USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 706 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: B 367 THR OG1 : rot -18:sc= 0.488 USER MOD Set 1.2: B 379 SER OG : rot 20:sc= -0.161! USER MOD Set 2.1: B 362 SER OG : rot 51:sc= -0.312! USER MOD Set 2.2: B 365 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 352 SER OG : rot -128:sc= -3.98! USER MOD Set 3.2: B 355 ASN : amide:sc= -4.98! C(o=-9!,f=-11!) USER MOD Set 4.1: B 333 THR OG1 : rot -143:sc= -2.29! USER MOD Set 4.2: B 336 CYS SG : rot 180:sc= -0.56! USER MOD Set 5.1: B 311 SER OG : rot -120:sc= -0.364 USER MOD Set 5.2: B 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 334 LYS NZ :NH3+ -127:sc= -0.143 (180deg=-0.726) USER MOD Single : B 338 MET CE :methyl -147:sc= -0.125 (180deg=-3.56!) USER MOD Single : B 343 LYS NZ :NH3+ 161:sc= -0.376 (180deg=-1.6!) USER MOD Single : B 344 THR OG1 : rot -150:sc= -0.644 USER MOD Single : B 345 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 349 GLN : amide:sc= -1.39 K(o=-1.4,f=-0.87) USER MOD Single : B 354 THR OG1 : rot -47:sc= -0.199 USER MOD Single : B 357 LYS NZ :NH3+ 143:sc= -0.102 (180deg=-1.87!) USER MOD Single : B 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 373 TYR OH : rot 180:sc= 0 USER MOD Single : B 374 GLN : amide:sc= -0.0654 X(o=-0.065,f=-0.065) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.03! USER MOD Single : B 378 TYR OH : rot 180:sc= 0 USER MOD Single : B 381 GLN : amide:sc= -0.524 K(o=-0.52,f=-4.3!) USER MOD Single : B 382 THR OG1 : rot 180:sc= 0.638 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0603 USER MOD Single : B 387 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : B 390 GLN : amide:sc= -3.53! K(o=-3.5!,f=-2.6) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 0.981 11.829 1.936 1.00 0.00 N ATOM 126 CA LEU A 15 0.309 10.554 1.684 1.00 0.00 C ATOM 127 C LEU A 15 -0.862 10.408 2.644 1.00 0.00 C ATOM 128 O LEU A 15 -1.947 9.970 2.266 1.00 0.00 O ATOM 129 CB LEU A 15 1.288 9.387 1.892 1.00 0.00 C ATOM 130 CG LEU A 15 2.213 9.162 0.677 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.408 8.837 -0.582 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.048 10.400 0.398 1.00 0.00 C ATOM 0 HA LEU A 15 -0.049 10.536 0.655 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.896 9.581 2.775 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.724 8.475 2.088 1.00 0.00 H new ATOM 0 HG LEU A 15 2.861 8.321 0.924 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.089 8.684 -1.420 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.826 7.930 -0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.735 9.664 -0.807 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.692 10.218 -0.462 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.390 11.243 0.187 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.662 10.629 1.269 1.00 0.00 H new ATOM 144 N LEU A 16 -0.643 10.798 3.886 1.00 0.00 N ATOM 145 CA LEU A 16 -1.695 10.727 4.881 1.00 0.00 C ATOM 146 C LEU A 16 -2.883 11.572 4.422 1.00 0.00 C ATOM 147 O LEU A 16 -4.036 11.170 4.562 1.00 0.00 O ATOM 148 CB LEU A 16 -1.162 11.223 6.227 1.00 0.00 C ATOM 149 CG LEU A 16 -1.602 10.284 7.359 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.123 10.117 7.342 1.00 0.00 C ATOM 151 CD2 LEU A 16 -0.931 8.911 7.191 1.00 0.00 C ATOM 0 H LEU A 16 0.246 11.164 4.227 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.026 9.695 5.000 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.074 11.279 6.195 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.528 12.231 6.420 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.301 10.718 8.312 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.425 9.449 8.149 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.597 11.089 7.479 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.432 9.694 6.386 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.248 8.250 7.998 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.221 8.479 6.233 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.152 9.029 7.223 1.00 0.00 H new ATOM 163 N GLY A 17 -2.594 12.728 3.828 1.00 0.00 N ATOM 164 CA GLY A 17 -3.656 13.585 3.310 1.00 0.00 C ATOM 165 C GLY A 17 -4.435 12.827 2.246 1.00 0.00 C ATOM 166 O GLY A 17 -5.666 12.814 2.242 1.00 0.00 O ATOM 0 H GLY A 17 -1.649 13.088 3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.322 13.889 4.118 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.231 14.496 2.888 1.00 0.00 H new ATOM 170 N GLU A 18 -3.699 12.171 1.357 1.00 0.00 N ATOM 171 CA GLU A 18 -4.310 11.375 0.306 1.00 0.00 C ATOM 172 C GLU A 18 -5.133 10.258 0.919 1.00 0.00 C ATOM 173 O GLU A 18 -6.172 9.883 0.397 1.00 0.00 O ATOM 174 CB GLU A 18 -3.207 10.800 -0.586 1.00 0.00 C ATOM 175 CG GLU A 18 -2.732 11.875 -1.560 1.00 0.00 C ATOM 176 CD GLU A 18 -1.698 11.294 -2.517 1.00 0.00 C ATOM 177 OE1 GLU A 18 -1.275 10.172 -2.291 1.00 0.00 O ATOM 178 OE2 GLU A 18 -1.344 11.981 -3.460 1.00 0.00 O1- ATOM 0 H GLU A 18 -2.679 12.176 1.345 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.971 11.998 -0.296 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.374 10.453 0.025 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.581 9.936 -1.135 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.579 12.267 -2.122 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.300 12.711 -1.009 1.00 0.00 H new ATOM 394 N VAL B 310 9.458 -12.651 0.693 1.00 0.00 N ATOM 395 CA VAL B 310 8.167 -12.007 0.486 1.00 0.00 C ATOM 396 C VAL B 310 7.411 -11.874 1.808 1.00 0.00 C ATOM 397 O VAL B 310 7.330 -12.824 2.587 1.00 0.00 O ATOM 398 CB VAL B 310 7.334 -12.824 -0.504 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.928 -12.237 -0.593 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.992 -12.772 -1.884 1.00 0.00 C ATOM 0 HA VAL B 310 8.339 -11.009 0.082 1.00 0.00 H new ATOM 0 HB VAL B 310 7.276 -13.858 -0.164 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.335 -12.819 -1.298 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.458 -12.269 0.390 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.986 -11.203 -0.934 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.400 -13.353 -2.591 1.00 0.00 H new ATOM 0 HG22 VAL B 310 8.048 -11.737 -2.222 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.998 -13.188 -1.824 1.00 0.00 H new ATOM 410 N SER B 311 6.860 -10.686 2.049 1.00 0.00 N ATOM 411 CA SER B 311 6.111 -10.424 3.272 1.00 0.00 C ATOM 412 C SER B 311 4.631 -10.262 2.954 1.00 0.00 C ATOM 413 O SER B 311 4.278 -9.895 1.842 1.00 0.00 O ATOM 414 CB SER B 311 6.632 -9.155 3.926 1.00 0.00 C ATOM 415 OG SER B 311 7.777 -8.699 3.218 1.00 0.00 O ATOM 0 H SER B 311 6.919 -9.891 1.413 1.00 0.00 H new ATOM 0 HA SER B 311 6.239 -11.265 3.954 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.859 -8.387 3.924 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.887 -9.347 4.968 1.00 0.00 H new ATOM 0 HG SER B 311 8.547 -8.674 3.823 1.00 0.00 H new ATOM 421 N PHE B 312 3.772 -10.565 3.925 1.00 0.00 N ATOM 422 CA PHE B 312 2.328 -10.481 3.725 1.00 0.00 C ATOM 423 C PHE B 312 1.658 -9.668 4.832 1.00 0.00 C ATOM 424 O PHE B 312 1.950 -9.877 6.012 1.00 0.00 O ATOM 425 CB PHE B 312 1.772 -11.903 3.745 1.00 0.00 C ATOM 426 CG PHE B 312 2.090 -12.599 2.441 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.481 -12.177 1.253 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.995 -13.669 2.420 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.776 -12.822 0.048 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.289 -14.315 1.212 1.00 0.00 C ATOM 431 CZ PHE B 312 2.678 -13.891 0.027 1.00 0.00 C ATOM 0 H PHE B 312 4.051 -10.871 4.857 1.00 0.00 H new ATOM 0 HA PHE B 312 2.126 -9.985 2.776 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.202 -12.459 4.578 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.693 -11.879 3.901 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.783 -11.353 1.267 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.466 -13.996 3.335 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.307 -12.494 -0.868 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.987 -15.139 1.196 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.903 -14.389 -0.904 1.00 0.00 H new ATOM 441 N PHE B 313 0.743 -8.755 4.467 1.00 0.00 N ATOM 442 CA PHE B 313 0.051 -7.965 5.475 1.00 0.00 C ATOM 443 C PHE B 313 -1.420 -7.831 5.136 1.00 0.00 C ATOM 444 O PHE B 313 -1.782 -7.441 4.029 1.00 0.00 O ATOM 445 CB PHE B 313 0.652 -6.571 5.573 1.00 0.00 C ATOM 446 CG PHE B 313 1.960 -6.628 6.317 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.136 -6.959 5.639 1.00 0.00 C ATOM 448 CD2 PHE B 313 1.994 -6.339 7.685 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.352 -7.002 6.331 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.209 -6.380 8.377 1.00 0.00 C ATOM 451 CZ PHE B 313 4.389 -6.711 7.699 1.00 0.00 C ATOM 0 H PHE B 313 0.476 -8.555 3.503 1.00 0.00 H new ATOM 0 HA PHE B 313 0.163 -8.482 6.428 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.809 -6.162 4.575 1.00 0.00 H new ATOM 0 HB3 PHE B 313 -0.039 -5.903 6.086 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.107 -7.181 4.583 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.083 -6.084 8.207 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.262 -7.260 5.809 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.237 -6.157 9.433 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.328 -6.742 8.232 1.00 0.00 H new ATOM 461 N LEU B 314 -2.261 -8.125 6.108 1.00 0.00 N ATOM 462 CA LEU B 314 -3.685 -8.000 5.919 1.00 0.00 C ATOM 463 C LEU B 314 -4.091 -6.559 6.124 1.00 0.00 C ATOM 464 O LEU B 314 -4.101 -6.007 7.213 1.00 0.00 O ATOM 465 CB LEU B 314 -4.464 -9.018 6.777 1.00 0.00 C ATOM 466 CG LEU B 314 -4.951 -8.491 8.141 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.812 -7.837 8.932 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.131 -7.520 7.972 1.00 0.00 C ATOM 0 H LEU B 314 -1.980 -8.451 7.033 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.951 -8.258 4.894 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.328 -9.362 6.209 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.828 -9.887 6.947 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.300 -9.349 8.715 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.193 -7.477 9.888 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.024 -8.569 9.108 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.409 -6.999 8.364 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.453 -7.165 8.951 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.820 -6.672 7.363 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.958 -8.034 7.483 1.00 0.00 H new ATOM 480 N VAL B 315 -4.334 -5.941 5.011 1.00 0.00 N ATOM 481 CA VAL B 315 -4.670 -4.539 4.974 1.00 0.00 C ATOM 482 C VAL B 315 -6.042 -4.345 4.347 1.00 0.00 C ATOM 483 O VAL B 315 -6.492 -5.195 3.592 1.00 0.00 O ATOM 484 CB VAL B 315 -3.615 -3.839 4.134 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.239 -4.000 4.773 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.612 -4.447 2.723 1.00 0.00 C ATOM 0 H VAL B 315 -4.307 -6.390 4.095 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.697 -4.127 5.983 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.847 -2.776 4.075 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.492 -3.494 4.161 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.248 -3.562 5.771 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -1.992 -5.059 4.844 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -2.857 -3.950 2.114 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.384 -5.511 2.786 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.593 -4.312 2.267 1.00 0.00 H new ATOM 496 N LYS B 316 -6.701 -3.226 4.639 1.00 0.00 N ATOM 497 CA LYS B 316 -8.006 -2.978 4.045 1.00 0.00 C ATOM 498 C LYS B 316 -7.845 -2.096 2.823 1.00 0.00 C ATOM 499 O LYS B 316 -7.049 -1.168 2.820 1.00 0.00 O ATOM 500 CB LYS B 316 -8.942 -2.311 5.026 1.00 0.00 C ATOM 501 CG LYS B 316 -8.717 -2.873 6.422 1.00 0.00 C ATOM 502 CD LYS B 316 -10.019 -2.802 7.224 1.00 0.00 C ATOM 503 CE LYS B 316 -10.599 -1.388 7.144 1.00 0.00 C ATOM 504 NZ LYS B 316 -11.357 -1.090 8.393 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.362 -2.496 5.266 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.438 -3.938 3.762 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.774 -1.234 5.027 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -9.976 -2.472 4.722 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.374 -3.906 6.358 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.935 -2.309 6.930 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -10.738 -3.523 6.833 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -9.832 -3.070 8.264 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -9.797 -0.662 7.010 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -11.255 -1.301 6.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -11.751 -0.129 8.339 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -12.131 -1.776 8.501 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -10.718 -1.157 9.211 1.00 0.00 H new ATOM 518 N GLU B 317 -8.594 -2.412 1.788 1.00 0.00 N ATOM 519 CA GLU B 317 -8.502 -1.678 0.527 1.00 0.00 C ATOM 520 C GLU B 317 -9.845 -1.155 0.043 1.00 0.00 C ATOM 521 O GLU B 317 -10.900 -1.695 0.349 1.00 0.00 O ATOM 522 CB GLU B 317 -7.939 -2.594 -0.546 1.00 0.00 C ATOM 523 CG GLU B 317 -7.175 -1.766 -1.585 1.00 0.00 C ATOM 524 CD GLU B 317 -7.248 -2.438 -2.951 1.00 0.00 C ATOM 525 OE1 GLU B 317 -7.051 -3.640 -3.008 1.00 0.00 O ATOM 526 OE2 GLU B 317 -7.492 -1.739 -3.920 1.00 0.00 O1- ATOM 0 H GLU B 317 -9.276 -3.171 1.787 1.00 0.00 H new ATOM 0 HA GLU B 317 -7.854 -0.821 0.710 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.275 -3.332 -0.096 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -8.747 -3.144 -1.028 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -7.597 -0.762 -1.642 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -6.134 -1.657 -1.280 1.00 0.00 H new ATOM 678 N VAL B 326 -11.912 -2.384 2.410 1.00 0.00 N ATOM 679 CA VAL B 326 -12.321 -3.747 2.656 1.00 0.00 C ATOM 680 C VAL B 326 -11.122 -4.583 3.062 1.00 0.00 C ATOM 681 O VAL B 326 -10.122 -4.552 2.348 1.00 0.00 O ATOM 682 CB VAL B 326 -12.887 -4.292 1.359 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.800 -5.815 1.338 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.329 -3.828 1.225 1.00 0.00 C ATOM 0 HA VAL B 326 -13.060 -3.782 3.456 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.307 -3.918 0.515 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -13.210 -6.190 0.400 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.758 -6.121 1.426 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.370 -6.224 2.173 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.750 -4.212 0.296 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -14.911 -4.200 2.068 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.361 -2.739 1.214 1.00 0.00 H new ATOM 694 N PRO B 327 -11.182 -5.343 4.151 1.00 0.00 N ATOM 695 CA PRO B 327 -10.035 -6.183 4.559 1.00 0.00 C ATOM 696 C PRO B 327 -9.392 -6.757 3.322 1.00 0.00 C ATOM 697 O PRO B 327 -10.075 -7.019 2.337 1.00 0.00 O ATOM 698 CB PRO B 327 -10.663 -7.262 5.435 1.00 0.00 C ATOM 699 CG PRO B 327 -11.882 -6.629 6.027 1.00 0.00 C ATOM 700 CD PRO B 327 -12.311 -5.487 5.093 1.00 0.00 C ATOM 0 HA PRO B 327 -9.252 -5.648 5.096 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.923 -8.143 4.848 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.972 -7.589 6.212 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.683 -7.361 6.129 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.669 -6.248 7.026 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.237 -5.727 4.570 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.487 -4.565 5.647 1.00 0.00 H new ATOM 708 N ARG B 328 -8.093 -6.895 3.333 1.00 0.00 N ATOM 709 CA ARG B 328 -7.428 -7.366 2.156 1.00 0.00 C ATOM 710 C ARG B 328 -6.112 -7.960 2.550 1.00 0.00 C ATOM 711 O ARG B 328 -5.848 -8.160 3.732 1.00 0.00 O ATOM 712 CB ARG B 328 -7.233 -6.216 1.154 1.00 0.00 C ATOM 713 CG ARG B 328 -7.246 -6.751 -0.282 1.00 0.00 C ATOM 714 CD ARG B 328 -8.610 -6.490 -0.921 1.00 0.00 C ATOM 715 NE ARG B 328 -9.676 -6.935 -0.036 1.00 0.00 N ATOM 716 CZ ARG B 328 -10.091 -8.198 -0.037 1.00 0.00 C ATOM 717 NH1 ARG B 328 -9.541 -9.065 -0.843 1.00 0.00 N ATOM 718 NH2 ARG B 328 -11.047 -8.572 0.769 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.488 -6.692 4.128 1.00 0.00 H new ATOM 0 HA ARG B 328 -8.036 -8.129 1.669 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.024 -5.477 1.281 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.288 -5.709 1.352 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -6.462 -6.269 -0.866 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -7.032 -7.820 -0.283 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -8.723 -5.426 -1.131 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -8.678 -7.013 -1.875 1.00 0.00 H new ATOM 0 HE ARG B 328 -10.113 -6.265 0.597 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -8.793 -8.773 -1.472 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.859 -10.034 -0.844 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.476 -7.895 1.400 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.365 -9.541 0.768 1.00 0.00 H new ATOM 732 N LEU B 329 -5.306 -8.282 1.572 1.00 0.00 N ATOM 733 CA LEU B 329 -4.054 -8.911 1.853 1.00 0.00 C ATOM 734 C LEU B 329 -3.011 -8.389 0.894 1.00 0.00 C ATOM 735 O LEU B 329 -3.191 -8.432 -0.305 1.00 0.00 O ATOM 736 CB LEU B 329 -4.311 -10.418 1.745 1.00 0.00 C ATOM 737 CG LEU B 329 -3.205 -11.283 2.378 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.153 -12.638 1.663 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.826 -10.635 2.264 1.00 0.00 C ATOM 0 H LEU B 329 -5.497 -8.118 0.583 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.665 -8.693 2.848 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.261 -10.651 2.226 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.412 -10.686 0.693 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.447 -11.396 3.435 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.371 -13.254 2.107 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.114 -13.141 1.766 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.936 -12.484 0.606 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.080 -11.283 2.725 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.579 -10.488 1.213 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.834 -9.671 2.773 1.00 0.00 H new ATOM 751 N LEU B 330 -1.931 -7.864 1.451 1.00 0.00 N ATOM 752 CA LEU B 330 -0.859 -7.300 0.666 1.00 0.00 C ATOM 753 C LEU B 330 0.294 -8.263 0.647 1.00 0.00 C ATOM 754 O LEU B 330 0.425 -9.078 1.550 1.00 0.00 O ATOM 755 CB LEU B 330 -0.447 -5.977 1.317 1.00 0.00 C ATOM 756 CG LEU B 330 0.878 -5.440 0.756 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.693 -5.025 -0.699 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.299 -4.234 1.592 1.00 0.00 C ATOM 0 H LEU B 330 -1.779 -7.820 2.459 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.175 -7.120 -0.362 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.232 -5.237 1.160 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.353 -6.118 2.394 1.00 0.00 H new ATOM 0 HG LEU B 330 1.646 -6.212 0.801 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.636 -4.645 -1.092 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.377 -5.887 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.066 -4.246 -0.761 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.239 -3.837 1.210 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.529 -3.464 1.534 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.429 -4.539 2.630 1.00 0.00 H new ATOM 770 N GLY B 331 1.156 -8.134 -0.350 1.00 0.00 N ATOM 771 CA GLY B 331 2.307 -8.973 -0.411 1.00 0.00 C ATOM 772 C GLY B 331 3.501 -8.182 -0.899 1.00 0.00 C ATOM 773 O GLY B 331 3.606 -7.851 -2.073 1.00 0.00 O ATOM 0 H GLY B 331 1.069 -7.461 -1.111 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.515 -9.390 0.574 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.119 -9.813 -1.080 1.00 0.00 H new ATOM 777 N ILE B 332 4.416 -7.906 0.004 1.00 0.00 N ATOM 778 CA ILE B 332 5.621 -7.202 -0.363 1.00 0.00 C ATOM 779 C ILE B 332 6.647 -8.219 -0.795 1.00 0.00 C ATOM 780 O ILE B 332 6.986 -9.128 -0.047 1.00 0.00 O ATOM 781 CB ILE B 332 6.190 -6.419 0.813 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.112 -5.515 1.410 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.377 -5.573 0.336 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.475 -4.671 0.304 1.00 0.00 C ATOM 0 H ILE B 332 4.348 -8.157 0.990 1.00 0.00 H new ATOM 0 HA ILE B 332 5.384 -6.501 -1.163 1.00 0.00 H new ATOM 0 HB ILE B 332 6.528 -7.116 1.580 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.351 -6.118 1.904 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.548 -4.867 2.170 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.785 -5.012 1.177 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.148 -6.226 -0.073 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.043 -4.879 -0.435 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.707 -4.028 0.734 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.240 -4.056 -0.170 1.00 0.00 H new ATOM 0 HD13 ILE B 332 4.024 -5.327 -0.440 1.00 0.00 H new ATOM 796 N THR B 333 7.133 -8.046 -1.997 1.00 0.00 N ATOM 797 CA THR B 333 8.115 -8.926 -2.552 1.00 0.00 C ATOM 798 C THR B 333 9.364 -8.130 -2.830 1.00 0.00 C ATOM 799 O THR B 333 9.288 -7.011 -3.322 1.00 0.00 O ATOM 800 CB THR B 333 7.567 -9.514 -3.845 1.00 0.00 C ATOM 801 OG1 THR B 333 7.805 -8.619 -4.914 1.00 0.00 O ATOM 802 CG2 THR B 333 6.063 -9.741 -3.694 1.00 0.00 C ATOM 0 H THR B 333 6.854 -7.286 -2.617 1.00 0.00 H new ATOM 0 HA THR B 333 8.348 -9.736 -1.861 1.00 0.00 H new ATOM 0 HB THR B 333 8.063 -10.462 -4.054 1.00 0.00 H new ATOM 0 HG1 THR B 333 7.045 -8.639 -5.533 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.664 -10.162 -4.617 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.880 -10.432 -2.871 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.571 -8.791 -3.486 1.00 0.00 H new ATOM 810 N LYS B 334 10.506 -8.698 -2.518 1.00 0.00 N ATOM 811 CA LYS B 334 11.772 -8.007 -2.742 1.00 0.00 C ATOM 812 C LYS B 334 11.949 -7.610 -4.202 1.00 0.00 C ATOM 813 O LYS B 334 13.036 -7.256 -4.630 1.00 0.00 O ATOM 814 CB LYS B 334 12.925 -8.892 -2.311 1.00 0.00 C ATOM 815 CG LYS B 334 12.905 -10.198 -3.108 1.00 0.00 C ATOM 816 CD LYS B 334 13.995 -11.134 -2.580 1.00 0.00 C ATOM 817 CE LYS B 334 13.777 -12.539 -3.143 1.00 0.00 C ATOM 818 NZ LYS B 334 12.525 -13.113 -2.577 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.593 -9.629 -2.111 1.00 0.00 H new ATOM 0 HA LYS B 334 11.761 -7.095 -2.146 1.00 0.00 H new ATOM 0 HB2 LYS B 334 13.871 -8.374 -2.469 1.00 0.00 H new ATOM 0 HB3 LYS B 334 12.852 -9.105 -1.245 1.00 0.00 H new ATOM 0 HG2 LYS B 334 11.928 -10.674 -3.022 1.00 0.00 H new ATOM 0 HG3 LYS B 334 13.067 -9.993 -4.166 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.979 -10.764 -2.869 1.00 0.00 H new ATOM 0 HD3 LYS B 334 13.971 -11.159 -1.491 1.00 0.00 H new ATOM 0 HE2 LYS B 334 13.713 -12.500 -4.230 1.00 0.00 H new ATOM 0 HE3 LYS B 334 14.626 -13.177 -2.896 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 12.728 -14.043 -2.159 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 12.152 -12.477 -1.843 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 11.819 -13.220 -3.333 1.00 0.00 H new ATOM 832 N GLU B 335 10.871 -7.684 -4.944 1.00 0.00 N ATOM 833 CA GLU B 335 10.860 -7.310 -6.350 1.00 0.00 C ATOM 834 C GLU B 335 9.537 -6.659 -6.731 1.00 0.00 C ATOM 835 O GLU B 335 9.345 -6.273 -7.885 1.00 0.00 O ATOM 836 CB GLU B 335 11.091 -8.540 -7.222 1.00 0.00 C ATOM 837 CG GLU B 335 10.113 -9.646 -6.813 1.00 0.00 C ATOM 838 CD GLU B 335 10.361 -10.898 -7.646 1.00 0.00 C ATOM 839 OE1 GLU B 335 10.452 -10.771 -8.856 1.00 0.00 O ATOM 840 OE2 GLU B 335 10.454 -11.966 -7.064 1.00 0.00 O1- ATOM 0 H GLU B 335 9.969 -8.006 -4.594 1.00 0.00 H new ATOM 0 HA GLU B 335 11.663 -6.591 -6.513 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.951 -8.286 -8.273 1.00 0.00 H new ATOM 0 HB3 GLU B 335 12.118 -8.889 -7.113 1.00 0.00 H new ATOM 0 HG2 GLU B 335 10.233 -9.875 -5.754 1.00 0.00 H new ATOM 0 HG3 GLU B 335 9.087 -9.305 -6.952 1.00 0.00 H new ATOM 847 N CYS B 336 8.599 -6.582 -5.787 1.00 0.00 N ATOM 848 CA CYS B 336 7.296 -6.030 -6.109 1.00 0.00 C ATOM 849 C CYS B 336 6.405 -5.880 -4.901 1.00 0.00 C ATOM 850 O CYS B 336 6.762 -6.219 -3.776 1.00 0.00 O ATOM 851 CB CYS B 336 6.590 -6.913 -7.142 1.00 0.00 C ATOM 852 SG CYS B 336 5.242 -7.828 -6.351 1.00 0.00 S ATOM 0 H CYS B 336 8.717 -6.887 -4.821 1.00 0.00 H new ATOM 0 HA CYS B 336 7.475 -5.034 -6.513 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.198 -6.298 -7.952 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.302 -7.609 -7.586 1.00 0.00 H new ATOM 0 HG CYS B 336 4.647 -8.573 -7.234 1.00 0.00 H new ATOM 858 N VAL B 337 5.231 -5.355 -5.181 1.00 0.00 N ATOM 859 CA VAL B 337 4.220 -5.121 -4.177 1.00 0.00 C ATOM 860 C VAL B 337 2.919 -5.572 -4.764 1.00 0.00 C ATOM 861 O VAL B 337 2.760 -5.475 -5.974 1.00 0.00 O ATOM 862 CB VAL B 337 4.186 -3.638 -3.886 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.352 -3.356 -2.641 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.621 -3.197 -3.668 1.00 0.00 C ATOM 0 H VAL B 337 4.951 -5.077 -6.121 1.00 0.00 H new ATOM 0 HA VAL B 337 4.418 -5.658 -3.249 1.00 0.00 H new ATOM 0 HB VAL B 337 3.732 -3.093 -4.714 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.339 -2.283 -2.447 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.333 -3.709 -2.798 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.787 -3.874 -1.786 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.645 -2.128 -3.454 1.00 0.00 H new ATOM 0 HG22 VAL B 337 6.046 -3.745 -2.827 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.204 -3.400 -4.566 1.00 0.00 H new ATOM 874 N MET B 338 2.009 -6.118 -3.973 1.00 0.00 N ATOM 875 CA MET B 338 0.797 -6.610 -4.602 1.00 0.00 C ATOM 876 C MET B 338 -0.413 -6.639 -3.690 1.00 0.00 C ATOM 877 O MET B 338 -0.305 -6.887 -2.494 1.00 0.00 O ATOM 878 CB MET B 338 1.035 -8.022 -5.121 1.00 0.00 C ATOM 879 CG MET B 338 2.001 -8.779 -4.206 1.00 0.00 C ATOM 880 SD MET B 338 2.329 -10.420 -4.895 1.00 0.00 S ATOM 881 CE MET B 338 3.035 -11.160 -3.403 1.00 0.00 C ATOM 0 H MET B 338 2.075 -6.228 -2.961 1.00 0.00 H new ATOM 0 HA MET B 338 0.574 -5.908 -5.405 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.087 -8.557 -5.180 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.441 -7.980 -6.132 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.933 -8.223 -4.105 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.575 -8.871 -3.207 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.801 -11.883 -3.683 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.481 -10.380 -2.786 1.00 0.00 H new ATOM 0 HE3 MET B 338 2.249 -11.664 -2.840 1.00 0.00 H new ATOM 891 N ARG B 339 -1.580 -6.457 -4.302 1.00 0.00 N ATOM 892 CA ARG B 339 -2.835 -6.530 -3.577 1.00 0.00 C ATOM 893 C ARG B 339 -3.382 -7.938 -3.695 1.00 0.00 C ATOM 894 O ARG B 339 -3.826 -8.363 -4.765 1.00 0.00 O ATOM 895 CB ARG B 339 -3.847 -5.543 -4.145 1.00 0.00 C ATOM 896 CG ARG B 339 -3.232 -4.145 -4.190 1.00 0.00 C ATOM 897 CD ARG B 339 -4.166 -3.203 -4.951 1.00 0.00 C ATOM 898 NE ARG B 339 -5.539 -3.697 -4.896 1.00 0.00 N ATOM 899 CZ ARG B 339 -6.416 -3.412 -5.854 1.00 0.00 C ATOM 900 NH1 ARG B 339 -6.064 -2.670 -6.868 1.00 0.00 N ATOM 901 NH2 ARG B 339 -7.635 -3.874 -5.779 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.678 -6.258 -5.298 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.658 -6.276 -2.532 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.148 -5.851 -5.146 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.747 -5.535 -3.530 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -3.070 -3.774 -3.178 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.257 -4.180 -4.677 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.115 -2.203 -4.520 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -3.843 -3.120 -5.989 1.00 0.00 H new ATOM 0 HE ARG B 339 -5.831 -4.273 -4.106 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -5.113 -2.306 -6.928 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -6.740 -2.454 -7.601 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -7.913 -4.453 -4.986 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -8.309 -3.656 -6.513 1.00 0.00 H new ATOM 915 N VAL B 340 -3.308 -8.661 -2.595 1.00 0.00 N ATOM 916 CA VAL B 340 -3.761 -10.033 -2.548 1.00 0.00 C ATOM 917 C VAL B 340 -5.151 -10.131 -1.953 1.00 0.00 C ATOM 918 O VAL B 340 -5.549 -9.306 -1.136 1.00 0.00 O ATOM 919 CB VAL B 340 -2.767 -10.872 -1.760 1.00 0.00 C ATOM 920 CG1 VAL B 340 -2.983 -12.334 -2.089 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.358 -10.472 -2.155 1.00 0.00 C ATOM 0 H VAL B 340 -2.933 -8.313 -1.712 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.818 -10.419 -3.566 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.909 -10.711 -0.691 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.274 -12.942 -1.528 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -4.000 -12.621 -1.820 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.832 -12.493 -3.157 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.639 -11.069 -1.594 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.217 -10.643 -3.222 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.204 -9.416 -1.933 1.00 0.00 H new ATOM 931 N ASP B 341 -5.896 -11.135 -2.401 1.00 0.00 N ATOM 932 CA ASP B 341 -7.260 -11.325 -1.941 1.00 0.00 C ATOM 933 C ASP B 341 -7.295 -12.208 -0.708 1.00 0.00 C ATOM 934 O ASP B 341 -7.364 -13.421 -0.812 1.00 0.00 O ATOM 935 CB ASP B 341 -8.100 -11.957 -3.051 1.00 0.00 C ATOM 936 CG ASP B 341 -9.583 -11.755 -2.762 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.914 -11.512 -1.613 1.00 0.00 O1- ATOM 938 OD2 ASP B 341 -10.365 -11.843 -3.693 1.00 0.00 O ATOM 0 H ASP B 341 -5.577 -11.826 -3.080 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.674 -10.350 -1.682 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.844 -11.510 -4.011 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.877 -13.021 -3.126 1.00 0.00 H new ATOM 943 N GLU B 342 -7.256 -11.576 0.449 1.00 0.00 N ATOM 944 CA GLU B 342 -7.290 -12.284 1.727 1.00 0.00 C ATOM 945 C GLU B 342 -8.184 -13.510 1.637 1.00 0.00 C ATOM 946 O GLU B 342 -7.979 -14.503 2.334 1.00 0.00 O ATOM 947 CB GLU B 342 -7.849 -11.325 2.787 1.00 0.00 C ATOM 948 CG GLU B 342 -7.194 -11.561 4.147 1.00 0.00 C ATOM 949 CD GLU B 342 -8.230 -11.402 5.254 1.00 0.00 C ATOM 950 OE1 GLU B 342 -9.041 -10.497 5.154 1.00 0.00 O1- ATOM 951 OE2 GLU B 342 -8.197 -12.189 6.186 1.00 0.00 O ATOM 0 H GLU B 342 -7.200 -10.561 0.536 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.284 -12.612 1.990 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.681 -10.295 2.474 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.927 -11.461 2.871 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.760 -12.560 4.183 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.378 -10.854 4.296 1.00 0.00 H new ATOM 958 N LYS B 343 -9.167 -13.419 0.769 1.00 0.00 N ATOM 959 CA LYS B 343 -10.108 -14.505 0.562 1.00 0.00 C ATOM 960 C LYS B 343 -9.488 -15.643 -0.243 1.00 0.00 C ATOM 961 O LYS B 343 -9.698 -16.816 0.066 1.00 0.00 O ATOM 962 CB LYS B 343 -11.319 -13.977 -0.197 1.00 0.00 C ATOM 963 CG LYS B 343 -12.010 -12.898 0.634 1.00 0.00 C ATOM 964 CD LYS B 343 -12.952 -12.093 -0.263 1.00 0.00 C ATOM 965 CE LYS B 343 -14.078 -11.495 0.581 1.00 0.00 C ATOM 966 NZ LYS B 343 -13.580 -11.234 1.961 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.339 -12.598 0.189 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.396 -14.891 1.540 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -11.009 -13.568 -1.158 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -12.014 -14.791 -0.406 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.569 -13.355 1.451 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.268 -12.239 1.085 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.401 -11.299 -0.767 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.368 -12.735 -1.040 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.432 -10.568 0.130 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -14.926 -12.179 0.612 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -14.208 -10.553 2.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.567 -12.124 2.499 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -12.617 -10.843 1.915 1.00 0.00 H new ATOM 980 N THR B 344 -8.762 -15.290 -1.300 1.00 0.00 N ATOM 981 CA THR B 344 -8.161 -16.289 -2.174 1.00 0.00 C ATOM 982 C THR B 344 -6.641 -16.347 -2.028 1.00 0.00 C ATOM 983 O THR B 344 -6.010 -17.278 -2.526 1.00 0.00 O ATOM 984 CB THR B 344 -8.524 -15.967 -3.620 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.548 -15.094 -4.171 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.898 -15.297 -3.667 1.00 0.00 C ATOM 0 H THR B 344 -8.577 -14.324 -1.570 1.00 0.00 H new ATOM 0 HA THR B 344 -8.552 -17.265 -1.887 1.00 0.00 H new ATOM 0 HB THR B 344 -8.553 -16.889 -4.200 1.00 0.00 H new ATOM 0 HG1 THR B 344 -7.965 -14.525 -4.851 1.00 0.00 H new ATOM 0 HG21 THR B 344 -10.156 -15.068 -4.701 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.646 -15.970 -3.247 1.00 0.00 H new ATOM 0 HG23 THR B 344 -9.873 -14.375 -3.086 1.00 0.00 H new ATOM 994 N LYS B 345 -6.052 -15.356 -1.361 1.00 0.00 N ATOM 995 CA LYS B 345 -4.611 -15.326 -1.180 1.00 0.00 C ATOM 996 C LYS B 345 -3.923 -15.123 -2.522 1.00 0.00 C ATOM 997 O LYS B 345 -2.699 -15.027 -2.599 1.00 0.00 O ATOM 998 CB LYS B 345 -4.146 -16.632 -0.547 1.00 0.00 C ATOM 999 CG LYS B 345 -2.802 -16.422 0.155 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.362 -17.731 0.814 1.00 0.00 C ATOM 1001 CE LYS B 345 -2.259 -17.534 2.327 1.00 0.00 C ATOM 1002 NZ LYS B 345 -1.796 -18.799 2.963 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.550 -14.571 -0.942 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.350 -14.497 -0.522 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.889 -16.984 0.169 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -4.050 -17.403 -1.312 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -2.051 -16.094 -0.564 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -2.890 -15.636 0.905 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -3.077 -18.522 0.588 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.399 -18.047 0.412 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -1.564 -16.726 2.553 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -3.228 -17.244 2.733 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -1.726 -18.665 3.992 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -2.475 -19.559 2.758 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -0.863 -19.057 2.583 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.728 -15.038 -3.578 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.197 -14.820 -4.910 1.00 0.00 C ATOM 1018 C GLU B 346 -3.992 -13.336 -5.131 1.00 0.00 C ATOM 1019 O GLU B 346 -4.642 -12.506 -4.496 1.00 0.00 O ATOM 1020 CB GLU B 346 -5.150 -15.368 -5.966 1.00 0.00 C ATOM 1021 CG GLU B 346 -5.473 -16.825 -5.646 1.00 0.00 C ATOM 1022 CD GLU B 346 -5.373 -17.672 -6.911 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -4.277 -18.104 -7.225 1.00 0.00 O ATOM 1024 OE2 GLU B 346 -6.395 -17.874 -7.547 1.00 0.00 O1- ATOM 0 H GLU B 346 -5.744 -15.117 -3.533 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.245 -15.343 -4.999 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -6.066 -14.777 -5.988 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -4.698 -15.292 -6.955 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -4.783 -17.202 -4.891 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -6.476 -16.900 -5.227 1.00 0.00 H new ATOM 1031 N VAL B 347 -3.062 -13.008 -6.003 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.752 -11.612 -6.267 1.00 0.00 C ATOM 1033 C VAL B 347 -3.704 -10.992 -7.264 1.00 0.00 C ATOM 1034 O VAL B 347 -4.005 -11.569 -8.310 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.324 -11.460 -6.756 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.084 -10.001 -7.153 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.387 -11.827 -5.611 1.00 0.00 C ATOM 0 H VAL B 347 -2.510 -13.679 -6.538 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.868 -11.081 -5.322 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.145 -12.106 -7.615 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.059 -9.884 -7.506 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.776 -9.722 -7.948 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.246 -9.357 -6.288 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.647 -11.725 -5.940 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.566 -11.162 -4.767 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.571 -12.857 -5.306 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.146 -9.790 -6.934 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.036 -9.051 -7.802 1.00 0.00 C ATOM 1049 C ILE B 348 -4.236 -7.972 -8.501 1.00 0.00 C ATOM 1050 O ILE B 348 -4.547 -7.576 -9.624 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.167 -8.417 -6.992 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -6.918 -9.506 -6.221 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.135 -7.706 -7.941 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.819 -8.861 -5.166 1.00 0.00 C ATOM 0 H ILE B 348 -3.900 -9.308 -6.069 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.479 -9.726 -8.534 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.750 -7.697 -6.288 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -7.516 -10.105 -6.908 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -6.209 -10.182 -5.744 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -7.942 -7.253 -7.365 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.602 -6.930 -8.490 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.551 -8.428 -8.644 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -8.352 -9.638 -4.619 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.210 -8.282 -4.472 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -8.538 -8.203 -5.654 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.200 -7.489 -7.816 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.370 -6.446 -8.372 1.00 0.00 C ATOM 1068 C GLN B 349 -0.910 -6.667 -8.058 1.00 0.00 C ATOM 1069 O GLN B 349 -0.563 -7.315 -7.072 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.778 -5.134 -7.769 1.00 0.00 C ATOM 1071 CG GLN B 349 -1.950 -4.002 -8.366 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.736 -2.698 -8.300 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -3.664 -2.493 -9.082 1.00 0.00 O ATOM 1074 NE2 GLN B 349 -2.422 -1.802 -7.404 1.00 0.00 N ATOM 0 H GLN B 349 -2.925 -7.805 -6.886 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.501 -6.452 -9.454 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -3.838 -4.955 -7.952 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.641 -5.164 -6.688 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -1.011 -3.899 -7.822 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.695 -4.232 -9.401 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -1.652 -1.975 -6.757 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -2.946 -0.929 -7.350 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.066 -6.082 -8.888 1.00 0.00 N ATOM 1084 CA GLU B 350 1.373 -6.170 -8.698 1.00 0.00 C ATOM 1085 C GLU B 350 2.069 -4.898 -9.134 1.00 0.00 C ATOM 1086 O GLU B 350 1.644 -4.226 -10.073 1.00 0.00 O ATOM 1087 CB GLU B 350 1.995 -7.300 -9.509 1.00 0.00 C ATOM 1088 CG GLU B 350 1.427 -8.647 -9.082 1.00 0.00 C ATOM 1089 CD GLU B 350 1.864 -9.743 -10.048 1.00 0.00 C ATOM 1090 OE1 GLU B 350 3.020 -10.127 -9.995 1.00 0.00 O ATOM 1091 OE2 GLU B 350 1.031 -10.191 -10.819 1.00 0.00 O1- ATOM 0 H GLU B 350 -0.352 -5.539 -9.703 1.00 0.00 H new ATOM 0 HA GLU B 350 1.509 -6.348 -7.631 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.805 -7.140 -10.570 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.077 -7.297 -9.375 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.765 -8.887 -8.074 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.339 -8.595 -9.050 1.00 0.00 H new ATOM 1098 N TRP B 351 3.174 -4.614 -8.475 1.00 0.00 N ATOM 1099 CA TRP B 351 3.983 -3.454 -8.825 1.00 0.00 C ATOM 1100 C TRP B 351 5.371 -3.568 -8.238 1.00 0.00 C ATOM 1101 O TRP B 351 5.532 -3.936 -7.085 1.00 0.00 O ATOM 1102 CB TRP B 351 3.332 -2.176 -8.347 1.00 0.00 C ATOM 1103 CG TRP B 351 4.072 -1.039 -8.944 1.00 0.00 C ATOM 1104 CD1 TRP B 351 5.021 -0.332 -8.316 1.00 0.00 C ATOM 1105 CD2 TRP B 351 3.962 -0.484 -10.284 1.00 0.00 C ATOM 1106 NE1 TRP B 351 5.490 0.638 -9.173 1.00 0.00 N ATOM 1107 CE2 TRP B 351 4.869 0.590 -10.397 1.00 0.00 C ATOM 1108 CE3 TRP B 351 3.167 -0.805 -11.390 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 4.988 1.333 -11.570 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 3.279 -0.058 -12.583 1.00 0.00 C ATOM 1111 CH2 TRP B 351 4.190 1.011 -12.668 1.00 0.00 C ATOM 0 H TRP B 351 3.535 -5.165 -7.696 1.00 0.00 H new ATOM 0 HA TRP B 351 4.061 -3.424 -9.912 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.284 -2.147 -8.644 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.357 -2.119 -7.259 1.00 0.00 H new ATOM 0 HD1 TRP B 351 5.362 -0.496 -7.304 1.00 0.00 H new ATOM 0 HE1 TRP B 351 6.214 1.313 -8.928 1.00 0.00 H new ATOM 0 HE3 TRP B 351 2.467 -1.625 -11.331 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 5.691 2.150 -11.628 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 2.663 -0.308 -13.434 1.00 0.00 H new ATOM 0 HH2 TRP B 351 4.271 1.581 -13.582 1.00 0.00 H new ATOM 1122 N SER B 352 6.369 -3.259 -9.054 1.00 0.00 N ATOM 1123 CA SER B 352 7.750 -3.350 -8.635 1.00 0.00 C ATOM 1124 C SER B 352 7.987 -2.594 -7.349 1.00 0.00 C ATOM 1125 O SER B 352 7.503 -1.477 -7.164 1.00 0.00 O ATOM 1126 CB SER B 352 8.680 -2.799 -9.708 1.00 0.00 C ATOM 1127 OG SER B 352 7.913 -2.215 -10.751 1.00 0.00 O ATOM 0 H SER B 352 6.241 -2.942 -10.015 1.00 0.00 H new ATOM 0 HA SER B 352 7.964 -4.406 -8.472 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.350 -2.056 -9.276 1.00 0.00 H new ATOM 0 HB3 SER B 352 9.305 -3.598 -10.107 1.00 0.00 H new ATOM 0 HG SER B 352 8.197 -2.585 -11.613 1.00 0.00 H new ATOM 1133 N LEU B 353 8.770 -3.198 -6.483 1.00 0.00 N ATOM 1134 CA LEU B 353 9.126 -2.585 -5.239 1.00 0.00 C ATOM 1135 C LEU B 353 10.225 -1.585 -5.552 1.00 0.00 C ATOM 1136 O LEU B 353 10.276 -0.482 -5.006 1.00 0.00 O ATOM 1137 CB LEU B 353 9.612 -3.686 -4.294 1.00 0.00 C ATOM 1138 CG LEU B 353 9.280 -3.365 -2.840 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.458 -4.612 -2.007 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.233 -2.313 -2.320 1.00 0.00 C ATOM 0 H LEU B 353 9.172 -4.124 -6.628 1.00 0.00 H new ATOM 0 HA LEU B 353 8.293 -2.071 -4.759 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.152 -4.634 -4.572 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.689 -3.810 -4.403 1.00 0.00 H new ATOM 0 HG LEU B 353 8.254 -3.003 -2.779 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.223 -4.391 -0.966 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.790 -5.392 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.490 -4.954 -2.081 1.00 0.00 H new ATOM 0 HD21 LEU B 353 9.993 -2.086 -1.281 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.256 -2.685 -2.383 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.139 -1.408 -2.920 1.00 0.00 H new ATOM 1152 N THR B 354 11.066 -1.972 -6.506 1.00 0.00 N ATOM 1153 CA THR B 354 12.139 -1.101 -6.966 1.00 0.00 C ATOM 1154 C THR B 354 11.573 0.002 -7.837 1.00 0.00 C ATOM 1155 O THR B 354 12.322 0.740 -8.479 1.00 0.00 O ATOM 1156 CB THR B 354 13.172 -1.905 -7.759 1.00 0.00 C ATOM 1157 OG1 THR B 354 14.381 -1.163 -7.847 1.00 0.00 O ATOM 1158 CG2 THR B 354 12.639 -2.181 -9.164 1.00 0.00 C ATOM 0 H THR B 354 11.025 -2.878 -6.973 1.00 0.00 H new ATOM 0 HA THR B 354 12.626 -0.659 -6.097 1.00 0.00 H new ATOM 0 HB THR B 354 13.361 -2.852 -7.253 1.00 0.00 H new ATOM 0 HG1 THR B 354 14.180 -0.240 -8.109 1.00 0.00 H new ATOM 0 HG21 THR B 354 13.376 -2.754 -9.727 1.00 0.00 H new ATOM 0 HG22 THR B 354 11.712 -2.750 -9.096 1.00 0.00 H new ATOM 0 HG23 THR B 354 12.448 -1.236 -9.673 1.00 0.00 H new ATOM 1166 N ASN B 355 10.248 0.122 -7.841 1.00 0.00 N ATOM 1167 CA ASN B 355 9.599 1.166 -8.627 1.00 0.00 C ATOM 1168 C ASN B 355 8.915 2.160 -7.713 1.00 0.00 C ATOM 1169 O ASN B 355 8.369 3.164 -8.169 1.00 0.00 O ATOM 1170 CB ASN B 355 8.563 0.570 -9.575 1.00 0.00 C ATOM 1171 CG ASN B 355 9.256 0.026 -10.821 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.461 -0.225 -10.799 1.00 0.00 O ATOM 1173 ND2 ASN B 355 8.565 -0.173 -11.909 1.00 0.00 N ATOM 0 H ASN B 355 9.612 -0.480 -7.318 1.00 0.00 H new ATOM 0 HA ASN B 355 10.369 1.670 -9.211 1.00 0.00 H new ATOM 0 HB2 ASN B 355 8.015 -0.228 -9.074 1.00 0.00 H new ATOM 0 HB3 ASN B 355 7.834 1.330 -9.856 1.00 0.00 H new ATOM 0 HD21 ASN B 355 9.023 -0.537 -12.744 1.00 0.00 H new ATOM 0 HD22 ASN B 355 7.567 0.036 -11.924 1.00 0.00 H new ATOM 1180 N ILE B 356 8.938 1.877 -6.417 1.00 0.00 N ATOM 1181 CA ILE B 356 8.303 2.759 -5.463 1.00 0.00 C ATOM 1182 C ILE B 356 8.875 4.171 -5.556 1.00 0.00 C ATOM 1183 O ILE B 356 10.054 4.352 -5.860 1.00 0.00 O ATOM 1184 CB ILE B 356 8.496 2.183 -4.074 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.635 0.923 -3.951 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.065 3.220 -3.049 1.00 0.00 C ATOM 1187 CD1 ILE B 356 7.898 0.222 -2.619 1.00 0.00 C ATOM 0 H ILE B 356 9.384 1.054 -6.012 1.00 0.00 H new ATOM 0 HA ILE B 356 7.238 2.832 -5.684 1.00 0.00 H new ATOM 0 HB ILE B 356 9.541 1.926 -3.900 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.580 1.187 -4.027 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.854 0.244 -4.775 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.199 2.817 -2.045 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.671 4.119 -3.163 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.015 3.469 -3.203 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.277 -0.671 -2.549 1.00 0.00 H new ATOM 0 HD12 ILE B 356 8.949 -0.061 -2.558 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.656 0.897 -1.798 1.00 0.00 H new ATOM 1199 N LYS B 357 8.032 5.174 -5.286 1.00 0.00 N ATOM 1200 CA LYS B 357 8.473 6.566 -5.341 1.00 0.00 C ATOM 1201 C LYS B 357 8.620 7.101 -3.924 1.00 0.00 C ATOM 1202 O LYS B 357 9.631 7.706 -3.569 1.00 0.00 O ATOM 1203 CB LYS B 357 7.464 7.406 -6.140 1.00 0.00 C ATOM 1204 CG LYS B 357 8.190 8.578 -6.802 1.00 0.00 C ATOM 1205 CD LYS B 357 7.184 9.447 -7.560 1.00 0.00 C ATOM 1206 CE LYS B 357 7.928 10.339 -8.554 1.00 0.00 C ATOM 1207 NZ LYS B 357 7.128 11.569 -8.816 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.053 5.047 -5.030 1.00 0.00 H new ATOM 0 HA LYS B 357 9.438 6.627 -5.844 1.00 0.00 H new ATOM 0 HB2 LYS B 357 6.980 6.789 -6.897 1.00 0.00 H new ATOM 0 HB3 LYS B 357 6.679 7.776 -5.480 1.00 0.00 H new ATOM 0 HG2 LYS B 357 8.703 9.174 -6.047 1.00 0.00 H new ATOM 0 HG3 LYS B 357 8.952 8.206 -7.487 1.00 0.00 H new ATOM 0 HD2 LYS B 357 6.467 8.817 -8.086 1.00 0.00 H new ATOM 0 HD3 LYS B 357 6.616 10.060 -6.860 1.00 0.00 H new ATOM 0 HE2 LYS B 357 8.907 10.607 -8.156 1.00 0.00 H new ATOM 0 HE3 LYS B 357 8.100 9.799 -9.485 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 7.767 12.383 -8.921 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 6.578 11.446 -9.690 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 6.480 11.738 -8.020 1.00 0.00 H new ATOM 1221 N ARG B 358 7.616 6.816 -3.115 1.00 0.00 N ATOM 1222 CA ARG B 358 7.619 7.198 -1.716 1.00 0.00 C ATOM 1223 C ARG B 358 6.387 6.598 -1.051 1.00 0.00 C ATOM 1224 O ARG B 358 5.304 6.600 -1.611 1.00 0.00 O ATOM 1225 CB ARG B 358 7.639 8.718 -1.561 1.00 0.00 C ATOM 1226 CG ARG B 358 6.639 9.356 -2.515 1.00 0.00 C ATOM 1227 CD ARG B 358 6.863 10.861 -2.585 1.00 0.00 C ATOM 1228 NE ARG B 358 5.616 11.566 -2.313 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.392 12.778 -2.805 1.00 0.00 C ATOM 1230 NH1 ARG B 358 6.298 13.366 -3.538 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.265 13.384 -2.550 1.00 0.00 N1+ ATOM 0 H ARG B 358 6.778 6.314 -3.409 1.00 0.00 H new ATOM 0 HA ARG B 358 8.520 6.817 -1.234 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.397 8.989 -0.533 1.00 0.00 H new ATOM 0 HB3 ARG B 358 8.640 9.099 -1.764 1.00 0.00 H new ATOM 0 HG2 ARG B 358 6.744 8.919 -3.508 1.00 0.00 H new ATOM 0 HG3 ARG B 358 5.623 9.148 -2.180 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.623 11.158 -1.862 1.00 0.00 H new ATOM 0 HD3 ARG B 358 7.237 11.135 -3.571 1.00 0.00 H new ATOM 0 HE ARG B 358 4.904 11.120 -1.735 1.00 0.00 H new ATOM 0 HH11 ARG B 358 7.181 12.894 -3.734 1.00 0.00 H new ATOM 0 HH12 ARG B 358 6.123 14.298 -3.915 1.00 0.00 H new ATOM 0 HH21 ARG B 358 3.559 12.926 -1.974 1.00 0.00 H new ATOM 0 HH22 ARG B 358 4.090 14.316 -2.927 1.00 0.00 H new ATOM 1245 N TRP B 359 6.570 6.049 0.122 1.00 0.00 N ATOM 1246 CA TRP B 359 5.487 5.404 0.832 1.00 0.00 C ATOM 1247 C TRP B 359 5.257 6.083 2.167 1.00 0.00 C ATOM 1248 O TRP B 359 6.006 6.984 2.539 1.00 0.00 O ATOM 1249 CB TRP B 359 5.826 3.928 0.998 1.00 0.00 C ATOM 1250 CG TRP B 359 7.128 3.769 1.699 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.270 3.344 2.966 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.465 4.022 1.200 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.617 3.300 3.278 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.395 3.729 2.224 1.00 0.00 C ATOM 1255 CE3 TRP B 359 8.949 4.475 -0.029 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.767 3.893 2.032 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.327 4.641 -0.230 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.235 4.354 0.802 1.00 0.00 C ATOM 0 H TRP B 359 7.465 6.034 0.612 1.00 0.00 H new ATOM 0 HA TRP B 359 4.559 5.489 0.267 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.039 3.429 1.563 1.00 0.00 H new ATOM 0 HB3 TRP B 359 5.871 3.447 0.021 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.463 3.079 3.633 1.00 0.00 H new ATOM 0 HE1 TRP B 359 8.988 2.989 4.176 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.259 4.699 -0.829 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.460 3.665 2.828 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.692 4.992 -1.184 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.295 4.490 0.643 1.00 0.00 H new ATOM 1269 N ALA B 360 4.209 5.687 2.881 1.00 0.00 N ATOM 1270 CA ALA B 360 3.930 6.338 4.149 1.00 0.00 C ATOM 1271 C ALA B 360 3.093 5.473 5.065 1.00 0.00 C ATOM 1272 O ALA B 360 1.872 5.398 4.942 1.00 0.00 O ATOM 1273 CB ALA B 360 3.210 7.660 3.905 1.00 0.00 C ATOM 0 H ALA B 360 3.561 4.945 2.614 1.00 0.00 H new ATOM 0 HA ALA B 360 4.887 6.514 4.640 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.003 8.143 4.860 1.00 0.00 H new ATOM 0 HB2 ALA B 360 3.839 8.310 3.298 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.272 7.472 3.383 1.00 0.00 H new ATOM 1279 N ALA B 361 3.772 4.838 5.992 1.00 0.00 N ATOM 1280 CA ALA B 361 3.124 3.988 6.961 1.00 0.00 C ATOM 1281 C ALA B 361 2.542 4.815 8.104 1.00 0.00 C ATOM 1282 O ALA B 361 3.127 5.819 8.510 1.00 0.00 O ATOM 1283 CB ALA B 361 4.121 2.991 7.519 1.00 0.00 C ATOM 0 H ALA B 361 4.785 4.896 6.095 1.00 0.00 H new ATOM 0 HA ALA B 361 2.312 3.458 6.463 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.626 2.352 8.250 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.515 2.378 6.708 1.00 0.00 H new ATOM 0 HB3 ALA B 361 4.940 3.526 8.000 1.00 0.00 H new ATOM 1289 N SER B 362 1.394 4.388 8.619 1.00 0.00 N ATOM 1290 CA SER B 362 0.748 5.090 9.712 1.00 0.00 C ATOM 1291 C SER B 362 0.340 4.091 10.798 1.00 0.00 C ATOM 1292 O SER B 362 0.491 2.883 10.617 1.00 0.00 O ATOM 1293 CB SER B 362 -0.472 5.832 9.176 1.00 0.00 C ATOM 1294 OG SER B 362 -0.455 5.796 7.754 1.00 0.00 O ATOM 0 H SER B 362 0.895 3.559 8.295 1.00 0.00 H new ATOM 0 HA SER B 362 1.437 5.811 10.151 1.00 0.00 H new ATOM 0 HB2 SER B 362 -1.386 5.373 9.552 1.00 0.00 H new ATOM 0 HB3 SER B 362 -0.467 6.864 9.525 1.00 0.00 H new ATOM 0 HG SER B 362 -0.335 4.872 7.452 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.157 4.557 11.917 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.569 3.664 13.033 1.00 0.00 C ATOM 1302 C PRO B 363 -1.913 3.003 12.768 1.00 0.00 C ATOM 1303 O PRO B 363 -2.342 2.126 13.513 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.661 4.591 14.240 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.824 5.979 13.705 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.391 5.975 12.237 1.00 0.00 C ATOM 0 HA PRO B 363 0.137 2.845 13.174 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.505 4.319 14.873 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.236 4.516 14.855 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.861 6.303 13.795 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.220 6.682 14.279 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.162 6.403 11.596 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.512 6.568 12.089 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.571 3.448 11.710 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.879 2.922 11.338 1.00 0.00 C ATOM 1316 C LYS B 364 -3.923 2.558 9.869 1.00 0.00 C ATOM 1317 O LYS B 364 -4.792 1.806 9.427 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.953 3.961 11.597 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.739 4.575 12.978 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.933 5.459 13.342 1.00 0.00 C ATOM 1321 CE LYS B 364 -6.998 4.615 14.045 1.00 0.00 C ATOM 1322 NZ LYS B 364 -6.715 4.575 15.508 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.220 4.177 11.089 1.00 0.00 H new ATOM 0 HA LYS B 364 -4.056 2.031 11.940 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.917 4.737 10.832 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.940 3.502 11.539 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.618 3.787 13.722 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.822 5.165 12.986 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -5.612 6.273 13.992 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.349 5.914 12.443 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -7.987 5.036 13.867 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -7.004 3.604 13.637 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -7.439 4.001 15.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -5.778 4.154 15.669 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -6.731 5.542 15.891 1.00 0.00 H new ATOM 1336 N SER B 365 -2.996 3.111 9.113 1.00 0.00 N ATOM 1337 CA SER B 365 -2.955 2.851 7.689 1.00 0.00 C ATOM 1338 C SER B 365 -1.565 2.985 7.130 1.00 0.00 C ATOM 1339 O SER B 365 -0.653 3.475 7.788 1.00 0.00 O ATOM 1340 CB SER B 365 -3.888 3.800 6.952 1.00 0.00 C ATOM 1341 OG SER B 365 -3.442 5.139 7.132 1.00 0.00 O ATOM 0 H SER B 365 -2.268 3.737 9.457 1.00 0.00 H new ATOM 0 HA SER B 365 -3.281 1.821 7.542 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.911 3.553 5.891 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.906 3.691 7.327 1.00 0.00 H new ATOM 0 HG SER B 365 -4.042 5.750 6.656 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.421 2.533 5.901 1.00 0.00 N ATOM 1348 CA PHE B 366 -0.146 2.597 5.228 1.00 0.00 C ATOM 1349 C PHE B 366 -0.374 2.959 3.783 1.00 0.00 C ATOM 1350 O PHE B 366 -1.491 2.825 3.280 1.00 0.00 O ATOM 1351 CB PHE B 366 0.589 1.274 5.405 1.00 0.00 C ATOM 1352 CG PHE B 366 1.354 0.894 4.171 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.629 1.422 3.948 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.803 -0.026 3.273 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.356 1.020 2.821 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.522 -0.417 2.144 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.799 0.100 1.919 1.00 0.00 C ATOM 0 H PHE B 366 -2.173 2.118 5.350 1.00 0.00 H new ATOM 0 HA PHE B 366 0.489 3.370 5.661 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.274 1.349 6.249 1.00 0.00 H new ATOM 0 HB3 PHE B 366 -0.128 0.489 5.645 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.051 2.135 4.641 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.180 -0.434 3.454 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.345 1.418 2.646 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.092 -1.119 1.445 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.360 -0.209 1.049 1.00 0.00 H new ATOM 1367 N THR B 367 0.640 3.512 3.140 1.00 0.00 N ATOM 1368 CA THR B 367 0.442 3.983 1.786 1.00 0.00 C ATOM 1369 C THR B 367 1.679 3.849 0.927 1.00 0.00 C ATOM 1370 O THR B 367 2.792 3.737 1.425 1.00 0.00 O ATOM 1371 CB THR B 367 0.022 5.445 1.847 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.229 5.555 2.511 1.00 0.00 O ATOM 1373 CG2 THR B 367 -0.094 6.003 0.438 1.00 0.00 C ATOM 0 H THR B 367 1.578 3.642 3.520 1.00 0.00 H new ATOM 0 HA THR B 367 -0.327 3.364 1.324 1.00 0.00 H new ATOM 0 HB THR B 367 0.772 6.013 2.397 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.669 4.679 2.527 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.395 7.050 0.485 1.00 0.00 H new ATOM 0 HG22 THR B 367 0.870 5.925 -0.065 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.840 5.435 -0.118 1.00 0.00 H new ATOM 1381 N LEU B 368 1.451 3.844 -0.376 1.00 0.00 N ATOM 1382 CA LEU B 368 2.517 3.705 -1.339 1.00 0.00 C ATOM 1383 C LEU B 368 2.397 4.726 -2.452 1.00 0.00 C ATOM 1384 O LEU B 368 1.299 4.946 -2.945 1.00 0.00 O ATOM 1385 CB LEU B 368 2.393 2.345 -1.980 1.00 0.00 C ATOM 1386 CG LEU B 368 3.236 1.360 -1.216 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.720 -0.052 -1.495 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.694 1.489 -1.649 1.00 0.00 C ATOM 0 H LEU B 368 0.523 3.936 -0.789 1.00 0.00 H new ATOM 0 HA LEU B 368 3.466 3.843 -0.820 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.351 2.025 -1.983 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.716 2.389 -3.020 1.00 0.00 H new ATOM 0 HG LEU B 368 3.173 1.562 -0.147 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.324 -0.775 -0.946 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.681 -0.130 -1.175 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.787 -0.259 -2.563 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.303 0.775 -1.095 1.00 0.00 H new ATOM 0 HD22 LEU B 368 4.776 1.284 -2.716 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.046 2.500 -1.446 1.00 0.00 H new ATOM 1400 N ASP B 369 3.524 5.296 -2.903 1.00 0.00 N ATOM 1401 CA ASP B 369 3.468 6.220 -4.021 1.00 0.00 C ATOM 1402 C ASP B 369 4.256 5.683 -5.196 1.00 0.00 C ATOM 1403 O ASP B 369 5.469 5.864 -5.288 1.00 0.00 O ATOM 1404 CB ASP B 369 4.044 7.576 -3.663 1.00 0.00 C ATOM 1405 CG ASP B 369 3.636 8.601 -4.714 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.690 8.265 -5.887 1.00 0.00 O1- ATOM 1407 OD2 ASP B 369 3.269 9.701 -4.336 1.00 0.00 O ATOM 0 H ASP B 369 4.454 5.134 -2.518 1.00 0.00 H new ATOM 0 HA ASP B 369 2.415 6.329 -4.279 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.687 7.886 -2.681 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.131 7.516 -3.602 1.00 0.00 H new ATOM 1412 N PHE B 370 3.548 5.044 -6.098 1.00 0.00 N ATOM 1413 CA PHE B 370 4.170 4.513 -7.316 1.00 0.00 C ATOM 1414 C PHE B 370 3.314 4.786 -8.537 1.00 0.00 C ATOM 1415 O PHE B 370 2.424 4.003 -8.870 1.00 0.00 O ATOM 1416 CB PHE B 370 4.401 3.014 -7.236 1.00 0.00 C ATOM 1417 CG PHE B 370 3.112 2.310 -6.946 1.00 0.00 C ATOM 1418 CD1 PHE B 370 2.564 2.421 -5.685 1.00 0.00 C ATOM 1419 CD2 PHE B 370 2.489 1.531 -7.923 1.00 0.00 C ATOM 1420 CE1 PHE B 370 1.378 1.755 -5.371 1.00 0.00 C ATOM 1421 CE2 PHE B 370 1.296 0.864 -7.624 1.00 0.00 C ATOM 1422 CZ PHE B 370 0.740 0.973 -6.343 1.00 0.00 C ATOM 0 H PHE B 370 2.545 4.873 -6.024 1.00 0.00 H new ATOM 0 HA PHE B 370 5.129 5.023 -7.405 1.00 0.00 H new ATOM 0 HB2 PHE B 370 4.819 2.652 -8.175 1.00 0.00 H new ATOM 0 HB3 PHE B 370 5.129 2.791 -6.456 1.00 0.00 H new ATOM 0 HD1 PHE B 370 3.055 3.026 -4.937 1.00 0.00 H new ATOM 0 HD2 PHE B 370 2.927 1.444 -8.906 1.00 0.00 H new ATOM 0 HE1 PHE B 370 0.953 1.842 -4.382 1.00 0.00 H new ATOM 0 HE2 PHE B 370 0.805 0.267 -8.378 1.00 0.00 H new ATOM 0 HZ PHE B 370 -0.178 0.456 -6.105 1.00 0.00 H new ATOM 1432 N GLY B 371 3.604 5.885 -9.213 1.00 0.00 N ATOM 1433 CA GLY B 371 2.866 6.235 -10.421 1.00 0.00 C ATOM 1434 C GLY B 371 2.445 7.686 -10.387 1.00 0.00 C ATOM 1435 O GLY B 371 1.609 8.125 -11.171 1.00 0.00 O ATOM 0 H GLY B 371 4.336 6.545 -8.952 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.486 6.051 -11.298 1.00 0.00 H new ATOM 0 HA3 GLY B 371 1.986 5.598 -10.513 1.00 0.00 H new ATOM 1439 N ASP B 372 3.017 8.414 -9.449 1.00 0.00 N ATOM 1440 CA ASP B 372 2.705 9.824 -9.279 1.00 0.00 C ATOM 1441 C ASP B 372 2.598 10.542 -10.613 1.00 0.00 C ATOM 1442 O ASP B 372 2.045 11.639 -10.686 1.00 0.00 O ATOM 1443 CB ASP B 372 3.788 10.486 -8.431 1.00 0.00 C ATOM 1444 CG ASP B 372 3.285 11.809 -7.867 1.00 0.00 C ATOM 1445 OD1 ASP B 372 2.868 12.642 -8.654 1.00 0.00 O ATOM 1446 OD2 ASP B 372 3.323 11.969 -6.658 1.00 0.00 O1- ATOM 0 H ASP B 372 3.705 8.052 -8.788 1.00 0.00 H new ATOM 0 HA ASP B 372 1.738 9.896 -8.781 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.077 9.822 -7.616 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.679 10.656 -9.035 1.00 0.00 H new ATOM 1451 N TYR B 373 3.097 9.925 -11.669 1.00 0.00 N ATOM 1452 CA TYR B 373 3.004 10.538 -12.970 1.00 0.00 C ATOM 1453 C TYR B 373 1.551 10.863 -13.234 1.00 0.00 C ATOM 1454 O TYR B 373 1.208 11.914 -13.774 1.00 0.00 O ATOM 1455 CB TYR B 373 3.545 9.576 -14.016 1.00 0.00 C ATOM 1456 CG TYR B 373 4.645 8.758 -13.385 1.00 0.00 C ATOM 1457 CD1 TYR B 373 5.789 9.394 -12.898 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.526 7.368 -13.294 1.00 0.00 C ATOM 1459 CE1 TYR B 373 6.818 8.644 -12.318 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.558 6.614 -12.717 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.705 7.253 -12.229 1.00 0.00 C ATOM 1462 OH TYR B 373 7.721 6.512 -11.662 1.00 0.00 O ATOM 0 H TYR B 373 3.561 9.017 -11.648 1.00 0.00 H new ATOM 0 HA TYR B 373 3.592 11.455 -13.014 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.750 8.926 -14.381 1.00 0.00 H new ATOM 0 HB3 TYR B 373 3.927 10.126 -14.876 1.00 0.00 H new ATOM 0 HD1 TYR B 373 5.880 10.468 -12.969 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.640 6.876 -13.668 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.700 9.139 -11.939 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.468 5.540 -12.649 1.00 0.00 H new ATOM 0 HH TYR B 373 7.481 5.562 -11.678 1.00 0.00 H new ATOM 1472 N GLN B 374 0.711 9.960 -12.779 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.720 10.120 -12.874 1.00 0.00 C ATOM 1474 C GLN B 374 -1.280 9.958 -11.477 1.00 0.00 C ATOM 1475 O GLN B 374 -1.271 10.894 -10.679 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.311 9.061 -13.802 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.505 7.763 -13.685 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.415 6.567 -13.951 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -1.937 6.416 -15.056 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -1.641 5.705 -12.998 1.00 0.00 N ATOM 0 H GLN B 374 1.004 9.092 -12.331 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.972 11.098 -13.283 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.354 8.877 -13.543 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.297 9.418 -14.832 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.320 7.770 -14.398 1.00 0.00 H new ATOM 0 HG3 GLN B 374 -0.066 7.684 -12.690 1.00 0.00 H new ATOM 0 HE21 GLN B 374 -1.208 5.831 -12.083 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -2.251 4.905 -13.168 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.663 8.735 -11.160 1.00 0.00 N ATOM 1490 CA ASP B 375 -2.103 8.414 -9.826 1.00 0.00 C ATOM 1491 C ASP B 375 -1.334 7.195 -9.363 1.00 0.00 C ATOM 1492 O ASP B 375 -1.687 6.059 -9.680 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.599 8.128 -9.818 1.00 0.00 C ATOM 1494 CG ASP B 375 -4.169 8.364 -8.423 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.600 7.847 -7.477 1.00 0.00 O1- ATOM 1496 OD2 ASP B 375 -5.166 9.063 -8.323 1.00 0.00 O ATOM 0 H ASP B 375 -1.676 7.951 -11.812 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.919 9.254 -9.156 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -4.104 8.770 -10.539 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.782 7.098 -10.125 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.272 7.441 -8.633 1.00 0.00 N ATOM 1502 CA GLY B 376 0.570 6.360 -8.143 1.00 0.00 C ATOM 1503 C GLY B 376 0.281 6.019 -6.696 1.00 0.00 C ATOM 1504 O GLY B 376 0.929 5.148 -6.115 1.00 0.00 O ATOM 0 H GLY B 376 0.034 8.375 -8.362 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.417 5.475 -8.760 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.618 6.643 -8.245 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.619 6.761 -6.096 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.897 6.580 -4.684 1.00 0.00 C ATOM 1510 C TYR B 377 -1.926 5.513 -4.390 1.00 0.00 C ATOM 1511 O TYR B 377 -3.128 5.736 -4.526 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.350 7.896 -4.083 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.789 9.018 -4.916 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.536 8.956 -5.352 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.593 10.104 -5.270 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.061 9.975 -6.144 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -1.069 11.132 -6.060 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.259 11.069 -6.499 1.00 0.00 C ATOM 1519 OH TYR B 377 0.770 12.082 -7.283 1.00 0.00 O ATOM 0 H TYR B 377 -1.168 7.489 -6.554 1.00 0.00 H new ATOM 0 HA TYR B 377 0.035 6.241 -4.232 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.439 7.948 -4.061 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -1.006 7.980 -3.052 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.156 8.116 -5.075 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.618 10.150 -4.934 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.085 9.922 -6.484 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.688 11.974 -6.331 1.00 0.00 H new ATOM 0 HH TYR B 377 0.078 12.760 -7.433 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.437 4.376 -3.902 1.00 0.00 N ATOM 1530 CA TYR B 378 -2.333 3.297 -3.489 1.00 0.00 C ATOM 1531 C TYR B 378 -2.157 3.074 -1.998 1.00 0.00 C ATOM 1532 O TYR B 378 -1.033 2.940 -1.514 1.00 0.00 O ATOM 1533 CB TYR B 378 -2.054 2.013 -4.259 1.00 0.00 C ATOM 1534 CG TYR B 378 -3.285 1.649 -5.041 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -4.356 1.010 -4.408 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -3.353 1.956 -6.399 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -5.502 0.676 -5.141 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -4.497 1.625 -7.135 1.00 0.00 C ATOM 1539 CZ TYR B 378 -5.572 0.984 -6.506 1.00 0.00 C ATOM 1540 OH TYR B 378 -6.701 0.655 -7.229 1.00 0.00 O ATOM 0 H TYR B 378 -0.443 4.178 -3.784 1.00 0.00 H new ATOM 0 HA TYR B 378 -3.362 3.581 -3.708 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -1.206 2.150 -4.930 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.790 1.209 -3.572 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -4.300 0.774 -3.356 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -2.523 2.449 -6.883 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -6.330 0.182 -4.655 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -4.551 1.864 -8.187 1.00 0.00 H new ATOM 0 HH TYR B 378 -6.588 0.939 -8.160 1.00 0.00 H new ATOM 1550 N SER B 379 -3.261 3.091 -1.260 1.00 0.00 N ATOM 1551 CA SER B 379 -3.188 2.947 0.176 1.00 0.00 C ATOM 1552 C SER B 379 -4.254 2.039 0.713 1.00 0.00 C ATOM 1553 O SER B 379 -5.294 1.834 0.089 1.00 0.00 O ATOM 1554 CB SER B 379 -3.342 4.299 0.835 1.00 0.00 C ATOM 1555 OG SER B 379 -3.099 4.159 2.218 1.00 0.00 O ATOM 0 H SER B 379 -4.204 3.202 -1.633 1.00 0.00 H new ATOM 0 HA SER B 379 -2.215 2.509 0.401 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.644 5.013 0.399 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.345 4.690 0.665 1.00 0.00 H new ATOM 0 HG SER B 379 -2.596 3.334 2.380 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.981 1.520 1.896 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.896 0.632 2.560 1.00 0.00 C ATOM 1563 C VAL B 380 -4.901 0.913 4.057 1.00 0.00 C ATOM 1564 O VAL B 380 -4.080 1.690 4.543 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.428 -0.785 2.319 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -4.857 -1.269 0.935 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -2.901 -0.812 2.413 1.00 0.00 C ATOM 0 H VAL B 380 -3.122 1.705 2.415 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.905 0.777 2.173 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.872 -1.443 3.066 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.510 -2.291 0.783 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -5.944 -1.240 0.860 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.424 -0.621 0.173 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.544 -1.827 2.242 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.478 -0.147 1.660 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.592 -0.481 3.404 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.815 0.269 4.787 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.882 0.469 6.236 1.00 0.00 C ATOM 1579 C GLN B 381 -5.278 -0.704 6.967 1.00 0.00 C ATOM 1580 O GLN B 381 -5.673 -1.852 6.789 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.312 0.668 6.715 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.470 2.031 7.378 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.953 2.362 7.500 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.790 1.687 6.901 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.330 3.361 8.244 1.00 0.00 N ATOM 0 H GLN B 381 -6.504 -0.381 4.409 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.313 1.372 6.455 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.998 0.586 5.872 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.578 -0.119 7.421 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -7.005 2.025 8.364 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.962 2.795 6.790 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.634 3.919 8.739 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.321 3.586 8.332 1.00 0.00 H new ATOM 1594 N THR B 382 -4.324 -0.372 7.796 1.00 0.00 N ATOM 1595 CA THR B 382 -3.623 -1.358 8.608 1.00 0.00 C ATOM 1596 C THR B 382 -3.057 -0.703 9.854 1.00 0.00 C ATOM 1597 O THR B 382 -2.522 0.399 9.783 1.00 0.00 O ATOM 1598 CB THR B 382 -2.498 -2.002 7.806 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.518 -2.520 8.694 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.860 -0.965 6.885 1.00 0.00 C ATOM 0 H THR B 382 -4.004 0.586 7.935 1.00 0.00 H new ATOM 0 HA THR B 382 -4.333 -2.131 8.903 1.00 0.00 H new ATOM 0 HB THR B 382 -2.905 -2.813 7.203 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.796 -2.935 8.178 1.00 0.00 H new ATOM 0 HG21 THR B 382 -1.057 -1.431 6.314 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.613 -0.575 6.200 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.455 -0.148 7.482 1.00 0.00 H new ATOM 1608 N THR B 383 -3.150 -1.378 10.986 1.00 0.00 N ATOM 1609 CA THR B 383 -2.616 -0.805 12.208 1.00 0.00 C ATOM 1610 C THR B 383 -1.153 -1.157 12.388 1.00 0.00 C ATOM 1611 O THR B 383 -0.569 -0.945 13.451 1.00 0.00 O ATOM 1612 CB THR B 383 -3.452 -1.219 13.404 1.00 0.00 C ATOM 1613 OG1 THR B 383 -4.011 -2.508 13.177 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.563 -0.183 13.550 1.00 0.00 C ATOM 0 H THR B 383 -3.578 -2.299 11.085 1.00 0.00 H new ATOM 0 HA THR B 383 -2.672 0.281 12.129 1.00 0.00 H new ATOM 0 HB THR B 383 -2.847 -1.268 14.309 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.549 -2.773 13.952 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.192 -0.442 14.402 1.00 0.00 H new ATOM 0 HG22 THR B 383 -4.124 0.802 13.709 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.168 -0.168 12.643 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.547 -1.606 11.299 1.00 0.00 N ATOM 1623 CA GLU B 384 0.882 -1.881 11.294 1.00 0.00 C ATOM 1624 C GLU B 384 1.456 -1.507 9.934 1.00 0.00 C ATOM 1625 O GLU B 384 1.632 -2.342 9.048 1.00 0.00 O ATOM 1626 CB GLU B 384 1.168 -3.362 11.591 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.115 -4.062 12.046 1.00 0.00 C ATOM 1628 CD GLU B 384 0.157 -5.541 12.301 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.273 -6.278 11.336 1.00 0.00 O ATOM 1630 OE2 GLU B 384 0.244 -5.917 13.460 1.00 0.00 O1- ATOM 0 H GLU B 384 -1.019 -1.787 10.413 1.00 0.00 H new ATOM 0 HA GLU B 384 1.353 -1.287 12.077 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.562 -3.851 10.700 1.00 0.00 H new ATOM 0 HB3 GLU B 384 1.932 -3.445 12.364 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.493 -3.592 12.954 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.888 -3.952 11.285 1.00 0.00 H new ATOM 1637 N GLY B 385 1.775 -0.235 9.795 1.00 0.00 N ATOM 1638 CA GLY B 385 2.367 0.265 8.573 1.00 0.00 C ATOM 1639 C GLY B 385 3.874 0.095 8.613 1.00 0.00 C ATOM 1640 O GLY B 385 4.471 -0.523 7.741 1.00 0.00 O ATOM 0 H GLY B 385 1.633 0.472 10.517 1.00 0.00 H new ATOM 0 HA2 GLY B 385 1.956 -0.269 7.716 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.116 1.318 8.443 1.00 0.00 H new ATOM 1644 N GLU B 386 4.468 0.678 9.644 1.00 0.00 N ATOM 1645 CA GLU B 386 5.911 0.639 9.836 1.00 0.00 C ATOM 1646 C GLU B 386 6.448 -0.748 9.601 1.00 0.00 C ATOM 1647 O GLU B 386 7.623 -0.931 9.337 1.00 0.00 O ATOM 1648 CB GLU B 386 6.249 1.075 11.251 1.00 0.00 C ATOM 1649 CG GLU B 386 5.352 0.331 12.236 1.00 0.00 C ATOM 1650 CD GLU B 386 5.715 0.720 13.665 1.00 0.00 C ATOM 1651 OE1 GLU B 386 5.357 1.815 14.070 1.00 0.00 O ATOM 1652 OE2 GLU B 386 6.349 -0.079 14.334 1.00 0.00 O1- ATOM 0 H GLU B 386 3.965 1.190 10.369 1.00 0.00 H new ATOM 0 HA GLU B 386 6.371 1.317 9.117 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.297 0.867 11.467 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.109 2.151 11.355 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.306 0.568 12.040 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.465 -0.745 12.103 1.00 0.00 H new ATOM 1659 N GLN B 387 5.580 -1.715 9.683 1.00 0.00 N ATOM 1660 CA GLN B 387 5.991 -3.092 9.460 1.00 0.00 C ATOM 1661 C GLN B 387 6.017 -3.362 7.977 1.00 0.00 C ATOM 1662 O GLN B 387 6.919 -4.016 7.461 1.00 0.00 O ATOM 1663 CB GLN B 387 5.033 -4.058 10.152 1.00 0.00 C ATOM 1664 CG GLN B 387 5.186 -3.939 11.669 1.00 0.00 C ATOM 1665 CD GLN B 387 5.756 -5.236 12.235 1.00 0.00 C ATOM 1666 OE1 GLN B 387 5.107 -6.280 12.173 1.00 0.00 O ATOM 1667 NE2 GLN B 387 6.938 -5.230 12.786 1.00 0.00 N ATOM 0 H GLN B 387 4.591 -1.589 9.900 1.00 0.00 H new ATOM 0 HA GLN B 387 6.986 -3.242 9.880 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.006 -3.837 9.862 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.240 -5.080 9.835 1.00 0.00 H new ATOM 0 HG2 GLN B 387 5.844 -3.105 11.913 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.219 -3.726 12.126 1.00 0.00 H new ATOM 0 HE21 GLN B 387 7.473 -4.363 12.836 1.00 0.00 H new ATOM 0 HE22 GLN B 387 7.327 -6.092 13.167 1.00 0.00 H new ATOM 1676 N ILE B 388 5.030 -2.822 7.302 1.00 0.00 N ATOM 1677 CA ILE B 388 4.930 -2.955 5.864 1.00 0.00 C ATOM 1678 C ILE B 388 5.921 -2.016 5.190 1.00 0.00 C ATOM 1679 O ILE B 388 6.562 -2.355 4.196 1.00 0.00 O ATOM 1680 CB ILE B 388 3.526 -2.546 5.442 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.521 -3.622 5.828 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.484 -2.337 3.933 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.124 -3.002 5.857 1.00 0.00 C ATOM 0 H ILE B 388 4.277 -2.281 7.728 1.00 0.00 H new ATOM 0 HA ILE B 388 5.143 -3.984 5.576 1.00 0.00 H new ATOM 0 HB ILE B 388 3.266 -1.618 5.951 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.555 -4.444 5.113 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.770 -4.038 6.804 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.477 -2.044 3.634 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.188 -1.553 3.655 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.757 -3.264 3.429 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.394 -3.763 6.132 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.100 -2.194 6.588 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.881 -2.606 4.871 1.00 0.00 H new ATOM 1695 N ALA B 389 5.984 -0.812 5.733 1.00 0.00 N ATOM 1696 CA ALA B 389 6.830 0.248 5.201 1.00 0.00 C ATOM 1697 C ALA B 389 8.311 0.042 5.474 1.00 0.00 C ATOM 1698 O ALA B 389 9.133 0.308 4.606 1.00 0.00 O ATOM 1699 CB ALA B 389 6.408 1.565 5.824 1.00 0.00 C ATOM 0 H ALA B 389 5.449 -0.539 6.558 1.00 0.00 H new ATOM 0 HA ALA B 389 6.699 0.242 4.119 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.033 2.369 5.435 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.365 1.766 5.579 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.522 1.509 6.907 1.00 0.00 H new ATOM 1705 N GLN B 390 8.665 -0.391 6.674 1.00 0.00 N ATOM 1706 CA GLN B 390 10.085 -0.545 6.991 1.00 0.00 C ATOM 1707 C GLN B 390 10.720 -1.600 6.123 1.00 0.00 C ATOM 1708 O GLN B 390 11.888 -1.516 5.741 1.00 0.00 O ATOM 1709 CB GLN B 390 10.277 -0.945 8.442 1.00 0.00 C ATOM 1710 CG GLN B 390 9.758 -2.368 8.660 1.00 0.00 C ATOM 1711 CD GLN B 390 9.572 -2.637 10.151 1.00 0.00 C ATOM 1712 OE1 GLN B 390 9.172 -3.735 10.538 1.00 0.00 O ATOM 1713 NE2 GLN B 390 9.849 -1.699 11.018 1.00 0.00 N ATOM 0 H GLN B 390 8.019 -0.636 7.424 1.00 0.00 H new ATOM 0 HA GLN B 390 10.559 0.419 6.807 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.333 -0.888 8.708 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.746 -0.251 9.094 1.00 0.00 H new ATOM 0 HG2 GLN B 390 8.811 -2.502 8.138 1.00 0.00 H new ATOM 0 HG3 GLN B 390 10.459 -3.088 8.238 1.00 0.00 H new ATOM 0 HE21 GLN B 390 10.180 -0.789 10.697 1.00 0.00 H new ATOM 0 HE22 GLN B 390 9.734 -1.877 12.016 1.00 0.00 H new ATOM 1722 N LEU B 391 9.930 -2.592 5.841 1.00 0.00 N ATOM 1723 CA LEU B 391 10.356 -3.708 5.034 1.00 0.00 C ATOM 1724 C LEU B 391 10.462 -3.251 3.590 1.00 0.00 C ATOM 1725 O LEU B 391 11.519 -3.355 2.969 1.00 0.00 O ATOM 1726 CB LEU B 391 9.345 -4.828 5.269 1.00 0.00 C ATOM 1727 CG LEU B 391 8.528 -5.191 4.022 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.398 -5.947 3.007 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.369 -6.070 4.473 1.00 0.00 C ATOM 0 H LEU B 391 8.965 -2.655 6.164 1.00 0.00 H new ATOM 0 HA LEU B 391 11.343 -4.088 5.298 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.873 -5.715 5.618 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.663 -4.529 6.065 1.00 0.00 H new ATOM 0 HG LEU B 391 8.161 -4.287 3.536 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.801 -6.196 2.130 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.237 -5.319 2.708 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.774 -6.864 3.462 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.765 -6.348 3.609 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.759 -6.970 4.948 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.752 -5.522 5.185 1.00 0.00 H new ATOM 1741 N ILE B 392 9.384 -2.678 3.091 1.00 0.00 N ATOM 1742 CA ILE B 392 9.371 -2.128 1.769 1.00 0.00 C ATOM 1743 C ILE B 392 10.593 -1.269 1.677 1.00 0.00 C ATOM 1744 O ILE B 392 11.462 -1.467 0.839 1.00 0.00 O ATOM 1745 CB ILE B 392 8.117 -1.268 1.628 1.00 0.00 C ATOM 1746 CG1 ILE B 392 6.990 -2.110 1.035 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.393 -0.048 0.741 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.678 -1.333 1.099 1.00 0.00 C ATOM 0 H ILE B 392 8.502 -2.586 3.595 1.00 0.00 H new ATOM 0 HA ILE B 392 9.366 -2.890 0.990 1.00 0.00 H new ATOM 0 HB ILE B 392 7.821 -0.908 2.613 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.221 -2.368 0.001 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.896 -3.047 1.584 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.487 0.551 0.654 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.185 0.554 1.187 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.704 -0.381 -0.249 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.876 -1.937 0.675 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.445 -1.098 2.137 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.775 -0.408 0.530 1.00 0.00 H new ATOM 1760 N ALA B 393 10.644 -0.347 2.621 1.00 0.00 N ATOM 1761 CA ALA B 393 11.757 0.575 2.755 1.00 0.00 C ATOM 1762 C ALA B 393 13.072 -0.177 2.810 1.00 0.00 C ATOM 1763 O ALA B 393 14.105 0.314 2.354 1.00 0.00 O ATOM 1764 CB ALA B 393 11.622 1.338 4.054 1.00 0.00 C ATOM 0 H ALA B 393 9.912 -0.216 3.319 1.00 0.00 H new ATOM 0 HA ALA B 393 11.745 1.246 1.896 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.457 2.031 4.157 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.685 1.895 4.053 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.626 0.638 4.889 1.00 0.00 H new ATOM 1770 N GLY B 394 13.029 -1.362 3.408 1.00 0.00 N ATOM 1771 CA GLY B 394 14.234 -2.162 3.560 1.00 0.00 C ATOM 1772 C GLY B 394 14.491 -2.984 2.324 1.00 0.00 C ATOM 1773 O GLY B 394 15.594 -3.474 2.102 1.00 0.00 O ATOM 0 H GLY B 394 12.183 -1.784 3.791 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.086 -1.510 3.752 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.133 -2.819 4.424 1.00 0.00 H new ATOM 1777 N TYR B 395 13.458 -3.126 1.531 1.00 0.00 N ATOM 1778 CA TYR B 395 13.542 -3.883 0.311 1.00 0.00 C ATOM 1779 C TYR B 395 14.024 -2.976 -0.809 1.00 0.00 C ATOM 1780 O TYR B 395 14.836 -3.383 -1.633 1.00 0.00 O ATOM 1781 CB TYR B 395 12.173 -4.484 0.036 1.00 0.00 C ATOM 1782 CG TYR B 395 11.967 -5.775 0.840 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.740 -6.080 1.988 1.00 0.00 C ATOM 1784 CD2 TYR B 395 10.999 -6.690 0.410 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.530 -7.283 2.675 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.800 -7.893 1.099 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.565 -8.191 2.227 1.00 0.00 C ATOM 1788 OH TYR B 395 11.367 -9.378 2.902 1.00 0.00 O ATOM 0 H TYR B 395 12.540 -2.721 1.714 1.00 0.00 H new ATOM 0 HA TYR B 395 14.261 -4.698 0.389 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.397 -3.763 0.294 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.072 -4.694 -1.029 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.491 -5.385 2.333 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.400 -6.466 -0.461 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.115 -7.510 3.554 1.00 0.00 H new ATOM 0 HE2 TYR B 395 10.052 -8.592 0.756 1.00 0.00 H new ATOM 0 HH TYR B 395 10.660 -9.892 2.459 1.00 0.00 H new ATOM 1798 N ILE B 396 13.585 -1.723 -0.796 1.00 0.00 N ATOM 1799 CA ILE B 396 14.078 -0.777 -1.798 1.00 0.00 C ATOM 1800 C ILE B 396 15.528 -0.490 -1.536 1.00 0.00 C ATOM 1801 O ILE B 396 16.244 0.077 -2.362 1.00 0.00 O ATOM 1802 CB ILE B 396 13.312 0.543 -1.838 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.117 0.478 -0.915 1.00 0.00 C ATOM 1804 CG2 ILE B 396 12.841 0.795 -3.269 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.298 1.762 -1.038 1.00 0.00 C ATOM 0 H ILE B 396 12.912 -1.344 -0.129 1.00 0.00 H new ATOM 0 HA ILE B 396 13.930 -1.253 -2.767 1.00 0.00 H new ATOM 0 HB ILE B 396 13.964 1.353 -1.511 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.499 -0.384 -1.166 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.448 0.344 0.115 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.292 1.736 -3.311 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.704 0.849 -3.932 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.190 -0.020 -3.587 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.438 1.710 -0.371 1.00 0.00 H new ATOM 0 HD12 ILE B 396 11.918 2.616 -0.765 1.00 0.00 H new ATOM 0 HD13 ILE B 396 10.954 1.877 -2.066 1.00 0.00 H new ATOM 1817 N ASP B 397 15.942 -0.900 -0.370 1.00 0.00 N ATOM 1818 CA ASP B 397 17.312 -0.693 0.065 1.00 0.00 C ATOM 1819 C ASP B 397 18.207 -1.714 -0.588 1.00 0.00 C ATOM 1820 O ASP B 397 19.421 -1.542 -0.697 1.00 0.00 O ATOM 1821 CB ASP B 397 17.383 -0.839 1.581 1.00 0.00 C ATOM 1822 CG ASP B 397 18.318 0.212 2.169 1.00 0.00 C ATOM 1823 OD1 ASP B 397 19.417 0.352 1.656 1.00 0.00 O1- ATOM 1824 OD2 ASP B 397 17.922 0.861 3.122 1.00 0.00 O ATOM 0 H ASP B 397 15.352 -1.384 0.307 1.00 0.00 H new ATOM 0 HA ASP B 397 17.642 0.306 -0.220 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.387 -0.731 2.011 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.736 -1.837 1.841 1.00 0.00 H new ATOM 1829 N ILE B 398 17.580 -2.792 -0.985 1.00 0.00 N ATOM 1830 CA ILE B 398 18.257 -3.899 -1.598 1.00 0.00 C ATOM 1831 C ILE B 398 18.290 -3.778 -3.105 1.00 0.00 C ATOM 1832 O ILE B 398 19.346 -3.746 -3.737 1.00 0.00 O ATOM 1833 CB ILE B 398 17.477 -5.134 -1.220 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.465 -5.264 0.308 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.119 -6.349 -1.859 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.383 -6.244 0.775 1.00 0.00 C ATOM 0 H ILE B 398 16.573 -2.924 -0.889 1.00 0.00 H new ATOM 0 HA ILE B 398 19.292 -3.934 -1.257 1.00 0.00 H new ATOM 0 HB ILE B 398 16.450 -5.059 -1.577 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.441 -5.605 0.654 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.291 -4.286 0.757 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.557 -7.243 -1.587 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.116 -6.234 -2.943 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.146 -6.445 -1.507 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.400 -6.314 1.863 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.405 -5.889 0.450 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.573 -7.227 0.345 1.00 0.00 H new ATOM 1848 N ILE B 399 17.095 -3.777 -3.656 1.00 0.00 N ATOM 1849 CA ILE B 399 16.893 -3.733 -5.090 1.00 0.00 C ATOM 1850 C ILE B 399 17.396 -2.437 -5.706 1.00 0.00 C ATOM 1851 O ILE B 399 17.628 -2.376 -6.912 1.00 0.00 O ATOM 1852 CB ILE B 399 15.407 -3.873 -5.347 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.727 -2.609 -4.844 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.881 -5.072 -4.559 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.291 -2.932 -4.394 1.00 0.00 C ATOM 0 H ILE B 399 16.229 -3.807 -3.118 1.00 0.00 H new ATOM 0 HA ILE B 399 17.460 -4.542 -5.550 1.00 0.00 H new ATOM 0 HB ILE B 399 15.209 -4.018 -6.409 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.292 -2.188 -4.013 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.710 -1.856 -5.632 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.811 -5.183 -4.736 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.398 -5.975 -4.883 1.00 0.00 H new ATOM 0 HG23 ILE B 399 15.058 -4.914 -3.495 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.809 -2.023 -4.035 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.727 -3.333 -5.236 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.318 -3.669 -3.592 1.00 0.00 H new ATOM 1867 N LEU B 400 17.543 -1.391 -4.897 1.00 0.00 N ATOM 1868 CA LEU B 400 18.002 -0.115 -5.455 1.00 0.00 C ATOM 1869 C LEU B 400 19.229 -0.320 -6.341 1.00 0.00 C ATOM 1870 O LEU B 400 19.664 0.645 -6.945 1.00 0.00 O ATOM 1871 CB LEU B 400 18.335 0.899 -4.358 1.00 0.00 C ATOM 1872 CG LEU B 400 19.129 0.232 -3.234 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.498 -0.229 -3.745 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.332 1.240 -2.101 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.716 -1.438 -6.403 1.00 0.00 O ATOM 0 H LEU B 400 17.361 -1.393 -3.893 1.00 0.00 H new ATOM 0 HA LEU B 400 17.182 0.281 -6.054 1.00 0.00 H new ATOM 0 HB2 LEU B 400 18.912 1.723 -4.779 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.415 1.326 -3.958 1.00 0.00 H new ATOM 0 HG LEU B 400 18.575 -0.636 -2.876 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.050 -0.701 -2.932 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.362 -0.945 -4.555 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.058 0.631 -4.112 1.00 0.00 H new ATOM 0 HD21 LEU B 400 19.898 0.772 -1.295 1.00 0.00 H new ATOM 0 HD22 LEU B 400 19.881 2.103 -2.476 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.362 1.563 -1.723 1.00 0.00 H new