG21 THR A 402 -8.832 -12.590 -4.639 1.00 1.29 H new ATOM 0 HG22 THR A 402 -7.542 -11.392 -4.372 1.00 1.29 H new ATOM 0 HG23 THR A 402 -9.244 -10.874 -4.411 1.00 1.29 H new ATOM 653 N THR A 403 -7.712 -10.817 -8.890 1.00 1.43 N ATOM 654 CA THR A 403 -7.465 -10.761 -10.326 1.00 1.62 C ATOM 655 C THR A 403 -7.955 -12.047 -10.992 1.00 1.84 C ATOM 656 O THR A 403 -8.597 -12.874 -10.345 1.00 1.85 O ATOM 657 CB THR A 403 -5.963 -10.563 -10.632 1.00 1.77 C ATOM 658 OG1 THR A 403 -5.358 -9.745 -9.623 1.00 1.78 O ATOM 659 CG2 THR A 403 -5.769 -9.896 -11.987 1.00 1.95 C ATOM 0 H THR A 403 -7.888 -11.755 -8.529 1.00 1.43 H new ATOM 0 HA THR A 403 -8.013 -9.907 -10.725 1.00 1.62 H new ATOM 0 HB THR A 403 -5.492 -11.546 -10.646 1.00 1.77 H new ATOM 0 HG1 THR A 403 -4.406 -9.626 -9.825 1.00 1.78 H new ATOM 0 HG21 THR A 403 -4.704 -9.767 -12.180 1.00 1.95 H new ATOM 0 HG22 THR A 403 -6.206 -10.521 -12.766 1.00 1.95 H new ATOM 0 HG23 THR A 403 -6.258 -8.922 -11.986 1.00 1.95 H new ATOM 667 N GLU A 404 -7.662 -12.204 -12.282 1.00 2.08 N ATOM 668 CA GLU A 404 -8.082 -13.385 -13.034 1.00 2.34 C ATOM 669 C GLU A 404 -7.905 -14.661 -12.215 1.00 2.30 C ATOM 670 O GLU A 404 -8.800 -15.506 -12.167 1.00 2.37 O ATOM 671 CB GLU A 404 -7.284 -13.490 -14.335 1.00 2.72 C ATOM 672 CG GLU A 404 -7.440 -12.282 -15.244 1.00 2.91 C ATOM 673 CD GLU A 404 -6.620 -12.401 -16.513 1.00 3.42 C ATOM 674 OE1 GLU A 404 -6.848 -13.361 -17.280 1.00 3.79 O ATOM 675 OE2 GLU A 404 -5.749 -11.535 -16.740 1.00 3.87 O ATOM 0 H GLU A 404 -7.133 -11.525 -12.830 1.00 2.08 H new ATOM 0 HA GLU A 404 -9.142 -13.274 -13.264 1.00 2.34 H new ATOM 0 HB2 GLU A 404 -6.229 -13.619 -14.095 1.00 2.72 H new ATOM 0 HB3 GLU A 404 -7.600 -14.383 -14.874 1.00 2.72 H new ATOM 0 HG2 GLU A 404 -8.491 -12.161 -15.505 1.00 2.91 H new ATOM 0 HG3 GLU A 404 -7.140 -11.384 -14.704 1.00 2.91 H new ATOM 682 N ASN A 405 -6.750 -14.796 -11.568 1.00 2.26 N ATOM 683 CA ASN A 405 -6.468 -15.970 -10.750 1.00 2.30 C ATOM 684 C ASN A 405 -7.377 -16.002 -9.523 1.00 2.07 C ATOM 685 O ASN A 405 -8.022 -17.013 -9.242 1.00 2.40 O ATOM 686 CB ASN A 405 -5.002 -15.977 -10.316 1.00 2.43 C ATOM 687 CG ASN A 405 -4.639 -17.215 -9.520 1.00 2.67 C ATOM 688 OD1 ASN A 405 -4.766 -18.339 -10.005 1.00 3.16 O ATOM 689 ND2 ASN A 405 -4.181 -17.014 -8.289 1.00 2.73 N ATOM 0 H ASN A 405 -5.997 -14.109 -11.595 1.00 2.26 H new ATOM 0 HA ASN A 405 -6.662 -16.859 -11.350 1.00 2.30 H new ATOM 0 HB2 ASN A 405 -4.365 -15.916 -11.198 1.00 2.43 H new ATOM 0 HB3 ASN A 405 -4.800 -15.090 -9.715 1.00 2.43 H new ATOM 0 HD21 ASN A 405 -3.919 -17.809 -7.706 1.00 2.73 H new ATOM 0 HD22 ASN A 405 -4.092 -16.065 -7.927 1.00 2.73 H new ATOM 696 N ALA A 406 -7.424 -14.883 -8.803 1.00 1.82 N ATOM 697 CA ALA A 406 -8.255 -14.767 -7.607 1.00 1.67 C ATOM 698 C ALA A 406 -7.960 -15.882 -6.608 1.00 1.85 C ATOM 699 O ALA A 406 -8.857 -16.623 -6.205 1.00 2.18 O ATOM 700 CB ALA A 406 -9.727 -14.758 -7.981 1.00 1.72 C ATOM 0 H ALA A 406 -6.894 -14.041 -9.028 1.00 1.82 H new ATOM 0 HA ALA A 406 -8.011 -13.821 -7.124 1.00 1.67 H new ATOM 0 HB1 ALA A 406 -10.331 -14.671 -7.078 1.00 1.72 H new ATOM 0 HB2 ALA A 406 -9.931 -13.912 -8.637 1.00 1.72 H new ATOM 0 HB3 ALA A 406 -9.977 -15.685 -8.497 1.00 1.72 H new ATOM 706 N ALA A 407 -6.700 -15.991 -6.209 1.00 1.91 N ATOM 707 CA ALA A 407 -6.279 -17.007 -5.251 1.00 2.19 C ATOM 708 C ALA A 407 -5.066 -16.528 -4.468 1.00 2.37 C ATOM 709 O ALA A 407 -4.445 -17.290 -3.726 1.00 2.77 O ATOM 710 CB ALA A 407 -5.963 -18.309 -5.970 1.00 2.38 C ATOM 0 H ALA A 407 -5.947 -15.385 -6.535 1.00 1.91 H new ATOM 0 HA ALA A 407 -7.095 -17.184 -4.551 1.00 2.19 H new ATOM 0 HB1 ALA A 407 -5.650 -19.059 -5.244 1.00 2.38 H new ATOM 0 HB2 ALA A 407 -6.852 -18.660 -6.494 1.00 2.38 H new ATOM 0 HB3 ALA A 407 -5.160 -18.142 -6.688 1.00 2.38 H new ATOM 716 N ALA A 408 -4.745 -15.251 -4.645 1.00 2.15 N ATOM 717 CA ALA A 408 -3.614 -14.624 -3.972 1.00 2.35 C ATOM 718 C ALA A 408 -3.492 -13.154 -4.379 1.00 2.05 C ATOM 719 O ALA A 408 -3.371 -12.279 -3.521 1.00 1.99 O ATOM 720 CB ALA A 408 -2.320 -15.369 -4.271 1.00 2.76 C ATOM 0 H ALA A 408 -5.262 -14.622 -5.259 1.00 2.15 H new ATOM 0 HA ALA A 408 -3.793 -14.672 -2.898 1.00 2.35 H new ATOM 0 HB1 ALA A 408 -1.492 -14.881 -3.757 1.00 2.76 H new ATOM 0 HB2 ALA A 408 -2.405 -16.399 -3.925 1.00 2.76 H new ATOM 0 HB3 ALA A 408 -2.135 -15.361 -5.345 1.00 2.76 H new ATOM 726 N PRO A 409 -3.530 -12.853 -5.698 1.00 1.99 N ATOM 727 CA PRO A 409 -3.429 -11.476 -6.191 1.00 1.80 C ATOM 728 C PRO A 409 -4.522 -10.585 -5.630 1.00 1.41 C ATOM 729 O PRO A 409 -5.634 -11.042 -5.381 1.00 1.86 O ATOM 730 CB PRO A 409 -3.576 -11.614 -7.710 1.00 2.10 C ATOM 731 CG PRO A 409 -3.228 -13.031 -8.004 1.00 2.49 C ATOM 732 CD PRO A 409 -3.674 -13.817 -6.806 1.00 2.27 C ATOM 0 HA PRO A 409 -2.492 -11.008 -5.889 1.00 1.80 H new ATOM 0 HB2 PRO A 409 -4.592 -11.382 -8.031 1.00 2.10 H new ATOM 0 HB3 PRO A 409 -2.912 -10.927 -8.235 1.00 2.10 H new ATOM 0 HG2 PRO A 409 -3.729 -13.377 -8.908 1.00 2.49 H new ATOM 0 HG3 PRO A 409 -2.157 -13.145 -8.170 1.00 2.49 H new ATOM 0 HD2 PRO A 409 -4.703 -14.160 -6.910 1.00 2.27 H new ATOM 0 HD3 PRO A 409 -3.057 -14.702 -6.652 1.00 2.27 H new ATOM 740 N ASP A 410 -4.196 -9.311 -5.429 1.00 0.92 N ATOM 741 CA ASP A 410 -5.155 -8.351 -4.896 1.00 0.79 C ATOM 742 C ASP A 410 -4.552 -6.950 -4.807 1.00 0.68 C ATOM 743 O ASP A 410 -3.449 -6.762 -4.294 1.00 0.93 O ATOM 744 CB ASP A 410 -5.656 -8.803 -3.520 1.00 1.18 C ATOM 745 CG ASP A 410 -4.526 -9.176 -2.576 1.00 1.62 C ATOM 746 OD1 ASP A 410 -3.662 -8.313 -2.317 1.00 2.14 O ATOM 747 OD2 ASP A 410 -4.502 -10.330 -2.101 1.00 1.99 O ATOM 0 H ASP A 410 -3.275 -8.921 -5.628 1.00 0.92 H new ATOM 0 HA ASP A 410 -6.000 -8.309 -5.584 1.00 0.79 H new ATOM 0 HB2 ASP A 410 -6.248 -8.004 -3.073 1.00 1.18 H new ATOM 0 HB3 ASP A 410 -6.318 -9.660 -3.643 1.00 1.18 H new ATOM 752 N GLU A 411 -5.296 -5.969 -5.310 1.00 0.54 N ATOM 753 CA GLU A 411 -4.862 -4.579 -5.290 1.00 0.45 C ATOM 754 C GLU A 411 -5.796 -3.762 -4.407 1.00 0.40 C ATOM 755 O GLU A 411 -7.011 -3.938 -4.459 1.00 0.42 O ATOM 756 CB GLU A 411 -4.844 -4.003 -6.705 1.00 0.49 C ATOM 757 CG GLU A 411 -3.966 -4.785 -7.669 1.00 0.58 C ATOM 758 CD GLU A 411 -3.941 -4.177 -9.057 1.00 1.47 C ATOM 759 OE1 GLU A 411 -5.018 -4.080 -9.682 1.00 2.10 O ATOM 760 OE2 GLU A 411 -2.844 -3.797 -9.519 1.00 2.08 O ATOM 0 H GLU A 411 -6.210 -6.115 -5.739 1.00 0.54 H new ATOM 0 HA GLU A 411 -3.851 -4.533 -4.885 1.00 0.45 H new ATOM 0 HB2 GLU A 411 -5.863 -3.980 -7.092 1.00 0.49 H new ATOM 0 HB3 GLU A 411 -4.495 -2.971 -6.664 1.00 0.49 H new ATOM 0 HG2 GLU A 411 -2.950 -4.828 -7.277 1.00 0.58 H new ATOM 0 HG3 GLU A 411 -4.327 -5.812 -7.732 1.00 0.58 H new ATOM 767 N TYR A 412 -5.232 -2.887 -3.585 1.00 0.38 N ATOM 768 CA TYR A 412 -6.037 -2.074 -2.681 1.00 0.35 C ATOM 769 C TYR A 412 -6.053 -0.607 -3.097 1.00 0.33 C ATOM 770 O TYR A 412 -5.004 0.002 -3.308 1.00 0.34 O ATOM 771 CB TYR A 412 -5.504 -2.182 -1.246 1.00 0.39 C ATOM 772 CG TYR A 412 -5.500 -3.587 -0.677 1.00 0.45 C ATOM 773 CD1 TYR A 412 -4.871 -4.627 -1.353 1.00 0.50 C ATOM 774 CD2 TYR A 412 -6.133 -3.878 0.526 1.00 0.53 C ATOM 775 CE1 TYR A 412 -4.874 -5.913 -0.844 1.00 0.58 C ATOM 776 CE2 TYR A 412 -6.138 -5.159 1.039 1.00 0.61 C ATOM 777 CZ TYR A 412 -5.481 -6.158 0.385 1.00 0.62 C ATOM 778 OH TYR A 412 -5.513 -7.448 0.862 1.00 0.72 O ATOM 0 H TYR A 412 -4.227 -2.722 -3.525 1.00 0.38 H new ATOM 0 HA TYR A 412 -7.056 -2.457 -2.730 1.00 0.35 H new ATOM 0 HB2 TYR A 412 -4.487 -1.791 -1.220 1.00 0.39 H new ATOM 0 HB3 TYR A 412 -6.107 -1.544 -0.600 1.00 0.39 H new ATOM 0 HD1 TYR A 412 -4.372 -4.427 -2.290 1.00 0.50 H new ATOM 0 HD2 TYR A 412 -6.630 -3.087 1.069 1.00 0.53 H new ATOM 0 HE1 TYR A 412 -4.410 -6.719 -1.394 1.00 0.58 H new ATOM 0 HE2 TYR A 412 -6.663 -5.370 1.959 1.00 0.61 H new ATOM 0 HH TYR A 412 -5.967 -7.465 1.730 1.00 0.72 H new ATOM 788 N TYR A 413 -7.253 -0.036 -3.175 1.00 0.33 N ATOM 789 CA TYR A 413 -7.409 1.371 -3.519 1.00 0.32 C ATOM 790 C TYR A 413 -6.693 2.208 -2.474 1.00 0.32 C ATOM 791 O TYR A 413 -6.641 1.821 -1.312 1.00 0.40 O ATOM 792 CB TYR A 413 -8.889 1.752 -3.551 1.00 0.36 C ATOM 793 CG TYR A 413 -9.140 3.183 -3.982 1.00 0.38 C ATOM 794 CD1 TYR A 413 -8.613 3.675 -5.170 1.00 0.40 C ATOM 795 CD2 TYR A 413 -9.904 4.039 -3.201 1.00 0.44 C ATOM 796 CE1 TYR A 413 -8.839 4.980 -5.565 1.00 0.44 C ATOM 797 CE2 TYR A 413 -10.135 5.345 -3.589 1.00 0.48 C ATOM 798 CZ TYR A 413 -9.601 5.810 -4.770 1.00 0.46 C ATOM 799 OH TYR A 413 -9.827 7.111 -5.159 1.00 0.51 O ATOM 0 H TYR A 413 -8.130 -0.528 -3.004 1.00 0.33 H new ATOM 0 HA TYR A 413 -6.983 1.552 -4.506 1.00 0.32 H new ATOM 0 HB2 TYR A 413 -9.414 1.080 -4.230 1.00 0.36 H new ATOM 0 HB3 TYR A 413 -9.316 1.600 -2.560 1.00 0.36 H new ATOM 0 HD1 TYR A 413 -8.017 3.027 -5.795 1.00 0.40 H new ATOM 0 HD2 TYR A 413 -10.325 3.678 -2.274 1.00 0.44 H new ATOM 0 HE1 TYR A 413 -8.421 5.347 -6.491 1.00 0.44 H new ATOM 0 HE2 TYR A 413 -10.731 5.998 -2.969 1.00 0.48 H new ATOM 0 HH TYR A 413 -10.383 7.561 -4.489 1.00 0.51 H new ATOM 809 N VAL A 414 -6.127 3.339 -2.869 1.00 0.33 N ATOM 810 CA VAL A 414 -5.414 4.162 -1.905 1.00 0.33 C ATOM 811 C VAL A 414 -5.431 5.646 -2.254 1.00 0.29 C ATOM 812 O VAL A 414 -5.168 6.042 -3.390 1.00 0.38 O ATOM 813 CB VAL A 414 -3.955 3.689 -1.761 1.00 0.39 C ATOM 814 CG1 VAL A 414 -3.235 3.727 -3.100 1.00 1.09 C ATOM 815 CG2 VAL A 414 -3.222 4.526 -0.729 1.00 1.15 C ATOM 0 H VAL A 414 -6.145 3.700 -3.823 1.00 0.33 H new ATOM 0 HA VAL A 414 -5.942 4.043 -0.959 1.00 0.33 H new ATOM 0 HB VAL A 414 -3.966 2.655 -1.417 1.00 0.39 H new ATOM 0 HG11 VAL A 414 -2.207 3.388 -2.970 1.00 1.09 H new ATOM 0 HG12 VAL A 414 -3.746 3.073 -3.807 1.00 1.09 H new ATOM 0 HG13 VAL A 414 -3.235 4.747 -3.484 1.00 1.09 H new ATOM 0 HG21 VAL A 414 -2.193 4.177 -0.641 1.00 1.15 H new ATOM 0 HG22 VAL A 414 -3.225 5.571 -1.039 1.00 1.15 H new ATOM 0 HG23 VAL A 414 -3.720 4.432 0.236 1.00 1.15 H new ATOM 825 N HIS A 415 -5.725 6.459 -1.241 1.00 0.33 N ATOM 826 CA HIS A 415 -5.762 7.908 -1.386 1.00 0.32 C ATOM 827 C HIS A 415 -4.681 8.533 -0.512 1.00 0.32 C ATOM 828 O HIS A 415 -4.794 8.543 0.713 1.00 0.34 O ATOM 829 CB HIS A 415 -7.137 8.451 -0.989 1.00 0.37 C ATOM 830 CG HIS A 415 -7.217 9.948 -0.990 1.00 0.44 C ATOM 831 ND1 HIS A 415 -6.906 10.722 -2.089 1.00 0.50 N ATOM 832 CD2 HIS A 415 -7.577 10.816 -0.014 1.00 0.54 C ATOM 833 CE1 HIS A 415 -7.072 11.998 -1.789 1.00 0.60 C ATOM 834 NE2 HIS A 415 -7.478 12.082 -0.536 1.00 0.62 N ATOM 0 H HIS A 415 -5.943 6.130 -0.300 1.00 0.33 H new ATOM 0 HA HIS A 415 -5.579 8.165 -2.429 1.00 0.32 H new ATOM 0 HB2 HIS A 415 -7.886 8.056 -1.675 1.00 0.37 H new ATOM 0 HB3 HIS A 415 -7.390 8.083 0.005 1.00 0.37 H new ATOM 0 HD1 HIS A 415 -6.596 10.365 -2.993 1.00 0.50 H new ATOM 0 HD2 HIS A 415 -7.885 10.560 0.989 1.00 0.54 H new ATOM 0 HE1 HIS A 415 -6.904 12.831 -2.456 1.00 0.60 H new ATOM 843 N TYR A 416 -3.629 9.038 -1.143 1.00 0.37 N ATOM 844 CA TYR A 416 -2.525 9.644 -0.411 1.00 0.40 C ATOM 845 C TYR A 416 -2.992 10.854 0.394 1.00 0.45 C ATOM 846 O TYR A 416 -3.601 11.778 -0.145 1.00 0.57 O ATOM 847 CB TYR A 416 -1.400 10.027 -1.374 1.00 0.46 C ATOM 848 CG TYR A 416 -0.844 8.845 -2.135 1.00 0.47 C ATOM 849 CD1 TYR A 416 -1.506 8.333 -3.244 1.00 0.53 C ATOM 850 CD2 TYR A 416 0.343 8.238 -1.743 1.00 0.51 C ATOM 851 CE1 TYR A 416 -1.002 7.252 -3.942 1.00 0.59 C ATOM 852 CE2 TYR A 416 0.854 7.156 -2.435 1.00 0.54 C ATOM 853 CZ TYR A 416 0.178 6.667 -3.534 1.00 0.57 C ATOM 854 OH TYR A 416 0.682 5.589 -4.226 1.00 0.65 O ATOM 0 H TYR A 416 -3.517 9.040 -2.157 1.00 0.37 H new ATOM 0 HA TYR A 416 -2.141 8.910 0.297 1.00 0.40 H new ATOM 0 HB2 TYR A 416 -1.773 10.766 -2.084 1.00 0.46 H new ATOM 0 HB3 TYR A 416 -0.595 10.502 -0.813 1.00 0.46 H new ATOM 0 HD1 TYR A 416 -2.431 8.788 -3.566 1.00 0.53 H new ATOM 0 HD2 TYR A 416 0.875 8.618 -0.883 1.00 0.51 H new ATOM 0 HE1 TYR A 416 -1.530 6.868 -4.802 1.00 0.59 H new ATOM 0 HE2 TYR A 416 1.778 6.696 -2.117 1.00 0.54 H new ATOM 0 HH TYR A 416 0.417 5.651 -5.167 1.00 0.65 H new ATOM 864 N VAL A 417 -2.709 10.826 1.694 1.00 0.45 N ATOM 865 CA VAL A 417 -3.101 11.904 2.600 1.00 0.55 C ATOM 866 C VAL A 417 -2.120 13.064 2.533 1.00 0.66 C ATOM 867 O VAL A 417 -1.882 13.757 3.523 1.00 1.34 O ATOM 868 CB VAL A 417 -3.177 11.394 4.049 1.00 0.68 C ATOM 869 CG1 VAL A 417 -4.016 12.325 4.913 1.00 1.10 C ATOM 870 CG2 VAL A 417 -3.722 9.983 4.067 1.00 1.01 C ATOM 0 H VAL A 417 -2.206 10.063 2.147 1.00 0.45 H new ATOM 0 HA VAL A 417 -4.084 12.253 2.283 1.00 0.55 H new ATOM 0 HB VAL A 417 -2.172 11.382 4.472 1.00 0.68 H new ATOM 0 HG11 VAL A 417 -4.053 11.941 5.932 1.00 1.10 H new ATOM 0 HG12 VAL A 417 -3.570 13.319 4.916 1.00 1.10 H new ATOM 0 HG13 VAL A 417 -5.027 12.383 4.510 1.00 1.10 H new ATOM 0 HG21 VAL A 417 -3.774 9.626 5.096 1.00 1.01 H new ATOM 0 HG22 VAL A 417 -4.720 9.973 3.629 1.00 1.01 H new ATOM 0 HG23 VAL A 417 -3.065 9.332 3.490 1.00 1.01 H new ATOM 880 N GLY A 418 -1.552 13.270 1.357 1.00 0.71 N ATOM 881 CA GLY A 418 -0.599 14.350 1.180 1.00 0.82 C ATOM 882 C GLY A 418 -0.135 14.497 -0.254 1.00 0.72 C ATOM 883 O GLY A 418 -0.050 15.611 -0.772 1.00 0.76 O ATOM 0 H GLY A 418 -1.731 12.712 0.522 1.00 0.71 H new ATOM 0 HA2 GLY A 418 -1.053 15.285 1.508 1.00 0.82 H new ATOM 0 HA3 GLY A 418 0.265 14.174 1.820 1.00 0.82 H new ATOM 887 N LEU A 419 0.173 13.375 -0.896 1.00 0.66 N ATOM 888 CA LEU A 419 0.641 13.395 -2.276 1.00 0.60 C ATOM 889 C LEU A 419 -0.437 13.907 -3.231 1.00 0.59 C ATOM 890 O LEU A 419 -1.436 14.490 -2.811 1.00 0.76 O ATOM 891 CB LEU A 419 1.106 12.003 -2.710 1.00 0.58 C ATOM 892 CG LEU A 419 2.411 11.518 -2.070 1.00 0.78 C ATOM 893 CD1 LEU A 419 2.211 11.212 -0.593 1.00 1.60 C ATOM 894 CD2 LEU A 419 2.940 10.297 -2.806 1.00 1.40 C ATOM 0 H LEU A 419 0.107 12.444 -0.484 1.00 0.66 H new ATOM 0 HA LEU A 419 1.486 14.083 -2.321 1.00 0.60 H new ATOM 0 HB2 LEU A 419 0.318 11.286 -2.477 1.00 0.58 H new ATOM 0 HB3 LEU A 419 1.229 12.001 -3.793 1.00 0.58 H new ATOM 0 HG LEU A 419 3.149 12.316 -2.150 1.00 0.78 H new ATOM 0 HD11 LEU A 419 3.152 10.870 -0.162 1.00 1.60 H new ATOM 0 HD12 LEU A 419 1.882 12.113 -0.076 1.00 1.60 H new ATOM 0 HD13 LEU A 419 1.456 10.434 -0.482 1.00 1.60 H new ATOM 0 HD21 LEU A 419 3.867 9.964 -2.340 1.00 1.40 H new ATOM 0 HD22 LEU A 419 2.202 9.496 -2.759 1.00 1.40 H new ATOM 0 HD23 LEU A 419 3.130 10.554 -3.848 1.00 1.40 H new ATOM 906 N ASN A 420 -0.207 13.690 -4.519 1.00 0.61 N ATOM 907 CA ASN A 420 -1.128 14.128 -5.562 1.00 0.63 C ATOM 908 C ASN A 420 -2.380 13.258 -5.614 1.00 0.56 C ATOM 909 O ASN A 420 -2.321 12.050 -5.387 1.00 0.56 O ATOM 910 CB ASN A 420 -0.419 14.093 -6.913 1.00 0.75 C ATOM 911 CG ASN A 420 0.875 14.881 -6.908 1.00 1.57 C ATOM 912 OD1 ASN A 420 1.795 14.579 -6.149 1.00 2.53 O ATOM 913 ND2 ASN A 420 0.952 15.898 -7.755 1.00 1.98 N ATOM 0 H ASN A 420 0.620 13.207 -4.871 1.00 0.61 H new ATOM 0 HA ASN A 420 -1.441 15.146 -5.329 1.00 0.63 H new ATOM 0 HB2 ASN A 420 -0.210 13.058 -7.183 1.00 0.75 H new ATOM 0 HB3 ASN A 420 -1.083 14.495 -7.679 1.00 0.75 H new ATOM 0 HD21 ASN A 420 1.799 16.465 -7.795 1.00 1.98 H new ATOM 0 HD22 ASN A 420 0.165 16.113 -8.367 1.00 1.98 H new ATOM 920 N ARG A 421 -3.512 13.884 -5.929 1.00 0.62 N ATOM 921 CA ARG A 421 -4.783 13.173 -6.028 1.00 0.67 C ATOM 922 C ARG A 421 -4.754 12.173 -7.182 1.00 0.66 C ATOM 923 O ARG A 421 -5.288 11.069 -7.073 1.00 0.69 O ATOM 924 CB ARG A 421 -5.934 14.162 -6.220 1.00 0.87 C ATOM 925 CG ARG A 421 -6.108 15.124 -5.057 1.00 1.09 C ATOM 926 CD ARG A 421 -7.279 16.066 -5.285 1.00 1.51 C ATOM 927 NE ARG A 421 -7.085 16.911 -6.460 1.00 2.25 N ATOM 928 CZ ARG A 421 -6.111 17.812 -6.570 1.00 3.00 C ATOM 929 NH1 ARG A 421 -5.260 18.002 -5.569 1.00 3.28 N ATOM 930 NH2 ARG A 421 -5.992 18.528 -7.678 1.00 3.98 N ATOM 0 H ARG A 421 -3.574 14.884 -6.120 1.00 0.62 H new ATOM 0 HA ARG A 421 -4.940 12.626 -5.099 1.00 0.67 H new ATOM 0 HB2 ARG A 421 -5.762 14.734 -7.132 1.00 0.87 H new ATOM 0 HB3 ARG A 421 -6.860 13.606 -6.363 1.00 0.87 H new ATOM 0 HG2 ARG A 421 -6.267 14.560 -4.138 1.00 1.09 H new ATOM 0 HG3 ARG A 421 -5.194 15.703 -4.922 1.00 1.09 H new ATOM 0 HD2 ARG A 421 -8.193 15.485 -5.404 1.00 1.51 H new ATOM 0 HD3 ARG A 421 -7.414 16.695 -4.405 1.00 1.51 H new ATOM 0 HE ARG A 421 -7.733 16.805 -7.241 1.00 2.25 H new ATOM 0 HH11 ARG A 421 -5.351 17.457 -4.712 1.00 3.28 H new ATOM 0 HH12 ARG A 421 -4.515 18.693 -5.657 1.00 3.28 H new ATOM 0 HH21 ARG A 421 -6.647 18.389 -8.448 1.00 3.98 H new ATOM 0 HH22 ARG A 421 -5.246 19.218 -7.762 1.00 3.98 H new ATOM 944 N ARG A 422 -4.125 12.567 -8.287 1.00 0.71 N ATOM 945 CA ARG A 422 -4.018 11.706 -9.462 1.00 0.83 C ATOM 946 C ARG A 422 -3.388 10.367 -9.101 1.00 0.72 C ATOM 947 O ARG A 422 -3.755 9.325 -9.645 1.00 0.77 O ATOM 948 CB ARG A 422 -3.181 12.382 -10.549 1.00 1.01 C ATOM 949 CG ARG A 422 -1.888 12.996 -10.038 1.00 1.19 C ATOM 950 CD ARG A 422 -1.100 13.653 -11.161 1.00 1.49 C ATOM 951 NE ARG A 422 -0.750 12.704 -12.215 1.00 2.09 N ATOM 952 CZ ARG A 422 -0.057 13.030 -13.303 1.00 2.79 C ATOM 953 NH1 ARG A 422 0.367 14.275 -13.474 1.00 3.07 N ATOM 954 NH2 ARG A 422 0.214 12.111 -14.218 1.00 3.71 N ATOM 0 H ARG A 422 -3.681 13.479 -8.393 1.00 0.71 H new ATOM 0 HA ARG A 422 -5.026 11.533 -9.838 1.00 0.83 H new ATOM 0 HB2 ARG A 422 -2.944 11.649 -11.320 1.00 1.01 H new ATOM 0 HB3 ARG A 422 -3.779 13.160 -11.023 1.00 1.01 H new ATOM 0 HG2 ARG A 422 -2.114 13.736 -9.270 1.00 1.19 H new ATOM 0 HG3 ARG A 422 -1.279 12.224 -9.568 1.00 1.19 H new ATOM 0 HD2 ARG A 422 -1.687 14.467 -11.587 1.00 1.49 H new ATOM 0 HD3 ARG A 422 -0.190 14.095 -10.755 1.00 1.49 H new ATOM 0 HE ARG A 422 -1.054 11.736 -12.111 1.00 2.09 H new ATOM 0 HH11 ARG A 422 0.162 14.985 -12.771 1.00 3.07 H new ATOM 0 HH12 ARG A 422 0.898 14.523 -14.309 1.00 3.07 H new ATOM 0 HH21 ARG A 422 -0.109 11.152 -14.089 1.00 3.71 H new ATOM 0 HH22 ARG A 422 0.745 12.362 -15.052 1.00 3.71 H new ATOM 968 N LEU A 423 -2.436 10.415 -8.182 1.00 0.65 N ATOM 969 CA LEU A 423 -1.731 9.224 -7.729 1.00 0.62 C ATOM 970 C LEU A 423 -2.697 8.130 -7.280 1.00 0.52 C ATOM 971 O LEU A 423 -2.361 6.946 -7.321 1.00 0.53 O ATOM 972 CB LEU A 423 -0.776 9.593 -6.594 1.00 0.69 C ATOM 973 CG LEU A 423 0.650 9.965 -7.020 1.00 0.89 C ATOM 974 CD1 LEU A 423 0.654 10.863 -8.247 1.00 1.31 C ATOM 975 CD2 LEU A 423 1.376 10.649 -5.872 1.00 1.49 C ATOM 0 H LEU A 423 -2.131 11.277 -7.730 1.00 0.65 H new ATOM 0 HA LEU A 423 -1.161 8.827 -8.569 1.00 0.62 H new ATOM 0 HB2 LEU A 423 -1.202 10.432 -6.044 1.00 0.69 H new ATOM 0 HB3 LEU A 423 -0.721 8.753 -5.902 1.00 0.69 H new ATOM 0 HG LEU A 423 1.170 9.043 -7.281 1.00 0.89 H new ATOM 0 HD11 LEU A 423 1.682 11.105 -8.518 1.00 1.31 H new ATOM 0 HD12 LEU A 423 0.172 10.347 -9.077 1.00 1.31 H new ATOM 0 HD13 LEU A 423 0.111 11.782 -8.027 1.00 1.31 H new ATOM 0 HD21 LEU A 423 2.387 10.909 -6.185 1.00 1.49 H new ATOM 0 HD22 LEU A 423 0.839 11.555 -5.590 1.00 1.49 H new ATOM 0 HD23 LEU A 423 1.423 9.974 -5.017 1.00 1.49 H new ATOM 987 N ASP A 424 -3.894 8.530 -6.854 1.00 0.49 N ATOM 988 CA ASP A 424 -4.904 7.574 -6.403 1.00 0.50 C ATOM 989 C ASP A 424 -5.099 6.455 -7.418 1.00 0.45 C ATOM 990 O ASP A 424 -5.189 6.699 -8.620 1.00 0.49 O ATOM 991 CB ASP A 424 -6.239 8.277 -6.154 1.00 0.66 C ATOM 992 CG ASP A 424 -6.241 9.091 -4.879 1.00 0.81 C ATOM 993 OD1 ASP A 424 -5.371 9.975 -4.733 1.00 0.97 O ATOM 994 OD2 ASP A 424 -7.117 8.845 -4.024 1.00 1.20 O ATOM 0 H ASP A 424 -4.188 9.506 -6.812 1.00 0.49 H new ATOM 0 HA ASP A 424 -4.547 7.138 -5.470 1.00 0.50 H new ATOM 0 HB2 ASP A 424 -6.464 8.930 -6.997 1.00 0.66 H new ATOM 0 HB3 ASP A 424 -7.034 7.533 -6.106 1.00 0.66 H new ATOM 999 N GLY A 425 -5.166 5.226 -6.919 1.00 0.44 N ATOM 1000 CA GLY A 425 -5.354 4.079 -7.785 1.00 0.50 C ATOM 1001 C GLY A 425 -5.335 2.772 -7.020 1.00 0.45 C ATOM 1002 O GLY A 425 -5.876 2.684 -5.918 1.00 0.70 O ATOM 0 H GLY A 425 -5.093 5.004 -5.926 1.00 0.44 H new ATOM 0 HA2 GLY A 425 -6.304 4.176 -8.311 1.00 0.50 H new ATOM 0 HA3 GLY A 425 -4.570 4.066 -8.542 1.00 0.50 H new ATOM 1006 N TRP A 426 -4.709 1.756 -7.602 1.00 0.50 N ATOM 1007 CA TRP A 426 -4.621 0.448 -6.965 1.00 0.44 C ATOM 1008 C TRP A 426 -3.164 0.029 -6.792 1.00 0.45 C ATOM 1009 O TRP A 426 -2.339 0.234 -7.683 1.00 0.57 O ATOM 1010 CB TRP A 426 -5.386 -0.596 -7.785 1.00 0.47 C ATOM 1011 CG TRP A 426 -6.833 -0.252 -7.977 1.00 0.49 C ATOM 1012 CD1 TRP A 426 -7.343 0.733 -8.775 1.00 0.57 C ATOM 1013 CD2 TRP A 426 -7.955 -0.876 -7.344 1.00 0.48 C ATOM 1014 NE1 TRP A 426 -8.714 0.749 -8.685 1.00 0.61 N ATOM 1015 CE2 TRP A 426 -9.114 -0.228 -7.811 1.00 0.55 C ATOM 1016 CE3 TRP A 426 -8.095 -1.925 -6.430 1.00 0.50 C ATOM 1017 CZ2 TRP A 426 -10.391 -0.591 -7.394 1.00 0.59 C ATOM 1018 CZ3 TRP A 426 -9.364 -2.285 -6.016 1.00 0.56 C ATOM 1019 CH2 TRP A 426 -10.498 -1.620 -6.499 1.00 0.59 C ATOM 0 H TRP A 426 -4.255 1.813 -8.514 1.00 0.50 H new ATOM 0 HA TRP A 426 -5.076 0.515 -5.977 1.00 0.44 H new ATOM 0 HB2 TRP A 426 -4.912 -0.701 -8.761 1.00 0.47 H new ATOM 0 HB3 TRP A 426 -5.312 -1.564 -7.289 1.00 0.47 H new ATOM 0 HD1 TRP A 426 -6.755 1.401 -9.387 1.00 0.57 H new ATOM 0 HE1 TRP A 426 -9.334 1.385 -9.187 1.00 0.61 H new ATOM 0 HE3 TRP A 426 -7.226 -2.445 -6.054 1.00 0.50 H new ATOM 0 HZ2 TRP A 426 -11.267 -0.078 -7.764 1.00 0.59 H new ATOM 0 HZ3 TRP A 426 -9.483 -3.092 -5.309 1.00 0.56 H new ATOM 0 HH2 TRP A 426 -11.476 -1.926 -6.158 1.00 0.59 H new ATOM 1030 N VAL A 427 -2.851 -0.544 -5.634 1.00 0.39 N ATOM 1031 CA VAL A 427 -1.488 -0.976 -5.335 1.00 0.46 C ATOM 1032 C VAL A 427 -1.458 -2.376 -4.734 1.00 0.51 C ATOM 1033 O VAL A 427 -2.322 -2.742 -3.938 1.00 0.70 O ATOM 1034 CB VAL A 427 -0.799 -0.014 -4.350 1.00 0.64 C ATOM 1035 CG1 VAL A 427 -0.599 1.354 -4.973 1.00 0.89 C ATOM 1036 CG2 VAL A 427 -1.606 0.100 -3.069 1.00 0.85 C ATOM 0 H VAL A 427 -3.522 -0.720 -4.886 1.00 0.39 H new ATOM 0 HA VAL A 427 -0.954 -0.978 -6.285 1.00 0.46 H new ATOM 0 HB VAL A 427 0.183 -0.422 -4.110 1.00 0.64 H new ATOM 0 HG11 VAL A 427 -0.110 2.013 -4.255 1.00 0.89 H new ATOM 0 HG12 VAL A 427 0.024 1.261 -5.863 1.00 0.89 H new ATOM 0 HG13 VAL A 427 -1.567 1.773 -5.250 1.00 0.89 H new ATOM 0 HG21 VAL A 427 -1.105 0.784 -2.383 1.00 0.85 H new ATOM 0 HG22 VAL A 427 -2.601 0.480 -3.299 1.00 0.85 H new ATOM 0 HG23 VAL A 427 -1.691 -0.882 -2.604 1.00 0.85 H new ATOM 1046 N GLY A 428 -0.444 -3.150 -5.109 1.00 0.52 N ATOM 1047 CA GLY A 428 -0.302 -4.494 -4.585 1.00 0.65 C ATOM 1048 C GLY A 428 -0.076 -4.498 -3.086 1.00 0.79 C ATOM 1049 O GLY A 428 0.574 -3.601 -2.550 1.00 1.72 O ATOM 0 H GLY A 428 0.282 -2.869 -5.768 1.00 0.52 H new ATOM 0 HA2 GLY A 428 -1.197 -5.071 -4.818 1.00 0.65 H new ATOM 0 HA3 GLY A 428 0.534 -4.989 -5.079 1.00 0.65 H new ATOM 1053 N ARG A 429 -0.619 -5.503 -2.412 1.00 0.54 N ATOM 1054 CA ARG A 429 -0.482 -5.622 -0.963 1.00 0.54 C ATOM 1055 C ARG A 429 0.983 -5.618 -0.538 1.00 0.49 C ATOM 1056 O ARG A 429 1.320 -5.209 0.571 1.00 0.53 O ATOM 1057 CB ARG A 429 -1.148 -6.907 -0.476 1.00 0.68 C ATOM 1058 CG ARG A 429 -0.999 -7.128 1.021 1.00 0.83 C ATOM 1059 CD ARG A 429 -1.466 -5.909 1.810 1.00 0.85 C ATOM 1060 NE ARG A 429 -1.185 -6.034 3.238 1.00 1.20 N ATOM 1061 CZ ARG A 429 -1.815 -6.880 4.042 1.00 1.26 C ATOM 1062 NH1 ARG A 429 -2.802 -7.629 3.571 1.00 1.73 N ATOM 1063 NH2 ARG A 429 -1.475 -6.963 5.320 1.00 1.65 N ATOM 0 H ARG A 429 -1.161 -6.251 -2.845 1.00 0.54 H new ATOM 0 HA ARG A 429 -0.973 -4.759 -0.513 1.00 0.54 H new ATOM 0 HB2 ARG A 429 -2.208 -6.878 -0.729 1.00 0.68 H new ATOM 0 HB3 ARG A 429 -0.717 -7.756 -1.007 1.00 0.68 H new ATOM 0 HG2 ARG A 429 -1.577 -8.002 1.321 1.00 0.83 H new ATOM 0 HG3 ARG A 429 0.044 -7.339 1.258 1.00 0.83 H new ATOM 0 HD2 ARG A 429 -0.974 -5.017 1.422 1.00 0.85 H new ATOM 0 HD3 ARG A 429 -2.537 -5.772 1.663 1.00 0.85 H new ATOM 0 HE ARG A 429 -0.463 -5.436 3.640 1.00 1.20 H new ATOM 0 HH11 ARG A 429 -3.076 -7.554 2.591 1.00 1.73 H new ATOM 0 HH12 ARG A 429 -3.287 -8.280 4.188 1.00 1.73 H new ATOM 0 HH21 ARG A 429 -0.727 -6.375 5.688 1.00 1.65 H new ATOM 0 HH22 ARG A 429 -1.961 -7.615 5.936 1.00 1.65 H new ATOM 1077 N HIS A 430 1.841 -6.088 -1.428 1.00 0.49 N ATOM 1078 CA HIS A 430 3.276 -6.162 -1.167 1.00 0.53 C ATOM 1079 C HIS A 430 3.798 -4.786 -0.807 1.00 0.47 C ATOM 1080 O HIS A 430 4.756 -4.633 -0.047 1.00 0.49 O ATOM 1081 CB HIS A 430 4.012 -6.657 -2.419 1.00 0.65 C ATOM 1082 CG HIS A 430 3.245 -7.669 -3.219 1.00 0.77 C ATOM 1083 ND1 HIS A 430 3.622 -8.074 -4.478 1.00 1.20 N ATOM 1084 CD2 HIS A 430 2.100 -8.335 -2.943 1.00 1.47 C ATOM 1085 CE1 HIS A 430 2.737 -8.940 -4.938 1.00 1.31 C ATOM 1086 NE2 HIS A 430 1.808 -9.118 -4.025 1.00 1.46 N ATOM 0 H HIS A 430 1.568 -6.429 -2.350 1.00 0.49 H new ATOM 0 HA HIS A 430 3.448 -6.854 -0.343 1.00 0.53 H new ATOM 0 HB2 HIS A 430 4.239 -5.802 -3.056 1.00 0.65 H new ATOM 0 HB3 HIS A 430 4.965 -7.093 -2.119 1.00 0.65 H new ATOM 0 HD2 HIS A 430 1.522 -8.261 -2.034 1.00 1.47 H new ATOM 0 HE1 HIS A 430 2.771 -9.422 -5.904 1.00 1.31 H new ATOM 0 HE2 HIS A 430 1.002 -9.738 -4.110 1.00 1.46 H new ATOM 1095 N ARG A 431 3.153 -3.796 -1.390 1.00 0.43 N ATOM 1096 CA ARG A 431 3.506 -2.406 -1.198 1.00 0.41 C ATOM 1097 C ARG A 431 2.885 -1.844 0.080 1.00 0.37 C ATOM 1098 O ARG A 431 3.494 -1.027 0.768 1.00 0.57 O ATOM 1099 CB ARG A 431 3.043 -1.628 -2.425 1.00 0.44 C ATOM 1100 CG ARG A 431 3.404 -2.333 -3.729 1.00 0.53 C ATOM 1101 CD ARG A 431 2.967 -1.530 -4.944 1.00 0.64 C ATOM 1102 NE ARG A 431 3.527 -2.062 -6.187 1.00 1.39 N ATOM 1103 CZ ARG A 431 3.277 -3.281 -6.657 1.00 2.05 C ATOM 1104 NH1 ARG A 431 2.455 -4.095 -6.006 1.00 2.55 N ATOM 1105 NH2 ARG A 431 3.845 -3.686 -7.785 1.00 2.84 N ATOM 0 H ARG A 431 2.361 -3.937 -2.017 1.00 0.43 H new ATOM 0 HA ARG A 431 4.586 -2.312 -1.084 1.00 0.41 H new ATOM 0 HB2 ARG A 431 1.963 -1.488 -2.377 1.00 0.44 H new ATOM 0 HB3 ARG A 431 3.494 -0.636 -2.414 1.00 0.44 H new ATOM 0 HG2 ARG A 431 4.481 -2.495 -3.769 1.00 0.53 H new ATOM 0 HG3 ARG A 431 2.933 -3.315 -3.754 1.00 0.53 H new ATOM 0 HD2 ARG A 431 1.879 -1.532 -5.007 1.00 0.64 H new ATOM 0 HD3 ARG A 431 3.277 -0.492 -4.822 1.00 0.64 H new ATOM 0 HE ARG A 431 4.148 -1.460 -6.727 1.00 1.39 H new ATOM 0 HH11 ARG A 431 2.011 -3.787 -5.141 1.00 2.55 H new ATOM 0 HH12 ARG A 431 2.267 -5.029 -6.371 1.00 2.55 H new ATOM 0 HH21 ARG A 431 4.473 -3.063 -8.292 1.00 2.84 H new ATOM 0 HH22 ARG A 431 3.653 -4.621 -8.146 1.00 2.84 H new ATOM 1119 N ILE A 432 1.669 -2.284 0.390 1.00 0.39 N ATOM 1120 CA ILE A 432 0.968 -1.816 1.584 1.00 0.36 C ATOM 1121 C ILE A 432 1.293 -2.675 2.805 1.00 0.38 C ATOM 1122 O ILE A 432 1.306 -3.903 2.731 1.00 0.44 O ATOM 1123 CB ILE A 432 -0.557 -1.792 1.356 1.00 0.38 C ATOM 1124 CG1 ILE A 432 -0.898 -0.743 0.292 1.00 0.40 C ATOM 1125 CG2 ILE A 432 -1.294 -1.507 2.660 1.00 0.42 C ATOM 1126 CD1 ILE A 432 -2.372 -0.641 -0.030 1.00 0.46 C ATOM 0 H ILE A 432 1.149 -2.962 -0.167 1.00 0.39 H new ATOM 0 HA ILE A 432 1.315 -0.801 1.778 1.00 0.36 H new ATOM 0 HB ILE A 432 -0.881 -2.771 1.003 1.00 0.38 H new ATOM 0 HG12 ILE A 432 -0.544 0.230 0.631 1.00 0.40 H new ATOM 0 HG13 ILE A 432 -0.354 -0.979 -0.622 1.00 0.40 H new ATOM 0 HG21 ILE A 432 -2.368 -1.495 2.476 1.00 0.42 H new ATOM 0 HG22 ILE A 432 -1.060 -2.284 3.388 1.00 0.42 H new ATOM 0 HG23 ILE A 432 -0.982 -0.538 3.050 1.00 0.42 H new ATOM 0 HD11 ILE A 432 -2.526 0.124 -0.791 1.00 0.46 H new ATOM 0 HD12 ILE A 432 -2.730 -1.601 -0.402 1.00 0.46 H new ATOM 0 HD13 ILE A 432 -2.923 -0.372 0.871 1.00 0.46 H new ATOM 1138 N SER A 433 1.553 -2.011 3.929 1.00 0.34 N ATOM 1139 CA SER A 433 1.881 -2.697 5.176 1.00 0.38 C ATOM 1140 C SER A 433 1.690 -1.765 6.368 1.00 0.36 C ATOM 1141 O SER A 433 2.017 -0.581 6.301 1.00 0.34 O ATOM 1142 CB SER A 433 3.325 -3.205 5.145 1.00 0.41 C ATOM 1143 OG SER A 433 3.526 -4.122 4.083 1.00 0.53 O ATOM 0 H SER A 433 1.543 -0.994 4.001 1.00 0.34 H new ATOM 0 HA SER A 433 1.207 -3.547 5.281 1.00 0.38 H new ATOM 0 HB2 SER A 433 4.007 -2.362 5.034 1.00 0.41 H new ATOM 0 HB3 SER A 433 3.564 -3.686 6.094 1.00 0.41 H new ATOM 0 HG SER A 433 2.658 -4.417 3.736 1.00 0.53 H new ATOM 1149 N ASP A 434 1.152 -2.307 7.459 1.00 0.43 N ATOM 1150 CA ASP A 434 0.909 -1.525 8.668 1.00 0.48 C ATOM 1151 C ASP A 434 2.213 -1.196 9.398 1.00 0.48 C ATOM 1152 O ASP A 434 2.195 -0.811 10.568 1.00 0.74 O ATOM 1153 CB ASP A 434 -0.033 -2.281 9.606 1.00 0.60 C ATOM 1154 CG ASP A 434 0.544 -3.608 10.060 1.00 0.83 C ATOM 1155 OD1 ASP A 434 0.816 -4.465 9.192 1.00 1.12 O ATOM 1156 OD2 ASP A 434 0.725 -3.790 11.282 1.00 1.35 O ATOM 0 H ASP A 434 0.876 -3.286 7.530 1.00 0.43 H new ATOM 0 HA ASP A 434 0.445 -0.586 8.366 1.00 0.48 H new ATOM 0 HB2 ASP A 434 -0.245 -1.663 10.478 1.00 0.60 H new ATOM 0 HB3 ASP A 434 -0.983 -2.455 9.100 1.00 0.60 H new ATOM 1161 N ASN A 435 3.340 -1.348 8.707 1.00 0.43 N ATOM 1162 CA ASN A 435 4.643 -1.066 9.301 1.00 0.47 C ATOM 1163 C ASN A 435 5.610 -0.516 8.259 1.00 0.39 C ATOM 1164 O ASN A 435 5.742 -1.066 7.165 1.00 0.38 O ATOM 1165 CB ASN A 435 5.225 -2.331 9.935 1.00 0.59 C ATOM 1166 CG ASN A 435 4.352 -2.876 11.049 1.00 1.26 C ATOM 1167 OD1 ASN A 435 4.105 -2.198 12.047 1.00 2.16 O ATOM 1168 ND2 ASN A 435 3.879 -4.105 10.885 1.00 1.81 N ATOM 0 H ASN A 435 3.377 -1.664 7.738 1.00 0.43 H new ATOM 0 HA ASN A 435 4.503 -0.311 10.075 1.00 0.47 H new ATOM 0 HB2 ASN A 435 5.348 -3.095 9.167 1.00 0.59 H new ATOM 0 HB3 ASN A 435 6.217 -2.113 10.329 1.00 0.59 H new ATOM 0 HD21 ASN A 435 3.286 -4.523 11.602 1.00 1.81 H new ATOM 0 HD22 ASN A 435 4.109 -4.632 10.042 1.00 1.81 H new ATOM 1175 N ALA A 436 6.283 0.576 8.608 1.00 0.49 N ATOM 1176 CA ALA A 436 7.239 1.213 7.709 1.00 0.55 C ATOM 1177 C ALA A 436 8.470 0.337 7.492 1.00 0.55 C ATOM 1178 O ALA A 436 8.964 0.216 6.370 1.00 0.54 O ATOM 1179 CB ALA A 436 7.647 2.573 8.254 1.00 0.75 C ATOM 0 H ALA A 436 6.183 1.040 9.511 1.00 0.49 H new ATOM 0 HA ALA A 436 6.752 1.348 6.743 1.00 0.55 H new ATOM 0 HB1 ALA A 436 8.361 3.038 7.574 1.00 0.75 H new ATOM 0 HB2 ALA A 436 6.766 3.208 8.345 1.00 0.75 H new ATOM 0 HB3 ALA A 436 8.107 2.449 9.234 1.00 0.75 H new ATOM 1185 N ASP A 437 8.962 -0.265 8.571 1.00 0.65 N ATOM 1186 CA ASP A 437 10.140 -1.124 8.499 1.00 0.75 C ATOM 1187 C ASP A 437 9.952 -2.225 7.461 1.00 0.71 C ATOM 1188 O ASP A 437 10.874 -2.550 6.712 1.00 0.78 O ATOM 1189 CB ASP A 437 10.427 -1.744 9.868 1.00 0.92 C ATOM 1190 CG ASP A 437 10.712 -0.699 10.930 1.00 1.02 C ATOM 1191 OD1 ASP A 437 10.688 0.504 10.599 1.00 1.34 O ATOM 1192 OD2 ASP A 437 10.959 -1.084 12.093 1.00 1.34 O ATOM 0 H ASP A 437 8.563 -0.174 9.505 1.00 0.65 H new ATOM 0 HA ASP A 437 10.988 -0.509 8.198 1.00 0.75 H new ATOM 0 HB2 ASP A 437 9.573 -2.347 10.176 1.00 0.92 H new ATOM 0 HB3 ASP A 437 11.280 -2.417 9.787 1.00 0.92 H new ATOM 1197 N ASP A 438 8.752 -2.793 7.419 1.00 0.68 N ATOM 1198 CA ASP A 438 8.439 -3.856 6.470 1.00 0.73 C ATOM 1199 C ASP A 438 8.069 -3.276 5.107 1.00 0.73 C ATOM 1200 O ASP A 438 7.115 -3.727 4.471 1.00 1.35 O ATOM 1201 CB ASP A 438 7.293 -4.721 6.997 1.00 0.88 C ATOM 1202 CG ASP A 438 7.615 -5.356 8.335 1.00 1.08 C ATOM 1203 OD1 ASP A 438 7.866 -4.607 9.303 1.00 1.56 O ATOM 1204 OD2 ASP A 438 7.614 -6.602 8.417 1.00 1.36 O ATOM 0 H ASP A 438 7.979 -2.535 8.032 1.00 0.68 H new ATOM 0 HA ASP A 438 9.327 -4.477 6.353 1.00 0.73 H new ATOM 0 HB2 ASP A 438 6.396 -4.110 7.095 1.00 0.88 H new ATOM 0 HB3 ASP A 438 7.069 -5.503 6.272 1.00 0.88 H new ATOM 1209 N LEU A 439 8.825 -2.274 4.666 1.00 0.54 N ATOM 1210 CA LEU A 439 8.573 -1.627 3.382 1.00 0.53 C ATOM 1211 C LEU A 439 9.862 -1.056 2.791 1.00 0.61 C ATOM 1212 O LEU A 439 10.511 -1.696 1.963 1.00 0.86 O ATOM 1213 CB LEU A 439 7.533 -0.509 3.543 1.00 0.52 C ATOM 1214 CG LEU A 439 6.124 -0.969 3.924 1.00 0.63 C ATOM 1215 CD1 LEU A 439 5.237 0.231 4.218 1.00 1.12 C ATOM 1216 CD2 LEU A 439 5.521 -1.815 2.814 1.00 1.10 C ATOM 0 H LEU A 439 9.619 -1.892 5.180 1.00 0.54 H new ATOM 0 HA LEU A 439 8.185 -2.381 2.697 1.00 0.53 H new ATOM 0 HB2 LEU A 439 7.887 0.186 4.304 1.00 0.52 H new ATOM 0 HB3 LEU A 439 7.474 0.046 2.607 1.00 0.52 H new ATOM 0 HG LEU A 439 6.192 -1.580 4.824 1.00 0.63 H new ATOM 0 HD11 LEU A 439 4.238 -0.112 4.487 1.00 1.12 H new ATOM 0 HD12 LEU A 439 5.660 0.802 5.045 1.00 1.12 H new ATOM 0 HD13 LEU A 439 5.177 0.864 3.333 1.00 1.12 H new ATOM 0 HD21 LEU A 439 4.519 -2.133 3.102 1.00 1.10 H new ATOM 0 HD22 LEU A 439 5.465 -1.227 1.898 1.00 1.10 H new ATOM 0 HD23 LEU A 439 6.146 -2.692 2.645 1.00 1.10 H new ATOM 1228 N GLY A 440 10.227 0.150 3.220 1.00 0.59 N ATOM 1229 CA GLY A 440 11.432 0.788 2.721 1.00 0.77 C ATOM 1230 C GLY A 440 11.837 1.982 3.563 1.00 0.96 C ATOM 1231 O GLY A 440 12.184 3.036 3.031 1.00 1.36 O ATOM 0 H GLY A 440 9.707 0.697 3.906 1.00 0.59 H new ATOM 0 HA2 GLY A 440 12.246 0.063 2.706 1.00 0.77 H new ATOM 0 HA3 GLY A 440 11.272 1.109 1.692 1.00 0.77 H new ATOM 1235 N GLY A 441 11.785 1.816 4.883 1.00 0.93 N ATOM 1236 CA GLY A 441 12.144 2.895 5.784 1.00 1.24 C ATOM 1237 C GLY A 441 11.237 4.098 5.630 1.00 1.14 C ATOM 1238 O GLY A 441 10.018 3.954 5.524 1.00 1.83 O ATOM 0 H GLY A 441 11.500 0.952 5.343 1.00 0.93 H new ATOM 0 HA2 GLY A 441 12.098 2.537 6.813 1.00 1.24 H new ATOM 0 HA3 GLY A 441 13.175 3.194 5.597 1.00 1.24 H new ATOM 1242 N ILE A 442 11.829 5.287 5.607 1.00 1.10 N ATOM 1243 CA ILE A 442 11.063 6.517 5.455 1.00 1.03 C ATOM 1244 C ILE A 442 11.606 7.349 4.299 1.00 1.05 C ATOM 1245 O ILE A 442 12.664 7.967 4.415 1.00 1.39 O ATOM 1246 CB ILE A 442 11.088 7.362 6.745 1.00 1.26 C ATOM 1247 CG1 ILE A 442 10.527 6.557 7.922 1.00 1.41 C ATOM 1248 CG2 ILE A 442 10.302 8.652 6.553 1.00 1.38 C ATOM 1249 CD1 ILE A 442 9.084 6.133 7.742 1.00 1.48 C ATOM 0 H ILE A 442 12.836 5.424 5.692 1.00 1.10 H new ATOM 0 HA ILE A 442 10.032 6.231 5.246 1.00 1.03 H new ATOM 0 HB ILE A 442 12.123 7.622 6.969 1.00 1.26 H new ATOM 0 HG12 ILE A 442 11.141 5.668 8.068 1.00 1.41 H new ATOM 0 HG13 ILE A 442 10.610 7.154 8.830 1.00 1.41 H new ATOM 0 HG21 ILE A 442 10.330 9.236 7.473 1.00 1.38 H new ATOM 0 HG22 ILE A 442 10.745 9.231 5.742 1.00 1.38 H new ATOM 0 HG23 ILE A 442 9.267 8.414 6.306 1.00 1.38 H new ATOM 0 HD11 ILE A 442 8.759 5.568 8.616 1.00 1.48 H new ATOM 0 HD12 ILE A 442 8.457 7.017 7.627 1.00 1.48 H new ATOM 0 HD13 ILE A 442 8.997 5.508 6.853 1.00 1.48 H new