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 180:sc= -0.182 USER MOD Set 1.2: B 379 SER OG : rot 99:sc= 0.935 USER MOD Set 2.1: B 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 373 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: B 362 SER OG : rot 50:sc= -0.333! USER MOD Set 3.2: B 365 SER OG : rot 180:sc= 0 USER MOD Set 4.1: B 352 SER OG : rot -81:sc= -4.03! USER MOD Set 4.2: B 355 ASN : amide:sc= -5.11! C(o=-9.1!,f=-11!) USER MOD Set 5.1: B 333 THR OG1 : rot -144:sc= -2.5! USER MOD Set 5.2: B 336 CYS SG : rot 180:sc= -0.378! USER MOD Set 6.1: B 311 SER OG : rot -120:sc= -0.406 USER MOD Set 6.2: 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+ -153:sc= -0.245 (180deg=-1.33!) USER MOD Single : B 338 MET CE :methyl -143:sc= -0.212 (180deg=-4.27!) USER MOD Single : B 343 LYS NZ :NH3+ 157:sc= -0.108 (180deg=-1.08) USER MOD Single : B 344 THR OG1 : rot -150:sc= -0.692 USER MOD Single : B 345 LYS NZ :NH3+ -144:sc= -0.26 (180deg=-1.2!) USER MOD Single : B 349 GLN : amide:sc= -1.45 K(o=-1.5,f=-0.27) USER MOD Single : B 354 THR OG1 : rot -48:sc= -0.215 USER MOD Single : B 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 374 GLN : amide:sc= -0.166 K(o=-0.17,f=-1.6) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.07! USER MOD Single : B 378 TYR OH : rot 180:sc= 0 USER MOD Single : B 381 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : B 382 THR OG1 : rot 180:sc= 0.582 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0694 USER MOD Single : B 387 GLN : amide:sc= -0.951 X(o=-0.95,f=-1.2) USER MOD Single : B 390 GLN : amide:sc= -8.15! C(o=-8.1!,f=-5.9!) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 1.133 11.839 1.902 1.00 0.00 N ATOM 126 CA LEU A 15 0.463 10.573 1.619 1.00 0.00 C ATOM 127 C LEU A 15 -0.760 10.438 2.512 1.00 0.00 C ATOM 128 O LEU A 15 -1.825 10.009 2.070 1.00 0.00 O ATOM 129 CB LEU A 15 1.418 9.393 1.875 1.00 0.00 C ATOM 130 CG LEU A 15 2.401 9.166 0.704 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.661 8.869 -0.601 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.273 10.399 0.501 1.00 0.00 C ATOM 0 HA LEU A 15 0.159 10.560 0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.982 9.578 2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.835 8.486 2.038 1.00 0.00 H new ATOM 0 HG LEU A 15 3.019 8.306 0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.384 8.715 -1.402 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.056 7.970 -0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.015 9.710 -0.852 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.961 10.226 -0.327 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.641 11.258 0.274 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.841 10.596 1.410 1.00 0.00 H new ATOM 144 N LEU A 16 -0.604 10.828 3.768 1.00 0.00 N ATOM 145 CA LEU A 16 -1.707 10.765 4.710 1.00 0.00 C ATOM 146 C LEU A 16 -2.859 11.642 4.211 1.00 0.00 C ATOM 147 O LEU A 16 -4.028 11.247 4.261 1.00 0.00 O ATOM 148 CB LEU A 16 -1.227 11.231 6.088 1.00 0.00 C ATOM 149 CG LEU A 16 -1.694 10.256 7.178 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.210 10.069 7.099 1.00 0.00 C ATOM 151 CD2 LEU A 16 -0.999 8.897 6.997 1.00 0.00 C ATOM 0 H LEU A 16 0.268 11.188 4.155 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.065 9.739 4.794 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.139 11.301 6.096 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.612 12.229 6.295 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.434 10.668 8.153 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.532 9.376 7.876 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.703 11.030 7.243 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.477 9.668 6.121 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.335 8.210 7.774 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.249 8.488 6.018 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.081 9.028 7.071 1.00 0.00 H new ATOM 163 N GLY A 17 -2.522 12.817 3.692 1.00 0.00 N ATOM 164 CA GLY A 17 -3.539 13.711 3.148 1.00 0.00 C ATOM 165 C GLY A 17 -4.262 13.013 2.008 1.00 0.00 C ATOM 166 O GLY A 17 -5.484 13.086 1.885 1.00 0.00 O ATOM 0 H GLY A 17 -1.567 13.170 3.636 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.248 13.991 3.927 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.077 14.632 2.792 1.00 0.00 H new ATOM 170 N GLU A 18 -3.489 12.314 1.184 1.00 0.00 N ATOM 171 CA GLU A 18 -4.051 11.573 0.067 1.00 0.00 C ATOM 172 C GLU A 18 -4.916 10.431 0.578 1.00 0.00 C ATOM 173 O GLU A 18 -5.979 10.159 0.031 1.00 0.00 O ATOM 174 CB GLU A 18 -2.917 11.029 -0.792 1.00 0.00 C ATOM 175 CG GLU A 18 -2.542 12.073 -1.838 1.00 0.00 C ATOM 176 CD GLU A 18 -3.384 11.884 -3.096 1.00 0.00 C ATOM 177 OE1 GLU A 18 -4.413 11.233 -3.007 1.00 0.00 O ATOM 178 OE2 GLU A 18 -2.986 12.392 -4.131 1.00 0.00 O1- ATOM 0 H GLU A 18 -2.475 12.247 1.270 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.675 12.236 -0.532 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.054 10.792 -0.170 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.224 10.103 -1.278 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.697 13.074 -1.435 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.483 11.988 -2.084 1.00 0.00 H new ATOM 394 N VAL B 310 9.401 -12.663 0.670 1.00 0.00 N ATOM 395 CA VAL B 310 8.120 -11.998 0.467 1.00 0.00 C ATOM 396 C VAL B 310 7.368 -11.855 1.790 1.00 0.00 C ATOM 397 O VAL B 310 7.282 -12.802 2.573 1.00 0.00 O ATOM 398 CB VAL B 310 7.271 -12.801 -0.521 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.877 -12.182 -0.614 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.931 -12.767 -1.902 1.00 0.00 C ATOM 0 HA VAL B 310 8.308 -11.003 0.064 1.00 0.00 H new ATOM 0 HB VAL B 310 7.191 -13.832 -0.177 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.271 -12.753 -1.318 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.405 -12.199 0.368 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.959 -11.151 -0.959 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.328 -13.338 -2.608 1.00 0.00 H new ATOM 0 HG22 VAL B 310 8.008 -11.735 -2.243 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.928 -13.204 -1.840 1.00 0.00 H new ATOM 410 N SER B 311 6.826 -10.663 2.029 1.00 0.00 N ATOM 411 CA SER B 311 6.082 -10.391 3.253 1.00 0.00 C ATOM 412 C SER B 311 4.605 -10.209 2.937 1.00 0.00 C ATOM 413 O SER B 311 4.254 -9.837 1.826 1.00 0.00 O ATOM 414 CB SER B 311 6.620 -9.131 3.907 1.00 0.00 C ATOM 415 OG SER B 311 7.761 -8.682 3.190 1.00 0.00 O ATOM 0 H SER B 311 6.889 -9.871 1.390 1.00 0.00 H new ATOM 0 HA SER B 311 6.199 -11.234 3.934 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.853 -8.356 3.916 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.884 -9.330 4.946 1.00 0.00 H new ATOM 0 HG SER B 311 8.538 -8.667 3.787 1.00 0.00 H new ATOM 421 N PHE B 312 3.744 -10.499 3.910 1.00 0.00 N ATOM 422 CA PHE B 312 2.301 -10.396 3.708 1.00 0.00 C ATOM 423 C PHE B 312 1.637 -9.581 4.820 1.00 0.00 C ATOM 424 O PHE B 312 1.934 -9.791 5.996 1.00 0.00 O ATOM 425 CB PHE B 312 1.731 -11.812 3.721 1.00 0.00 C ATOM 426 CG PHE B 312 2.067 -12.513 2.424 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.500 -12.074 1.222 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.948 -13.603 2.423 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.812 -12.722 0.021 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.260 -14.251 1.223 1.00 0.00 C ATOM 431 CZ PHE B 312 2.692 -13.811 0.021 1.00 0.00 C ATOM 0 H PHE B 312 4.019 -10.806 4.843 1.00 0.00 H new ATOM 0 HA PHE B 312 2.105 -9.892 2.762 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.140 -12.370 4.563 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.650 -11.777 3.856 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.821 -11.234 1.221 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.386 -13.943 3.350 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.374 -12.382 -0.906 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.939 -15.091 1.224 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.933 -14.311 -0.905 1.00 0.00 H new ATOM 441 N PHE B 313 0.719 -8.666 4.461 1.00 0.00 N ATOM 442 CA PHE B 313 0.034 -7.881 5.477 1.00 0.00 C ATOM 443 C PHE B 313 -1.437 -7.745 5.143 1.00 0.00 C ATOM 444 O PHE B 313 -1.803 -7.351 4.039 1.00 0.00 O ATOM 445 CB PHE B 313 0.639 -6.489 5.581 1.00 0.00 C ATOM 446 CG PHE B 313 1.952 -6.558 6.314 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.122 -6.887 5.624 1.00 0.00 C ATOM 448 CD2 PHE B 313 1.999 -6.285 7.684 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.343 -6.941 6.304 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.221 -6.338 8.366 1.00 0.00 C ATOM 451 CZ PHE B 313 4.393 -6.666 7.674 1.00 0.00 C ATOM 0 H PHE B 313 0.446 -8.462 3.499 1.00 0.00 H new ATOM 0 HA PHE B 313 0.149 -8.401 6.428 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.789 -6.072 4.585 1.00 0.00 H new ATOM 0 HB3 PHE B 313 -0.046 -5.823 6.105 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.083 -7.100 4.566 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.094 -6.033 8.216 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.247 -7.195 5.771 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.259 -6.126 9.424 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.336 -6.707 8.199 1.00 0.00 H new ATOM 461 N LEU B 314 -2.272 -8.043 6.117 1.00 0.00 N ATOM 462 CA LEU B 314 -3.698 -7.920 5.935 1.00 0.00 C ATOM 463 C LEU B 314 -4.113 -6.484 6.152 1.00 0.00 C ATOM 464 O LEU B 314 -4.179 -5.953 7.250 1.00 0.00 O ATOM 465 CB LEU B 314 -4.472 -8.948 6.787 1.00 0.00 C ATOM 466 CG LEU B 314 -4.946 -8.439 8.163 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.809 -7.783 8.952 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.144 -7.482 8.018 1.00 0.00 C ATOM 0 H LEU B 314 -1.986 -8.371 7.039 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.963 -8.169 4.908 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.342 -9.282 6.222 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.837 -9.821 6.940 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.275 -9.308 8.733 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.186 -7.438 9.915 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.012 -8.509 9.113 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.419 -6.934 8.390 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.457 -7.139 9.004 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.853 -6.625 7.411 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.971 -8.004 7.536 1.00 0.00 H new ATOM 480 N VAL B 315 -4.310 -5.849 5.042 1.00 0.00 N ATOM 481 CA VAL B 315 -4.662 -4.451 5.008 1.00 0.00 C ATOM 482 C VAL B 315 -6.085 -4.284 4.482 1.00 0.00 C ATOM 483 O VAL B 315 -6.586 -5.159 3.793 1.00 0.00 O ATOM 484 CB VAL B 315 -3.677 -3.751 4.090 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.252 -3.937 4.610 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.810 -4.339 2.673 1.00 0.00 C ATOM 0 H VAL B 315 -4.233 -6.282 4.122 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.620 -4.020 6.008 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.895 -2.683 4.062 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.553 -3.431 3.944 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.172 -3.513 5.611 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.014 -5.000 4.646 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.106 -3.842 2.005 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.593 -5.407 2.700 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.826 -4.185 2.309 1.00 0.00 H new ATOM 496 N LYS B 316 -6.738 -3.163 4.792 1.00 0.00 N ATOM 497 CA LYS B 316 -8.090 -2.942 4.314 1.00 0.00 C ATOM 498 C LYS B 316 -8.059 -2.037 3.099 1.00 0.00 C ATOM 499 O LYS B 316 -7.232 -1.136 3.006 1.00 0.00 O ATOM 500 CB LYS B 316 -8.948 -2.296 5.388 1.00 0.00 C ATOM 501 CG LYS B 316 -8.692 -2.960 6.744 1.00 0.00 C ATOM 502 CD LYS B 316 -9.509 -2.250 7.826 1.00 0.00 C ATOM 503 CE LYS B 316 -10.338 -3.280 8.596 1.00 0.00 C ATOM 504 NZ LYS B 316 -11.042 -2.609 9.726 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.355 -2.409 5.363 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.520 -3.909 4.053 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.725 -1.231 5.449 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.002 -2.386 5.124 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -8.965 -4.014 6.701 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.631 -2.915 6.988 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -8.845 -1.718 8.508 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.164 -1.506 7.373 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -11.062 -3.750 7.931 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -9.692 -4.072 8.975 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -11.605 -3.310 10.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -10.343 -2.180 10.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -11.670 -1.869 9.353 1.00 0.00 H new ATOM 518 N GLU B 317 -8.950 -2.304 2.171 1.00 0.00 N ATOM 519 CA GLU B 317 -9.011 -1.536 0.940 1.00 0.00 C ATOM 520 C GLU B 317 -10.416 -1.069 0.610 1.00 0.00 C ATOM 521 O GLU B 317 -11.409 -1.699 0.954 1.00 0.00 O ATOM 522 CB GLU B 317 -8.510 -2.391 -0.206 1.00 0.00 C ATOM 523 CG GLU B 317 -8.093 -1.498 -1.381 1.00 0.00 C ATOM 524 CD GLU B 317 -7.446 -2.336 -2.478 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.833 -3.338 -2.149 1.00 0.00 O1- ATOM 526 OE2 GLU B 317 -7.567 -1.959 -3.633 1.00 0.00 O ATOM 0 H GLU B 317 -9.645 -3.047 2.242 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.388 -0.653 1.082 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.663 -2.994 0.122 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.290 -3.083 -0.523 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -8.964 -0.977 -1.778 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.395 -0.735 -1.037 1.00 0.00 H new ATOM 678 N VAL B 326 -12.467 -2.834 2.810 1.00 0.00 N ATOM 679 CA VAL B 326 -12.651 -4.261 2.848 1.00 0.00 C ATOM 680 C VAL B 326 -11.352 -4.939 3.259 1.00 0.00 C ATOM 681 O VAL B 326 -10.326 -4.691 2.627 1.00 0.00 O ATOM 682 CB VAL B 326 -13.037 -4.707 1.451 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.783 -6.201 1.294 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.509 -4.387 1.218 1.00 0.00 C ATOM 0 HA VAL B 326 -13.424 -4.529 3.568 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.433 -4.179 0.713 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -13.063 -6.514 0.288 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.726 -6.410 1.458 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.379 -6.750 2.023 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.796 -4.704 0.215 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.117 -4.914 1.953 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.668 -3.313 1.318 1.00 0.00 H new ATOM 694 N PRO B 327 -11.347 -5.788 4.271 1.00 0.00 N ATOM 695 CA PRO B 327 -10.101 -6.480 4.667 1.00 0.00 C ATOM 696 C PRO B 327 -9.404 -6.940 3.407 1.00 0.00 C ATOM 697 O PRO B 327 -10.066 -7.299 2.436 1.00 0.00 O ATOM 698 CB PRO B 327 -10.583 -7.653 5.518 1.00 0.00 C ATOM 699 CG PRO B 327 -11.895 -7.216 6.088 1.00 0.00 C ATOM 700 CD PRO B 327 -12.484 -6.179 5.123 1.00 0.00 C ATOM 0 HA PRO B 327 -9.392 -5.865 5.221 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.697 -8.555 4.916 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.869 -7.885 6.308 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.569 -8.066 6.198 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.760 -6.785 7.080 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.297 -6.602 4.532 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.892 -5.323 5.660 1.00 0.00 H new ATOM 708 N ARG B 328 -8.092 -6.880 3.382 1.00 0.00 N ATOM 709 CA ARG B 328 -7.391 -7.236 2.188 1.00 0.00 C ATOM 710 C ARG B 328 -6.086 -7.864 2.566 1.00 0.00 C ATOM 711 O ARG B 328 -5.858 -8.161 3.734 1.00 0.00 O ATOM 712 CB ARG B 328 -7.187 -5.989 1.317 1.00 0.00 C ATOM 713 CG ARG B 328 -7.255 -6.373 -0.162 1.00 0.00 C ATOM 714 CD ARG B 328 -8.707 -6.310 -0.642 1.00 0.00 C ATOM 715 NE ARG B 328 -8.919 -7.254 -1.736 1.00 0.00 N ATOM 716 CZ ARG B 328 -10.129 -7.735 -2.001 1.00 0.00 C ATOM 717 NH1 ARG B 328 -11.151 -7.363 -1.281 1.00 0.00 N ATOM 718 NH2 ARG B 328 -10.296 -8.577 -2.985 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.504 -6.592 4.165 1.00 0.00 H new ATOM 0 HA ARG B 328 -7.967 -7.955 1.605 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -7.951 -5.246 1.545 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.223 -5.533 1.540 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -6.636 -5.697 -0.752 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -6.857 -7.377 -0.306 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -9.381 -6.541 0.183 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -8.944 -5.299 -0.973 1.00 0.00 H new ATOM 0 HE ARG B 328 -8.126 -7.549 -2.306 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -11.021 -6.703 -0.514 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -12.080 -7.732 -1.485 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -9.498 -8.866 -3.550 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.225 -8.946 -3.188 1.00 0.00 H new ATOM 732 N LEU B 329 -5.260 -8.123 1.589 1.00 0.00 N ATOM 733 CA LEU B 329 -4.019 -8.773 1.854 1.00 0.00 C ATOM 734 C LEU B 329 -2.970 -8.245 0.901 1.00 0.00 C ATOM 735 O LEU B 329 -3.144 -8.286 -0.301 1.00 0.00 O ATOM 736 CB LEU B 329 -4.297 -10.275 1.733 1.00 0.00 C ATOM 737 CG LEU B 329 -3.197 -11.157 2.351 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.197 -12.526 1.662 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.812 -10.537 2.201 1.00 0.00 C ATOM 0 H LEU B 329 -5.428 -7.893 0.610 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.620 -8.578 2.850 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.247 -10.500 2.218 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.408 -10.532 0.680 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.414 -11.254 3.415 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.419 -13.153 2.098 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.167 -13.003 1.801 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -3.005 -12.397 0.597 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.068 -11.194 2.652 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.585 -10.404 1.143 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.791 -9.569 2.701 1.00 0.00 H new ATOM 751 N LEU B 330 -1.893 -7.717 1.458 1.00 0.00 N ATOM 752 CA LEU B 330 -0.823 -7.156 0.671 1.00 0.00 C ATOM 753 C LEU B 330 0.314 -8.135 0.630 1.00 0.00 C ATOM 754 O LEU B 330 0.436 -8.968 1.518 1.00 0.00 O ATOM 755 CB LEU B 330 -0.383 -5.847 1.335 1.00 0.00 C ATOM 756 CG LEU B 330 0.946 -5.327 0.771 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.760 -4.885 -0.674 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.390 -4.143 1.620 1.00 0.00 C ATOM 0 H LEU B 330 -1.742 -7.668 2.466 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.148 -6.955 -0.350 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.156 -5.092 1.192 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.283 -6.002 2.409 1.00 0.00 H new ATOM 0 HG LEU B 330 1.699 -6.115 0.797 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.708 -4.517 -1.067 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.423 -5.731 -1.273 1.00 0.00 H new ATOM 0 HD13 LEU B 330 0.016 -4.090 -0.718 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.334 -3.755 1.238 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.633 -3.360 1.577 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.521 -4.465 2.653 1.00 0.00 H new ATOM 770 N GLY B 331 1.173 -8.006 -0.369 1.00 0.00 N ATOM 771 CA GLY B 331 2.311 -8.863 -0.451 1.00 0.00 C ATOM 772 C GLY B 331 3.520 -8.083 -0.925 1.00 0.00 C ATOM 773 O GLY B 331 3.633 -7.734 -2.092 1.00 0.00 O ATOM 0 H GLY B 331 1.093 -7.320 -1.119 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.514 -9.305 0.525 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.108 -9.685 -1.137 1.00 0.00 H new ATOM 777 N ILE B 332 4.437 -7.838 -0.016 1.00 0.00 N ATOM 778 CA ILE B 332 5.656 -7.151 -0.368 1.00 0.00 C ATOM 779 C ILE B 332 6.666 -8.180 -0.806 1.00 0.00 C ATOM 780 O ILE B 332 6.997 -9.094 -0.059 1.00 0.00 O ATOM 781 CB ILE B 332 6.232 -6.391 0.819 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.165 -5.473 1.418 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.436 -5.562 0.358 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.550 -4.609 0.315 1.00 0.00 C ATOM 0 H ILE B 332 4.362 -8.103 0.966 1.00 0.00 H new ATOM 0 HA ILE B 332 5.436 -6.437 -1.161 1.00 0.00 H new ATOM 0 HB ILE B 332 6.553 -7.101 1.581 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.390 -6.067 1.902 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.607 -4.839 2.186 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.849 -5.017 1.207 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.198 -6.224 -0.054 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.119 -4.854 -0.408 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.790 -3.956 0.745 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.328 -4.003 -0.149 1.00 0.00 H new ATOM 0 HD13 ILE B 332 4.093 -5.251 -0.438 1.00 0.00 H new ATOM 796 N THR B 333 7.149 -8.012 -2.010 1.00 0.00 N ATOM 797 CA THR B 333 8.116 -8.905 -2.570 1.00 0.00 C ATOM 798 C THR B 333 9.378 -8.130 -2.840 1.00 0.00 C ATOM 799 O THR B 333 9.322 -7.007 -3.327 1.00 0.00 O ATOM 800 CB THR B 333 7.560 -9.478 -3.867 1.00 0.00 C ATOM 801 OG1 THR B 333 7.807 -8.576 -4.928 1.00 0.00 O ATOM 802 CG2 THR B 333 6.053 -9.690 -3.716 1.00 0.00 C ATOM 0 H THR B 333 6.878 -7.247 -2.628 1.00 0.00 H new ATOM 0 HA THR B 333 8.334 -9.724 -1.884 1.00 0.00 H new ATOM 0 HB THR B 333 8.045 -10.430 -4.085 1.00 0.00 H new ATOM 0 HG1 THR B 333 7.052 -8.591 -5.553 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.649 -10.100 -4.641 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.863 -10.385 -2.898 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.571 -8.736 -3.501 1.00 0.00 H new ATOM 810 N LYS B 334 10.511 -8.717 -2.529 1.00 0.00 N ATOM 811 CA LYS B 334 11.787 -8.044 -2.747 1.00 0.00 C ATOM 812 C LYS B 334 11.973 -7.646 -4.207 1.00 0.00 C ATOM 813 O LYS B 334 13.065 -7.308 -4.633 1.00 0.00 O ATOM 814 CB LYS B 334 12.926 -8.951 -2.320 1.00 0.00 C ATOM 815 CG LYS B 334 12.886 -10.251 -3.128 1.00 0.00 C ATOM 816 CD LYS B 334 13.989 -11.191 -2.634 1.00 0.00 C ATOM 817 CE LYS B 334 13.723 -12.606 -3.148 1.00 0.00 C ATOM 818 NZ LYS B 334 12.393 -13.070 -2.662 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.584 -9.652 -2.127 1.00 0.00 H new ATOM 0 HA LYS B 334 11.789 -7.134 -2.147 1.00 0.00 H new ATOM 0 HB2 LYS B 334 13.881 -8.447 -2.472 1.00 0.00 H new ATOM 0 HB3 LYS B 334 12.848 -9.171 -1.255 1.00 0.00 H new ATOM 0 HG2 LYS B 334 11.912 -10.728 -3.022 1.00 0.00 H new ATOM 0 HG3 LYS B 334 13.023 -10.038 -4.188 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.961 -10.843 -2.983 1.00 0.00 H new ATOM 0 HD3 LYS B 334 14.022 -11.189 -1.545 1.00 0.00 H new ATOM 0 HE2 LYS B 334 13.749 -12.619 -4.238 1.00 0.00 H new ATOM 0 HE3 LYS B 334 14.505 -13.283 -2.802 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 12.390 -14.108 -2.597 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 12.205 -12.663 -1.723 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 11.654 -12.763 -3.326 1.00 0.00 H new ATOM 832 N GLU B 335 10.893 -7.701 -4.950 1.00 0.00 N ATOM 833 CA GLU B 335 10.890 -7.324 -6.355 1.00 0.00 C ATOM 834 C GLU B 335 9.578 -6.649 -6.732 1.00 0.00 C ATOM 835 O GLU B 335 9.391 -6.260 -7.884 1.00 0.00 O ATOM 836 CB GLU B 335 11.096 -8.556 -7.230 1.00 0.00 C ATOM 837 CG GLU B 335 10.096 -9.643 -6.827 1.00 0.00 C ATOM 838 CD GLU B 335 10.248 -10.858 -7.736 1.00 0.00 C ATOM 839 OE1 GLU B 335 11.368 -11.142 -8.127 1.00 0.00 O1- ATOM 840 OE2 GLU B 335 9.244 -11.485 -8.027 1.00 0.00 O ATOM 0 H GLU B 335 9.985 -8.009 -4.601 1.00 0.00 H new ATOM 0 HA GLU B 335 11.707 -6.621 -6.518 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.962 -8.296 -8.280 1.00 0.00 H new ATOM 0 HB3 GLU B 335 12.115 -8.926 -7.121 1.00 0.00 H new ATOM 0 HG2 GLU B 335 10.261 -9.933 -5.789 1.00 0.00 H new ATOM 0 HG3 GLU B 335 9.079 -9.255 -6.892 1.00 0.00 H new ATOM 847 N CYS B 336 8.644 -6.556 -5.785 1.00 0.00 N ATOM 848 CA CYS B 336 7.350 -5.979 -6.104 1.00 0.00 C ATOM 849 C CYS B 336 6.465 -5.812 -4.894 1.00 0.00 C ATOM 850 O CYS B 336 6.821 -6.151 -3.768 1.00 0.00 O ATOM 851 CB CYS B 336 6.627 -6.845 -7.140 1.00 0.00 C ATOM 852 SG CYS B 336 5.258 -7.733 -6.354 1.00 0.00 S ATOM 0 H CYS B 336 8.758 -6.864 -4.819 1.00 0.00 H new ATOM 0 HA CYS B 336 7.546 -4.985 -6.507 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.250 -6.220 -7.949 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.325 -7.555 -7.584 1.00 0.00 H new ATOM 0 HG CYS B 336 4.649 -8.464 -7.240 1.00 0.00 H new ATOM 858 N VAL B 337 5.298 -5.271 -5.174 1.00 0.00 N ATOM 859 CA VAL B 337 4.291 -5.015 -4.170 1.00 0.00 C ATOM 860 C VAL B 337 2.980 -5.432 -4.758 1.00 0.00 C ATOM 861 O VAL B 337 2.815 -5.306 -5.965 1.00 0.00 O ATOM 862 CB VAL B 337 4.295 -3.532 -3.877 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.443 -3.233 -2.647 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.736 -3.131 -3.631 1.00 0.00 C ATOM 0 H VAL B 337 5.020 -4.994 -6.116 1.00 0.00 H new ATOM 0 HA VAL B 337 4.474 -5.559 -3.243 1.00 0.00 H new ATOM 0 HB VAL B 337 3.875 -2.971 -4.712 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.455 -2.161 -2.448 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.418 -3.557 -2.827 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.847 -3.767 -1.786 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.785 -2.064 -3.415 1.00 0.00 H new ATOM 0 HG22 VAL B 337 6.130 -3.691 -2.783 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.331 -3.349 -4.518 1.00 0.00 H new ATOM 874 N MET B 338 2.066 -5.981 -3.972 1.00 0.00 N ATOM 875 CA MET B 338 0.840 -6.437 -4.603 1.00 0.00 C ATOM 876 C MET B 338 -0.364 -6.454 -3.684 1.00 0.00 C ATOM 877 O MET B 338 -0.254 -6.712 -2.489 1.00 0.00 O ATOM 878 CB MET B 338 1.049 -7.846 -5.145 1.00 0.00 C ATOM 879 CG MET B 338 1.983 -8.643 -4.233 1.00 0.00 C ATOM 880 SD MET B 338 2.265 -10.285 -4.939 1.00 0.00 S ATOM 881 CE MET B 338 3.033 -11.035 -3.483 1.00 0.00 C ATOM 0 H MET B 338 2.138 -6.116 -2.964 1.00 0.00 H new ATOM 0 HA MET B 338 0.625 -5.719 -5.394 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.089 -8.356 -5.226 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.469 -7.796 -6.150 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.931 -8.118 -4.118 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.546 -8.734 -3.238 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.828 -11.711 -3.798 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.452 -10.253 -2.849 1.00 0.00 H new ATOM 0 HE3 MET B 338 2.283 -11.593 -2.923 1.00 0.00 H new ATOM 891 N ARG B 339 -1.529 -6.250 -4.288 1.00 0.00 N ATOM 892 CA ARG B 339 -2.781 -6.304 -3.555 1.00 0.00 C ATOM 893 C ARG B 339 -3.362 -7.696 -3.690 1.00 0.00 C ATOM 894 O ARG B 339 -3.831 -8.088 -4.761 1.00 0.00 O ATOM 895 CB ARG B 339 -3.780 -5.287 -4.098 1.00 0.00 C ATOM 896 CG ARG B 339 -3.157 -3.890 -4.080 1.00 0.00 C ATOM 897 CD ARG B 339 -3.811 -3.051 -2.982 1.00 0.00 C ATOM 898 NE ARG B 339 -3.037 -1.838 -2.744 1.00 0.00 N ATOM 899 CZ ARG B 339 -2.015 -1.828 -1.894 1.00 0.00 C ATOM 900 NH1 ARG B 339 -1.684 -2.916 -1.250 1.00 0.00 N ATOM 901 NH2 ARG B 339 -1.339 -0.728 -1.702 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.629 -6.046 -5.282 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.587 -6.067 -2.509 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.068 -5.554 -5.115 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.688 -5.298 -3.496 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -2.083 -3.962 -3.906 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -3.291 -3.408 -5.049 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.829 -2.790 -3.272 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -3.880 -3.633 -2.063 1.00 0.00 H new ATOM 0 HE ARG B 339 -3.285 -0.981 -3.239 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -2.210 -3.777 -1.399 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -0.899 -2.904 -0.599 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -1.595 0.122 -2.204 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -0.555 -0.719 -1.050 1.00 0.00 H new ATOM 915 N VAL B 340 -3.290 -8.441 -2.605 1.00 0.00 N ATOM 916 CA VAL B 340 -3.775 -9.801 -2.579 1.00 0.00 C ATOM 917 C VAL B 340 -5.162 -9.879 -1.971 1.00 0.00 C ATOM 918 O VAL B 340 -5.535 -9.060 -1.134 1.00 0.00 O ATOM 919 CB VAL B 340 -2.793 -10.676 -1.817 1.00 0.00 C ATOM 920 CG1 VAL B 340 -3.038 -12.125 -2.177 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.379 -10.293 -2.210 1.00 0.00 C ATOM 0 H VAL B 340 -2.895 -8.120 -1.721 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.853 -10.166 -3.603 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.927 -10.537 -0.744 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.337 -12.758 -1.634 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -4.058 -12.399 -1.908 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.896 -12.263 -3.249 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.669 -10.917 -1.667 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.247 -10.441 -3.282 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.204 -9.246 -1.964 1.00 0.00 H new ATOM 931 N ASP B 341 -5.931 -10.855 -2.431 1.00 0.00 N ATOM 932 CA ASP B 341 -7.295 -11.023 -1.961 1.00 0.00 C ATOM 933 C ASP B 341 -7.338 -11.935 -0.751 1.00 0.00 C ATOM 934 O ASP B 341 -7.441 -13.143 -0.883 1.00 0.00 O ATOM 935 CB ASP B 341 -8.164 -11.607 -3.076 1.00 0.00 C ATOM 936 CG ASP B 341 -9.637 -11.360 -2.774 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.942 -11.037 -1.637 1.00 0.00 O ATOM 938 OD2 ASP B 341 -10.439 -11.497 -3.682 1.00 0.00 O1- ATOM 0 H ASP B 341 -5.634 -11.539 -3.127 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.681 -10.045 -1.674 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.899 -11.152 -4.030 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.978 -12.677 -3.170 1.00 0.00 H new ATOM 943 N GLU B 342 -7.269 -11.333 0.421 1.00 0.00 N ATOM 944 CA GLU B 342 -7.305 -12.072 1.681 1.00 0.00 C ATOM 945 C GLU B 342 -8.232 -13.271 1.574 1.00 0.00 C ATOM 946 O GLU B 342 -8.045 -14.287 2.245 1.00 0.00 O ATOM 947 CB GLU B 342 -7.821 -11.126 2.773 1.00 0.00 C ATOM 948 CG GLU B 342 -7.169 -11.427 4.121 1.00 0.00 C ATOM 949 CD GLU B 342 -8.200 -11.286 5.236 1.00 0.00 C ATOM 950 OE1 GLU B 342 -8.504 -10.160 5.595 1.00 0.00 O1- ATOM 951 OE2 GLU B 342 -8.670 -12.305 5.715 1.00 0.00 O ATOM 0 H GLU B 342 -7.187 -10.323 0.533 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.305 -12.433 1.921 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.616 -10.094 2.490 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.903 -11.223 2.860 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.758 -12.436 4.119 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.337 -10.744 4.294 1.00 0.00 H new ATOM 958 N LYS B 343 -9.223 -13.135 0.721 1.00 0.00 N ATOM 959 CA LYS B 343 -10.195 -14.190 0.499 1.00 0.00 C ATOM 960 C LYS B 343 -9.617 -15.321 -0.346 1.00 0.00 C ATOM 961 O LYS B 343 -9.854 -16.496 -0.067 1.00 0.00 O ATOM 962 CB LYS B 343 -11.401 -13.609 -0.224 1.00 0.00 C ATOM 963 CG LYS B 343 -12.054 -12.540 0.649 1.00 0.00 C ATOM 964 CD LYS B 343 -12.991 -11.689 -0.209 1.00 0.00 C ATOM 965 CE LYS B 343 -14.093 -11.094 0.670 1.00 0.00 C ATOM 966 NZ LYS B 343 -13.524 -10.721 1.996 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.380 -12.296 0.163 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.478 -14.597 1.470 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -11.094 -13.177 -1.177 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -12.119 -14.398 -0.448 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.611 -13.008 1.461 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.290 -11.911 1.107 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.430 -10.891 -0.696 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.431 -12.298 -0.999 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.524 -10.217 0.187 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -14.900 -11.816 0.799 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -14.121 -9.992 2.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.493 -11.561 2.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -12.561 -10.349 1.868 1.00 0.00 H new ATOM 980 N THR B 344 -8.897 -14.958 -1.404 1.00 0.00 N ATOM 981 CA THR B 344 -8.336 -15.948 -2.313 1.00 0.00 C ATOM 982 C THR B 344 -6.815 -16.048 -2.196 1.00 0.00 C ATOM 983 O THR B 344 -6.217 -16.982 -2.728 1.00 0.00 O ATOM 984 CB THR B 344 -8.713 -15.577 -3.745 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.724 -14.713 -4.286 1.00 0.00 O ATOM 986 CG2 THR B 344 -10.070 -14.871 -3.752 1.00 0.00 C ATOM 0 H THR B 344 -8.690 -13.990 -1.651 1.00 0.00 H new ATOM 0 HA THR B 344 -8.748 -16.921 -2.044 1.00 0.00 H new ATOM 0 HB THR B 344 -8.774 -16.482 -4.350 1.00 0.00 H new ATOM 0 HG1 THR B 344 -8.136 -14.115 -4.944 1.00 0.00 H new ATOM 0 HG21 THR B 344 -10.337 -14.607 -4.775 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.828 -15.536 -3.339 1.00 0.00 H new ATOM 0 HG23 THR B 344 -10.013 -13.966 -3.147 1.00 0.00 H new ATOM 994 N LYS B 345 -6.190 -15.089 -1.515 1.00 0.00 N ATOM 995 CA LYS B 345 -4.746 -15.101 -1.359 1.00 0.00 C ATOM 996 C LYS B 345 -4.074 -14.880 -2.707 1.00 0.00 C ATOM 997 O LYS B 345 -2.848 -14.823 -2.802 1.00 0.00 O ATOM 998 CB LYS B 345 -4.305 -16.435 -0.768 1.00 0.00 C ATOM 999 CG LYS B 345 -2.946 -16.277 -0.081 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.527 -17.614 0.534 1.00 0.00 C ATOM 1001 CE LYS B 345 -2.883 -17.627 2.022 1.00 0.00 C ATOM 1002 NZ LYS B 345 -2.126 -16.552 2.724 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.661 -14.302 -1.068 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.452 -14.297 -0.685 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -5.046 -16.788 -0.051 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -4.240 -17.187 -1.554 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -2.198 -15.946 -0.802 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -3.004 -15.511 0.692 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -3.029 -18.435 0.022 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.455 -17.766 0.405 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -3.955 -17.476 2.152 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -2.643 -18.598 2.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -1.857 -16.880 3.673 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -1.269 -16.320 2.182 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -2.723 -15.705 2.807 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.893 -14.733 -3.743 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.378 -14.493 -5.078 1.00 0.00 C ATOM 1018 C GLU B 346 -4.127 -13.010 -5.258 1.00 0.00 C ATOM 1019 O GLU B 346 -4.741 -12.178 -4.591 1.00 0.00 O ATOM 1020 CB GLU B 346 -5.367 -14.975 -6.132 1.00 0.00 C ATOM 1021 CG GLU B 346 -5.725 -16.435 -5.860 1.00 0.00 C ATOM 1022 CD GLU B 346 -5.652 -17.239 -7.154 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -6.341 -16.876 -8.093 1.00 0.00 O1- ATOM 1024 OE2 GLU B 346 -4.910 -18.207 -7.186 1.00 0.00 O ATOM 0 H GLU B 346 -5.910 -14.776 -3.681 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.446 -15.046 -5.200 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -6.266 -14.359 -6.112 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -4.933 -14.874 -7.127 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -5.041 -16.855 -5.122 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -6.728 -16.500 -5.438 1.00 0.00 H new ATOM 1031 N VAL B 347 -3.197 -12.688 -6.131 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.840 -11.296 -6.360 1.00 0.00 C ATOM 1033 C VAL B 347 -3.775 -10.616 -7.333 1.00 0.00 C ATOM 1034 O VAL B 347 -4.087 -11.144 -8.401 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.411 -11.179 -6.852 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.134 -9.719 -7.220 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.479 -11.597 -5.722 1.00 0.00 C ATOM 0 H VAL B 347 -2.675 -13.362 -6.692 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.933 -10.788 -5.400 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.253 -11.814 -7.724 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.108 -9.622 -7.576 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.822 -9.405 -8.005 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.275 -9.089 -6.341 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.556 -11.520 -6.056 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.633 -10.944 -4.863 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.692 -12.627 -5.437 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.188 -9.416 -6.958 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.058 -8.624 -7.797 1.00 0.00 C ATOM 1049 C ILE B 348 -4.226 -7.552 -8.469 1.00 0.00 C ATOM 1050 O ILE B 348 -4.517 -7.130 -9.590 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.162 -7.973 -6.960 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -6.807 -9.026 -6.051 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.222 -7.374 -7.887 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.224 -10.248 -6.877 1.00 0.00 C ATOM 0 H ILE B 348 -3.932 -8.973 -6.076 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.528 -9.263 -8.544 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.732 -7.182 -6.346 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -6.105 -9.325 -5.273 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -7.677 -8.602 -5.550 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -8.008 -6.911 -7.290 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.762 -6.622 -8.528 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.653 -8.162 -8.505 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -7.681 -10.991 -6.223 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.942 -9.944 -7.639 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -6.346 -10.679 -7.357 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.187 -7.101 -7.765 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.327 -6.069 -8.297 1.00 0.00 C ATOM 1068 C GLN B 349 -0.872 -6.363 -8.030 1.00 0.00 C ATOM 1069 O GLN B 349 -0.529 -7.069 -7.085 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.664 -4.769 -7.622 1.00 0.00 C ATOM 1071 CG GLN B 349 -1.818 -3.644 -8.202 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.491 -2.302 -7.932 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -2.979 -1.655 -8.859 1.00 0.00 O ATOM 1074 NE2 GLN B 349 -2.551 -1.848 -6.711 1.00 0.00 N ATOM 0 H GLN B 349 -2.931 -7.436 -6.836 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.484 -6.021 -9.375 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -3.722 -4.545 -7.755 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.488 -4.851 -6.549 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -0.823 -3.658 -7.758 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -1.690 -3.788 -9.275 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -2.146 -2.387 -5.946 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -3.003 -0.954 -6.521 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.025 -5.773 -8.852 1.00 0.00 N ATOM 1084 CA GLU B 350 1.413 -5.923 -8.699 1.00 0.00 C ATOM 1085 C GLU B 350 2.145 -4.664 -9.110 1.00 0.00 C ATOM 1086 O GLU B 350 1.731 -3.954 -10.026 1.00 0.00 O ATOM 1087 CB GLU B 350 1.974 -7.047 -9.557 1.00 0.00 C ATOM 1088 CG GLU B 350 1.379 -8.387 -9.147 1.00 0.00 C ATOM 1089 CD GLU B 350 1.781 -9.478 -10.133 1.00 0.00 C ATOM 1090 OE1 GLU B 350 2.968 -9.627 -10.374 1.00 0.00 O ATOM 1091 OE2 GLU B 350 0.895 -10.156 -10.626 1.00 0.00 O1- ATOM 0 H GLU B 350 -0.307 -5.183 -9.635 1.00 0.00 H new ATOM 0 HA GLU B 350 1.566 -6.143 -7.643 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.756 -6.853 -10.607 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.059 -7.080 -9.458 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.720 -8.651 -8.146 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.293 -8.311 -9.104 1.00 0.00 H new ATOM 1098 N TRP B 351 3.266 -4.433 -8.458 1.00 0.00 N ATOM 1099 CA TRP B 351 4.108 -3.291 -8.788 1.00 0.00 C ATOM 1100 C TRP B 351 5.492 -3.454 -8.202 1.00 0.00 C ATOM 1101 O TRP B 351 5.641 -3.851 -7.058 1.00 0.00 O ATOM 1102 CB TRP B 351 3.495 -2.005 -8.285 1.00 0.00 C ATOM 1103 CG TRP B 351 4.287 -0.882 -8.841 1.00 0.00 C ATOM 1104 CD1 TRP B 351 5.232 -0.211 -8.171 1.00 0.00 C ATOM 1105 CD2 TRP B 351 4.237 -0.306 -10.174 1.00 0.00 C ATOM 1106 NE1 TRP B 351 5.756 0.758 -8.996 1.00 0.00 N ATOM 1107 CE2 TRP B 351 5.172 0.749 -10.240 1.00 0.00 C ATOM 1108 CE3 TRP B 351 3.470 -0.586 -11.311 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 5.350 1.503 -11.397 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 3.640 0.175 -12.486 1.00 0.00 C ATOM 1111 CH2 TRP B 351 4.582 1.218 -12.524 1.00 0.00 C ATOM 0 H TRP B 351 3.618 -5.016 -7.699 1.00 0.00 H new ATOM 0 HA TRP B 351 4.186 -3.244 -9.874 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.453 -1.930 -8.597 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.504 -1.977 -7.195 1.00 0.00 H new ATOM 0 HD1 TRP B 351 5.533 -0.399 -7.151 1.00 0.00 H new ATOM 0 HE1 TRP B 351 6.492 1.407 -8.717 1.00 0.00 H new ATOM 0 HE3 TRP B 351 2.746 -1.387 -11.288 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 6.077 2.302 -11.421 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 3.044 -0.044 -13.360 1.00 0.00 H new ATOM 0 HH2 TRP B 351 4.710 1.798 -13.426 1.00 0.00 H new ATOM 1122 N SER B 352 6.498 -3.148 -9.009 1.00 0.00 N ATOM 1123 CA SER B 352 7.876 -3.283 -8.591 1.00 0.00 C ATOM 1124 C SER B 352 8.135 -2.539 -7.301 1.00 0.00 C ATOM 1125 O SER B 352 7.695 -1.405 -7.117 1.00 0.00 O ATOM 1126 CB SER B 352 8.821 -2.757 -9.662 1.00 0.00 C ATOM 1127 OG SER B 352 8.074 -2.148 -10.705 1.00 0.00 O ATOM 0 H SER B 352 6.379 -2.803 -9.961 1.00 0.00 H new ATOM 0 HA SER B 352 8.059 -4.346 -8.432 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.512 -2.035 -9.227 1.00 0.00 H new ATOM 0 HB3 SER B 352 9.423 -3.573 -10.062 1.00 0.00 H new ATOM 0 HG SER B 352 7.734 -2.839 -11.311 1.00 0.00 H new ATOM 1133 N LEU B 353 8.891 -3.174 -6.432 1.00 0.00 N ATOM 1134 CA LEU B 353 9.263 -2.575 -5.185 1.00 0.00 C ATOM 1135 C LEU B 353 10.386 -1.602 -5.492 1.00 0.00 C ATOM 1136 O LEU B 353 10.470 -0.507 -4.934 1.00 0.00 O ATOM 1137 CB LEU B 353 9.719 -3.694 -4.246 1.00 0.00 C ATOM 1138 CG LEU B 353 9.382 -3.379 -2.793 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.539 -4.635 -1.967 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.348 -2.344 -2.261 1.00 0.00 C ATOM 0 H LEU B 353 9.259 -4.114 -6.576 1.00 0.00 H new ATOM 0 HA LEU B 353 8.445 -2.041 -4.702 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.242 -4.630 -4.536 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.794 -3.839 -4.347 1.00 0.00 H new ATOM 0 HG LEU B 353 8.360 -3.004 -2.735 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.300 -4.418 -0.926 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.864 -5.404 -2.342 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.567 -4.990 -2.037 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.106 -2.120 -1.222 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.365 -2.731 -2.321 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.270 -1.434 -2.856 1.00 0.00 H new ATOM 1152 N THR B 354 11.214 -1.999 -6.454 1.00 0.00 N ATOM 1153 CA THR B 354 12.307 -1.151 -6.910 1.00 0.00 C ATOM 1154 C THR B 354 11.769 -0.039 -7.786 1.00 0.00 C ATOM 1155 O THR B 354 12.536 0.675 -8.434 1.00 0.00 O ATOM 1156 CB THR B 354 13.329 -1.977 -7.695 1.00 0.00 C ATOM 1157 OG1 THR B 354 14.553 -1.262 -7.777 1.00 0.00 O ATOM 1158 CG2 THR B 354 12.799 -2.242 -9.104 1.00 0.00 C ATOM 0 H THR B 354 11.148 -2.899 -6.930 1.00 0.00 H new ATOM 0 HA THR B 354 12.797 -0.717 -6.039 1.00 0.00 H new ATOM 0 HB THR B 354 13.495 -2.926 -7.186 1.00 0.00 H new ATOM 0 HG1 THR B 354 14.375 -0.341 -8.061 1.00 0.00 H new ATOM 0 HG21 THR B 354 13.527 -2.830 -9.662 1.00 0.00 H new ATOM 0 HG22 THR B 354 11.860 -2.792 -9.042 1.00 0.00 H new ATOM 0 HG23 THR B 354 12.631 -1.293 -9.614 1.00 0.00 H new ATOM 1166 N ASN B 355 10.448 0.119 -7.785 1.00 0.00 N ATOM 1167 CA ASN B 355 9.825 1.177 -8.576 1.00 0.00 C ATOM 1168 C ASN B 355 9.146 2.178 -7.665 1.00 0.00 C ATOM 1169 O ASN B 355 8.614 3.188 -8.127 1.00 0.00 O ATOM 1170 CB ASN B 355 8.792 0.601 -9.539 1.00 0.00 C ATOM 1171 CG ASN B 355 9.491 0.042 -10.774 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.692 -0.228 -10.738 1.00 0.00 O ATOM 1173 ND2 ASN B 355 8.811 -0.150 -11.871 1.00 0.00 N ATOM 0 H ASN B 355 9.797 -0.461 -7.255 1.00 0.00 H new ATOM 0 HA ASN B 355 10.609 1.671 -9.150 1.00 0.00 H new ATOM 0 HB2 ASN B 355 8.221 -0.186 -9.046 1.00 0.00 H new ATOM 0 HB3 ASN B 355 8.082 1.375 -9.831 1.00 0.00 H new ATOM 0 HD21 ASN B 355 9.274 -0.524 -12.699 1.00 0.00 H new ATOM 0 HD22 ASN B 355 7.816 0.074 -11.900 1.00 0.00 H new ATOM 1180 N ILE B 356 9.156 1.895 -6.370 1.00 0.00 N ATOM 1181 CA ILE B 356 8.523 2.784 -5.422 1.00 0.00 C ATOM 1182 C ILE B 356 9.115 4.191 -5.507 1.00 0.00 C ATOM 1183 O ILE B 356 10.292 4.356 -5.826 1.00 0.00 O ATOM 1184 CB ILE B 356 8.697 2.209 -4.032 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.833 0.948 -3.920 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.253 3.242 -3.011 1.00 0.00 C ATOM 1187 CD1 ILE B 356 8.081 0.242 -2.587 1.00 0.00 C ATOM 0 H ILE B 356 9.590 1.067 -5.961 1.00 0.00 H new ATOM 0 HA ILE B 356 7.462 2.868 -5.655 1.00 0.00 H new ATOM 0 HB ILE B 356 9.740 1.954 -3.847 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.779 1.214 -4.006 1.00 0.00 H new ATOM 0 HG13 ILE B 356 8.060 0.271 -4.744 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.375 2.837 -2.007 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.860 4.141 -3.115 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.205 3.491 -3.177 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.458 -0.651 -2.527 1.00 0.00 H new ATOM 0 HD12 ILE B 356 9.131 -0.042 -2.516 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.831 0.915 -1.767 1.00 0.00 H new ATOM 1199 N LYS B 357 8.289 5.202 -5.212 1.00 0.00 N ATOM 1200 CA LYS B 357 8.750 6.589 -5.255 1.00 0.00 C ATOM 1201 C LYS B 357 8.888 7.113 -3.834 1.00 0.00 C ATOM 1202 O LYS B 357 9.894 7.720 -3.469 1.00 0.00 O ATOM 1203 CB LYS B 357 7.764 7.446 -6.063 1.00 0.00 C ATOM 1204 CG LYS B 357 8.519 8.590 -6.739 1.00 0.00 C ATOM 1205 CD LYS B 357 9.083 8.108 -8.077 1.00 0.00 C ATOM 1206 CE LYS B 357 10.363 8.879 -8.402 1.00 0.00 C ATOM 1207 NZ LYS B 357 10.865 8.468 -9.743 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.312 5.086 -4.945 1.00 0.00 H new ATOM 0 HA LYS B 357 9.722 6.641 -5.746 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.263 6.834 -6.813 1.00 0.00 H new ATOM 0 HB3 LYS B 357 6.990 7.844 -5.407 1.00 0.00 H new ATOM 0 HG2 LYS B 357 7.852 9.437 -6.897 1.00 0.00 H new ATOM 0 HG3 LYS B 357 9.327 8.937 -6.095 1.00 0.00 H new ATOM 0 HD2 LYS B 357 9.292 7.039 -8.031 1.00 0.00 H new ATOM 0 HD3 LYS B 357 8.347 8.255 -8.868 1.00 0.00 H new ATOM 0 HE2 LYS B 357 10.167 9.951 -8.388 1.00 0.00 H new ATOM 0 HE3 LYS B 357 11.120 8.683 -7.643 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 11.735 8.993 -9.964 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 11.067 7.448 -9.740 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 10.144 8.676 -10.463 1.00 0.00 H new ATOM 1221 N ARG B 358 7.882 6.817 -3.032 1.00 0.00 N ATOM 1222 CA ARG B 358 7.875 7.185 -1.631 1.00 0.00 C ATOM 1223 C ARG B 358 6.623 6.603 -0.987 1.00 0.00 C ATOM 1224 O ARG B 358 5.548 6.632 -1.565 1.00 0.00 O ATOM 1225 CB ARG B 358 7.922 8.701 -1.461 1.00 0.00 C ATOM 1226 CG ARG B 358 6.925 9.366 -2.396 1.00 0.00 C ATOM 1227 CD ARG B 358 7.177 10.865 -2.435 1.00 0.00 C ATOM 1228 NE ARG B 358 5.911 11.580 -2.560 1.00 0.00 N ATOM 1229 CZ ARG B 358 5.849 12.780 -3.128 1.00 0.00 C ATOM 1230 NH1 ARG B 358 6.935 13.349 -3.574 1.00 0.00 N ATOM 1231 NH2 ARG B 358 4.700 13.387 -3.237 1.00 0.00 N1+ ATOM 0 H ARG B 358 7.047 6.315 -3.335 1.00 0.00 H new ATOM 0 HA ARG B 358 8.762 6.782 -1.142 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.695 8.965 -0.428 1.00 0.00 H new ATOM 0 HB3 ARG B 358 8.927 9.067 -1.670 1.00 0.00 H new ATOM 0 HG2 ARG B 358 7.016 8.946 -3.398 1.00 0.00 H new ATOM 0 HG3 ARG B 358 5.908 9.168 -2.059 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.694 11.179 -1.528 1.00 0.00 H new ATOM 0 HD3 ARG B 358 7.828 11.111 -3.274 1.00 0.00 H new ATOM 0 HE ARG B 358 5.057 11.150 -2.204 1.00 0.00 H new ATOM 0 HH11 ARG B 358 7.833 12.873 -3.487 1.00 0.00 H new ATOM 0 HH12 ARG B 358 6.886 14.270 -4.010 1.00 0.00 H new ATOM 0 HH21 ARG B 358 3.852 12.941 -2.887 1.00 0.00 H new ATOM 0 HH22 ARG B 358 4.649 14.308 -3.672 1.00 0.00 H new ATOM 1245 N TRP B 359 6.777 6.036 0.184 1.00 0.00 N ATOM 1246 CA TRP B 359 5.670 5.409 0.871 1.00 0.00 C ATOM 1247 C TRP B 359 5.417 6.095 2.198 1.00 0.00 C ATOM 1248 O TRP B 359 6.157 7.001 2.578 1.00 0.00 O ATOM 1249 CB TRP B 359 5.985 3.927 1.047 1.00 0.00 C ATOM 1250 CG TRP B 359 7.280 3.756 1.762 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.404 3.333 3.030 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.623 4.002 1.277 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.748 3.282 3.357 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.540 3.706 2.311 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.124 4.448 0.053 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.915 3.859 2.134 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.504 4.605 -0.133 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.399 4.316 0.910 1.00 0.00 C ATOM 0 H TRP B 359 7.664 5.995 0.686 1.00 0.00 H new ATOM 0 HA TRP B 359 4.756 5.506 0.285 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.186 3.442 1.607 1.00 0.00 H new ATOM 0 HB3 TRP B 359 6.032 3.440 0.073 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.588 3.074 3.688 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.108 2.970 4.259 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.444 4.673 -0.755 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.598 3.626 2.938 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.882 4.950 -1.084 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.461 4.448 0.764 1.00 0.00 H new ATOM 1269 N ALA B 360 4.357 5.702 2.897 1.00 0.00 N ATOM 1270 CA ALA B 360 4.053 6.361 4.156 1.00 0.00 C ATOM 1271 C ALA B 360 3.209 5.490 5.063 1.00 0.00 C ATOM 1272 O ALA B 360 1.990 5.409 4.926 1.00 0.00 O ATOM 1273 CB ALA B 360 3.321 7.671 3.895 1.00 0.00 C ATOM 0 H ALA B 360 3.716 4.957 2.624 1.00 0.00 H new ATOM 0 HA ALA B 360 5.001 6.554 4.658 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.097 8.158 4.844 1.00 0.00 H new ATOM 0 HB2 ALA B 360 3.950 8.325 3.291 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.391 7.469 3.363 1.00 0.00 H new ATOM 1279 N ALA B 361 3.883 4.859 5.997 1.00 0.00 N ATOM 1280 CA ALA B 361 3.232 4.003 6.959 1.00 0.00 C ATOM 1281 C ALA B 361 2.633 4.825 8.097 1.00 0.00 C ATOM 1282 O ALA B 361 3.206 5.833 8.510 1.00 0.00 O ATOM 1283 CB ALA B 361 4.231 3.012 7.527 1.00 0.00 C ATOM 0 H ALA B 361 4.895 4.925 6.110 1.00 0.00 H new ATOM 0 HA ALA B 361 2.430 3.467 6.452 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.733 2.369 8.253 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.637 2.402 6.720 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.041 3.552 8.017 1.00 0.00 H new ATOM 1289 N SER B 362 1.482 4.390 8.601 1.00 0.00 N ATOM 1290 CA SER B 362 0.822 5.086 9.689 1.00 0.00 C ATOM 1291 C SER B 362 0.416 4.082 10.771 1.00 0.00 C ATOM 1292 O SER B 362 0.581 2.875 10.590 1.00 0.00 O ATOM 1293 CB SER B 362 -0.399 5.818 9.143 1.00 0.00 C ATOM 1294 OG SER B 362 -0.374 5.780 7.722 1.00 0.00 O ATOM 0 H SER B 362 0.991 3.559 8.270 1.00 0.00 H new ATOM 0 HA SER B 362 1.500 5.814 10.135 1.00 0.00 H new ATOM 0 HB2 SER B 362 -1.312 5.353 9.515 1.00 0.00 H new ATOM 0 HB3 SER B 362 -0.403 6.851 9.490 1.00 0.00 H new ATOM 0 HG SER B 362 -0.231 4.858 7.422 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.093 4.540 11.887 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.502 3.640 12.998 1.00 0.00 C ATOM 1302 C PRO B 363 -1.833 2.957 12.721 1.00 0.00 C ATOM 1303 O PRO B 363 -2.250 2.066 13.455 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.621 4.567 14.206 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.799 5.952 13.669 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.342 5.955 12.209 1.00 0.00 C ATOM 0 HA PRO B 363 0.215 2.832 13.144 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.468 4.282 14.830 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.270 4.506 14.830 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.843 6.258 13.742 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.216 6.665 14.252 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.105 6.380 11.557 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.559 6.554 12.078 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.491 3.396 11.661 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.785 2.848 11.276 1.00 0.00 C ATOM 1316 C LYS B 364 -3.805 2.488 9.807 1.00 0.00 C ATOM 1317 O LYS B 364 -4.627 1.691 9.360 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.881 3.870 11.529 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.690 4.482 12.915 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.913 5.324 13.279 1.00 0.00 C ATOM 1321 CE LYS B 364 -5.718 5.930 14.670 1.00 0.00 C ATOM 1322 NZ LYS B 364 -6.072 7.376 14.636 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.149 4.135 11.047 1.00 0.00 H new ATOM 0 HA LYS B 364 -3.955 1.952 11.873 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.850 4.649 10.767 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.860 3.395 11.460 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.546 3.694 13.654 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.793 5.101 12.929 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -6.056 6.115 12.543 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.811 4.707 13.262 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -6.342 5.409 15.396 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -4.684 5.805 14.991 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -5.939 7.788 15.582 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -5.459 7.868 13.955 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -7.065 7.484 14.348 1.00 0.00 H new ATOM 1336 N SER B 365 -2.909 3.091 9.052 1.00 0.00 N ATOM 1337 CA SER B 365 -2.858 2.836 7.626 1.00 0.00 C ATOM 1338 C SER B 365 -1.464 2.975 7.080 1.00 0.00 C ATOM 1339 O SER B 365 -0.559 3.462 7.750 1.00 0.00 O ATOM 1340 CB SER B 365 -3.784 3.793 6.884 1.00 0.00 C ATOM 1341 OG SER B 365 -3.387 5.134 7.142 1.00 0.00 O ATOM 0 H SER B 365 -2.214 3.753 9.396 1.00 0.00 H new ATOM 0 HA SER B 365 -3.185 1.807 7.472 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.749 3.592 5.813 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.815 3.640 7.204 1.00 0.00 H new ATOM 0 HG SER B 365 -3.981 5.749 6.663 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.308 2.536 5.848 1.00 0.00 N ATOM 1348 CA PHE B 366 -0.025 2.614 5.190 1.00 0.00 C ATOM 1349 C PHE B 366 -0.242 2.983 3.745 1.00 0.00 C ATOM 1350 O PHE B 366 -1.350 2.841 3.228 1.00 0.00 O ATOM 1351 CB PHE B 366 0.716 1.297 5.368 1.00 0.00 C ATOM 1352 CG PHE B 366 1.483 0.920 4.135 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.762 1.437 3.923 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.925 0.015 3.226 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.492 1.038 2.796 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.646 -0.374 2.099 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.929 0.133 1.884 1.00 0.00 C ATOM 0 H PHE B 366 -2.052 2.123 5.286 1.00 0.00 H new ATOM 0 HA PHE B 366 0.601 3.388 5.633 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.401 1.376 6.212 1.00 0.00 H new ATOM 0 HB3 PHE B 366 0.003 0.508 5.608 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.186 2.141 4.624 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.065 -0.382 3.398 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.486 1.426 2.630 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.213 -1.067 1.393 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.490 -0.172 1.013 1.00 0.00 H new ATOM 1367 N THR B 367 0.774 3.550 3.116 1.00 0.00 N ATOM 1368 CA THR B 367 0.586 4.027 1.762 1.00 0.00 C ATOM 1369 C THR B 367 1.838 3.920 0.921 1.00 0.00 C ATOM 1370 O THR B 367 2.947 3.870 1.435 1.00 0.00 O ATOM 1371 CB THR B 367 0.138 5.481 1.827 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.153 5.554 2.415 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.102 6.073 0.427 1.00 0.00 C ATOM 0 H THR B 367 1.706 3.687 3.507 1.00 0.00 H new ATOM 0 HA THR B 367 -0.166 3.399 1.284 1.00 0.00 H new ATOM 0 HB THR B 367 0.843 6.049 2.434 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.441 6.490 2.458 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.219 7.113 0.480 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.097 6.023 -0.015 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.598 5.508 -0.189 1.00 0.00 H new ATOM 1381 N LEU B 368 1.626 3.875 -0.382 1.00 0.00 N ATOM 1382 CA LEU B 368 2.707 3.757 -1.332 1.00 0.00 C ATOM 1383 C LEU B 368 2.600 4.795 -2.427 1.00 0.00 C ATOM 1384 O LEU B 368 1.506 5.023 -2.924 1.00 0.00 O ATOM 1385 CB LEU B 368 2.597 2.409 -1.998 1.00 0.00 C ATOM 1386 CG LEU B 368 3.408 1.411 -1.219 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.868 0.011 -1.503 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.875 1.514 -1.626 1.00 0.00 C ATOM 0 H LEU B 368 0.700 3.919 -0.807 1.00 0.00 H new ATOM 0 HA LEU B 368 3.647 3.890 -0.797 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.554 2.095 -2.042 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.956 2.466 -3.026 1.00 0.00 H new ATOM 0 HG LEU B 368 3.333 1.615 -0.151 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.448 -0.723 -0.944 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.823 -0.044 -1.199 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.947 -0.200 -2.569 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.461 0.790 -1.060 1.00 0.00 H new ATOM 0 HD22 LEU B 368 4.972 1.307 -2.692 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.241 2.519 -1.417 1.00 0.00 H new ATOM 1400 N ASP B 369 3.731 5.371 -2.856 1.00 0.00 N ATOM 1401 CA ASP B 369 3.683 6.317 -3.957 1.00 0.00 C ATOM 1402 C ASP B 369 4.479 5.803 -5.140 1.00 0.00 C ATOM 1403 O ASP B 369 5.690 5.995 -5.229 1.00 0.00 O ATOM 1404 CB ASP B 369 4.257 7.668 -3.571 1.00 0.00 C ATOM 1405 CG ASP B 369 3.828 8.719 -4.586 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.823 8.401 -5.764 1.00 0.00 O ATOM 1407 OD2 ASP B 369 3.506 9.820 -4.174 1.00 0.00 O1- ATOM 0 H ASP B 369 4.658 5.201 -2.467 1.00 0.00 H new ATOM 0 HA ASP B 369 2.631 6.430 -4.218 1.00 0.00 H new ATOM 0 HB2 ASP B 369 3.913 7.949 -2.576 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.345 7.613 -3.529 1.00 0.00 H new ATOM 1412 N PHE B 370 3.775 5.179 -6.054 1.00 0.00 N ATOM 1413 CA PHE B 370 4.402 4.681 -7.283 1.00 0.00 C ATOM 1414 C PHE B 370 3.550 4.980 -8.500 1.00 0.00 C ATOM 1415 O PHE B 370 2.668 4.200 -8.860 1.00 0.00 O ATOM 1416 CB PHE B 370 4.638 3.182 -7.240 1.00 0.00 C ATOM 1417 CG PHE B 370 3.352 2.467 -6.964 1.00 0.00 C ATOM 1418 CD1 PHE B 370 2.823 2.524 -5.694 1.00 0.00 C ATOM 1419 CD2 PHE B 370 2.717 1.729 -7.965 1.00 0.00 C ATOM 1420 CE1 PHE B 370 1.643 1.842 -5.392 1.00 0.00 C ATOM 1421 CE2 PHE B 370 1.531 1.047 -7.679 1.00 0.00 C ATOM 1422 CZ PHE B 370 0.993 1.099 -6.388 1.00 0.00 C ATOM 0 H PHE B 370 2.774 4.998 -5.983 1.00 0.00 H new ATOM 0 HA PHE B 370 5.359 5.198 -7.355 1.00 0.00 H new ATOM 0 HB2 PHE B 370 5.055 2.844 -8.189 1.00 0.00 H new ATOM 0 HB3 PHE B 370 5.369 2.943 -6.468 1.00 0.00 H new ATOM 0 HD1 PHE B 370 3.323 3.099 -4.928 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.141 1.685 -8.957 1.00 0.00 H new ATOM 0 HE1 PHE B 370 1.232 1.886 -4.394 1.00 0.00 H new ATOM 0 HE2 PHE B 370 1.031 0.482 -8.452 1.00 0.00 H new ATOM 0 HZ PHE B 370 0.080 0.569 -6.160 1.00 0.00 H new ATOM 1432 N GLY B 371 3.834 6.099 -9.145 1.00 0.00 N ATOM 1433 CA GLY B 371 3.098 6.478 -10.345 1.00 0.00 C ATOM 1434 C GLY B 371 2.661 7.923 -10.274 1.00 0.00 C ATOM 1435 O GLY B 371 1.826 8.375 -11.050 1.00 0.00 O ATOM 0 H GLY B 371 4.561 6.757 -8.864 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.724 6.326 -11.224 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.225 5.835 -10.460 1.00 0.00 H new ATOM 1439 N ASP B 372 3.220 8.628 -9.311 1.00 0.00 N ATOM 1440 CA ASP B 372 2.889 10.030 -9.105 1.00 0.00 C ATOM 1441 C ASP B 372 2.785 10.783 -10.420 1.00 0.00 C ATOM 1442 O ASP B 372 2.218 11.874 -10.467 1.00 0.00 O ATOM 1443 CB ASP B 372 3.960 10.680 -8.231 1.00 0.00 C ATOM 1444 CG ASP B 372 3.438 11.979 -7.631 1.00 0.00 C ATOM 1445 OD1 ASP B 372 3.002 12.827 -8.394 1.00 0.00 O ATOM 1446 OD2 ASP B 372 3.480 12.110 -6.419 1.00 0.00 O1- ATOM 0 H ASP B 372 3.907 8.255 -8.656 1.00 0.00 H new ATOM 0 HA ASP B 372 1.917 10.078 -8.613 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.253 9.996 -7.435 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.852 10.879 -8.825 1.00 0.00 H new ATOM 1451 N TYR B 373 3.301 10.203 -11.488 1.00 0.00 N ATOM 1452 CA TYR B 373 3.210 10.851 -12.772 1.00 0.00 C ATOM 1453 C TYR B 373 1.755 11.161 -13.043 1.00 0.00 C ATOM 1454 O TYR B 373 1.401 12.219 -13.560 1.00 0.00 O ATOM 1455 CB TYR B 373 3.778 9.929 -13.839 1.00 0.00 C ATOM 1456 CG TYR B 373 4.880 9.105 -13.218 1.00 0.00 C ATOM 1457 CD1 TYR B 373 6.009 9.741 -12.696 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.776 7.714 -13.168 1.00 0.00 C ATOM 1459 CE1 TYR B 373 7.039 8.986 -12.122 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.809 6.954 -12.598 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.940 7.592 -12.076 1.00 0.00 C ATOM 1462 OH TYR B 373 7.958 6.847 -11.516 1.00 0.00 O ATOM 0 H TYR B 373 3.778 9.301 -11.489 1.00 0.00 H new ATOM 0 HA TYR B 373 3.783 11.778 -12.783 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.997 9.280 -14.235 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.165 10.510 -14.676 1.00 0.00 H new ATOM 0 HD1 TYR B 373 6.087 10.817 -12.735 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.901 7.223 -13.568 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.909 9.480 -11.715 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.731 5.877 -12.562 1.00 0.00 H new ATOM 0 HH TYR B 373 7.731 5.895 -11.563 1.00 0.00 H new ATOM 1472 N GLN B 374 0.925 10.233 -12.619 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.508 10.372 -12.723 1.00 0.00 C ATOM 1474 C GLN B 374 -1.078 10.162 -11.337 1.00 0.00 C ATOM 1475 O GLN B 374 -1.094 11.078 -10.516 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.071 9.328 -13.686 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.244 8.041 -13.598 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.128 6.838 -13.907 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -2.262 6.761 -13.432 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -0.680 5.890 -14.684 1.00 0.00 N ATOM 0 H GLN B 374 1.228 9.358 -12.191 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.774 11.357 -13.107 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.113 9.119 -13.442 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.053 9.713 -14.705 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.588 8.083 -14.301 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.186 7.942 -12.601 1.00 0.00 H new ATOM 0 HE21 GLN B 374 0.259 5.954 -15.077 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -1.269 5.085 -14.898 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.442 8.925 -11.056 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.890 8.561 -9.737 1.00 0.00 C ATOM 1491 C ASP B 375 -1.105 7.344 -9.296 1.00 0.00 C ATOM 1492 O ASP B 375 -1.432 6.210 -9.644 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.380 8.247 -9.753 1.00 0.00 C ATOM 1494 CG ASP B 375 -3.973 8.448 -8.362 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.820 7.560 -7.541 1.00 0.00 O ATOM 1496 OD2 ASP B 375 -4.569 9.489 -8.140 1.00 0.00 O1- ATOM 0 H ASP B 375 -1.434 8.158 -11.729 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.728 9.387 -9.044 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.888 8.892 -10.470 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.540 7.219 -10.080 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.057 7.591 -8.548 1.00 0.00 N ATOM 1502 CA GLY B 376 0.799 6.513 -8.071 1.00 0.00 C ATOM 1503 C GLY B 376 0.504 6.138 -6.635 1.00 0.00 C ATOM 1504 O GLY B 376 1.157 5.262 -6.066 1.00 0.00 O ATOM 0 H GLY B 376 0.230 8.524 -8.253 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.666 5.638 -8.707 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.843 6.815 -8.158 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.408 6.858 -6.026 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.697 6.645 -4.622 1.00 0.00 C ATOM 1510 C TYR B 377 -1.711 5.556 -4.359 1.00 0.00 C ATOM 1511 O TYR B 377 -2.915 5.759 -4.514 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.174 7.941 -3.996 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.625 9.085 -4.804 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.708 9.056 -5.221 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.446 10.159 -5.153 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.224 10.096 -5.989 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -0.931 11.210 -5.919 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.404 11.180 -6.339 1.00 0.00 C ATOM 1519 OH TYR B 377 0.907 12.215 -7.100 1.00 0.00 O ATOM 0 H TYR B 377 -0.960 7.590 -6.473 1.00 0.00 H new ATOM 0 HA TYR B 377 0.236 6.311 -4.169 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.263 7.976 -3.979 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.837 8.010 -2.962 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.340 8.224 -4.947 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.477 10.178 -4.832 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.253 10.069 -6.315 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.563 12.044 -6.186 1.00 0.00 H new ATOM 0 HH TYR B 377 0.205 12.882 -7.251 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.210 4.423 -3.876 1.00 0.00 N ATOM 1530 CA TYR B 378 -2.093 3.321 -3.494 1.00 0.00 C ATOM 1531 C TYR B 378 -1.942 3.069 -2.005 1.00 0.00 C ATOM 1532 O TYR B 378 -0.826 2.914 -1.505 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.780 2.058 -4.277 1.00 0.00 C ATOM 1534 CG TYR B 378 -2.993 1.679 -5.080 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -4.065 1.018 -4.468 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -3.045 1.996 -6.437 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -5.193 0.672 -5.222 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -4.171 1.651 -7.194 1.00 0.00 C ATOM 1539 CZ TYR B 378 -5.246 0.988 -6.587 1.00 0.00 C ATOM 1540 OH TYR B 378 -6.358 0.648 -7.330 1.00 0.00 O ATOM 0 H TYR B 378 -0.215 4.243 -3.741 1.00 0.00 H new ATOM 0 HA TYR B 378 -3.122 3.598 -3.725 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -0.927 2.223 -4.935 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.508 1.250 -3.598 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -4.022 0.776 -3.416 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -2.217 2.508 -6.904 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -6.021 0.162 -4.753 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -4.211 1.896 -8.245 1.00 0.00 H new ATOM 0 HH TYR B 378 -6.234 0.940 -8.257 1.00 0.00 H new ATOM 1550 N SER B 379 -3.057 3.085 -1.287 1.00 0.00 N ATOM 1551 CA SER B 379 -3.010 2.911 0.151 1.00 0.00 C ATOM 1552 C SER B 379 -4.109 2.016 0.661 1.00 0.00 C ATOM 1553 O SER B 379 -5.106 1.771 -0.017 1.00 0.00 O ATOM 1554 CB SER B 379 -3.145 4.260 0.834 1.00 0.00 C ATOM 1555 OG SER B 379 -3.086 4.072 2.236 1.00 0.00 O ATOM 0 H SER B 379 -3.992 3.215 -1.674 1.00 0.00 H new ATOM 0 HA SER B 379 -2.052 2.444 0.380 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.347 4.928 0.509 1.00 0.00 H new ATOM 0 HB3 SER B 379 -4.088 4.731 0.556 1.00 0.00 H new ATOM 0 HG SER B 379 -2.183 4.279 2.556 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.917 1.557 1.884 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.880 0.703 2.525 1.00 0.00 C ATOM 1563 C VAL B 380 -4.858 0.936 4.032 1.00 0.00 C ATOM 1564 O VAL B 380 -4.019 1.690 4.525 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.509 -0.730 2.237 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -5.020 -1.145 0.867 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -2.987 -0.851 2.277 1.00 0.00 C ATOM 0 H VAL B 380 -3.095 1.767 2.450 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.879 0.922 2.148 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.961 -1.383 2.984 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.744 -2.182 0.674 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.105 -1.047 0.838 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.578 -0.504 0.104 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.698 -1.882 2.071 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.550 -0.194 1.525 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.625 -0.563 3.264 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.769 0.291 4.766 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.803 0.459 6.215 1.00 0.00 C ATOM 1579 C GLN B 381 -5.178 -0.724 6.914 1.00 0.00 C ATOM 1580 O GLN B 381 -5.564 -1.873 6.716 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.226 0.617 6.695 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.338 1.794 7.662 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.803 2.044 8.007 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.514 1.119 8.402 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.298 3.244 7.882 1.00 0.00 N ATOM 0 H GLN B 381 -6.477 -0.338 4.388 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.232 1.356 6.455 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.888 0.775 5.843 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.553 -0.298 7.188 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.772 1.585 8.570 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.903 2.687 7.213 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.707 4.008 7.555 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.276 3.419 8.112 1.00 0.00 H new ATOM 1594 N THR B 382 -4.220 -0.407 7.741 1.00 0.00 N ATOM 1595 CA THR B 382 -3.507 -1.402 8.521 1.00 0.00 C ATOM 1596 C THR B 382 -2.946 -0.765 9.777 1.00 0.00 C ATOM 1597 O THR B 382 -2.381 0.326 9.718 1.00 0.00 O ATOM 1598 CB THR B 382 -2.381 -2.013 7.697 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.389 -2.538 8.569 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.757 -0.948 6.797 1.00 0.00 C ATOM 0 H THR B 382 -3.905 0.550 7.899 1.00 0.00 H new ATOM 0 HA THR B 382 -4.202 -2.194 8.802 1.00 0.00 H new ATOM 0 HB THR B 382 -2.784 -2.813 7.076 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.664 -2.933 8.040 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.953 -1.393 6.211 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.517 -0.548 6.126 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.356 -0.142 7.411 1.00 0.00 H new ATOM 1608 N THR B 383 -3.074 -1.438 10.904 1.00 0.00 N ATOM 1609 CA THR B 383 -2.547 -0.881 12.136 1.00 0.00 C ATOM 1610 C THR B 383 -1.089 -1.243 12.322 1.00 0.00 C ATOM 1611 O THR B 383 -0.514 -1.059 13.395 1.00 0.00 O ATOM 1612 CB THR B 383 -3.395 -1.301 13.322 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.979 -2.573 13.070 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.485 -0.246 13.485 1.00 0.00 C ATOM 0 H THR B 383 -3.526 -2.348 10.994 1.00 0.00 H new ATOM 0 HA THR B 383 -2.597 0.206 12.069 1.00 0.00 H new ATOM 0 HB THR B 383 -2.793 -1.380 14.227 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.524 -2.841 13.839 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.122 -0.508 14.330 1.00 0.00 H new ATOM 0 HG22 THR B 383 -4.026 0.726 13.664 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.087 -0.201 12.577 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.475 -1.668 11.228 1.00 0.00 N ATOM 1623 CA GLU B 384 0.952 -1.950 11.230 1.00 0.00 C ATOM 1624 C GLU B 384 1.538 -1.544 9.884 1.00 0.00 C ATOM 1625 O GLU B 384 1.724 -2.358 8.981 1.00 0.00 O ATOM 1626 CB GLU B 384 1.230 -3.440 11.493 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.051 -4.136 11.962 1.00 0.00 C ATOM 1628 CD GLU B 384 0.216 -5.620 12.193 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.590 -5.969 13.300 1.00 0.00 O1- ATOM 1630 OE2 GLU B 384 0.041 -6.385 11.259 1.00 0.00 O ATOM 0 H GLU B 384 -0.939 -1.824 10.333 1.00 0.00 H new ATOM 0 HA GLU B 384 1.419 -1.379 12.032 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.600 -3.915 10.585 1.00 0.00 H new ATOM 0 HB3 GLU B 384 2.009 -3.546 12.248 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.409 -3.675 12.883 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.836 -4.011 11.217 1.00 0.00 H new ATOM 1637 N GLY B 385 1.854 -0.269 9.776 1.00 0.00 N ATOM 1638 CA GLY B 385 2.455 0.262 8.572 1.00 0.00 C ATOM 1639 C GLY B 385 3.960 0.082 8.619 1.00 0.00 C ATOM 1640 O GLY B 385 4.556 -0.536 7.745 1.00 0.00 O ATOM 0 H GLY B 385 1.703 0.421 10.512 1.00 0.00 H new ATOM 0 HA2 GLY B 385 2.047 -0.246 7.698 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.210 1.319 8.470 1.00 0.00 H new ATOM 1644 N GLU B 386 4.556 0.654 9.654 1.00 0.00 N ATOM 1645 CA GLU B 386 5.999 0.598 9.847 1.00 0.00 C ATOM 1646 C GLU B 386 6.522 -0.793 9.601 1.00 0.00 C ATOM 1647 O GLU B 386 7.694 -0.986 9.327 1.00 0.00 O ATOM 1648 CB GLU B 386 6.337 1.016 11.268 1.00 0.00 C ATOM 1649 CG GLU B 386 5.427 0.273 12.243 1.00 0.00 C ATOM 1650 CD GLU B 386 5.798 0.637 13.676 1.00 0.00 C ATOM 1651 OE1 GLU B 386 6.781 0.105 14.168 1.00 0.00 O ATOM 1652 OE2 GLU B 386 5.096 1.445 14.263 1.00 0.00 O1- ATOM 0 H GLU B 386 4.057 1.168 10.381 1.00 0.00 H new ATOM 0 HA GLU B 386 6.468 1.277 9.135 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.382 0.793 11.486 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.210 2.092 11.383 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.385 0.531 12.051 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.522 -0.803 12.095 1.00 0.00 H new ATOM 1659 N GLN B 387 5.644 -1.753 9.684 1.00 0.00 N ATOM 1660 CA GLN B 387 6.039 -3.133 9.454 1.00 0.00 C ATOM 1661 C GLN B 387 6.067 -3.396 7.970 1.00 0.00 C ATOM 1662 O GLN B 387 6.958 -4.063 7.456 1.00 0.00 O ATOM 1663 CB GLN B 387 5.064 -4.091 10.137 1.00 0.00 C ATOM 1664 CG GLN B 387 5.150 -3.924 11.654 1.00 0.00 C ATOM 1665 CD GLN B 387 4.407 -5.064 12.343 1.00 0.00 C ATOM 1666 OE1 GLN B 387 4.486 -6.211 11.905 1.00 0.00 O ATOM 1667 NE2 GLN B 387 3.684 -4.815 13.401 1.00 0.00 N ATOM 0 H GLN B 387 4.658 -1.618 9.906 1.00 0.00 H new ATOM 0 HA GLN B 387 7.030 -3.297 9.876 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.047 -3.893 9.797 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.297 -5.119 9.861 1.00 0.00 H new ATOM 0 HG2 GLN B 387 6.193 -3.915 11.969 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.720 -2.967 11.949 1.00 0.00 H new ATOM 0 HE21 GLN B 387 3.620 -3.863 13.762 1.00 0.00 H new ATOM 0 HE22 GLN B 387 3.183 -5.572 13.866 1.00 0.00 H new ATOM 1676 N ILE B 388 5.094 -2.832 7.296 1.00 0.00 N ATOM 1677 CA ILE B 388 4.997 -2.951 5.856 1.00 0.00 C ATOM 1678 C ILE B 388 6.002 -2.016 5.197 1.00 0.00 C ATOM 1679 O ILE B 388 6.642 -2.353 4.201 1.00 0.00 O ATOM 1680 CB ILE B 388 3.599 -2.524 5.431 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.583 -3.595 5.797 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.570 -2.302 3.924 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.189 -2.967 5.810 1.00 0.00 C ATOM 0 H ILE B 388 4.350 -2.281 7.724 1.00 0.00 H new ATOM 0 HA ILE B 388 5.199 -3.980 5.558 1.00 0.00 H new ATOM 0 HB ILE B 388 3.344 -1.599 5.948 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.622 -4.413 5.078 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.816 -4.018 6.774 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.569 -1.996 3.620 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.284 -1.523 3.657 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.837 -3.228 3.415 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.451 -3.725 6.071 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.159 -2.163 6.545 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.962 -2.565 4.823 1.00 0.00 H new ATOM 1695 N ALA B 389 6.076 -0.818 5.752 1.00 0.00 N ATOM 1696 CA ALA B 389 6.936 0.239 5.234 1.00 0.00 C ATOM 1697 C ALA B 389 8.411 0.015 5.517 1.00 0.00 C ATOM 1698 O ALA B 389 9.244 0.273 4.658 1.00 0.00 O ATOM 1699 CB ALA B 389 6.519 1.555 5.863 1.00 0.00 C ATOM 0 H ALA B 389 5.541 -0.548 6.577 1.00 0.00 H new ATOM 0 HA ALA B 389 6.815 0.245 4.151 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.154 2.356 5.485 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.480 1.766 5.611 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.623 1.490 6.946 1.00 0.00 H new ATOM 1705 N GLN B 390 8.748 -0.424 6.719 1.00 0.00 N ATOM 1706 CA GLN B 390 10.164 -0.598 7.052 1.00 0.00 C ATOM 1707 C GLN B 390 10.795 -1.655 6.185 1.00 0.00 C ATOM 1708 O GLN B 390 11.968 -1.585 5.817 1.00 0.00 O ATOM 1709 CB GLN B 390 10.341 -1.006 8.504 1.00 0.00 C ATOM 1710 CG GLN B 390 9.773 -2.411 8.721 1.00 0.00 C ATOM 1711 CD GLN B 390 10.842 -3.463 8.438 1.00 0.00 C ATOM 1712 OE1 GLN B 390 12.017 -3.259 8.745 1.00 0.00 O ATOM 1713 NE2 GLN B 390 10.502 -4.587 7.869 1.00 0.00 N ATOM 0 H GLN B 390 8.091 -0.661 7.462 1.00 0.00 H new ATOM 0 HA GLN B 390 10.650 0.362 6.879 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.398 -0.986 8.771 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.834 -0.294 9.156 1.00 0.00 H new ATOM 0 HG2 GLN B 390 9.416 -2.512 9.746 1.00 0.00 H new ATOM 0 HG3 GLN B 390 8.915 -2.569 8.067 1.00 0.00 H new ATOM 0 HE21 GLN B 390 9.529 -4.756 7.615 1.00 0.00 H new ATOM 0 HE22 GLN B 390 11.209 -5.297 7.679 1.00 0.00 H new ATOM 1722 N LEU B 391 9.996 -2.636 5.889 1.00 0.00 N ATOM 1723 CA LEU B 391 10.417 -3.752 5.079 1.00 0.00 C ATOM 1724 C LEU B 391 10.539 -3.290 3.639 1.00 0.00 C ATOM 1725 O LEU B 391 11.600 -3.402 3.028 1.00 0.00 O ATOM 1726 CB LEU B 391 9.390 -4.861 5.298 1.00 0.00 C ATOM 1727 CG LEU B 391 8.578 -5.206 4.042 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.445 -5.962 3.027 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.409 -6.078 4.479 1.00 0.00 C ATOM 0 H LEU B 391 9.027 -2.690 6.202 1.00 0.00 H new ATOM 0 HA LEU B 391 11.398 -4.143 5.350 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.904 -5.757 5.645 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.706 -4.559 6.091 1.00 0.00 H new ATOM 0 HG LEU B 391 8.224 -4.294 3.561 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.850 -6.197 2.144 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.293 -5.341 2.739 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.809 -6.886 3.476 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.808 -6.343 3.609 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.788 -6.986 4.949 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.793 -5.530 5.192 1.00 0.00 H new ATOM 1741 N ILE B 392 9.471 -2.704 3.133 1.00 0.00 N ATOM 1742 CA ILE B 392 9.475 -2.148 1.815 1.00 0.00 C ATOM 1743 C ILE B 392 10.708 -1.305 1.735 1.00 0.00 C ATOM 1744 O ILE B 392 11.581 -1.512 0.904 1.00 0.00 O ATOM 1745 CB ILE B 392 8.235 -1.270 1.665 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.100 -2.097 1.065 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.535 -0.054 0.777 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.802 -1.298 1.110 1.00 0.00 C ATOM 0 H ILE B 392 8.586 -2.606 3.630 1.00 0.00 H new ATOM 0 HA ILE B 392 9.466 -2.909 1.034 1.00 0.00 H new ATOM 0 HB ILE B 392 7.937 -0.905 2.648 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.338 -2.365 0.036 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.984 -3.029 1.619 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.638 0.558 0.683 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.333 0.537 1.227 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.848 -0.393 -0.211 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.994 -1.891 0.681 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.562 -1.052 2.144 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.921 -0.379 0.537 1.00 0.00 H new ATOM 1760 N ALA B 393 10.764 -0.385 2.683 1.00 0.00 N ATOM 1761 CA ALA B 393 11.889 0.521 2.830 1.00 0.00 C ATOM 1762 C ALA B 393 13.193 -0.250 2.888 1.00 0.00 C ATOM 1763 O ALA B 393 14.236 0.230 2.441 1.00 0.00 O ATOM 1764 CB ALA B 393 11.755 1.278 4.132 1.00 0.00 C ATOM 0 H ALA B 393 10.027 -0.245 3.375 1.00 0.00 H new ATOM 0 HA ALA B 393 11.893 1.198 1.975 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.598 1.959 4.245 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.826 1.848 4.127 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.744 0.573 4.963 1.00 0.00 H new ATOM 1770 N GLY B 394 13.131 -1.439 3.479 1.00 0.00 N ATOM 1771 CA GLY B 394 14.327 -2.255 3.631 1.00 0.00 C ATOM 1772 C GLY B 394 14.576 -3.074 2.393 1.00 0.00 C ATOM 1773 O GLY B 394 15.673 -3.578 2.172 1.00 0.00 O ATOM 0 H GLY B 394 12.278 -1.853 3.855 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.187 -1.615 3.828 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.216 -2.914 4.492 1.00 0.00 H new ATOM 1777 N TYR B 395 13.543 -3.201 1.594 1.00 0.00 N ATOM 1778 CA TYR B 395 13.623 -3.955 0.372 1.00 0.00 C ATOM 1779 C TYR B 395 14.121 -3.049 -0.743 1.00 0.00 C ATOM 1780 O TYR B 395 14.931 -3.464 -1.565 1.00 0.00 O ATOM 1781 CB TYR B 395 12.248 -4.538 0.089 1.00 0.00 C ATOM 1782 CG TYR B 395 12.024 -5.830 0.886 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.786 -6.145 2.039 1.00 0.00 C ATOM 1784 CD2 TYR B 395 11.049 -6.734 0.448 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.558 -7.348 2.722 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.833 -7.936 1.133 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.587 -8.244 2.267 1.00 0.00 C ATOM 1788 OH TYR B 395 11.370 -9.430 2.939 1.00 0.00 O ATOM 0 H TYR B 395 12.629 -2.786 1.774 1.00 0.00 H new ATOM 0 HA TYR B 395 14.331 -4.780 0.450 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.480 -3.809 0.348 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.148 -4.742 -0.977 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.542 -5.459 2.391 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.458 -6.502 -0.426 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.135 -7.583 3.604 1.00 0.00 H new ATOM 0 HE2 TYR B 395 10.081 -8.627 0.783 1.00 0.00 H new ATOM 0 HH TYR B 395 10.660 -9.935 2.490 1.00 0.00 H new ATOM 1798 N ILE B 396 13.698 -1.791 -0.726 1.00 0.00 N ATOM 1799 CA ILE B 396 14.207 -0.847 -1.722 1.00 0.00 C ATOM 1800 C ILE B 396 15.660 -0.580 -1.455 1.00 0.00 C ATOM 1801 O ILE B 396 16.387 -0.021 -2.278 1.00 0.00 O ATOM 1802 CB ILE B 396 13.460 0.483 -1.759 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.255 0.429 -0.844 1.00 0.00 C ATOM 1804 CG2 ILE B 396 13.005 0.752 -3.191 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.456 1.726 -0.962 1.00 0.00 C ATOM 0 H ILE B 396 13.028 -1.407 -0.060 1.00 0.00 H new ATOM 0 HA ILE B 396 14.055 -1.318 -2.693 1.00 0.00 H new ATOM 0 HB ILE B 396 14.120 1.282 -1.421 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.626 -0.421 -1.106 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.576 0.282 0.187 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.469 1.701 -3.230 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.875 0.799 -3.846 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.345 -0.051 -3.520 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.590 1.681 -0.301 1.00 0.00 H new ATOM 0 HD12 ILE B 396 12.086 2.569 -0.678 1.00 0.00 H new ATOM 0 HD13 ILE B 396 11.121 1.855 -1.991 1.00 0.00 H new ATOM 1817 N ASP B 397 16.063 -0.999 -0.288 1.00 0.00 N ATOM 1818 CA ASP B 397 17.434 -0.811 0.154 1.00 0.00 C ATOM 1819 C ASP B 397 18.318 -1.845 -0.497 1.00 0.00 C ATOM 1820 O ASP B 397 19.534 -1.691 -0.600 1.00 0.00 O ATOM 1821 CB ASP B 397 17.497 -0.958 1.670 1.00 0.00 C ATOM 1822 CG ASP B 397 18.452 0.074 2.260 1.00 0.00 C ATOM 1823 OD1 ASP B 397 18.068 1.230 2.336 1.00 0.00 O ATOM 1824 OD2 ASP B 397 19.551 -0.307 2.628 1.00 0.00 O1- ATOM 0 H ASP B 397 15.464 -1.477 0.385 1.00 0.00 H new ATOM 0 HA ASP B 397 17.779 0.184 -0.128 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.502 -0.829 2.097 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.829 -1.963 1.932 1.00 0.00 H new ATOM 1829 N ILE B 398 17.677 -2.915 -0.897 1.00 0.00 N ATOM 1830 CA ILE B 398 18.342 -4.029 -1.508 1.00 0.00 C ATOM 1831 C ILE B 398 18.382 -3.909 -3.016 1.00 0.00 C ATOM 1832 O ILE B 398 19.441 -3.887 -3.643 1.00 0.00 O ATOM 1833 CB ILE B 398 17.543 -5.254 -1.134 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.530 -5.386 0.394 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.166 -6.477 -1.775 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.431 -6.349 0.859 1.00 0.00 C ATOM 0 H ILE B 398 16.668 -3.034 -0.805 1.00 0.00 H new ATOM 0 HA ILE B 398 19.375 -4.077 -1.163 1.00 0.00 H new ATOM 0 HB ILE B 398 16.517 -5.164 -1.492 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.500 -5.744 0.739 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.373 -4.406 0.845 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.590 -7.362 -1.506 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.166 -6.360 -2.859 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.191 -6.590 -1.423 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.447 -6.422 1.946 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.459 -5.976 0.535 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.604 -7.335 0.427 1.00 0.00 H new ATOM 1848 N ILE B 399 17.189 -3.893 -3.572 1.00 0.00 N ATOM 1849 CA ILE B 399 16.994 -3.847 -5.006 1.00 0.00 C ATOM 1850 C ILE B 399 17.520 -2.560 -5.619 1.00 0.00 C ATOM 1851 O ILE B 399 17.757 -2.504 -6.825 1.00 0.00 O ATOM 1852 CB ILE B 399 15.506 -3.964 -5.268 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.843 -2.689 -4.769 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.958 -5.154 -4.484 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.401 -2.990 -4.328 1.00 0.00 C ATOM 0 H ILE B 399 16.320 -3.912 -3.037 1.00 0.00 H new ATOM 0 HA ILE B 399 17.549 -4.665 -5.465 1.00 0.00 H new ATOM 0 HB ILE B 399 15.310 -4.106 -6.331 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.410 -2.276 -3.934 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.842 -1.936 -5.557 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.887 -5.247 -4.665 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.462 -6.065 -4.807 1.00 0.00 H new ATOM 0 HG23 ILE B 399 15.133 -5.000 -3.419 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.931 -2.074 -3.972 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.836 -3.382 -5.174 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.412 -3.728 -3.526 1.00 0.00 H new ATOM 1867 N LEU B 400 17.680 -1.516 -4.811 1.00 0.00 N ATOM 1868 CA LEU B 400 18.162 -0.248 -5.367 1.00 0.00 C ATOM 1869 C LEU B 400 19.390 -0.473 -6.246 1.00 0.00 C ATOM 1870 O LEU B 400 19.848 0.487 -6.847 1.00 0.00 O ATOM 1871 CB LEU B 400 18.504 0.761 -4.269 1.00 0.00 C ATOM 1872 CG LEU B 400 19.276 0.081 -3.138 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.638 -0.410 -3.639 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.492 1.088 -2.007 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.857 -1.598 -6.308 1.00 0.00 O ATOM 0 H LEU B 400 17.493 -1.514 -3.808 1.00 0.00 H new ATOM 0 HA LEU B 400 17.352 0.161 -5.971 1.00 0.00 H new ATOM 0 HB2 LEU B 400 19.099 1.573 -4.686 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.589 1.205 -3.877 1.00 0.00 H new ATOM 0 HG LEU B 400 18.702 -0.774 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.174 -0.891 -2.821 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.492 -1.126 -4.448 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.218 0.437 -4.004 1.00 0.00 H new ATOM 0 HD21 LEU B 400 20.042 0.611 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU B 400 20.062 1.939 -2.381 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.526 1.433 -1.637 1.00 0.00 H new