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 396 GLN : amide:sc= -0.252 X(o=0.063,f=0.29) USER MOD Set 1.2: A 415 HIS : no HE2:sc= 0.316 K(o=0.063,f=-2.8!) USER MOD Set 2.1: A 378 ASN : amide:sc= -5.37! C(o=-5.7!,f=-1.5!) USER MOD Set 2.2: A 383 TYR OH : rot 180:sc= -0.37 USER MOD Single : A 376 SER OG : rot -30:sc= 0.0664 USER MOD Single : A 381 LYS NZ :NH3+ -165:sc= -0.0419 (180deg=-0.284) USER MOD Single : A 391 THR OG1 : rot -109:sc= -0.541 USER MOD Single : A 393 HIS : no HD1:sc= -0.683 X(o=-0.68,f=-0.4) 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 180:sc= 0 USER MOD Single : A 403 THR OG1 : rot 174:sc= -2.75! USER MOD Single : A 405 ASN : amide:sc= -0.0782 X(o=-0.078,f=0) USER MOD Single : A 412 TYR OH : rot -4:sc= 0.406 USER MOD Single : A 413 TYR OH : rot 180:sc= 0 USER MOD Single : A 416 TYR OH : rot 180:sc= -0.188 USER MOD Single : A 420 ASN : amide:sc= 0.0439 K(o=0.044,f=-2.5!) USER MOD Single : A 430 HIS : no HD1:sc= -2.05 K(o=-2.1,f=-3.6) USER MOD Single : A 433 SER OG : rot -12:sc= 0.555 USER MOD Single : A 435 ASN : amide:sc= -0.808 K(o=-0.81,f=-9.4!) USER MOD ----------------------------------------------------------------- ATOM 157 N ILE A 373 -7.133 -8.798 4.038 1.00 1.42 N ATOM 158 CA ILE A 373 -7.262 -7.667 4.960 1.00 1.22 C ATOM 159 C ILE A 373 -8.673 -7.076 5.001 1.00 1.13 C ATOM 160 O ILE A 373 -9.225 -6.670 3.979 1.00 1.20 O ATOM 161 CB ILE A 373 -6.270 -6.551 4.581 1.00 1.16 C ATOM 162 CG1 ILE A 373 -4.832 -7.034 4.773 1.00 1.40 C ATOM 163 CG2 ILE A 373 -6.533 -5.290 5.396 1.00 1.26 C ATOM 164 CD1 ILE A 373 -3.793 -6.018 4.357 1.00 1.48 C ATOM 0 HA ILE A 373 -7.040 -8.062 5.951 1.00 1.22 H new ATOM 0 HB ILE A 373 -6.414 -6.304 3.529 1.00 1.16 H new ATOM 0 HG12 ILE A 373 -4.680 -7.289 5.822 1.00 1.40 H new ATOM 0 HG13 ILE A 373 -4.685 -7.948 4.198 1.00 1.40 H new ATOM 0 HG21 ILE A 373 -5.820 -4.517 5.110 1.00 1.26 H new ATOM 0 HG22 ILE A 373 -7.547 -4.938 5.204 1.00 1.26 H new ATOM 0 HG23 ILE A 373 -6.421 -5.513 6.457 1.00 1.26 H new ATOM 0 HD11 ILE A 373 -2.797 -6.429 4.521 1.00 1.48 H new ATOM 0 HD12 ILE A 373 -3.919 -5.781 3.301 1.00 1.48 H new ATOM 0 HD13 ILE A 373 -3.914 -5.111 4.949 1.00 1.48 H new ATOM 176 N ASP A 374 -9.232 -6.984 6.203 1.00 1.16 N ATOM 177 CA ASP A 374 -10.553 -6.394 6.382 1.00 1.17 C ATOM 178 C ASP A 374 -10.408 -4.893 6.620 1.00 1.03 C ATOM 179 O ASP A 374 -9.606 -4.467 7.450 1.00 1.25 O ATOM 180 CB ASP A 374 -11.283 -7.051 7.555 1.00 1.40 C ATOM 181 CG ASP A 374 -11.520 -8.532 7.336 1.00 1.77 C ATOM 182 OD1 ASP A 374 -10.528 -9.277 7.189 1.00 2.17 O ATOM 183 OD2 ASP A 374 -12.698 -8.948 7.311 1.00 2.04 O ATOM 0 H ASP A 374 -8.793 -7.309 7.064 1.00 1.16 H new ATOM 0 HA ASP A 374 -11.143 -6.562 5.481 1.00 1.17 H new ATOM 0 HB2 ASP A 374 -10.701 -6.910 8.466 1.00 1.40 H new ATOM 0 HB3 ASP A 374 -12.240 -6.552 7.708 1.00 1.40 H new ATOM 188 N ILE A 375 -11.160 -4.093 5.873 1.00 0.84 N ATOM 189 CA ILE A 375 -11.078 -2.641 6.001 1.00 0.76 C ATOM 190 C ILE A 375 -11.955 -2.101 7.125 1.00 0.76 C ATOM 191 O ILE A 375 -11.551 -1.190 7.849 1.00 0.79 O ATOM 192 CB ILE A 375 -11.465 -1.933 4.696 1.00 0.77 C ATOM 193 CG1 ILE A 375 -10.534 -2.364 3.563 1.00 0.82 C ATOM 194 CG2 ILE A 375 -11.411 -0.429 4.902 1.00 0.84 C ATOM 195 CD1 ILE A 375 -10.941 -1.828 2.209 1.00 0.92 C ATOM 0 H ILE A 375 -11.829 -4.421 5.177 1.00 0.84 H new ATOM 0 HA ILE A 375 -10.035 -2.430 6.238 1.00 0.76 H new ATOM 0 HB ILE A 375 -12.481 -2.213 4.418 1.00 0.77 H new ATOM 0 HG12 ILE A 375 -9.522 -2.028 3.788 1.00 0.82 H new ATOM 0 HG13 ILE A 375 -10.507 -3.453 3.520 1.00 0.82 H new ATOM 0 HG21 ILE A 375 -11.686 0.075 3.976 1.00 0.84 H new ATOM 0 HG22 ILE A 375 -12.108 -0.144 5.690 1.00 0.84 H new ATOM 0 HG23 ILE A 375 -10.401 -0.137 5.188 1.00 0.84 H new ATOM 0 HD11 ILE A 375 -10.235 -2.174 1.454 1.00 0.92 H new ATOM 0 HD12 ILE A 375 -11.941 -2.185 1.962 1.00 0.92 H new ATOM 0 HD13 ILE A 375 -10.940 -0.738 2.234 1.00 0.92 H new ATOM 207 N SER A 376 -13.157 -2.648 7.255 1.00 0.79 N ATOM 208 CA SER A 376 -14.097 -2.206 8.284 1.00 0.87 C ATOM 209 C SER A 376 -13.430 -2.150 9.653 1.00 0.96 C ATOM 210 O SER A 376 -13.931 -1.509 10.577 1.00 1.54 O ATOM 211 CB SER A 376 -15.307 -3.136 8.329 1.00 0.95 C ATOM 212 OG SER A 376 -16.238 -2.716 9.311 1.00 1.71 O ATOM 0 H SER A 376 -13.507 -3.400 6.661 1.00 0.79 H new ATOM 0 HA SER A 376 -14.428 -1.200 8.026 1.00 0.87 H new ATOM 0 HB2 SER A 376 -15.789 -3.157 7.352 1.00 0.95 H new ATOM 0 HB3 SER A 376 -14.980 -4.153 8.545 1.00 0.95 H new ATOM 0 HG SER A 376 -15.764 -2.262 10.039 1.00 1.71 H new ATOM 218 N GLU A 377 -12.300 -2.827 9.764 1.00 0.93 N ATOM 219 CA GLU A 377 -11.539 -2.877 11.002 1.00 1.03 C ATOM 220 C GLU A 377 -11.174 -1.478 11.491 1.00 0.87 C ATOM 221 O GLU A 377 -11.273 -1.181 12.682 1.00 0.93 O ATOM 222 CB GLU A 377 -10.262 -3.688 10.790 1.00 1.18 C ATOM 223 CG GLU A 377 -10.509 -5.072 10.213 1.00 1.28 C ATOM 224 CD GLU A 377 -11.126 -6.028 11.217 1.00 1.54 C ATOM 225 OE1 GLU A 377 -11.359 -5.608 12.370 1.00 1.90 O ATOM 226 OE2 GLU A 377 -11.380 -7.195 10.850 1.00 1.92 O ATOM 0 H GLU A 377 -11.884 -3.358 8.999 1.00 0.93 H new ATOM 0 HA GLU A 377 -12.163 -3.352 11.759 1.00 1.03 H new ATOM 0 HB2 GLU A 377 -9.599 -3.138 10.122 1.00 1.18 H new ATOM 0 HB3 GLU A 377 -9.743 -3.788 11.743 1.00 1.18 H new ATOM 0 HG2 GLU A 377 -11.166 -4.987 9.348 1.00 1.28 H new ATOM 0 HG3 GLU A 377 -9.565 -5.486 9.857 1.00 1.28 H new ATOM 233 N ASN A 378 -10.736 -0.630 10.565 1.00 0.71 N ATOM 234 CA ASN A 378 -10.333 0.734 10.899 1.00 0.61 C ATOM 235 C ASN A 378 -10.081 1.564 9.642 1.00 0.58 C ATOM 236 O ASN A 378 -8.941 1.924 9.347 1.00 0.59 O ATOM 237 CB ASN A 378 -9.076 0.711 11.775 1.00 0.62 C ATOM 238 CG ASN A 378 -8.006 -0.230 11.250 1.00 1.15 C ATOM 239 OD1 ASN A 378 -7.061 -0.564 11.963 1.00 1.16 O ATOM 240 ND2 ASN A 378 -8.138 -0.654 9.998 1.00 2.14 N ATOM 0 H ASN A 378 -10.651 -0.863 9.576 1.00 0.71 H new ATOM 0 HA ASN A 378 -11.149 1.200 11.451 1.00 0.61 H new ATOM 0 HB2 ASN A 378 -8.666 1.719 11.840 1.00 0.62 H new ATOM 0 HB3 ASN A 378 -9.350 0.413 12.787 1.00 0.62 H new ATOM 0 HD21 ASN A 378 -7.441 -1.280 9.595 1.00 2.14 H new ATOM 0 HD22 ASN A 378 -8.937 -0.354 9.439 1.00 2.14 H new ATOM 247 N PRO A 379 -11.144 1.884 8.882 1.00 0.62 N ATOM 248 CA PRO A 379 -11.023 2.680 7.656 1.00 0.65 C ATOM 249 C PRO A 379 -10.239 3.969 7.885 1.00 0.61 C ATOM 250 O PRO A 379 -9.429 4.372 7.049 1.00 0.62 O ATOM 251 CB PRO A 379 -12.474 2.995 7.294 1.00 0.77 C ATOM 252 CG PRO A 379 -13.264 1.884 7.894 1.00 0.85 C ATOM 253 CD PRO A 379 -12.543 1.500 9.156 1.00 0.75 C ATOM 0 HA PRO A 379 -10.481 2.149 6.873 1.00 0.65 H new ATOM 0 HB2 PRO A 379 -12.781 3.961 7.695 1.00 0.77 H new ATOM 0 HB3 PRO A 379 -12.612 3.040 6.214 1.00 0.77 H new ATOM 0 HG2 PRO A 379 -14.284 2.202 8.108 1.00 0.85 H new ATOM 0 HG3 PRO A 379 -13.331 1.038 7.210 1.00 0.85 H new ATOM 0 HD2 PRO A 379 -12.942 2.027 10.023 1.00 0.75 H new ATOM 0 HD3 PRO A 379 -12.634 0.433 9.362 1.00 0.75 H new ATOM 261 N ASP A 380 -10.483 4.607 9.027 1.00 0.62 N ATOM 262 CA ASP A 380 -9.799 5.848 9.376 1.00 0.64 C ATOM 263 C ASP A 380 -8.290 5.632 9.458 1.00 0.55 C ATOM 264 O ASP A 380 -7.508 6.507 9.085 1.00 0.55 O ATOM 265 CB ASP A 380 -10.326 6.388 10.709 1.00 0.75 C ATOM 266 CG ASP A 380 -11.810 6.702 10.664 1.00 0.86 C ATOM 267 OD1 ASP A 380 -12.426 6.502 9.595 1.00 1.21 O ATOM 268 OD2 ASP A 380 -12.357 7.146 11.695 1.00 1.20 O ATOM 0 H ASP A 380 -11.151 4.284 9.727 1.00 0.62 H new ATOM 0 HA ASP A 380 -10.000 6.579 8.593 1.00 0.64 H new ATOM 0 HB2 ASP A 380 -10.137 5.656 11.494 1.00 0.75 H new ATOM 0 HB3 ASP A 380 -9.775 7.290 10.975 1.00 0.75 H new ATOM 273 N LYS A 381 -7.890 4.461 9.950 1.00 0.51 N ATOM 274 CA LYS A 381 -6.476 4.125 10.083 1.00 0.47 C ATOM 275 C LYS A 381 -5.726 4.338 8.770 1.00 0.39 C ATOM 276 O LYS A 381 -6.177 3.910 7.708 1.00 0.37 O ATOM 277 CB LYS A 381 -6.312 2.678 10.540 1.00 0.50 C ATOM 278 CG LYS A 381 -4.869 2.221 10.539 1.00 0.52 C ATOM 279 CD LYS A 381 -4.714 0.836 11.127 1.00 0.59 C ATOM 280 CE LYS A 381 -3.274 0.371 11.049 1.00 0.67 C ATOM 281 NZ LYS A 381 -2.803 0.243 9.642 1.00 1.66 N ATOM 0 H LYS A 381 -8.527 3.729 10.263 1.00 0.51 H new ATOM 0 HA LYS A 381 -6.050 4.791 10.833 1.00 0.47 H new ATOM 0 HB2 LYS A 381 -6.721 2.571 11.545 1.00 0.50 H new ATOM 0 HB3 LYS A 381 -6.894 2.028 9.887 1.00 0.50 H new ATOM 0 HG2 LYS A 381 -4.488 2.226 9.518 1.00 0.52 H new ATOM 0 HG3 LYS A 381 -4.265 2.927 11.109 1.00 0.52 H new ATOM 0 HD2 LYS A 381 -5.043 0.839 12.166 1.00 0.59 H new ATOM 0 HD3 LYS A 381 -5.355 0.136 10.592 1.00 0.59 H new ATOM 0 HE2 LYS A 381 -2.636 1.076 11.582 1.00 0.67 H new ATOM 0 HE3 LYS A 381 -3.176 -0.591 11.553 1.00 0.67 H new ATOM 0 HZ1 LYS A 381 -1.922 -0.309 9.620 1.00 1.66 H new ATOM 0 HZ2 LYS A 381 -3.529 -0.241 9.076 1.00 1.66 H new ATOM 0 HZ3 LYS A 381 -2.629 1.189 9.247 1.00 1.66 H new ATOM 295 N ILE A 382 -4.576 5.001 8.856 1.00 0.40 N ATOM 296 CA ILE A 382 -3.754 5.274 7.682 1.00 0.35 C ATOM 297 C ILE A 382 -2.812 4.109 7.390 1.00 0.34 C ATOM 298 O ILE A 382 -2.123 3.622 8.286 1.00 0.41 O ATOM 299 CB ILE A 382 -2.913 6.554 7.875 1.00 0.37 C ATOM 300 CG1 ILE A 382 -3.810 7.733 8.266 1.00 0.38 C ATOM 301 CG2 ILE A 382 -2.130 6.872 6.610 1.00 0.41 C ATOM 302 CD1 ILE A 382 -4.870 8.066 7.238 1.00 0.37 C ATOM 0 H ILE A 382 -4.192 5.360 9.730 1.00 0.40 H new ATOM 0 HA ILE A 382 -4.435 5.412 6.842 1.00 0.35 H new ATOM 0 HB ILE A 382 -2.203 6.382 8.684 1.00 0.37 H new ATOM 0 HG12 ILE A 382 -4.297 7.507 9.215 1.00 0.38 H new ATOM 0 HG13 ILE A 382 -3.187 8.612 8.429 1.00 0.38 H new ATOM 0 HG21 ILE A 382 -1.543 7.777 6.764 1.00 0.41 H new ATOM 0 HG22 ILE A 382 -1.463 6.042 6.377 1.00 0.41 H new ATOM 0 HG23 ILE A 382 -2.822 7.025 5.782 1.00 0.41 H new ATOM 0 HD11 ILE A 382 -5.463 8.911 7.588 1.00 0.37 H new ATOM 0 HD12 ILE A 382 -4.392 8.325 6.293 1.00 0.37 H new ATOM 0 HD13 ILE A 382 -5.519 7.203 7.092 1.00 0.37 H new ATOM 314 N TYR A 383 -2.776 3.674 6.133 1.00 0.30 N ATOM 315 CA TYR A 383 -1.901 2.574 5.738 1.00 0.30 C ATOM 316 C TYR A 383 -0.704 3.097 4.953 1.00 0.28 C ATOM 317 O TYR A 383 -0.829 4.034 4.169 1.00 0.25 O ATOM 318 CB TYR A 383 -2.664 1.542 4.901 1.00 0.32 C ATOM 319 CG TYR A 383 -3.795 0.869 5.643 1.00 0.36 C ATOM 320 CD1 TYR A 383 -4.904 1.592 6.064 1.00 0.40 C ATOM 321 CD2 TYR A 383 -3.751 -0.490 5.925 1.00 0.48 C ATOM 322 CE1 TYR A 383 -5.938 0.977 6.744 1.00 0.48 C ATOM 323 CE2 TYR A 383 -4.781 -1.111 6.604 1.00 0.55 C ATOM 324 CZ TYR A 383 -5.871 -0.374 7.011 1.00 0.52 C ATOM 325 OH TYR A 383 -6.900 -0.989 7.685 1.00 0.63 O ATOM 0 H TYR A 383 -3.338 4.063 5.376 1.00 0.30 H new ATOM 0 HA TYR A 383 -1.543 2.088 6.646 1.00 0.30 H new ATOM 0 HB2 TYR A 383 -3.065 2.033 4.014 1.00 0.32 H new ATOM 0 HB3 TYR A 383 -1.965 0.780 4.555 1.00 0.32 H new ATOM 0 HD1 TYR A 383 -4.959 2.651 5.857 1.00 0.40 H new ATOM 0 HD2 TYR A 383 -2.897 -1.071 5.608 1.00 0.48 H new ATOM 0 HE1 TYR A 383 -6.794 1.552 7.065 1.00 0.48 H new ATOM 0 HE2 TYR A 383 -4.732 -2.169 6.815 1.00 0.55 H new ATOM 0 HH TYR A 383 -6.698 -1.942 7.792 1.00 0.63 H new ATOM 335 N PHE A 384 0.453 2.482 5.164 1.00 0.31 N ATOM 336 CA PHE A 384 1.672 2.886 4.470 1.00 0.30 C ATOM 337 C PHE A 384 1.855 2.070 3.194 1.00 0.28 C ATOM 338 O PHE A 384 1.585 0.869 3.176 1.00 0.33 O ATOM 339 CB PHE A 384 2.894 2.721 5.379 1.00 0.40 C ATOM 340 CG PHE A 384 2.866 3.583 6.614 1.00 0.48 C ATOM 341 CD1 PHE A 384 1.816 3.503 7.516 1.00 0.83 C ATOM 342 CD2 PHE A 384 3.902 4.465 6.878 1.00 0.57 C ATOM 343 CE1 PHE A 384 1.797 4.287 8.654 1.00 0.96 C ATOM 344 CE2 PHE A 384 3.891 5.251 8.015 1.00 0.64 C ATOM 345 CZ PHE A 384 2.836 5.163 8.903 1.00 0.74 C ATOM 0 H PHE A 384 0.574 1.702 5.810 1.00 0.31 H new ATOM 0 HA PHE A 384 1.577 3.939 4.204 1.00 0.30 H new ATOM 0 HB2 PHE A 384 2.970 1.676 5.680 1.00 0.40 H new ATOM 0 HB3 PHE A 384 3.792 2.954 4.807 1.00 0.40 H new ATOM 0 HD1 PHE A 384 1.002 2.819 7.327 1.00 0.83 H new ATOM 0 HD2 PHE A 384 4.728 4.539 6.187 1.00 0.57 H new ATOM 0 HE1 PHE A 384 0.972 4.215 9.347 1.00 0.96 H new ATOM 0 HE2 PHE A 384 4.706 5.933 8.209 1.00 0.64 H new ATOM 0 HZ PHE A 384 2.824 5.778 9.791 1.00 0.74 H new ATOM 355 N ILE A 385 2.309 2.724 2.128 1.00 0.26 N ATOM 356 CA ILE A 385 2.515 2.041 0.855 1.00 0.27 C ATOM 357 C ILE A 385 3.876 2.392 0.259 1.00 0.24 C ATOM 358 O ILE A 385 4.220 3.567 0.123 1.00 0.30 O ATOM 359 CB ILE A 385 1.427 2.401 -0.183 1.00 0.33 C ATOM 360 CG1 ILE A 385 0.039 2.496 0.464 1.00 0.32 C ATOM 361 CG2 ILE A 385 1.415 1.369 -1.304 1.00 0.49 C ATOM 362 CD1 ILE A 385 -0.180 3.761 1.262 1.00 0.32 C ATOM 0 H ILE A 385 2.539 3.718 2.120 1.00 0.26 H new ATOM 0 HA ILE A 385 2.462 0.974 1.072 1.00 0.27 H new ATOM 0 HB ILE A 385 1.668 3.381 -0.596 1.00 0.33 H new ATOM 0 HG12 ILE A 385 -0.720 2.434 -0.316 1.00 0.32 H new ATOM 0 HG13 ILE A 385 -0.106 1.636 1.118 1.00 0.32 H new ATOM 0 HG21 ILE A 385 0.646 1.630 -2.031 1.00 0.49 H new ATOM 0 HG22 ILE A 385 2.388 1.354 -1.795 1.00 0.49 H new ATOM 0 HG23 ILE A 385 1.203 0.384 -0.889 1.00 0.49 H new ATOM 0 HD11 ILE A 385 -1.184 3.754 1.687 1.00 0.32 H new ATOM 0 HD12 ILE A 385 0.554 3.816 2.066 1.00 0.32 H new ATOM 0 HD13 ILE A 385 -0.069 4.627 0.609 1.00 0.32 H new ATOM 374 N ARG A 386 4.644 1.367 -0.098 1.00 0.29 N ATOM 375 CA ARG A 386 5.964 1.568 -0.686 1.00 0.30 C ATOM 376 C ARG A 386 5.861 1.758 -2.197 1.00 0.33 C ATOM 377 O ARG A 386 5.360 0.886 -2.909 1.00 0.42 O ATOM 378 CB ARG A 386 6.869 0.374 -0.369 1.00 0.38 C ATOM 379 CG ARG A 386 8.283 0.511 -0.916 1.00 0.50 C ATOM 380 CD ARG A 386 9.122 -0.720 -0.606 1.00 1.02 C ATOM 381 NE ARG A 386 10.450 -0.654 -1.216 1.00 1.40 N ATOM 382 CZ ARG A 386 11.350 0.290 -0.945 1.00 1.86 C ATOM 383 NH1 ARG A 386 11.070 1.256 -0.080 1.00 2.42 N ATOM 384 NH2 ARG A 386 12.533 0.267 -1.544 1.00 2.39 N ATOM 0 H ARG A 386 4.375 0.389 0.010 1.00 0.29 H new ATOM 0 HA ARG A 386 6.398 2.470 -0.254 1.00 0.30 H new ATOM 0 HB2 ARG A 386 6.919 0.245 0.712 1.00 0.38 H new ATOM 0 HB3 ARG A 386 6.418 -0.530 -0.777 1.00 0.38 H new ATOM 0 HG2 ARG A 386 8.244 0.664 -1.995 1.00 0.50 H new ATOM 0 HG3 ARG A 386 8.757 1.393 -0.486 1.00 0.50 H new ATOM 0 HD2 ARG A 386 9.225 -0.824 0.474 1.00 1.02 H new ATOM 0 HD3 ARG A 386 8.604 -1.610 -0.964 1.00 1.02 H new ATOM 0 HE ARG A 386 10.703 -1.376 -1.891 1.00 1.40 H new ATOM 0 HH11 ARG A 386 10.161 1.279 0.382 1.00 2.42 H new ATOM 0 HH12 ARG A 386 11.764 1.976 0.123 1.00 2.42 H new ATOM 0 HH21 ARG A 386 12.753 -0.473 -2.211 1.00 2.39 H new ATOM 0 HH22 ARG A 386 13.223 0.989 -1.338 1.00 2.39 H new ATOM 398 N ARG A 387 6.347 2.895 -2.682 1.00 0.41 N ATOM 399 CA ARG A 387 6.319 3.193 -4.110 1.00 0.51 C ATOM 400 C ARG A 387 7.347 2.349 -4.856 1.00 0.49 C ATOM 401 O ARG A 387 8.294 1.839 -4.257 1.00 0.47 O ATOM 402 CB ARG A 387 6.579 4.680 -4.353 1.00 0.63 C ATOM 403 CG ARG A 387 5.486 5.585 -3.806 1.00 0.84 C ATOM 404 CD ARG A 387 5.778 7.049 -4.102 1.00 0.94 C ATOM 405 NE ARG A 387 5.908 7.306 -5.535 1.00 1.32 N ATOM 406 CZ ARG A 387 4.894 7.249 -6.395 1.00 1.79 C ATOM 407 NH1 ARG A 387 3.662 7.004 -5.964 1.00 2.30 N ATOM 408 NH2 ARG A 387 5.108 7.456 -7.688 1.00 2.25 N ATOM 0 H ARG A 387 6.766 3.626 -2.107 1.00 0.41 H new ATOM 0 HA ARG A 387 5.328 2.946 -4.490 1.00 0.51 H new ATOM 0 HB2 ARG A 387 7.529 4.954 -3.895 1.00 0.63 H new ATOM 0 HB3 ARG A 387 6.680 4.853 -5.425 1.00 0.63 H new ATOM 0 HG2 ARG A 387 4.528 5.307 -4.245 1.00 0.84 H new ATOM 0 HG3 ARG A 387 5.397 5.441 -2.729 1.00 0.84 H new ATOM 0 HD2 ARG A 387 4.978 7.667 -3.695 1.00 0.94 H new ATOM 0 HD3 ARG A 387 6.698 7.344 -3.597 1.00 0.94 H new ATOM 0 HE ARG A 387 6.831 7.543 -5.898 1.00 1.32 H new ATOM 0 HH11 ARG A 387 3.489 6.858 -4.969 1.00 2.30 H new ATOM 0 HH12 ARG A 387 2.889 6.961 -6.628 1.00 2.30 H new ATOM 0 HH21 ARG A 387 6.050 7.659 -8.023 1.00 2.25 H new ATOM 0 HH22 ARG A 387 4.331 7.412 -8.347 1.00 2.25 H new ATOM 422 N GLU A 388 7.151 2.192 -6.163 1.00 0.64 N ATOM 423 CA GLU A 388 8.060 1.396 -6.982 1.00 0.69 C ATOM 424 C GLU A 388 9.497 1.881 -6.846 1.00 0.61 C ATOM 425 O GLU A 388 10.413 1.077 -6.666 1.00 0.63 O ATOM 426 CB GLU A 388 7.632 1.433 -8.449 1.00 0.88 C ATOM 427 CG GLU A 388 6.230 0.897 -8.690 1.00 1.58 C ATOM 428 CD GLU A 388 5.833 0.938 -10.153 1.00 2.20 C ATOM 429 OE1 GLU A 388 6.521 0.295 -10.972 1.00 2.82 O ATOM 430 OE2 GLU A 388 4.834 1.613 -10.478 1.00 2.65 O ATOM 0 H GLU A 388 6.372 2.605 -6.676 1.00 0.64 H new ATOM 0 HA GLU A 388 8.013 0.368 -6.624 1.00 0.69 H new ATOM 0 HB2 GLU A 388 7.685 2.461 -8.808 1.00 0.88 H new ATOM 0 HB3 GLU A 388 8.340 0.852 -9.040 1.00 0.88 H new ATOM 0 HG2 GLU A 388 6.171 -0.130 -8.330 1.00 1.58 H new ATOM 0 HG3 GLU A 388 5.517 1.480 -8.107 1.00 1.58 H new ATOM 437 N ASP A 389 9.694 3.195 -6.911 1.00 0.65 N ATOM 438 CA ASP A 389 11.030 3.760 -6.771 1.00 0.69 C ATOM 439 C ASP A 389 11.616 3.338 -5.430 1.00 0.64 C ATOM 440 O ASP A 389 12.829 3.188 -5.283 1.00 0.91 O ATOM 441 CB ASP A 389 10.998 5.284 -6.894 1.00 0.81 C ATOM 442 CG ASP A 389 10.101 5.936 -5.864 1.00 0.80 C ATOM 443 OD1 ASP A 389 8.890 5.637 -5.857 1.00 1.06 O ATOM 444 OD2 ASP A 389 10.609 6.751 -5.067 1.00 1.23 O ATOM 0 H ASP A 389 8.954 3.881 -7.058 1.00 0.65 H new ATOM 0 HA ASP A 389 11.661 3.381 -7.575 1.00 0.69 H new ATOM 0 HB2 ASP A 389 12.010 5.674 -6.787 1.00 0.81 H new ATOM 0 HB3 ASP A 389 10.655 5.556 -7.892 1.00 0.81 H new ATOM 449 N GLY A 390 10.728 3.124 -4.464 1.00 0.55 N ATOM 450 CA GLY A 390 11.140 2.690 -3.145 1.00 0.53 C ATOM 451 C GLY A 390 10.941 3.749 -2.076 1.00 0.55 C ATOM 452 O GLY A 390 11.756 3.874 -1.162 1.00 1.03 O ATOM 0 H GLY A 390 9.721 3.245 -4.575 1.00 0.55 H new ATOM 0 HA2 GLY A 390 10.578 1.797 -2.872 1.00 0.53 H new ATOM 0 HA3 GLY A 390 12.192 2.407 -3.175 1.00 0.53 H new ATOM 456 N THR A 391 9.853 4.507 -2.183 1.00 0.57 N ATOM 457 CA THR A 391 9.555 5.551 -1.207 1.00 0.54 C ATOM 458 C THR A 391 8.205 5.322 -0.536 1.00 0.41 C ATOM 459 O THR A 391 7.157 5.452 -1.166 1.00 0.44 O ATOM 460 CB THR A 391 9.570 6.949 -1.845 1.00 0.71 C ATOM 461 OG1 THR A 391 8.742 6.968 -3.014 1.00 0.98 O ATOM 462 CG2 THR A 391 10.988 7.358 -2.206 1.00 0.88 C ATOM 0 H THR A 391 9.166 4.419 -2.932 1.00 0.57 H new ATOM 0 HA THR A 391 10.341 5.499 -0.454 1.00 0.54 H new ATOM 0 HB THR A 391 9.177 7.662 -1.120 1.00 0.71 H new ATOM 0 HG1 THR A 391 9.306 7.026 -3.813 1.00 0.98 H new ATOM 0 HG21 THR A 391 10.977 8.351 -2.656 1.00 0.88 H new ATOM 0 HG22 THR A 391 11.602 7.375 -1.306 1.00 0.88 H new ATOM 0 HG23 THR A 391 11.404 6.642 -2.915 1.00 0.88 H new ATOM 470 N VAL A 392 8.242 4.990 0.751 1.00 0.37 N ATOM 471 CA VAL A 392 7.024 4.750 1.516 1.00 0.33 C ATOM 472 C VAL A 392 6.269 6.053 1.766 1.00 0.32 C ATOM 473 O VAL A 392 6.872 7.079 2.084 1.00 0.41 O ATOM 474 CB VAL A 392 7.336 4.076 2.866 1.00 0.45 C ATOM 475 CG1 VAL A 392 6.055 3.809 3.644 1.00 0.55 C ATOM 476 CG2 VAL A 392 8.116 2.788 2.649 1.00 0.52 C ATOM 0 H VAL A 392 9.104 4.881 1.286 1.00 0.37 H new ATOM 0 HA VAL A 392 6.399 4.082 0.923 1.00 0.33 H new ATOM 0 HB VAL A 392 7.953 4.755 3.455 1.00 0.45 H new ATOM 0 HG11 VAL A 392 6.299 3.333 4.594 1.00 0.55 H new ATOM 0 HG12 VAL A 392 5.540 4.751 3.832 1.00 0.55 H new ATOM 0 HG13 VAL A 392 5.407 3.151 3.064 1.00 0.55 H new ATOM 0 HG21 VAL A 392 8.328 2.324 3.612 1.00 0.52 H new ATOM 0 HG22 VAL A 392 7.526 2.104 2.039 1.00 0.52 H new ATOM 0 HG23 VAL A 392 9.053 3.012 2.140 1.00 0.52 H new ATOM 486 N HIS A 393 4.948 6.002 1.623 1.00 0.29 N ATOM 487 CA HIS A 393 4.102 7.173 1.834 1.00 0.31 C ATOM 488 C HIS A 393 2.716 6.764 2.319 1.00 0.27 C ATOM 489 O HIS A 393 2.147 5.780 1.849 1.00 0.26 O ATOM 490 CB HIS A 393 3.978 7.993 0.547 1.00 0.37 C ATOM 491 CG HIS A 393 5.235 8.713 0.165 1.00 0.92 C ATOM 492 ND1 HIS A 393 5.831 9.660 0.969 1.00 1.92 N ATOM 493 CD2 HIS A 393 6.007 8.624 -0.944 1.00 0.94 C ATOM 494 CE1 HIS A 393 6.913 10.125 0.371 1.00 2.43 C ATOM 495 NE2 HIS A 393 7.042 9.512 -0.791 1.00 1.82 N ATOM 0 H HIS A 393 4.438 5.158 1.361 1.00 0.29 H new ATOM 0 HA HIS A 393 4.574 7.788 2.600 1.00 0.31 H new ATOM 0 HB2 HIS A 393 3.688 7.330 -0.268 1.00 0.37 H new ATOM 0 HB3 HIS A 393 3.176 8.721 0.667 1.00 0.37 H new ATOM 0 HD2 HIS A 393 5.839 7.975 -1.791 1.00 0.94 H new ATOM 0 HE1 HIS A 393 7.579 10.878 0.765 1.00 2.43 H new ATOM 0 HE2 HIS A 393 7.790 9.672 -1.466 1.00 1.82 H new ATOM 504 N ARG A 394 2.185 7.530 3.268 1.00 0.29 N ATOM 505 CA ARG A 394 0.869 7.257 3.831 1.00 0.28 C ATOM 506 C ARG A 394 -0.204 7.216 2.748 1.00 0.26 C ATOM 507 O ARG A 394 -0.119 7.924 1.743 1.00 0.32 O ATOM 508 CB ARG A 394 0.512 8.308 4.882 1.00 0.35 C ATOM 509 CG ARG A 394 1.397 8.253 6.116 1.00 0.42 C ATOM 510 CD ARG A 394 0.988 9.295 7.143 1.00 0.52 C ATOM 511 NE ARG A 394 1.174 10.657 6.648 1.00 1.34 N ATOM 512 CZ ARG A 394 0.919 11.744 7.370 1.00 2.01 C ATOM 513 NH1 ARG A 394 0.467 11.630 8.612 1.00 2.41 N ATOM 514 NH2 ARG A 394 1.120 12.947 6.850 1.00 2.96 N ATOM 0 H ARG A 394 2.649 8.348 3.664 1.00 0.29 H new ATOM 0 HA ARG A 394 0.908 6.276 4.304 1.00 0.28 H new ATOM 0 HB2 ARG A 394 0.587 9.299 4.434 1.00 0.35 H new ATOM 0 HB3 ARG A 394 -0.527 8.172 5.183 1.00 0.35 H new ATOM 0 HG2 ARG A 394 1.340 7.260 6.562 1.00 0.42 H new ATOM 0 HG3 ARG A 394 2.436 8.414 5.827 1.00 0.42 H new ATOM 0 HD2 ARG A 394 -0.058 9.147 7.412 1.00 0.52 H new ATOM 0 HD3 ARG A 394 1.574 9.157 8.052 1.00 0.52 H new ATOM 0 HE ARG A 394 1.519 10.781 5.696 1.00 1.34 H new ATOM 0 HH11 ARG A 394 0.314 10.706 9.016 1.00 2.41 H new ATOM 0 HH12 ARG A 394 0.273 12.466 9.163 1.00 2.41 H new ATOM 0 HH21 ARG A 394 1.470 13.038 5.896 1.00 2.96 H new ATOM 0 HH22 ARG A 394 0.924 13.781 7.404 1.00 2.96 H new ATOM 528 N GLY A 395 -1.213 6.378 2.964 1.00 0.23 N ATOM 529 CA GLY A 395 -2.295 6.245 2.009 1.00 0.25 C ATOM 530 C GLY A 395 -3.497 5.533 2.599 1.00 0.23 C ATOM 531 O GLY A 395 -3.367 4.451 3.172 1.00 0.26 O ATOM 0 H GLY A 395 -1.299 5.785 3.790 1.00 0.23 H new ATOM 0 HA2 GLY A 395 -2.595 7.234 1.663 1.00 0.25 H new ATOM 0 HA3 GLY A 395 -1.942 5.695 1.137 1.00 0.25 H new ATOM 535 N GLN A 396 -4.671 6.144 2.464 1.00 0.29 N ATOM 536 CA GLN A 396 -5.900 5.561 2.992 1.00 0.34 C ATOM 537 C GLN A 396 -6.493 4.539 2.028 1.00 0.35 C ATOM 538 O GLN A 396 -7.010 4.899 0.971 1.00 0.46 O ATOM 539 CB GLN A 396 -6.929 6.659 3.272 1.00 0.43 C ATOM 540 CG GLN A 396 -6.456 7.699 4.272 1.00 0.50 C ATOM 541 CD GLN A 396 -7.492 8.770 4.538 1.00 0.64 C ATOM 542 OE1 GLN A 396 -8.036 9.374 3.613 1.00 1.28 O ATOM 543 NE2 GLN A 396 -7.752 9.021 5.811 1.00 0.61 N ATOM 0 H GLN A 396 -4.797 7.041 1.994 1.00 0.29 H new ATOM 0 HA GLN A 396 -5.649 5.049 3.921 1.00 0.34 H new ATOM 0 HB2 GLN A 396 -7.180 7.157 2.335 1.00 0.43 H new ATOM 0 HB3 GLN A 396 -7.845 6.200 3.645 1.00 0.43 H new ATOM 0 HG2 GLN A 396 -6.201 7.205 5.210 1.00 0.50 H new ATOM 0 HG3 GLN A 396 -5.544 8.166 3.900 1.00 0.50 H new ATOM 0 HE21 GLN A 396 -7.275 8.494 6.542 1.00 0.61 H new ATOM 0 HE22 GLN A 396 -8.429 9.742 6.061 1.00 0.61 H new ATOM 552 N VAL A 397 -6.436 3.267 2.410 1.00 0.33 N ATOM 553 CA VAL A 397 -6.992 2.200 1.588 1.00 0.33 C ATOM 554 C VAL A 397 -8.511 2.142 1.764 1.00 0.33 C ATOM 555 O VAL A 397 -9.016 2.246 2.883 1.00 0.37 O ATOM 556 CB VAL A 397 -6.332 0.838 1.922 1.00 0.38 C ATOM 557 CG1 VAL A 397 -7.338 -0.182 2.430 1.00 0.73 C ATOM 558 CG2 VAL A 397 -5.598 0.296 0.709 1.00 0.83 C ATOM 0 H VAL A 397 -6.011 2.951 3.282 1.00 0.33 H new ATOM 0 HA VAL A 397 -6.775 2.416 0.542 1.00 0.33 H new ATOM 0 HB VAL A 397 -5.618 1.015 2.726 1.00 0.38 H new ATOM 0 HG11 VAL A 397 -6.827 -1.119 2.650 1.00 0.73 H new ATOM 0 HG12 VAL A 397 -7.812 0.194 3.337 1.00 0.73 H new ATOM 0 HG13 VAL A 397 -8.098 -0.354 1.668 1.00 0.73 H new ATOM 0 HG21 VAL A 397 -5.140 -0.661 0.959 1.00 0.83 H new ATOM 0 HG22 VAL A 397 -6.303 0.158 -0.111 1.00 0.83 H new ATOM 0 HG23 VAL A 397 -4.824 1.001 0.407 1.00 0.83 H new ATOM 568 N LEU A 398 -9.240 2.015 0.656 1.00 0.36 N ATOM 569 CA LEU A 398 -10.701 1.988 0.709 1.00 0.40 C ATOM 570 C LEU A 398 -11.290 0.695 0.146 1.00 0.41 C ATOM 571 O LEU A 398 -12.350 0.252 0.590 1.00 0.47 O ATOM 572 CB LEU A 398 -11.276 3.189 -0.046 1.00 0.46 C ATOM 573 CG LEU A 398 -10.864 4.559 0.499 1.00 0.49 C ATOM 574 CD1 LEU A 398 -11.440 5.670 -0.364 1.00 1.16 C ATOM 575 CD2 LEU A 398 -11.317 4.719 1.944 1.00 1.45 C ATOM 0 H LEU A 398 -8.847 1.930 -0.282 1.00 0.36 H new ATOM 0 HA LEU A 398 -10.980 2.038 1.761 1.00 0.40 H new ATOM 0 HB2 LEU A 398 -10.968 3.123 -1.090 1.00 0.46 H new ATOM 0 HB3 LEU A 398 -12.364 3.121 -0.030 1.00 0.46 H new ATOM 0 HG LEU A 398 -9.776 4.627 0.470 1.00 0.49 H new ATOM 0 HD11 LEU A 398 -11.137 6.637 0.038 1.00 1.16 H new ATOM 0 HD12 LEU A 398 -11.068 5.568 -1.384 1.00 1.16 H new ATOM 0 HD13 LEU A 398 -12.528 5.602 -0.366 1.00 1.16 H new ATOM 0 HD21 LEU A 398 -11.015 5.699 2.314 1.00 1.45 H new ATOM 0 HD22 LEU A 398 -12.402 4.630 1.997 1.00 1.45 H new ATOM 0 HD23 LEU A 398 -10.859 3.943 2.557 1.00 1.45 H new ATOM 587 N GLN A 399 -10.625 0.101 -0.842 1.00 0.39 N ATOM 588 CA GLN A 399 -11.131 -1.126 -1.457 1.00 0.43 C ATOM 589 C GLN A 399 -10.010 -2.117 -1.758 1.00 0.38 C ATOM 590 O GLN A 399 -8.831 -1.820 -1.566 1.00 0.35 O ATOM 591 CB GLN A 399 -11.887 -0.797 -2.746 1.00 0.49 C ATOM 592 CG GLN A 399 -13.103 0.088 -2.530 1.00 0.60 C ATOM 593 CD GLN A 399 -13.827 0.409 -3.824 1.00 1.36 C ATOM 594 OE1 GLN A 399 -14.303 -0.487 -4.521 1.00 2.08 O ATOM 595 NE2 GLN A 399 -13.913 1.693 -4.151 1.00 2.04 N ATOM 0 H GLN A 399 -9.746 0.443 -1.231 1.00 0.39 H new ATOM 0 HA GLN A 399 -11.808 -1.593 -0.742 1.00 0.43 H new ATOM 0 HB2 GLN A 399 -11.207 -0.303 -3.440 1.00 0.49 H new ATOM 0 HB3 GLN A 399 -12.204 -1.727 -3.219 1.00 0.49 H new ATOM 0 HG2 GLN A 399 -13.792 -0.408 -1.846 1.00 0.60 H new ATOM 0 HG3 GLN A 399 -12.792 1.017 -2.052 1.00 0.60 H new ATOM 0 HE21 GLN A 399 -13.504 2.403 -3.543 1.00 2.04 H new ATOM 0 HE22 GLN A 399 -14.388 1.970 -5.010 1.00 2.04 H new ATOM 604 N SER A 400 -10.399 -3.301 -2.230 1.00 0.42 N ATOM 605 CA SER A 400 -9.446 -4.355 -2.565 1.00 0.41 C ATOM 606 C SER A 400 -10.119 -5.441 -3.402 1.00 0.47 C ATOM 607 O SER A 400 -11.317 -5.684 -3.261 1.00 0.54 O ATOM 608 CB SER A 400 -8.855 -4.965 -1.294 1.00 0.47 C ATOM 609 OG SER A 400 -9.862 -5.577 -0.505 1.00 0.56 O ATOM 0 H SER A 400 -11.374 -3.554 -2.389 1.00 0.42 H new ATOM 0 HA SER A 400 -8.640 -3.912 -3.150 1.00 0.41 H new ATOM 0 HB2 SER A 400 -8.098 -5.703 -1.559 1.00 0.47 H new ATOM 0 HB3 SER A 400 -8.355 -4.190 -0.713 1.00 0.47 H new ATOM 0 HG SER A 400 -9.458 -5.961 0.301 1.00 0.56 H new ATOM 615 N ARG A 401 -9.350 -6.086 -4.281 1.00 0.51 N ATOM 616 CA ARG A 401 -9.899 -7.134 -5.137 1.00 0.60 C ATOM 617 C ARG A 401 -8.813 -8.078 -5.651 1.00 0.73 C ATOM 618 O ARG A 401 -7.736 -7.645 -6.058 1.00 0.86 O ATOM 619 CB ARG A 401 -10.619 -6.519 -6.339 1.00 0.65 C ATOM 620 CG ARG A 401 -9.678 -5.826 -7.314 1.00 0.72 C ATOM 621 CD ARG A 401 -10.307 -5.669 -8.687 1.00 0.91 C ATOM 622 NE ARG A 401 -9.347 -5.175 -9.672 1.00 1.02 N ATOM 623 CZ ARG A 401 -8.848 -3.944 -9.669 1.00 1.25 C ATOM 624 NH1 ARG A 401 -9.238 -3.068 -8.756 1.00 1.55 N ATOM 625 NH2 ARG A 401 -7.958 -3.587 -10.586 1.00 1.43 N ATOM 0 H ARG A 401 -8.356 -5.903 -4.417 1.00 0.51 H new ATOM 0 HA ARG A 401 -10.600 -7.705 -4.528 1.00 0.60 H new ATOM 0 HB2 ARG A 401 -11.165 -7.301 -6.866 1.00 0.65 H new ATOM 0 HB3 ARG A 401 -11.357 -5.800 -5.983 1.00 0.65 H new ATOM 0 HG2 ARG A 401 -9.407 -4.845 -6.923 1.00 0.72 H new ATOM 0 HG3 ARG A 401 -8.756 -6.400 -7.400 1.00 0.72 H new ATOM 0 HD2 ARG A 401 -10.704 -6.629 -9.017 1.00 0.91 H new ATOM 0 HD3 ARG A 401 -11.150 -4.980 -8.624 1.00 0.91 H new ATOM 0 HE ARG A 401 -9.042 -5.814 -10.406 1.00 1.02 H new ATOM 0 HH11 ARG A 401 -9.924 -3.337 -8.051 1.00 1.55 H new ATOM 0 HH12 ARG A 401 -8.852 -2.124 -8.758 1.00 1.55 H new ATOM 0 HH21 ARG A 401 -7.657 -4.258 -11.293 1.00 1.43 H new ATOM 0 HH22 ARG A 401 -7.575 -2.642 -10.584 1.00 1.43 H new ATOM 639 N THR A 402 -9.121 -9.371 -5.656 1.00 0.82 N ATOM 640 CA THR A 402 -8.193 -10.380 -6.154 1.00 0.99 C ATOM 641 C THR A 402 -8.151 -10.353 -7.675 1.00 1.16 C ATOM 642 O THR A 402 -9.185 -10.205 -8.329 1.00 1.79 O ATOM 643 CB THR A 402 -8.602 -11.791 -5.695 1.00 1.14 C ATOM 644 OG1 THR A 402 -9.951 -12.065 -6.092 1.00 1.38 O ATOM 645 CG2 THR A 402 -8.471 -11.928 -4.189 1.00 1.29 C ATOM 0 H THR A 402 -10.008 -9.745 -5.320 1.00 0.82 H new ATOM 0 HA THR A 402 -7.208 -10.147 -5.749 1.00 0.99 H new ATOM 0 HB THR A 402 -7.934 -12.511 -6.167 1.00 1.14 H new ATOM 0 HG1 THR A 402 -10.202 -12.965 -5.797 1.00 1.38 H new ATOM 0 HG21 THR A 402 -8.766 -12.933 -3.888 1.00 1.29 H new ATOM 0 HG22 THR A 402 -7.436 -11.750 -3.896 1.00 1.29 H new ATOM 0 HG23 THR A 402 -9.117 -11.199 -3.700 1.00 1.29 H new ATOM 653 N THR A 403 -6.958 -10.498 -8.237 1.00 1.43 N ATOM 654 CA THR A 403 -6.795 -10.491 -9.685 1.00 1.62 C ATOM 655 C THR A 403 -7.570 -11.655 -10.312 1.00 1.84 C ATOM 656 O THR A 403 -8.298 -12.366 -9.620 1.00 1.85 O ATOM 657 CB THR A 403 -5.304 -10.576 -10.073 1.00 1.77 C ATOM 658 OG1 THR A 403 -4.530 -9.745 -9.199 1.00 1.78 O ATOM 659 CG2 THR A 403 -5.075 -10.125 -11.508 1.00 1.95 C ATOM 0 H THR A 403 -6.091 -10.622 -7.714 1.00 1.43 H new ATOM 0 HA THR A 403 -7.195 -9.552 -10.067 1.00 1.62 H new ATOM 0 HB THR A 403 -4.996 -11.617 -9.982 1.00 1.77 H new ATOM 0 HG1 THR A 403 -3.576 -9.875 -9.383 1.00 1.78 H new ATOM 0 HG21 THR A 403 -4.014 -10.198 -11.747 1.00 1.95 H new ATOM 0 HG22 THR A 403 -5.644 -10.762 -12.185 1.00 1.95 H new ATOM 0 HG23 THR A 403 -5.402 -9.091 -11.621 1.00 1.95 H new ATOM 667 N GLU A 404 -7.420 -11.843 -11.619 1.00 2.08 N ATOM 668 CA GLU A 404 -8.116 -12.914 -12.326 1.00 2.34 C ATOM 669 C GLU A 404 -7.847 -14.274 -11.689 1.00 2.30 C ATOM 670 O GLU A 404 -8.768 -15.065 -11.485 1.00 2.37 O ATOM 671 CB GLU A 404 -7.696 -12.938 -13.797 1.00 2.72 C ATOM 672 CG GLU A 404 -7.998 -11.646 -14.539 1.00 2.91 C ATOM 673 CD GLU A 404 -7.571 -11.697 -15.992 1.00 3.42 C ATOM 674 OE1 GLU A 404 -8.080 -12.566 -16.730 1.00 3.79 O ATOM 675 OE2 GLU A 404 -6.729 -10.867 -16.392 1.00 3.87 O ATOM 0 H GLU A 404 -6.822 -11.267 -12.212 1.00 2.08 H new ATOM 0 HA GLU A 404 -9.185 -12.714 -12.257 1.00 2.34 H new ATOM 0 HB2 GLU A 404 -6.627 -13.140 -13.857 1.00 2.72 H new ATOM 0 HB3 GLU A 404 -8.205 -13.762 -14.298 1.00 2.72 H new ATOM 0 HG2 GLU A 404 -9.067 -11.441 -14.485 1.00 2.91 H new ATOM 0 HG3 GLU A 404 -7.490 -10.819 -14.043 1.00 2.91 H new ATOM 682 N ASN A 405 -6.583 -14.543 -11.381 1.00 2.26 N ATOM 683 CA ASN A 405 -6.200 -15.814 -10.771 1.00 2.30 C ATOM 684 C ASN A 405 -6.911 -16.012 -9.436 1.00 2.07 C ATOM 685 O ASN A 405 -7.461 -17.081 -9.168 1.00 2.40 O ATOM 686 CB ASN A 405 -4.685 -15.869 -10.569 1.00 2.43 C ATOM 687 CG ASN A 405 -4.229 -17.190 -9.980 1.00 2.67 C ATOM 688 OD1 ASN A 405 -4.440 -18.250 -10.567 1.00 3.16 O ATOM 689 ND2 ASN A 405 -3.601 -17.130 -8.812 1.00 2.73 N ATOM 0 H ASN A 405 -5.807 -13.901 -11.543 1.00 2.26 H new ATOM 0 HA ASN A 405 -6.499 -16.618 -11.444 1.00 2.30 H new ATOM 0 HB2 ASN A 405 -4.187 -15.710 -11.526 1.00 2.43 H new ATOM 0 HB3 ASN A 405 -4.379 -15.056 -9.911 1.00 2.43 H new ATOM 0 HD21 ASN A 405 -3.272 -17.986 -8.365 1.00 2.73 H new ATOM 0 HD22 ASN A 405 -3.448 -16.228 -8.361 1.00 2.73 H new ATOM 696 N ALA A 406 -6.888 -14.975 -8.603 1.00 1.82 N ATOM 697 CA ALA A 406 -7.515 -15.013 -7.297 1.00 1.67 C ATOM 698 C ALA A 406 -6.846 -16.041 -6.407 1.00 1.85 C ATOM 699 O ALA A 406 -5.866 -16.678 -6.795 1.00 2.18 O ATOM 700 CB ALA A 406 -9.004 -15.292 -7.420 1.00 1.72 C ATOM 0 H ALA A 406 -6.433 -14.088 -8.820 1.00 1.82 H new ATOM 0 HA ALA A 406 -7.391 -14.034 -6.834 1.00 1.67 H new ATOM 0 HB1 ALA A 406 -9.453 -15.316 -6.427 1.00 1.72 H new ATOM 0 HB2 ALA A 406 -9.474 -14.506 -8.012 1.00 1.72 H new ATOM 0 HB3 ALA A 406 -9.155 -16.254 -7.909 1.00 1.72 H new ATOM 706 N ALA A 407 -7.386 -16.193 -5.214 1.00 1.91 N ATOM 707 CA ALA A 407 -6.865 -17.135 -4.246 1.00 2.19 C ATOM 708 C ALA A 407 -5.442 -16.789 -3.815 1.00 2.37 C ATOM 709 O ALA A 407 -4.778 -17.585 -3.151 1.00 2.77 O ATOM 710 CB ALA A 407 -6.931 -18.551 -4.793 1.00 2.38 C ATOM 0 H ALA A 407 -8.197 -15.667 -4.890 1.00 1.91 H new ATOM 0 HA ALA A 407 -7.494 -17.070 -3.358 1.00 2.19 H new ATOM 0 HB1 ALA A 407 -6.535 -19.246 -4.052 1.00 2.38 H new ATOM 0 HB2 ALA A 407 -7.967 -18.808 -5.014 1.00 2.38 H new ATOM 0 HB3 ALA A 407 -6.338 -18.617 -5.705 1.00 2.38 H new ATOM 716 N ALA A 408 -4.982 -15.596 -4.184 1.00 2.15 N ATOM 717 CA ALA A 408 -3.639 -15.151 -3.822 1.00 2.35 C ATOM 718 C ALA A 408 -3.422 -13.673 -4.161 1.00 2.05 C ATOM 719 O ALA A 408 -3.026 -12.892 -3.296 1.00 1.99 O ATOM 720 CB ALA A 408 -2.585 -16.016 -4.501 1.00 2.76 C ATOM 0 H ALA A 408 -5.517 -14.922 -4.732 1.00 2.15 H new ATOM 0 HA ALA A 408 -3.538 -15.260 -2.742 1.00 2.35 H new ATOM 0 HB1 ALA A 408 -1.591 -15.668 -4.218 1.00 2.76 H new ATOM 0 HB2 ALA A 408 -2.709 -17.053 -4.189 1.00 2.76 H new ATOM 0 HB3 ALA A 408 -2.699 -15.947 -5.583 1.00 2.76 H new ATOM 726 N PRO A 409 -3.683 -13.258 -5.418 1.00 1.99 N ATOM 727 CA PRO A 409 -3.512 -11.863 -5.833 1.00 1.80 C ATOM 728 C PRO A 409 -4.581 -10.959 -5.246 1.00 1.41 C ATOM 729 O PRO A 409 -5.699 -11.395 -4.994 1.00 1.86 O ATOM 730 CB PRO A 409 -3.630 -11.925 -7.352 1.00 2.10 C ATOM 731 CG PRO A 409 -4.498 -13.104 -7.608 1.00 2.49 C ATOM 732 CD PRO A 409 -4.167 -14.100 -6.530 1.00 2.27 C ATOM 0 HA PRO A 409 -2.566 -11.445 -5.489 1.00 1.80 H new ATOM 0 HB2 PRO A 409 -4.071 -11.013 -7.754 1.00 2.10 H new ATOM 0 HB3 PRO A 409 -2.653 -12.041 -7.822 1.00 2.10 H new ATOM 0 HG2 PRO A 409 -5.552 -12.828 -7.575 1.00 2.49 H new ATOM 0 HG3 PRO A 409 -4.309 -13.521 -8.597 1.00 2.49 H new ATOM 0 HD2 PRO A 409 -5.041 -14.683 -6.241 1.00 2.27 H new ATOM 0 HD3 PRO A 409 -3.406 -14.808 -6.858 1.00 2.27 H new ATOM 740 N ASP A 410 -4.224 -9.700 -5.017 1.00 0.92 N ATOM 741 CA ASP A 410 -5.158 -8.739 -4.448 1.00 0.79 C ATOM 742 C ASP A 410 -4.600 -7.318 -4.500 1.00 0.68 C ATOM 743 O ASP A 410 -3.500 -7.049 -4.019 1.00 0.93 O ATOM 744 CB ASP A 410 -5.496 -9.131 -3.007 1.00 1.18 C ATOM 745 CG ASP A 410 -4.263 -9.469 -2.187 1.00 1.62 C ATOM 746 OD1 ASP A 410 -3.503 -10.368 -2.600 1.00 1.99 O ATOM 747 OD2 ASP A 410 -4.064 -8.843 -1.127 1.00 2.14 O ATOM 0 H ASP A 410 -3.297 -9.323 -5.216 1.00 0.92 H new ATOM 0 HA ASP A 410 -6.069 -8.755 -5.046 1.00 0.79 H new ATOM 0 HB2 ASP A 410 -6.032 -8.312 -2.528 1.00 1.18 H new ATOM 0 HB3 ASP A 410 -6.168 -9.989 -3.016 1.00 1.18 H new ATOM 752 N GLU A 411 -5.382 -6.417 -5.088 1.00 0.54 N ATOM 753 CA GLU A 411 -4.999 -5.016 -5.219 1.00 0.45 C ATOM 754 C GLU A 411 -5.858 -4.145 -4.309 1.00 0.40 C ATOM 755 O GLU A 411 -7.073 -4.315 -4.253 1.00 0.42 O ATOM 756 CB GLU A 411 -5.158 -4.566 -6.673 1.00 0.49 C ATOM 757 CG GLU A 411 -4.212 -5.268 -7.634 1.00 0.58 C ATOM 758 CD GLU A 411 -2.769 -4.849 -7.447 1.00 1.47 C ATOM 759 OE1 GLU A 411 -2.515 -3.939 -6.629 1.00 2.10 O ATOM 760 OE2 GLU A 411 -1.891 -5.439 -8.106 1.00 2.08 O ATOM 0 H GLU A 411 -6.295 -6.637 -5.485 1.00 0.54 H new ATOM 0 HA GLU A 411 -3.955 -4.909 -4.923 1.00 0.45 H new ATOM 0 HB2 GLU A 411 -6.185 -4.747 -6.990 1.00 0.49 H new ATOM 0 HB3 GLU A 411 -4.991 -3.491 -6.732 1.00 0.49 H new ATOM 0 HG2 GLU A 411 -4.294 -6.346 -7.495 1.00 0.58 H new ATOM 0 HG3 GLU A 411 -4.518 -5.055 -8.658 1.00 0.58 H new ATOM 767 N TYR A 412 -5.225 -3.219 -3.593 1.00 0.38 N ATOM 768 CA TYR A 412 -5.953 -2.340 -2.682 1.00 0.35 C ATOM 769 C TYR A 412 -5.934 -0.890 -3.155 1.00 0.33 C ATOM 770 O TYR A 412 -4.874 -0.328 -3.424 1.00 0.34 O ATOM 771 CB TYR A 412 -5.358 -2.402 -1.272 1.00 0.39 C ATOM 772 CG TYR A 412 -5.397 -3.769 -0.631 1.00 0.45 C ATOM 773 CD1 TYR A 412 -4.712 -4.838 -1.194 1.00 0.50 C ATOM 774 CD2 TYR A 412 -6.131 -3.995 0.524 1.00 0.53 C ATOM 775 CE1 TYR A 412 -4.755 -6.093 -0.620 1.00 0.58 C ATOM 776 CE2 TYR A 412 -6.177 -5.245 1.104 1.00 0.61 C ATOM 777 CZ TYR A 412 -5.451 -6.275 0.567 1.00 0.62 C ATOM 778 OH TYR A 412 -5.537 -7.538 1.106 1.00 0.72 O ATOM 0 H TYR A 412 -4.218 -3.059 -3.625 1.00 0.38 H new ATOM 0 HA TYR A 412 -6.984 -2.693 -2.667 1.00 0.35 H new ATOM 0 HB2 TYR A 412 -4.322 -2.065 -1.314 1.00 0.39 H new ATOM 0 HB3 TYR A 412 -5.896 -1.701 -0.634 1.00 0.39 H new ATOM 0 HD1 TYR A 412 -4.137 -4.685 -2.095 1.00 0.50 H new ATOM 0 HD2 TYR A 412 -6.675 -3.179 0.976 1.00 0.53 H new ATOM 0 HE1 TYR A 412 -4.252 -6.925 -1.090 1.00 0.58 H new ATOM 0 HE2 TYR A 412 -6.785 -5.412 1.981 1.00 0.61 H new ATOM 0 HH TYR A 412 -5.116 -8.182 0.499 1.00 0.72 H new ATOM 788 N TYR A 413 -7.114 -0.284 -3.212 1.00 0.33 N ATOM 789 CA TYR A 413 -7.239 1.112 -3.604 1.00 0.32 C ATOM 790 C TYR A 413 -6.645 1.986 -2.510 1.00 0.32 C ATOM 791 O TYR A 413 -6.972 1.809 -1.340 1.00 0.40 O ATOM 792 CB TYR A 413 -8.711 1.468 -3.803 1.00 0.36 C ATOM 793 CG TYR A 413 -8.943 2.882 -4.290 1.00 0.38 C ATOM 794 CD1 TYR A 413 -8.256 3.374 -5.393 1.00 0.40 C ATOM 795 CD2 TYR A 413 -9.846 3.722 -3.651 1.00 0.44 C ATOM 796 CE1 TYR A 413 -8.461 4.663 -5.844 1.00 0.44 C ATOM 797 CE2 TYR A 413 -10.057 5.014 -4.096 1.00 0.48 C ATOM 798 CZ TYR A 413 -9.377 5.481 -5.181 1.00 0.46 C ATOM 799 OH TYR A 413 -9.569 6.763 -5.640 1.00 0.51 O ATOM 0 H TYR A 413 -7.999 -0.740 -2.991 1.00 0.33 H new ATOM 0 HA TYR A 413 -6.707 1.277 -4.541 1.00 0.32 H new ATOM 0 HB2 TYR A 413 -9.149 0.772 -4.519 1.00 0.36 H new ATOM 0 HB3 TYR A 413 -9.238 1.329 -2.859 1.00 0.36 H new ATOM 0 HD1 TYR A 413 -7.550 2.738 -5.906 1.00 0.40 H new ATOM 0 HD2 TYR A 413 -10.392 3.360 -2.793 1.00 0.44 H new ATOM 0 HE1 TYR A 413 -7.918 5.034 -6.701 1.00 0.44 H new ATOM 0 HE2 TYR A 413 -10.761 5.653 -3.584 1.00 0.48 H new ATOM 0 HH TYR A 413 -10.236 7.214 -5.081 1.00 0.51 H new ATOM 809 N VAL A 414 -5.766 2.913 -2.870 1.00 0.33 N ATOM 810 CA VAL A 414 -5.146 3.763 -1.862 1.00 0.33 C ATOM 811 C VAL A 414 -5.199 5.245 -2.224 1.00 0.29 C ATOM 812 O VAL A 414 -4.938 5.638 -3.362 1.00 0.38 O ATOM 813 CB VAL A 414 -3.683 3.352 -1.610 1.00 0.39 C ATOM 814 CG1 VAL A 414 -2.856 3.488 -2.877 1.00 1.09 C ATOM 815 CG2 VAL A 414 -3.085 4.174 -0.484 1.00 1.15 C ATOM 0 H VAL A 414 -5.471 3.093 -3.830 1.00 0.33 H new ATOM 0 HA VAL A 414 -5.728 3.619 -0.952 1.00 0.33 H new ATOM 0 HB VAL A 414 -3.670 2.304 -1.312 1.00 0.39 H new ATOM 0 HG11 VAL A 414 -1.827 3.192 -2.673 1.00 1.09 H new ATOM 0 HG12 VAL A 414 -3.271 2.846 -3.653 1.00 1.09 H new ATOM 0 HG13 VAL A 414 -2.875 4.524 -3.215 1.00 1.09 H new ATOM 0 HG21 VAL A 414 -2.051 3.869 -0.321 1.00 1.15 H new ATOM 0 HG22 VAL A 414 -3.114 5.231 -0.750 1.00 1.15 H new ATOM 0 HG23 VAL A 414 -3.659 4.013 0.428 1.00 1.15 H new ATOM 825 N HIS A 415 -5.525 6.057 -1.223 1.00 0.33 N ATOM 826 CA HIS A 415 -5.607 7.503 -1.379 1.00 0.32 C ATOM 827 C HIS A 415 -4.529 8.171 -0.530 1.00 0.32 C ATOM 828 O HIS A 415 -4.755 8.484 0.639 1.00 0.34 O ATOM 829 CB HIS A 415 -6.993 8.000 -0.959 1.00 0.37 C ATOM 830 CG HIS A 415 -7.157 9.486 -1.042 1.00 0.44 C ATOM 831 ND1 HIS A 415 -7.050 10.190 -2.222 1.00 0.50 N ATOM 832 CD2 HIS A 415 -7.422 10.404 -0.082 1.00 0.54 C ATOM 833 CE1 HIS A 415 -7.241 11.476 -1.985 1.00 0.60 C ATOM 834 NE2 HIS A 415 -7.470 11.631 -0.694 1.00 0.62 N ATOM 0 H HIS A 415 -5.740 5.730 -0.281 1.00 0.33 H new ATOM 0 HA HIS A 415 -5.448 7.760 -2.426 1.00 0.32 H new ATOM 0 HB2 HIS A 415 -7.745 7.526 -1.590 1.00 0.37 H new ATOM 0 HB3 HIS A 415 -7.188 7.680 0.064 1.00 0.37 H new ATOM 0 HD1 HIS A 415 -6.854 9.782 -3.136 1.00 0.50 H new ATOM 0 HD2 HIS A 415 -7.568 10.207 0.970 1.00 0.54 H new ATOM 0 HE1 HIS A 415 -7.214 12.265 -2.722 1.00 0.60 H new ATOM 843 N TYR A 416 -3.353 8.370 -1.117 1.00 0.37 N ATOM 844 CA TYR A 416 -2.237 8.982 -0.403 1.00 0.40 C ATOM 845 C TYR A 416 -2.638 10.321 0.204 1.00 0.45 C ATOM 846 O TYR A 416 -3.173 11.192 -0.484 1.00 0.57 O ATOM 847 CB TYR A 416 -1.036 9.167 -1.334 1.00 0.46 C ATOM 848 CG TYR A 416 -0.520 7.877 -1.936 1.00 0.47 C ATOM 849 CD1 TYR A 416 -1.209 7.236 -2.957 1.00 0.53 C ATOM 850 CD2 TYR A 416 0.666 7.308 -1.487 1.00 0.51 C ATOM 851 CE1 TYR A 416 -0.734 6.063 -3.511 1.00 0.59 C ATOM 852 CE2 TYR A 416 1.149 6.136 -2.038 1.00 0.54 C ATOM 853 CZ TYR A 416 0.445 5.518 -3.049 1.00 0.57 C ATOM 854 OH TYR A 416 0.922 4.350 -3.600 1.00 0.65 O ATOM 0 H TYR A 416 -3.148 8.117 -2.084 1.00 0.37 H new ATOM 0 HA TYR A 416 -1.955 8.310 0.407 1.00 0.40 H new ATOM 0 HB2 TYR A 416 -1.315 9.846 -2.140 1.00 0.46 H new ATOM 0 HB3 TYR A 416 -0.229 9.645 -0.779 1.00 0.46 H new ATOM 0 HD1 TYR A 416 -2.131 7.661 -3.324 1.00 0.53 H new ATOM 0 HD2 TYR A 416 1.219 7.790 -0.694 1.00 0.51 H new ATOM 0 HE1 TYR A 416 -1.284 5.575 -4.302 1.00 0.59 H new ATOM 0 HE2 TYR A 416 2.073 5.707 -1.678 1.00 0.54 H new ATOM 0 HH TYR A 416 1.763 4.102 -3.163 1.00 0.65 H new ATOM 864 N VAL A 417 -2.376 10.476 1.499 1.00 0.45 N ATOM 865 CA VAL A 417 -2.709 11.705 2.209 1.00 0.55 C ATOM 866 C VAL A 417 -1.787 12.847 1.800 1.00 0.66 C ATOM 867 O VAL A 417 -0.565 12.719 1.847 1.00 1.34 O ATOM 868 CB VAL A 417 -2.622 11.512 3.734 1.00 0.68 C ATOM 869 CG1 VAL A 417 -2.962 12.804 4.461 1.00 1.10 C ATOM 870 CG2 VAL A 417 -3.543 10.387 4.178 1.00 1.01 C ATOM 0 H VAL A 417 -1.933 9.763 2.078 1.00 0.45 H new ATOM 0 HA VAL A 417 -3.734 11.957 1.938 1.00 0.55 H new ATOM 0 HB VAL A 417 -1.598 11.241 3.989 1.00 0.68 H new ATOM 0 HG11 VAL A 417 -2.894 12.645 5.537 1.00 1.10 H new ATOM 0 HG12 VAL A 417 -2.260 13.584 4.165 1.00 1.10 H new ATOM 0 HG13 VAL A 417 -3.976 13.111 4.203 1.00 1.10 H new ATOM 0 HG21 VAL A 417 -3.471 10.262 5.258 1.00 1.01 H new ATOM 0 HG22 VAL A 417 -4.571 10.631 3.909 1.00 1.01 H new ATOM 0 HG23 VAL A 417 -3.249 9.460 3.685 1.00 1.01 H new ATOM 880 N GLY A 418 -2.386 13.967 1.416 1.00 0.71 N ATOM 881 CA GLY A 418 -1.609 15.128 1.016 1.00 0.82 C ATOM 882 C GLY A 418 -1.031 15.010 -0.386 1.00 0.72 C ATOM 883 O GLY A 418 -0.959 16.001 -1.114 1.00 0.76 O ATOM 0 H GLY A 418 -3.397 14.094 1.374 1.00 0.71 H new ATOM 0 HA2 GLY A 418 -2.241 16.015 1.068 1.00 0.82 H new ATOM 0 HA3 GLY A 418 -0.795 15.274 1.726 1.00 0.82 H new ATOM 887 N LEU A 419 -0.607 13.806 -0.764 1.00 0.66 N ATOM 888 CA LEU A 419 -0.022 13.579 -2.084 1.00 0.60 C ATOM 889 C LEU A 419 -0.993 13.940 -3.204 1.00 0.59 C ATOM 890 O LEU A 419 -2.205 14.015 -2.999 1.00 0.76 O ATOM 891 CB LEU A 419 0.428 12.125 -2.246 1.00 0.58 C ATOM 892 CG LEU A 419 1.699 11.743 -1.484 1.00 0.78 C ATOM 893 CD1 LEU A 419 1.436 11.668 0.010 1.00 1.60 C ATOM 894 CD2 LEU A 419 2.250 10.421 -1.999 1.00 1.40 C ATOM 0 H LEU A 419 -0.657 12.974 -0.176 1.00 0.66 H new ATOM 0 HA LEU A 419 0.847 14.232 -2.158 1.00 0.60 H new ATOM 0 HB2 LEU A 419 -0.382 11.473 -1.918 1.00 0.58 H new ATOM 0 HB3 LEU A 419 0.587 11.927 -3.306 1.00 0.58 H new ATOM 0 HG LEU A 419 2.445 12.520 -1.655 1.00 0.78 H new ATOM 0 HD11 LEU A 419 2.355 11.395 0.528 1.00 1.60 H new ATOM 0 HD12 LEU A 419 1.092 12.638 0.368 1.00 1.60 H new ATOM 0 HD13 LEU A 419 0.671 10.917 0.208 1.00 1.60 H new ATOM 0 HD21 LEU A 419 3.154 10.164 -1.447 1.00 1.40 H new ATOM 0 HD22 LEU A 419 1.505 9.638 -1.861 1.00 1.40 H new ATOM 0 HD23 LEU A 419 2.487 10.514 -3.059 1.00 1.40 H new ATOM 906 N ASN A 420 -0.431 14.169 -4.389 1.00 0.61 N ATOM 907 CA ASN A 420 -1.210 14.532 -5.570 1.00 0.63 C ATOM 908 C ASN A 420 -2.369 13.565 -5.805 1.00 0.56 C ATOM 909 O ASN A 420 -2.230 12.354 -5.626 1.00 0.56 O ATOM 910 CB ASN A 420 -0.303 14.563 -6.802 1.00 0.75 C ATOM 911 CG ASN A 420 0.753 15.647 -6.716 1.00 1.57 C ATOM 912 OD1 ASN A 420 1.574 15.658 -5.800 1.00 2.53 O ATOM 913 ND2 ASN A 420 0.736 16.566 -7.674 1.00 1.98 N ATOM 0 H ASN A 420 0.573 14.108 -4.557 1.00 0.61 H new ATOM 0 HA ASN A 420 -1.632 15.522 -5.397 1.00 0.63 H new ATOM 0 HB2 ASN A 420 0.183 13.594 -6.916 1.00 0.75 H new ATOM 0 HB3 ASN A 420 -0.911 14.721 -7.693 1.00 0.75 H new ATOM 0 HD21 ASN A 420 1.423 17.320 -7.669 1.00 1.98 H new ATOM 0 HD22 ASN A 420 0.036 16.518 -8.415 1.00 1.98 H new ATOM 920 N ARG A 421 -3.509 14.116 -6.211 1.00 0.62 N ATOM 921 CA ARG A 421 -4.702 13.319 -6.482 1.00 0.67 C ATOM 922 C ARG A 421 -4.434 12.305 -7.591 1.00 0.66 C ATOM 923 O ARG A 421 -4.914 11.174 -7.539 1.00 0.69 O ATOM 924 CB ARG A 421 -5.863 14.232 -6.883 1.00 0.87 C ATOM 925 CG ARG A 421 -6.182 15.299 -5.848 1.00 1.09 C ATOM 926 CD ARG A 421 -7.247 16.262 -6.347 1.00 1.51 C ATOM 927 NE ARG A 421 -7.528 17.316 -5.375 1.00 2.25 N ATOM 928 CZ ARG A 421 -8.373 18.319 -5.594 1.00 3.00 C ATOM 929 NH1 ARG A 421 -9.013 18.413 -6.752 1.00 3.28 N ATOM 930 NH2 ARG A 421 -8.574 19.234 -4.654 1.00 3.98 N ATOM 0 H ARG A 421 -3.632 15.117 -6.360 1.00 0.62 H new ATOM 0 HA ARG A 421 -4.967 12.778 -5.574 1.00 0.67 H new ATOM 0 HB2 ARG A 421 -5.624 14.716 -7.830 1.00 0.87 H new ATOM 0 HB3 ARG A 421 -6.752 13.624 -7.052 1.00 0.87 H new ATOM 0 HG2 ARG A 421 -6.523 14.824 -4.928 1.00 1.09 H new ATOM 0 HG3 ARG A 421 -5.275 15.853 -5.604 1.00 1.09 H new ATOM 0 HD2 ARG A 421 -6.920 16.711 -7.285 1.00 1.51 H new ATOM 0 HD3 ARG A 421 -8.163 15.711 -6.560 1.00 1.51 H new ATOM 0 HE ARG A 421 -7.048 17.280 -4.476 1.00 2.25 H new ATOM 0 HH11 ARG A 421 -8.858 17.714 -7.479 1.00 3.28 H new ATOM 0 HH12 ARG A 421 -9.660 19.184 -6.916 1.00 3.28 H new ATOM 0 HH21 ARG A 421 -8.080 19.168 -3.764 1.00 3.98 H new ATOM 0 HH22 ARG A 421 -9.222 20.004 -4.822 1.00 3.98 H new ATOM 944 N ARG A 422 -3.668 12.722 -8.594 1.00 0.71 N ATOM 945 CA ARG A 422 -3.333 11.855 -9.719 1.00 0.83 C ATOM 946 C ARG A 422 -2.582 10.612 -9.247 1.00 0.72 C ATOM 947 O ARG A 422 -2.795 9.514 -9.762 1.00 0.77 O ATOM 948 CB ARG A 422 -2.493 12.621 -10.743 1.00 1.01 C ATOM 949 CG ARG A 422 -1.196 13.174 -10.178 1.00 1.19 C ATOM 950 CD ARG A 422 -0.422 13.960 -11.226 1.00 1.49 C ATOM 951 NE ARG A 422 -0.065 13.136 -12.380 1.00 2.09 N ATOM 952 CZ ARG A 422 0.822 12.145 -12.339 1.00 2.79 C ATOM 953 NH1 ARG A 422 1.496 11.895 -11.223 1.00 3.07 N ATOM 954 NH2 ARG A 422 1.050 11.415 -13.422 1.00 3.71 N ATOM 0 H ARG A 422 -3.266 13.658 -8.651 1.00 0.71 H new ATOM 0 HA ARG A 422 -4.262 11.533 -10.189 1.00 0.83 H new ATOM 0 HB2 ARG A 422 -2.262 11.960 -11.578 1.00 1.01 H new ATOM 0 HB3 ARG A 422 -3.085 13.444 -11.143 1.00 1.01 H new ATOM 0 HG2 ARG A 422 -1.414 13.818 -9.326 1.00 1.19 H new ATOM 0 HG3 ARG A 422 -0.580 12.354 -9.808 1.00 1.19 H new ATOM 0 HD2 ARG A 422 -1.021 14.808 -11.558 1.00 1.49 H new ATOM 0 HD3 ARG A 422 0.484 14.367 -10.777 1.00 1.49 H new ATOM 0 HE ARG A 422 -0.523 13.333 -13.270 1.00 2.09 H new ATOM 0 HH11 ARG A 422 1.335 12.464 -10.392 1.00 3.07 H new ATOM 0 HH12 ARG A 422 2.175 11.134 -11.197 1.00 3.07 H new ATOM 0 HH21 ARG A 422 0.546 11.613 -14.286 1.00 3.71 H new ATOM 0 HH22 ARG A 422 1.730 10.655 -13.391 1.00 3.71 H new ATOM 968 N LEU A 423 -1.703 10.797 -8.267 1.00 0.65 N ATOM 969 CA LEU A 423 -0.915 9.700 -7.718 1.00 0.62 C ATOM 970 C LEU A 423 -1.818 8.582 -7.205 1.00 0.52 C ATOM 971 O LEU A 423 -1.444 7.408 -7.229 1.00 0.53 O ATOM 972 CB LEU A 423 -0.022 10.208 -6.582 1.00 0.69 C ATOM 973 CG LEU A 423 0.975 11.301 -6.980 1.00 0.89 C ATOM 974 CD1 LEU A 423 1.747 11.787 -5.764 1.00 1.31 C ATOM 975 CD2 LEU A 423 1.931 10.789 -8.046 1.00 1.49 C ATOM 0 H LEU A 423 -1.518 11.702 -7.835 1.00 0.65 H new ATOM 0 HA LEU A 423 -0.290 9.300 -8.516 1.00 0.62 H new ATOM 0 HB2 LEU A 423 -0.658 10.591 -5.784 1.00 0.69 H new ATOM 0 HB3 LEU A 423 0.532 9.364 -6.171 1.00 0.69 H new ATOM 0 HG LEU A 423 0.416 12.141 -7.393 1.00 0.89 H new ATOM 0 HD11 LEU A 423 2.450 12.563 -6.066 1.00 1.31 H new ATOM 0 HD12 LEU A 423 1.051 12.193 -5.030 1.00 1.31 H new ATOM 0 HD13 LEU A 423 2.294 10.953 -5.323 1.00 1.31 H new ATOM 0 HD21 LEU A 423 2.632 11.579 -8.316 1.00 1.49 H new ATOM 0 HD22 LEU A 423 2.482 9.932 -7.659 1.00 1.49 H new ATOM 0 HD23 LEU A 423 1.365 10.489 -8.928 1.00 1.49 H new ATOM 987 N ASP A 424 -3.001 8.961 -6.733 1.00 0.49 N ATOM 988 CA ASP A 424 -3.966 8.003 -6.202 1.00 0.50 C ATOM 989 C ASP A 424 -4.221 6.870 -7.193 1.00 0.45 C ATOM 990 O ASP A 424 -4.412 7.106 -8.387 1.00 0.49 O ATOM 991 CB ASP A 424 -5.280 8.716 -5.876 1.00 0.66 C ATOM 992 CG ASP A 424 -5.084 9.891 -4.936 1.00 0.81 C ATOM 993 OD1 ASP A 424 -3.948 10.079 -4.454 1.00 0.97 O ATOM 994 OD2 ASP A 424 -6.064 10.624 -4.684 1.00 1.20 O ATOM 0 H ASP A 424 -3.316 9.931 -6.707 1.00 0.49 H new ATOM 0 HA ASP A 424 -3.551 7.570 -5.292 1.00 0.50 H new ATOM 0 HB2 ASP A 424 -5.739 9.067 -6.800 1.00 0.66 H new ATOM 0 HB3 ASP A 424 -5.973 8.006 -5.425 1.00 0.66 H new ATOM 999 N GLY A 425 -4.222 5.641 -6.687 1.00 0.44 N ATOM 1000 CA GLY A 425 -4.451 4.483 -7.533 1.00 0.50 C ATOM 1001 C GLY A 425 -4.339 3.178 -6.768 1.00 0.45 C ATOM 1002 O GLY A 425 -4.019 3.176 -5.581 1.00 0.70 O ATOM 0 H GLY A 425 -4.068 5.425 -5.702 1.00 0.44 H new ATOM 0 HA2 GLY A 425 -5.442 4.554 -7.982 1.00 0.50 H new ATOM 0 HA3 GLY A 425 -3.730 4.485 -8.350 1.00 0.50 H new ATOM 1006 N TRP A 426 -4.604 2.066 -7.447 1.00 0.50 N ATOM 1007 CA TRP A 426 -4.527 0.753 -6.817 1.00 0.44 C ATOM 1008 C TRP A 426 -3.077 0.322 -6.628 1.00 0.45 C ATOM 1009 O TRP A 426 -2.229 0.555 -7.489 1.00 0.57 O ATOM 1010 CB TRP A 426 -5.288 -0.287 -7.639 1.00 0.47 C ATOM 1011 CG TRP A 426 -6.750 0.017 -7.761 1.00 0.49 C ATOM 1012 CD1 TRP A 426 -7.321 1.017 -8.494 1.00 0.57 C ATOM 1013 CD2 TRP A 426 -7.825 -0.670 -7.111 1.00 0.48 C ATOM 1014 NE1 TRP A 426 -8.687 0.986 -8.352 1.00 0.61 N ATOM 1015 CE2 TRP A 426 -9.021 -0.040 -7.506 1.00 0.55 C ATOM 1016 CE3 TRP A 426 -7.897 -1.760 -6.237 1.00 0.50 C ATOM 1017 CZ2 TRP A 426 -10.269 -0.461 -7.057 1.00 0.59 C ATOM 1018 CZ3 TRP A 426 -9.136 -2.177 -5.793 1.00 0.56 C ATOM 1019 CH2 TRP A 426 -10.308 -1.529 -6.203 1.00 0.59 C ATOM 0 H TRP A 426 -4.873 2.048 -8.431 1.00 0.50 H new ATOM 0 HA TRP A 426 -4.992 0.826 -5.834 1.00 0.44 H new ATOM 0 HB2 TRP A 426 -4.850 -0.345 -8.636 1.00 0.47 H new ATOM 0 HB3 TRP A 426 -5.164 -1.267 -7.179 1.00 0.47 H new ATOM 0 HD1 TRP A 426 -6.778 1.729 -9.098 1.00 0.57 H new ATOM 0 HE1 TRP A 426 -9.345 1.622 -8.802 1.00 0.61 H new ATOM 0 HE3 TRP A 426 -6.999 -2.266 -5.915 1.00 0.50 H new ATOM 0 HZ2 TRP A 426 -11.174 0.037 -7.371 1.00 0.59 H new ATOM 0 HZ3 TRP A 426 -9.203 -3.017 -5.118 1.00 0.56 H new ATOM 0 HH2 TRP A 426 -11.262 -1.880 -5.838 1.00 0.59 H new ATOM 1030 N VAL A 427 -2.800 -0.301 -5.488 1.00 0.39 N ATOM 1031 CA VAL A 427 -1.454 -0.760 -5.168 1.00 0.46 C ATOM 1032 C VAL A 427 -1.466 -2.191 -4.640 1.00 0.51 C ATOM 1033 O VAL A 427 -2.332 -2.565 -3.850 1.00 0.70 O ATOM 1034 CB VAL A 427 -0.794 0.150 -4.118 1.00 0.64 C ATOM 1035 CG1 VAL A 427 -0.551 1.536 -4.683 1.00 0.89 C ATOM 1036 CG2 VAL A 427 -1.663 0.235 -2.878 1.00 0.85 C ATOM 0 H VAL A 427 -3.494 -0.500 -4.767 1.00 0.39 H new ATOM 0 HA VAL A 427 -0.880 -0.724 -6.094 1.00 0.46 H new ATOM 0 HB VAL A 427 0.169 -0.283 -3.846 1.00 0.64 H new ATOM 0 HG11 VAL A 427 -0.084 2.162 -3.923 1.00 0.89 H new ATOM 0 HG12 VAL A 427 0.106 1.466 -5.550 1.00 0.89 H new ATOM 0 HG13 VAL A 427 -1.501 1.978 -4.983 1.00 0.89 H new ATOM 0 HG21 VAL A 427 -1.185 0.882 -2.142 1.00 0.85 H new ATOM 0 HG22 VAL A 427 -2.637 0.646 -3.144 1.00 0.85 H new ATOM 0 HG23 VAL A 427 -1.792 -0.761 -2.455 1.00 0.85 H new ATOM 1046 N GLY A 428 -0.495 -2.984 -5.081 1.00 0.52 N ATOM 1047 CA GLY A 428 -0.405 -4.366 -4.643 1.00 0.65 C ATOM 1048 C GLY A 428 -0.197 -4.485 -3.147 1.00 0.79 C ATOM 1049 O GLY A 428 0.435 -3.625 -2.532 1.00 1.72 O ATOM 0 H GLY A 428 0.232 -2.694 -5.735 1.00 0.52 H new ATOM 0 HA2 GLY A 428 -1.317 -4.893 -4.923 1.00 0.65 H new ATOM 0 HA3 GLY A 428 0.419 -4.856 -5.162 1.00 0.65 H new ATOM 1053 N ARG A 429 -0.738 -5.549 -2.559 1.00 0.54 N ATOM 1054 CA ARG A 429 -0.617 -5.782 -1.123 1.00 0.54 C ATOM 1055 C ARG A 429 0.836 -5.699 -0.656 1.00 0.49 C ATOM 1056 O ARG A 429 1.118 -5.161 0.414 1.00 0.53 O ATOM 1057 CB ARG A 429 -1.218 -7.145 -0.752 1.00 0.68 C ATOM 1058 CG ARG A 429 -0.848 -7.623 0.647 1.00 0.83 C ATOM 1059 CD ARG A 429 -1.166 -6.578 1.707 1.00 0.85 C ATOM 1060 NE ARG A 429 -0.635 -6.949 3.015 1.00 1.20 N ATOM 1061 CZ ARG A 429 -0.597 -6.123 4.057 1.00 1.26 C ATOM 1062 NH1 ARG A 429 -1.028 -4.874 3.932 1.00 1.73 N ATOM 1063 NH2 ARG A 429 -0.122 -6.542 5.222 1.00 1.65 N ATOM 0 H ARG A 429 -1.266 -6.266 -3.057 1.00 0.54 H new ATOM 0 HA ARG A 429 -1.173 -4.995 -0.613 1.00 0.54 H new ATOM 0 HB2 ARG A 429 -2.304 -7.086 -0.830 1.00 0.68 H new ATOM 0 HB3 ARG A 429 -0.887 -7.887 -1.478 1.00 0.68 H new ATOM 0 HG2 ARG A 429 -1.388 -8.543 0.871 1.00 0.83 H new ATOM 0 HG3 ARG A 429 0.215 -7.861 0.680 1.00 0.83 H new ATOM 0 HD2 ARG A 429 -0.749 -5.617 1.406 1.00 0.85 H new ATOM 0 HD3 ARG A 429 -2.246 -6.449 1.777 1.00 0.85 H new ATOM 0 HE ARG A 429 -0.273 -7.895 3.137 1.00 1.20 H new ATOM 0 HH11 ARG A 429 -1.389 -4.546 3.036 1.00 1.73 H new ATOM 0 HH12 ARG A 429 -0.998 -4.242 4.732 1.00 1.73 H new ATOM 0 HH21 ARG A 429 0.215 -7.500 5.321 1.00 1.65 H new ATOM 0 HH22 ARG A 429 -0.094 -5.907 6.020 1.00 1.65 H new ATOM 1077 N HIS A 430 1.754 -6.237 -1.453 1.00 0.49 N ATOM 1078 CA HIS A 430 3.173 -6.223 -1.099 1.00 0.53 C ATOM 1079 C HIS A 430 3.654 -4.811 -0.775 1.00 0.47 C ATOM 1080 O HIS A 430 4.564 -4.626 0.032 1.00 0.49 O ATOM 1081 CB HIS A 430 4.020 -6.805 -2.231 1.00 0.65 C ATOM 1082 CG HIS A 430 3.891 -6.072 -3.530 1.00 0.77 C ATOM 1083 ND1 HIS A 430 2.705 -5.970 -4.227 1.00 1.20 N ATOM 1084 CD2 HIS A 430 4.815 -5.409 -4.268 1.00 1.47 C ATOM 1085 CE1 HIS A 430 2.906 -5.279 -5.335 1.00 1.31 C ATOM 1086 NE2 HIS A 430 4.176 -4.926 -5.382 1.00 1.46 N ATOM 0 H HIS A 430 1.544 -6.686 -2.344 1.00 0.49 H new ATOM 0 HA HIS A 430 3.290 -6.841 -0.209 1.00 0.53 H new ATOM 0 HB2 HIS A 430 5.067 -6.801 -1.926 1.00 0.65 H new ATOM 0 HB3 HIS A 430 3.737 -7.846 -2.384 1.00 0.65 H new ATOM 0 HD2 HIS A 430 5.860 -5.284 -4.024 1.00 1.47 H new ATOM 0 HE1 HIS A 430 2.157 -5.043 -6.077 1.00 1.31 H new ATOM 0 HE2 HIS A 430 4.613 -4.382 -6.126 1.00 1.46 H new ATOM 1095 N ARG A 431 3.044 -3.824 -1.417 1.00 0.43 N ATOM 1096 CA ARG A 431 3.416 -2.431 -1.207 1.00 0.41 C ATOM 1097 C ARG A 431 2.805 -1.874 0.078 1.00 0.37 C ATOM 1098 O ARG A 431 3.417 -1.050 0.756 1.00 0.57 O ATOM 1099 CB ARG A 431 2.986 -1.587 -2.407 1.00 0.44 C ATOM 1100 CG ARG A 431 3.573 -2.068 -3.724 1.00 0.53 C ATOM 1101 CD ARG A 431 3.159 -1.176 -4.882 1.00 0.64 C ATOM 1102 NE ARG A 431 3.629 -1.691 -6.168 1.00 1.39 N ATOM 1103 CZ ARG A 431 4.914 -1.838 -6.487 1.00 2.05 C ATOM 1104 NH1 ARG A 431 5.864 -1.491 -5.629 1.00 2.55 N ATOM 1105 NH2 ARG A 431 5.250 -2.330 -7.671 1.00 2.84 N ATOM 0 H ARG A 431 2.289 -3.962 -2.088 1.00 0.43 H new ATOM 0 HA ARG A 431 4.500 -2.385 -1.105 1.00 0.41 H new ATOM 0 HB2 ARG A 431 1.898 -1.596 -2.477 1.00 0.44 H new ATOM 0 HB3 ARG A 431 3.286 -0.552 -2.240 1.00 0.44 H new ATOM 0 HG2 ARG A 431 4.660 -2.089 -3.652 1.00 0.53 H new ATOM 0 HG3 ARG A 431 3.246 -3.090 -3.917 1.00 0.53 H new ATOM 0 HD2 ARG A 431 2.073 -1.089 -4.902 1.00 0.64 H new ATOM 0 HD3 ARG A 431 3.556 -0.173 -4.727 1.00 0.64 H new ATOM 0 HE ARG A 431 2.930 -1.954 -6.863 1.00 1.39 H new ATOM 0 HH11 ARG A 431 5.613 -1.108 -4.717 1.00 2.55 H new ATOM 0 HH12 ARG A 431 6.846 -1.607 -5.881 1.00 2.55 H new ATOM 0 HH21 ARG A 431 4.525 -2.596 -8.337 1.00 2.84 H new ATOM 0 HH22 ARG A 431 6.234 -2.443 -7.916 1.00 2.84 H new ATOM 1119 N ILE A 432 1.594 -2.315 0.406 1.00 0.39 N ATOM 1120 CA ILE A 432 0.911 -1.842 1.606 1.00 0.36 C ATOM 1121 C ILE A 432 1.249 -2.690 2.828 1.00 0.38 C ATOM 1122 O ILE A 432 1.348 -3.914 2.744 1.00 0.44 O ATOM 1123 CB ILE A 432 -0.618 -1.820 1.416 1.00 0.38 C ATOM 1124 CG1 ILE A 432 -0.985 -0.894 0.256 1.00 0.40 C ATOM 1125 CG2 ILE A 432 -1.310 -1.375 2.699 1.00 0.42 C ATOM 1126 CD1 ILE A 432 -2.474 -0.765 0.027 1.00 0.46 C ATOM 0 H ILE A 432 1.067 -2.997 -0.140 1.00 0.39 H new ATOM 0 HA ILE A 432 1.266 -0.826 1.775 1.00 0.36 H new ATOM 0 HB ILE A 432 -0.958 -2.828 1.180 1.00 0.38 H new ATOM 0 HG12 ILE A 432 -0.569 0.095 0.447 1.00 0.40 H new ATOM 0 HG13 ILE A 432 -0.517 -1.266 -0.656 1.00 0.40 H new ATOM 0 HG21 ILE A 432 -2.389 -1.365 2.546 1.00 0.42 H new ATOM 0 HG22 ILE A 432 -1.064 -2.067 3.504 1.00 0.42 H new ATOM 0 HG23 ILE A 432 -0.973 -0.373 2.966 1.00 0.42 H new ATOM 0 HD11 ILE A 432 -2.656 -0.093 -0.811 1.00 0.46 H new ATOM 0 HD12 ILE A 432 -2.894 -1.746 -0.196 1.00 0.46 H new ATOM 0 HD13 ILE A 432 -2.947 -0.364 0.923 1.00 0.46 H new ATOM 1138 N SER A 433 1.417 -2.021 3.965 1.00 0.34 N ATOM 1139 CA SER A 433 1.738 -2.690 5.221 1.00 0.38 C ATOM 1140 C SER A 433 1.390 -1.794 6.405 1.00 0.36 C ATOM 1141 O SER A 433 1.610 -0.583 6.365 1.00 0.34 O ATOM 1142 CB SER A 433 3.221 -3.064 5.267 1.00 0.41 C ATOM 1143 OG SER A 433 3.554 -3.968 4.227 1.00 0.53 O ATOM 0 H SER A 433 1.335 -1.007 4.042 1.00 0.34 H new ATOM 0 HA SER A 433 1.145 -3.602 5.283 1.00 0.38 H new ATOM 0 HB2 SER A 433 3.829 -2.164 5.178 1.00 0.41 H new ATOM 0 HB3 SER A 433 3.456 -3.513 6.232 1.00 0.41 H new ATOM 0 HG SER A 433 2.733 -4.309 3.815 1.00 0.53 H new ATOM 1149 N ASP A 434 0.841 -2.396 7.456 1.00 0.43 N ATOM 1150 CA ASP A 434 0.452 -1.655 8.655 1.00 0.48 C ATOM 1151 C ASP A 434 1.670 -1.173 9.444 1.00 0.48 C ATOM 1152 O ASP A 434 1.551 -0.803 10.613 1.00 0.74 O ATOM 1153 CB ASP A 434 -0.439 -2.522 9.546 1.00 0.60 C ATOM 1154 CG ASP A 434 0.241 -3.806 9.980 1.00 0.83 C ATOM 1155 OD1 ASP A 434 1.283 -3.725 10.664 1.00 1.35 O ATOM 1156 OD2 ASP A 434 -0.267 -4.893 9.636 1.00 1.12 O ATOM 0 H ASP A 434 0.654 -3.398 7.503 1.00 0.43 H new ATOM 0 HA ASP A 434 -0.105 -0.775 8.332 1.00 0.48 H new ATOM 0 HB2 ASP A 434 -0.728 -1.952 10.429 1.00 0.60 H new ATOM 0 HB3 ASP A 434 -1.356 -2.765 9.010 1.00 0.60 H new ATOM 1161 N ASN A 435 2.838 -1.175 8.806 1.00 0.43 N ATOM 1162 CA ASN A 435 4.065 -0.734 9.460 1.00 0.47 C ATOM 1163 C ASN A 435 5.153 -0.425 8.434 1.00 0.39 C ATOM 1164 O ASN A 435 5.358 -1.178 7.481 1.00 0.38 O ATOM 1165 CB ASN A 435 4.551 -1.796 10.451 1.00 0.59 C ATOM 1166 CG ASN A 435 4.779 -3.145 9.799 1.00 1.26 C ATOM 1167 OD1 ASN A 435 5.625 -3.287 8.919 1.00 2.16 O ATOM 1168 ND2 ASN A 435 4.022 -4.147 10.231 1.00 1.81 N ATOM 0 H ASN A 435 2.959 -1.477 7.839 1.00 0.43 H new ATOM 0 HA ASN A 435 3.847 0.183 10.007 1.00 0.47 H new ATOM 0 HB2 ASN A 435 5.479 -1.459 10.912 1.00 0.59 H new ATOM 0 HB3 ASN A 435 3.818 -1.903 11.251 1.00 0.59 H new ATOM 0 HD21 ASN A 435 4.131 -5.078 9.830 1.00 1.81 H new ATOM 0 HD22 ASN A 435 3.331 -3.985 10.964 1.00 1.81 H new ATOM 1175 N ALA A 436 5.839 0.695 8.636 1.00 0.49 N ATOM 1176 CA ALA A 436 6.903 1.124 7.734 1.00 0.55 C ATOM 1177 C ALA A 436 8.082 0.157 7.755 1.00 0.55 C ATOM 1178 O ALA A 436 8.769 -0.017 6.748 1.00 0.54 O ATOM 1179 CB ALA A 436 7.366 2.527 8.098 1.00 0.75 C ATOM 0 H ALA A 436 5.676 1.326 9.421 1.00 0.49 H new ATOM 0 HA ALA A 436 6.498 1.131 6.722 1.00 0.55 H new ATOM 0 HB1 ALA A 436 8.160 2.836 7.418 1.00 0.75 H new ATOM 0 HB2 ALA A 436 6.528 3.219 8.016 1.00 0.75 H new ATOM 0 HB3 ALA A 436 7.742 2.532 9.121 1.00 0.75 H new ATOM 1185 N ASP A 437 8.319 -0.458 8.910 1.00 0.65 N ATOM 1186 CA ASP A 437 9.426 -1.398 9.071 1.00 0.75 C ATOM 1187 C ASP A 437 9.440 -2.439 7.955 1.00 0.71 C ATOM 1188 O ASP A 437 10.502 -2.796 7.441 1.00 0.78 O ATOM 1189 CB ASP A 437 9.331 -2.095 10.429 1.00 0.92 C ATOM 1190 CG ASP A 437 9.358 -1.115 11.586 1.00 1.02 C ATOM 1191 OD1 ASP A 437 10.360 -0.381 11.719 1.00 1.34 O ATOM 1192 OD2 ASP A 437 8.378 -1.083 12.359 1.00 1.34 O ATOM 0 H ASP A 437 7.758 -0.322 9.751 1.00 0.65 H new ATOM 0 HA ASP A 437 10.355 -0.831 9.018 1.00 0.75 H new ATOM 0 HB2 ASP A 437 8.411 -2.678 10.472 1.00 0.92 H new ATOM 0 HB3 ASP A 437 10.158 -2.797 10.532 1.00 0.92 H new ATOM 1197 N ASP A 438 8.261 -2.925 7.585 1.00 0.68 N ATOM 1198 CA ASP A 438 8.146 -3.926 6.529 1.00 0.73 C ATOM 1199 C ASP A 438 7.804 -3.278 5.190 1.00 0.73 C ATOM 1200 O ASP A 438 6.880 -3.709 4.500 1.00 1.35 O ATOM 1201 CB ASP A 438 7.082 -4.965 6.893 1.00 0.88 C ATOM 1202 CG ASP A 438 7.410 -5.708 8.174 1.00 1.08 C ATOM 1203 OD1 ASP A 438 8.467 -5.418 8.775 1.00 1.56 O ATOM 1204 OD2 ASP A 438 6.610 -6.577 8.580 1.00 1.36 O ATOM 0 H ASP A 438 7.372 -2.643 7.999 1.00 0.68 H new ATOM 0 HA ASP A 438 9.112 -4.422 6.432 1.00 0.73 H new ATOM 0 HB2 ASP A 438 6.117 -4.470 7.001 1.00 0.88 H new ATOM 0 HB3 ASP A 438 6.983 -5.681 6.077 1.00 0.88 H new ATOM 1209 N LEU A 439 8.555 -2.239 4.826 1.00 0.54 N ATOM 1210 CA LEU A 439 8.325 -1.533 3.569 1.00 0.53 C ATOM 1211 C LEU A 439 9.628 -0.975 3.000 1.00 0.61 C ATOM 1212 O LEU A 439 10.263 -1.606 2.154 1.00 0.86 O ATOM 1213 CB LEU A 439 7.318 -0.397 3.773 1.00 0.52 C ATOM 1214 CG LEU A 439 5.896 -0.837 4.122 1.00 0.63 C ATOM 1215 CD1 LEU A 439 5.027 0.372 4.422 1.00 1.12 C ATOM 1216 CD2 LEU A 439 5.296 -1.651 2.987 1.00 1.10 C ATOM 0 H LEU A 439 9.325 -1.869 5.383 1.00 0.54 H new ATOM 0 HA LEU A 439 7.919 -2.249 2.855 1.00 0.53 H new ATOM 0 HB2 LEU A 439 7.685 0.253 4.568 1.00 0.52 H new ATOM 0 HB3 LEU A 439 7.282 0.202 2.863 1.00 0.52 H new ATOM 0 HG LEU A 439 5.938 -1.465 5.012 1.00 0.63 H new ATOM 0 HD11 LEU A 439 4.018 0.042 4.669 1.00 1.12 H new ATOM 0 HD12 LEU A 439 5.446 0.921 5.265 1.00 1.12 H new ATOM 0 HD13 LEU A 439 4.993 1.022 3.547 1.00 1.12 H new ATOM 0 HD21 LEU A 439 4.284 -1.956 3.253 1.00 1.10 H new ATOM 0 HD22 LEU A 439 5.266 -1.046 2.081 1.00 1.10 H new ATOM 0 HD23 LEU A 439 5.907 -2.536 2.812 1.00 1.10 H new ATOM 1228 N GLY A 440 10.022 0.208 3.464 1.00 0.59 N ATOM 1229 CA GLY A 440 11.246 0.820 2.981 1.00 0.77 C ATOM 1230 C GLY A 440 11.637 2.048 3.776 1.00 0.96 C ATOM 1231 O GLY A 440 12.248 2.972 3.237 1.00 1.36 O ATOM 0 H GLY A 440 9.517 0.752 4.164 1.00 0.59 H new ATOM 0 HA2 GLY A 440 12.055 0.090 3.026 1.00 0.77 H new ATOM 0 HA3 GLY A 440 11.122 1.094 1.933 1.00 0.77 H new ATOM 1235 N GLY A 441 11.289 2.060 5.061 1.00 0.93 N ATOM 1236 CA GLY A 441 11.620 3.191 5.909 1.00 1.24 C ATOM 1237 C GLY A 441 10.929 4.468 5.471 1.00 1.14 C ATOM 1238 O GLY A 441 10.636 4.644 4.290 1.00 1.83 O ATOM 0 H GLY A 441 10.784 1.307 5.529 1.00 0.93 H new ATOM 0 HA2 GLY A 441 11.339 2.964 6.937 1.00 1.24 H new ATOM 0 HA3 GLY A 441 12.699 3.344 5.900 1.00 1.24 H new ATOM 1242 N ILE A 442 10.671 5.360 6.423 1.00 1.10 N ATOM 1243 CA ILE A 442 10.019 6.629 6.124 1.00 1.03 C ATOM 1244 C ILE A 442 10.902 7.482 5.213 1.00 1.05 C ATOM 1245 O ILE A 442 11.591 8.392 5.678 1.00 1.39 O ATOM 1246 CB ILE A 442 9.696 7.417 7.410 1.00 1.26 C ATOM 1247 CG1 ILE A 442 8.865 6.557 8.368 1.00 1.41 C ATOM 1248 CG2 ILE A 442 8.960 8.709 7.078 1.00 1.38 C ATOM 1249 CD1 ILE A 442 7.525 6.131 7.803 1.00 1.48 C ATOM 0 H ILE A 442 10.904 5.227 7.407 1.00 1.10 H new ATOM 0 HA ILE A 442 9.082 6.401 5.615 1.00 1.03 H new ATOM 0 HB ILE A 442 10.635 7.675 7.901 1.00 1.26 H new ATOM 0 HG12 ILE A 442 9.437 5.667 8.631 1.00 1.41 H new ATOM 0 HG13 ILE A 442 8.699 7.114 9.290 1.00 1.41 H new ATOM 0 HG21 ILE A 442 8.741 9.250 7.999 1.00 1.38 H new ATOM 0 HG22 ILE A 442 9.584 9.328 6.433 1.00 1.38 H new ATOM 0 HG23 ILE A 442 8.027 8.475 6.565 1.00 1.38 H new ATOM 0 HD11 ILE A 442 6.996 5.526 8.539 1.00 1.48 H new ATOM 0 HD12 ILE A 442 6.933 7.015 7.566 1.00 1.48 H new ATOM 0 HD13 ILE A 442 7.682 5.546 6.897 1.00 1.48 H new