USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=21 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= -0.944! USER MOD Set 1.2: B 379 SER OG : rot 86:sc= 0.624 USER MOD Set 2.1: B 362 SER OG : rot -170:sc= 0.944 USER MOD Set 2.2: B 365 SER OG : rot 180:sc= 0.021 USER MOD Set 3.1: B 352 SER OG : rot -126:sc= -3.97! USER MOD Set 3.2: B 355 ASN : amide:sc= -5.03! C(o=-9!,f=-11!) USER MOD Set 4.1: B 349 GLN : amide:sc= -1.55 K(o=-1.6,f=-3.1) USER MOD Set 4.2: B 378 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: B 333 THR OG1 : rot -132:sc= -2.02! USER MOD Set 5.2: B 336 CYS SG : rot 180:sc= -0.272! USER MOD Set 6.1: B 311 SER OG : rot -120:sc= -0.398 USER MOD Set 6.2: B 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 316 LYS NZ :NH3+ 145:sc= -0.148 (180deg=-0.957) USER MOD Single : B 334 LYS NZ :NH3+ -154:sc= -0.153 (180deg=-0.778) USER MOD Single : B 338 MET CE :methyl -166:sc= -0.129 (180deg=-0.982) USER MOD Single : B 343 LYS NZ :NH3+ 159:sc= -0.424 (180deg=-1.61!) USER MOD Single : B 344 THR OG1 : rot -56:sc= -5.15! USER MOD Single : B 345 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 354 THR OG1 : rot -45:sc= -0.139 USER MOD Single : B 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 364 LYS NZ :NH3+ -120:sc= -0.297 (180deg=-0.632) USER MOD Single : B 373 TYR OH : rot 180:sc= 0 USER MOD Single : B 374 GLN : amide:sc= -0.24 K(o=-0.24,f=-1.4) USER MOD Single : B 377 TYR OH : rot 180:sc= -3.06! USER MOD Single : B 381 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 382 THR OG1 : rot -129:sc= 0.558 USER MOD Single : B 383 THR OG1 : rot 180:sc= 0.0604 USER MOD Single : B 387 GLN : amide:sc= -2.89! K(o=-2.9!,f=-0.29) USER MOD Single : B 390 GLN : amide:sc= -7.45! C(o=-7.5!,f=-5.5!) USER MOD ----------------------------------------------------------------- ATOM 125 N LEU A 15 1.268 11.979 2.172 1.00 0.00 N ATOM 126 CA LEU A 15 0.598 10.749 1.763 1.00 0.00 C ATOM 127 C LEU A 15 -0.690 10.591 2.552 1.00 0.00 C ATOM 128 O LEU A 15 -1.712 10.161 2.022 1.00 0.00 O ATOM 129 CB LEU A 15 1.511 9.539 2.021 1.00 0.00 C ATOM 130 CG LEU A 15 2.492 9.288 0.853 1.00 0.00 C ATOM 131 CD1 LEU A 15 1.742 9.019 -0.452 1.00 0.00 C ATOM 132 CD2 LEU A 15 3.403 10.496 0.656 1.00 0.00 C ATOM 0 HA LEU A 15 0.373 10.802 0.698 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.076 9.701 2.939 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.899 8.651 2.176 1.00 0.00 H new ATOM 0 HG LEU A 15 3.087 8.411 1.109 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.459 8.846 -1.255 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.110 8.139 -0.334 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.121 9.880 -0.699 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.088 10.304 -0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.799 11.374 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.974 10.674 1.567 1.00 0.00 H new ATOM 144 N LEU A 16 -0.641 10.961 3.821 1.00 0.00 N ATOM 145 CA LEU A 16 -1.816 10.876 4.666 1.00 0.00 C ATOM 146 C LEU A 16 -2.940 11.728 4.064 1.00 0.00 C ATOM 147 O LEU A 16 -4.101 11.316 4.026 1.00 0.00 O ATOM 148 CB LEU A 16 -1.464 11.357 6.075 1.00 0.00 C ATOM 149 CG LEU A 16 -1.846 10.293 7.117 1.00 0.00 C ATOM 150 CD1 LEU A 16 -3.338 9.968 7.006 1.00 0.00 C ATOM 151 CD2 LEU A 16 -1.021 9.014 6.887 1.00 0.00 C ATOM 0 H LEU A 16 0.194 11.320 4.284 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.158 9.843 4.727 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.397 11.569 6.137 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.987 12.289 6.289 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.635 10.682 8.113 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -3.602 9.213 7.747 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.921 10.871 7.184 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.554 9.587 6.008 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.297 8.265 7.629 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.221 8.627 5.888 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.040 9.244 6.981 1.00 0.00 H new ATOM 163 N GLY A 17 -2.581 12.903 3.547 1.00 0.00 N ATOM 164 CA GLY A 17 -3.565 13.768 2.907 1.00 0.00 C ATOM 165 C GLY A 17 -4.147 13.052 1.698 1.00 0.00 C ATOM 166 O GLY A 17 -5.353 13.077 1.460 1.00 0.00 O ATOM 0 H GLY A 17 -1.630 13.272 3.559 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -4.357 14.021 3.611 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.099 14.705 2.601 1.00 0.00 H new ATOM 170 N GLU A 18 -3.274 12.391 0.948 1.00 0.00 N ATOM 171 CA GLU A 18 -3.697 11.633 -0.219 1.00 0.00 C ATOM 172 C GLU A 18 -4.572 10.467 0.209 1.00 0.00 C ATOM 173 O GLU A 18 -5.545 10.139 -0.454 1.00 0.00 O ATOM 174 CB GLU A 18 -2.461 11.123 -0.959 1.00 0.00 C ATOM 175 CG GLU A 18 -1.817 12.282 -1.721 1.00 0.00 C ATOM 176 CD GLU A 18 -0.652 11.774 -2.560 1.00 0.00 C ATOM 177 OE1 GLU A 18 -0.281 10.624 -2.390 1.00 0.00 O1- ATOM 178 OE2 GLU A 18 -0.147 12.544 -3.361 1.00 0.00 O ATOM 0 H GLU A 18 -2.270 12.365 1.128 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.276 12.275 -0.883 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.749 10.697 -0.252 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.739 10.327 -1.650 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.556 12.760 -2.363 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.467 13.039 -1.019 1.00 0.00 H new ATOM 394 N VAL B 310 9.349 -12.637 0.640 1.00 0.00 N ATOM 395 CA VAL B 310 8.065 -11.972 0.464 1.00 0.00 C ATOM 396 C VAL B 310 7.338 -11.834 1.801 1.00 0.00 C ATOM 397 O VAL B 310 7.274 -12.782 2.584 1.00 0.00 O ATOM 398 CB VAL B 310 7.199 -12.768 -0.514 1.00 0.00 C ATOM 399 CG1 VAL B 310 5.807 -12.144 -0.589 1.00 0.00 C ATOM 400 CG2 VAL B 310 7.840 -12.738 -1.903 1.00 0.00 C ATOM 0 HA VAL B 310 8.245 -10.975 0.063 1.00 0.00 H new ATOM 0 HB VAL B 310 7.119 -13.799 -0.169 1.00 0.00 H new ATOM 0 HG11 VAL B 310 5.191 -12.712 -1.286 1.00 0.00 H new ATOM 0 HG12 VAL B 310 5.347 -12.161 0.399 1.00 0.00 H new ATOM 0 HG13 VAL B 310 5.888 -11.113 -0.934 1.00 0.00 H new ATOM 0 HG21 VAL B 310 7.224 -13.305 -2.601 1.00 0.00 H new ATOM 0 HG22 VAL B 310 7.919 -11.706 -2.245 1.00 0.00 H new ATOM 0 HG23 VAL B 310 8.834 -13.182 -1.854 1.00 0.00 H new ATOM 410 N SER B 311 6.791 -10.647 2.050 1.00 0.00 N ATOM 411 CA SER B 311 6.066 -10.381 3.288 1.00 0.00 C ATOM 412 C SER B 311 4.582 -10.207 2.998 1.00 0.00 C ATOM 413 O SER B 311 4.213 -9.851 1.890 1.00 0.00 O ATOM 414 CB SER B 311 6.605 -9.118 3.932 1.00 0.00 C ATOM 415 OG SER B 311 7.753 -8.681 3.218 1.00 0.00 O ATOM 0 H SER B 311 6.836 -9.854 1.410 1.00 0.00 H new ATOM 0 HA SER B 311 6.201 -11.224 3.965 1.00 0.00 H new ATOM 0 HB2 SER B 311 5.842 -8.340 3.928 1.00 0.00 H new ATOM 0 HB3 SER B 311 6.861 -9.308 4.974 1.00 0.00 H new ATOM 0 HG SER B 311 8.526 -8.663 3.820 1.00 0.00 H new ATOM 421 N PHE B 312 3.739 -10.493 3.988 1.00 0.00 N ATOM 422 CA PHE B 312 2.291 -10.401 3.813 1.00 0.00 C ATOM 423 C PHE B 312 1.645 -9.545 4.907 1.00 0.00 C ATOM 424 O PHE B 312 1.965 -9.710 6.085 1.00 0.00 O ATOM 425 CB PHE B 312 1.727 -11.818 3.890 1.00 0.00 C ATOM 426 CG PHE B 312 2.035 -12.563 2.611 1.00 0.00 C ATOM 427 CD1 PHE B 312 1.465 -12.150 1.401 1.00 0.00 C ATOM 428 CD2 PHE B 312 2.896 -13.670 2.636 1.00 0.00 C ATOM 429 CE1 PHE B 312 1.752 -12.841 0.219 1.00 0.00 C ATOM 430 CE2 PHE B 312 3.183 -14.360 1.453 1.00 0.00 C ATOM 431 CZ PHE B 312 2.612 -13.947 0.245 1.00 0.00 C ATOM 0 H PHE B 312 4.033 -10.790 4.918 1.00 0.00 H new ATOM 0 HA PHE B 312 2.074 -9.932 2.853 1.00 0.00 H new ATOM 0 HB2 PHE B 312 2.158 -12.345 4.741 1.00 0.00 H new ATOM 0 HB3 PHE B 312 0.649 -11.782 4.050 1.00 0.00 H new ATOM 0 HD1 PHE B 312 0.803 -11.297 1.380 1.00 0.00 H new ATOM 0 HD2 PHE B 312 3.337 -13.990 3.568 1.00 0.00 H new ATOM 0 HE1 PHE B 312 1.311 -12.522 -0.714 1.00 0.00 H new ATOM 0 HE2 PHE B 312 3.846 -15.212 1.473 1.00 0.00 H new ATOM 0 HZ PHE B 312 2.834 -14.480 -0.668 1.00 0.00 H new ATOM 441 N PHE B 313 0.716 -8.645 4.531 1.00 0.00 N ATOM 442 CA PHE B 313 0.048 -7.824 5.530 1.00 0.00 C ATOM 443 C PHE B 313 -1.420 -7.668 5.195 1.00 0.00 C ATOM 444 O PHE B 313 -1.778 -7.267 4.090 1.00 0.00 O ATOM 445 CB PHE B 313 0.682 -6.443 5.599 1.00 0.00 C ATOM 446 CG PHE B 313 1.993 -6.521 6.335 1.00 0.00 C ATOM 447 CD1 PHE B 313 3.163 -6.868 5.650 1.00 0.00 C ATOM 448 CD2 PHE B 313 2.039 -6.243 7.705 1.00 0.00 C ATOM 449 CE1 PHE B 313 4.379 -6.934 6.336 1.00 0.00 C ATOM 450 CE2 PHE B 313 3.256 -6.309 8.391 1.00 0.00 C ATOM 451 CZ PHE B 313 4.427 -6.654 7.704 1.00 0.00 C ATOM 0 H PHE B 313 0.425 -8.478 3.568 1.00 0.00 H new ATOM 0 HA PHE B 313 0.153 -8.323 6.493 1.00 0.00 H new ATOM 0 HB2 PHE B 313 0.842 -6.055 4.593 1.00 0.00 H new ATOM 0 HB3 PHE B 313 0.011 -5.749 6.105 1.00 0.00 H new ATOM 0 HD1 PHE B 313 3.126 -7.085 4.593 1.00 0.00 H new ATOM 0 HD2 PHE B 313 1.135 -5.977 8.233 1.00 0.00 H new ATOM 0 HE1 PHE B 313 5.282 -7.202 5.808 1.00 0.00 H new ATOM 0 HE2 PHE B 313 3.293 -6.094 9.449 1.00 0.00 H new ATOM 0 HZ PHE B 313 5.368 -6.704 8.232 1.00 0.00 H new ATOM 461 N LEU B 314 -2.263 -7.961 6.164 1.00 0.00 N ATOM 462 CA LEU B 314 -3.686 -7.821 5.974 1.00 0.00 C ATOM 463 C LEU B 314 -4.077 -6.375 6.150 1.00 0.00 C ATOM 464 O LEU B 314 -4.009 -5.780 7.215 1.00 0.00 O ATOM 465 CB LEU B 314 -4.476 -8.818 6.850 1.00 0.00 C ATOM 466 CG LEU B 314 -4.986 -8.251 8.189 1.00 0.00 C ATOM 467 CD1 LEU B 314 -3.855 -7.592 8.981 1.00 0.00 C ATOM 468 CD2 LEU B 314 -6.142 -7.261 7.967 1.00 0.00 C ATOM 0 H LEU B 314 -1.986 -8.296 7.087 1.00 0.00 H new ATOM 0 HA LEU B 314 -3.956 -8.092 4.953 1.00 0.00 H new ATOM 0 HB2 LEU B 314 -5.330 -9.182 6.279 1.00 0.00 H new ATOM 0 HB3 LEU B 314 -3.840 -9.679 7.057 1.00 0.00 H new ATOM 0 HG LEU B 314 -5.364 -9.088 8.776 1.00 0.00 H new ATOM 0 HD11 LEU B 314 -4.248 -7.202 9.920 1.00 0.00 H new ATOM 0 HD12 LEU B 314 -3.080 -8.329 9.190 1.00 0.00 H new ATOM 0 HD13 LEU B 314 -3.431 -6.775 8.398 1.00 0.00 H new ATOM 0 HD21 LEU B 314 -6.482 -6.877 8.929 1.00 0.00 H new ATOM 0 HD22 LEU B 314 -5.798 -6.433 7.347 1.00 0.00 H new ATOM 0 HD23 LEU B 314 -6.966 -7.770 7.468 1.00 0.00 H new ATOM 480 N VAL B 315 -4.393 -5.803 5.032 1.00 0.00 N ATOM 481 CA VAL B 315 -4.735 -4.403 4.959 1.00 0.00 C ATOM 482 C VAL B 315 -6.152 -4.238 4.423 1.00 0.00 C ATOM 483 O VAL B 315 -6.673 -5.152 3.807 1.00 0.00 O ATOM 484 CB VAL B 315 -3.742 -3.736 4.027 1.00 0.00 C ATOM 485 CG1 VAL B 315 -2.317 -3.919 4.556 1.00 0.00 C ATOM 486 CG2 VAL B 315 -3.873 -4.368 2.631 1.00 0.00 C ATOM 0 H VAL B 315 -4.424 -6.289 4.136 1.00 0.00 H new ATOM 0 HA VAL B 315 -4.694 -3.947 5.948 1.00 0.00 H new ATOM 0 HB VAL B 315 -3.952 -2.668 3.969 1.00 0.00 H new ATOM 0 HG11 VAL B 315 -1.613 -3.436 3.879 1.00 0.00 H new ATOM 0 HG12 VAL B 315 -2.236 -3.469 5.545 1.00 0.00 H new ATOM 0 HG13 VAL B 315 -2.087 -4.982 4.621 1.00 0.00 H new ATOM 0 HG21 VAL B 315 -3.164 -3.897 1.950 1.00 0.00 H new ATOM 0 HG22 VAL B 315 -3.662 -5.435 2.694 1.00 0.00 H new ATOM 0 HG23 VAL B 315 -4.887 -4.220 2.258 1.00 0.00 H new ATOM 496 N LYS B 316 -6.773 -3.075 4.639 1.00 0.00 N ATOM 497 CA LYS B 316 -8.115 -2.853 4.135 1.00 0.00 C ATOM 498 C LYS B 316 -8.050 -1.987 2.895 1.00 0.00 C ATOM 499 O LYS B 316 -7.190 -1.122 2.779 1.00 0.00 O ATOM 500 CB LYS B 316 -8.982 -2.167 5.178 1.00 0.00 C ATOM 501 CG LYS B 316 -8.742 -2.787 6.557 1.00 0.00 C ATOM 502 CD LYS B 316 -9.577 -2.048 7.605 1.00 0.00 C ATOM 503 CE LYS B 316 -10.662 -2.982 8.143 1.00 0.00 C ATOM 504 NZ LYS B 316 -10.026 -4.179 8.764 1.00 0.00 N1+ ATOM 0 H LYS B 316 -6.370 -2.290 5.151 1.00 0.00 H new ATOM 0 HA LYS B 316 -8.557 -3.820 3.897 1.00 0.00 H new ATOM 0 HB2 LYS B 316 -8.755 -1.101 5.206 1.00 0.00 H new ATOM 0 HB3 LYS B 316 -10.033 -2.262 4.907 1.00 0.00 H new ATOM 0 HG2 LYS B 316 -9.010 -3.844 6.543 1.00 0.00 H new ATOM 0 HG3 LYS B 316 -7.684 -2.729 6.814 1.00 0.00 H new ATOM 0 HD2 LYS B 316 -8.939 -1.707 8.420 1.00 0.00 H new ATOM 0 HD3 LYS B 316 -10.032 -1.161 7.164 1.00 0.00 H new ATOM 0 HE2 LYS B 316 -11.274 -2.460 8.878 1.00 0.00 H new ATOM 0 HE3 LYS B 316 -11.326 -3.288 7.335 1.00 0.00 H new ATOM 0 HZ1 LYS B 316 -10.587 -4.484 9.585 1.00 0.00 H new ATOM 0 HZ2 LYS B 316 -9.984 -4.950 8.068 1.00 0.00 H new ATOM 0 HZ3 LYS B 316 -9.062 -3.939 9.073 1.00 0.00 H new ATOM 518 N GLU B 317 -8.951 -2.241 1.974 1.00 0.00 N ATOM 519 CA GLU B 317 -8.980 -1.504 0.725 1.00 0.00 C ATOM 520 C GLU B 317 -10.361 -0.977 0.402 1.00 0.00 C ATOM 521 O GLU B 317 -11.378 -1.589 0.709 1.00 0.00 O ATOM 522 CB GLU B 317 -8.526 -2.407 -0.409 1.00 0.00 C ATOM 523 CG GLU B 317 -8.025 -1.561 -1.587 1.00 0.00 C ATOM 524 CD GLU B 317 -7.354 -2.450 -2.627 1.00 0.00 C ATOM 525 OE1 GLU B 317 -6.375 -3.093 -2.285 1.00 0.00 O1- ATOM 526 OE2 GLU B 317 -7.825 -2.470 -3.752 1.00 0.00 O ATOM 0 H GLU B 317 -9.676 -2.953 2.063 1.00 0.00 H new ATOM 0 HA GLU B 317 -8.309 -0.652 0.837 1.00 0.00 H new ATOM 0 HB2 GLU B 317 -7.732 -3.068 -0.062 1.00 0.00 H new ATOM 0 HB3 GLU B 317 -9.351 -3.042 -0.732 1.00 0.00 H new ATOM 0 HG2 GLU B 317 -8.859 -1.025 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU B 317 -7.320 -0.810 -1.231 1.00 0.00 H new ATOM 678 N VAL B 326 -12.392 -2.673 2.607 1.00 0.00 N ATOM 679 CA VAL B 326 -12.590 -4.100 2.657 1.00 0.00 C ATOM 680 C VAL B 326 -11.309 -4.792 3.107 1.00 0.00 C ATOM 681 O VAL B 326 -10.274 -4.609 2.467 1.00 0.00 O ATOM 682 CB VAL B 326 -12.957 -4.567 1.259 1.00 0.00 C ATOM 683 CG1 VAL B 326 -12.604 -6.038 1.088 1.00 0.00 C ATOM 684 CG2 VAL B 326 -14.449 -4.356 1.043 1.00 0.00 C ATOM 0 HA VAL B 326 -13.381 -4.345 3.366 1.00 0.00 H new ATOM 0 HB VAL B 326 -12.397 -3.992 0.522 1.00 0.00 H new ATOM 0 HG11 VAL B 326 -12.872 -6.362 0.082 1.00 0.00 H new ATOM 0 HG12 VAL B 326 -11.534 -6.175 1.241 1.00 0.00 H new ATOM 0 HG13 VAL B 326 -13.154 -6.631 1.818 1.00 0.00 H new ATOM 0 HG21 VAL B 326 -14.722 -4.688 0.042 1.00 0.00 H new ATOM 0 HG22 VAL B 326 -15.008 -4.931 1.781 1.00 0.00 H new ATOM 0 HG23 VAL B 326 -14.686 -3.298 1.151 1.00 0.00 H new ATOM 694 N PRO B 327 -11.330 -5.592 4.157 1.00 0.00 N ATOM 695 CA PRO B 327 -10.105 -6.295 4.591 1.00 0.00 C ATOM 696 C PRO B 327 -9.434 -6.870 3.364 1.00 0.00 C ATOM 697 O PRO B 327 -10.113 -7.248 2.409 1.00 0.00 O ATOM 698 CB PRO B 327 -10.611 -7.388 5.530 1.00 0.00 C ATOM 699 CG PRO B 327 -11.907 -6.875 6.070 1.00 0.00 C ATOM 700 CD PRO B 327 -12.479 -5.909 5.025 1.00 0.00 C ATOM 0 HA PRO B 327 -9.373 -5.661 5.092 1.00 0.00 H new ATOM 0 HB2 PRO B 327 -10.751 -8.329 4.999 1.00 0.00 H new ATOM 0 HB3 PRO B 327 -9.898 -7.578 6.332 1.00 0.00 H new ATOM 0 HG2 PRO B 327 -12.599 -7.696 6.255 1.00 0.00 H new ATOM 0 HG3 PRO B 327 -11.754 -6.366 7.022 1.00 0.00 H new ATOM 0 HD2 PRO B 327 -13.290 -6.368 4.460 1.00 0.00 H new ATOM 0 HD3 PRO B 327 -12.885 -5.012 5.492 1.00 0.00 H new ATOM 708 N ARG B 328 -8.122 -6.897 3.347 1.00 0.00 N ATOM 709 CA ARG B 328 -7.444 -7.379 2.184 1.00 0.00 C ATOM 710 C ARG B 328 -6.127 -7.956 2.603 1.00 0.00 C ATOM 711 O ARG B 328 -5.868 -8.114 3.794 1.00 0.00 O ATOM 712 CB ARG B 328 -7.262 -6.240 1.168 1.00 0.00 C ATOM 713 CG ARG B 328 -6.801 -6.798 -0.180 1.00 0.00 C ATOM 714 CD ARG B 328 -7.506 -6.044 -1.310 1.00 0.00 C ATOM 715 NE ARG B 328 -8.951 -6.213 -1.205 1.00 0.00 N ATOM 716 CZ ARG B 328 -9.540 -7.342 -1.584 1.00 0.00 C ATOM 717 NH1 ARG B 328 -8.823 -8.323 -2.064 1.00 0.00 N ATOM 718 NH2 ARG B 328 -10.834 -7.472 -1.477 1.00 0.00 N1+ ATOM 0 H ARG B 328 -7.519 -6.596 4.113 1.00 0.00 H new ATOM 0 HA ARG B 328 -8.032 -8.158 1.698 1.00 0.00 H new ATOM 0 HB2 ARG B 328 -8.201 -5.701 1.044 1.00 0.00 H new ATOM 0 HB3 ARG B 328 -6.530 -5.524 1.542 1.00 0.00 H new ATOM 0 HG2 ARG B 328 -5.720 -6.695 -0.278 1.00 0.00 H new ATOM 0 HG3 ARG B 328 -7.027 -7.863 -0.242 1.00 0.00 H new ATOM 0 HD2 ARG B 328 -7.252 -4.985 -1.264 1.00 0.00 H new ATOM 0 HD3 ARG B 328 -7.159 -6.413 -2.275 1.00 0.00 H new ATOM 0 HE ARG B 328 -9.519 -5.451 -0.834 1.00 0.00 H new ATOM 0 HH11 ARG B 328 -7.811 -8.222 -2.148 1.00 0.00 H new ATOM 0 HH12 ARG B 328 -9.275 -9.190 -2.355 1.00 0.00 H new ATOM 0 HH21 ARG B 328 -11.394 -6.706 -1.102 1.00 0.00 H new ATOM 0 HH22 ARG B 328 -11.285 -8.339 -1.768 1.00 0.00 H new ATOM 732 N LEU B 329 -5.316 -8.313 1.642 1.00 0.00 N ATOM 733 CA LEU B 329 -4.068 -8.928 1.947 1.00 0.00 C ATOM 734 C LEU B 329 -3.017 -8.406 0.994 1.00 0.00 C ATOM 735 O LEU B 329 -3.154 -8.514 -0.207 1.00 0.00 O ATOM 736 CB LEU B 329 -4.314 -10.438 1.853 1.00 0.00 C ATOM 737 CG LEU B 329 -3.204 -11.284 2.503 1.00 0.00 C ATOM 738 CD1 LEU B 329 -3.143 -12.656 1.820 1.00 0.00 C ATOM 739 CD2 LEU B 329 -1.833 -10.623 2.374 1.00 0.00 C ATOM 0 H LEU B 329 -5.503 -8.186 0.647 1.00 0.00 H new ATOM 0 HA LEU B 329 -3.692 -8.699 2.944 1.00 0.00 H new ATOM 0 HB2 LEU B 329 -5.265 -10.673 2.330 1.00 0.00 H new ATOM 0 HB3 LEU B 329 -4.406 -10.718 0.804 1.00 0.00 H new ATOM 0 HG LEU B 329 -3.445 -11.382 3.562 1.00 0.00 H new ATOM 0 HD11 LEU B 329 -2.358 -13.256 2.279 1.00 0.00 H new ATOM 0 HD12 LEU B 329 -4.101 -13.163 1.935 1.00 0.00 H new ATOM 0 HD13 LEU B 329 -2.927 -12.525 0.760 1.00 0.00 H new ATOM 0 HD21 LEU B 329 -1.079 -11.253 2.846 1.00 0.00 H new ATOM 0 HD22 LEU B 329 -1.589 -10.494 1.320 1.00 0.00 H new ATOM 0 HD23 LEU B 329 -1.851 -9.650 2.864 1.00 0.00 H new ATOM 751 N LEU B 330 -1.981 -7.806 1.556 1.00 0.00 N ATOM 752 CA LEU B 330 -0.912 -7.234 0.776 1.00 0.00 C ATOM 753 C LEU B 330 0.240 -8.198 0.744 1.00 0.00 C ATOM 754 O LEU B 330 0.373 -9.024 1.638 1.00 0.00 O ATOM 755 CB LEU B 330 -0.495 -5.920 1.443 1.00 0.00 C ATOM 756 CG LEU B 330 0.818 -5.370 0.865 1.00 0.00 C ATOM 757 CD1 LEU B 330 0.611 -4.948 -0.586 1.00 0.00 C ATOM 758 CD2 LEU B 330 1.243 -4.166 1.696 1.00 0.00 C ATOM 0 H LEU B 330 -1.863 -7.705 2.564 1.00 0.00 H new ATOM 0 HA LEU B 330 -1.231 -7.041 -0.248 1.00 0.00 H new ATOM 0 HB2 LEU B 330 -1.286 -5.181 1.313 1.00 0.00 H new ATOM 0 HB3 LEU B 330 -0.380 -6.079 2.515 1.00 0.00 H new ATOM 0 HG LEU B 330 1.590 -6.139 0.897 1.00 0.00 H new ATOM 0 HD11 LEU B 330 1.546 -4.559 -0.989 1.00 0.00 H new ATOM 0 HD12 LEU B 330 0.293 -5.809 -1.174 1.00 0.00 H new ATOM 0 HD13 LEU B 330 -0.155 -4.174 -0.634 1.00 0.00 H new ATOM 0 HD21 LEU B 330 2.175 -3.761 1.300 1.00 0.00 H new ATOM 0 HD22 LEU B 330 0.467 -3.401 1.652 1.00 0.00 H new ATOM 0 HD23 LEU B 330 1.392 -4.473 2.731 1.00 0.00 H new ATOM 770 N GLY B 331 1.097 -8.062 -0.255 1.00 0.00 N ATOM 771 CA GLY B 331 2.248 -8.902 -0.328 1.00 0.00 C ATOM 772 C GLY B 331 3.440 -8.115 -0.829 1.00 0.00 C ATOM 773 O GLY B 331 3.535 -7.782 -2.001 1.00 0.00 O ATOM 0 H GLY B 331 1.007 -7.383 -1.011 1.00 0.00 H new ATOM 0 HA2 GLY B 331 2.466 -9.319 0.655 1.00 0.00 H new ATOM 0 HA3 GLY B 331 2.052 -9.742 -0.994 1.00 0.00 H new ATOM 777 N ILE B 332 4.367 -7.844 0.063 1.00 0.00 N ATOM 778 CA ILE B 332 5.571 -7.145 -0.319 1.00 0.00 C ATOM 779 C ILE B 332 6.582 -8.167 -0.773 1.00 0.00 C ATOM 780 O ILE B 332 6.946 -9.067 -0.026 1.00 0.00 O ATOM 781 CB ILE B 332 6.165 -6.374 0.852 1.00 0.00 C ATOM 782 CG1 ILE B 332 5.103 -5.468 1.475 1.00 0.00 C ATOM 783 CG2 ILE B 332 7.350 -5.531 0.364 1.00 0.00 C ATOM 784 CD1 ILE B 332 4.446 -4.617 0.386 1.00 0.00 C ATOM 0 H ILE B 332 4.310 -8.095 1.050 1.00 0.00 H new ATOM 0 HA ILE B 332 5.326 -6.437 -1.110 1.00 0.00 H new ATOM 0 HB ILE B 332 6.512 -7.080 1.607 1.00 0.00 H new ATOM 0 HG12 ILE B 332 4.350 -6.071 1.983 1.00 0.00 H new ATOM 0 HG13 ILE B 332 5.557 -4.824 2.228 1.00 0.00 H new ATOM 0 HG21 ILE B 332 7.774 -4.980 1.203 1.00 0.00 H new ATOM 0 HG22 ILE B 332 8.111 -6.185 -0.062 1.00 0.00 H new ATOM 0 HG23 ILE B 332 7.008 -4.828 -0.396 1.00 0.00 H new ATOM 0 HD11 ILE B 332 3.690 -3.973 0.834 1.00 0.00 H new ATOM 0 HD12 ILE B 332 5.203 -4.003 -0.102 1.00 0.00 H new ATOM 0 HD13 ILE B 332 3.977 -5.268 -0.351 1.00 0.00 H new ATOM 796 N THR B 333 7.028 -8.007 -1.991 1.00 0.00 N ATOM 797 CA THR B 333 7.992 -8.890 -2.571 1.00 0.00 C ATOM 798 C THR B 333 9.242 -8.103 -2.861 1.00 0.00 C ATOM 799 O THR B 333 9.166 -6.974 -3.335 1.00 0.00 O ATOM 800 CB THR B 333 7.419 -9.461 -3.862 1.00 0.00 C ATOM 801 OG1 THR B 333 7.658 -8.559 -4.928 1.00 0.00 O ATOM 802 CG2 THR B 333 5.912 -9.666 -3.695 1.00 0.00 C ATOM 0 H THR B 333 6.727 -7.253 -2.609 1.00 0.00 H new ATOM 0 HA THR B 333 8.227 -9.709 -1.892 1.00 0.00 H new ATOM 0 HB THR B 333 7.897 -10.415 -4.084 1.00 0.00 H new ATOM 0 HG1 THR B 333 6.829 -8.423 -5.433 1.00 0.00 H new ATOM 0 HG21 THR B 333 5.496 -10.075 -4.616 1.00 0.00 H new ATOM 0 HG22 THR B 333 5.728 -10.360 -2.875 1.00 0.00 H new ATOM 0 HG23 THR B 333 5.437 -8.710 -3.475 1.00 0.00 H new ATOM 810 N LYS B 334 10.386 -8.687 -2.579 1.00 0.00 N ATOM 811 CA LYS B 334 11.653 -8.007 -2.818 1.00 0.00 C ATOM 812 C LYS B 334 11.805 -7.598 -4.279 1.00 0.00 C ATOM 813 O LYS B 334 12.888 -7.259 -4.728 1.00 0.00 O ATOM 814 CB LYS B 334 12.808 -8.911 -2.421 1.00 0.00 C ATOM 815 CG LYS B 334 12.782 -10.186 -3.263 1.00 0.00 C ATOM 816 CD LYS B 334 13.842 -11.161 -2.742 1.00 0.00 C ATOM 817 CE LYS B 334 13.652 -12.527 -3.408 1.00 0.00 C ATOM 818 NZ LYS B 334 12.346 -13.108 -2.985 1.00 0.00 N1+ ATOM 0 H LYS B 334 10.472 -9.625 -2.186 1.00 0.00 H new ATOM 0 HA LYS B 334 11.664 -7.102 -2.210 1.00 0.00 H new ATOM 0 HB2 LYS B 334 13.755 -8.390 -2.563 1.00 0.00 H new ATOM 0 HB3 LYS B 334 12.738 -9.162 -1.363 1.00 0.00 H new ATOM 0 HG2 LYS B 334 11.795 -10.646 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS B 334 12.974 -9.948 -4.309 1.00 0.00 H new ATOM 0 HD2 LYS B 334 14.840 -10.777 -2.954 1.00 0.00 H new ATOM 0 HD3 LYS B 334 13.761 -11.258 -1.659 1.00 0.00 H new ATOM 0 HE2 LYS B 334 13.681 -12.422 -4.493 1.00 0.00 H new ATOM 0 HE3 LYS B 334 14.467 -13.196 -3.130 1.00 0.00 H new ATOM 0 HZ1 LYS B 334 12.391 -14.145 -3.047 1.00 0.00 H new ATOM 0 HZ2 LYS B 334 12.143 -12.828 -2.004 1.00 0.00 H new ATOM 0 HZ3 LYS B 334 11.591 -12.756 -3.608 1.00 0.00 H new ATOM 832 N GLU B 335 10.709 -7.646 -5.001 1.00 0.00 N ATOM 833 CA GLU B 335 10.681 -7.260 -6.404 1.00 0.00 C ATOM 834 C GLU B 335 9.364 -6.578 -6.750 1.00 0.00 C ATOM 835 O GLU B 335 9.160 -6.164 -7.893 1.00 0.00 O ATOM 836 CB GLU B 335 10.866 -8.489 -7.292 1.00 0.00 C ATOM 837 CG GLU B 335 9.866 -9.572 -6.880 1.00 0.00 C ATOM 838 CD GLU B 335 10.088 -10.832 -7.710 1.00 0.00 C ATOM 839 OE1 GLU B 335 11.234 -11.121 -8.017 1.00 0.00 O ATOM 840 OE2 GLU B 335 9.111 -11.492 -8.024 1.00 0.00 O1- ATOM 0 H GLU B 335 9.807 -7.954 -4.637 1.00 0.00 H new ATOM 0 HA GLU B 335 11.497 -6.559 -6.579 1.00 0.00 H new ATOM 0 HB2 GLU B 335 10.717 -8.221 -8.338 1.00 0.00 H new ATOM 0 HB3 GLU B 335 11.885 -8.866 -7.201 1.00 0.00 H new ATOM 0 HG2 GLU B 335 9.981 -9.800 -5.820 1.00 0.00 H new ATOM 0 HG3 GLU B 335 8.847 -9.210 -7.020 1.00 0.00 H new ATOM 847 N CYS B 336 8.440 -6.505 -5.788 1.00 0.00 N ATOM 848 CA CYS B 336 7.139 -5.927 -6.075 1.00 0.00 C ATOM 849 C CYS B 336 6.268 -5.805 -4.850 1.00 0.00 C ATOM 850 O CYS B 336 6.632 -6.192 -3.743 1.00 0.00 O ATOM 851 CB CYS B 336 6.414 -6.767 -7.130 1.00 0.00 C ATOM 852 SG CYS B 336 5.031 -7.656 -6.372 1.00 0.00 S ATOM 0 H CYS B 336 8.569 -6.831 -4.830 1.00 0.00 H new ATOM 0 HA CYS B 336 7.320 -4.919 -6.449 1.00 0.00 H new ATOM 0 HB2 CYS B 336 6.048 -6.124 -7.930 1.00 0.00 H new ATOM 0 HB3 CYS B 336 7.108 -7.475 -7.582 1.00 0.00 H new ATOM 0 HG CYS B 336 4.422 -8.364 -7.277 1.00 0.00 H new ATOM 858 N VAL B 337 5.105 -5.248 -5.098 1.00 0.00 N ATOM 859 CA VAL B 337 4.106 -5.029 -4.080 1.00 0.00 C ATOM 860 C VAL B 337 2.804 -5.485 -4.661 1.00 0.00 C ATOM 861 O VAL B 337 2.631 -5.374 -5.868 1.00 0.00 O ATOM 862 CB VAL B 337 4.073 -3.548 -3.768 1.00 0.00 C ATOM 863 CG1 VAL B 337 3.262 -3.287 -2.499 1.00 0.00 C ATOM 864 CG2 VAL B 337 5.512 -3.102 -3.571 1.00 0.00 C ATOM 0 H VAL B 337 4.823 -4.930 -6.025 1.00 0.00 H new ATOM 0 HA VAL B 337 4.313 -5.571 -3.158 1.00 0.00 H new ATOM 0 HB VAL B 337 3.601 -2.995 -4.580 1.00 0.00 H new ATOM 0 HG11 VAL B 337 3.249 -2.217 -2.289 1.00 0.00 H new ATOM 0 HG12 VAL B 337 2.241 -3.642 -2.640 1.00 0.00 H new ATOM 0 HG13 VAL B 337 3.717 -3.815 -1.661 1.00 0.00 H new ATOM 0 HG21 VAL B 337 5.535 -2.036 -3.343 1.00 0.00 H new ATOM 0 HG22 VAL B 337 5.956 -3.659 -2.746 1.00 0.00 H new ATOM 0 HG23 VAL B 337 6.079 -3.290 -4.482 1.00 0.00 H new ATOM 874 N MET B 338 1.915 -6.061 -3.868 1.00 0.00 N ATOM 875 CA MET B 338 0.703 -6.574 -4.490 1.00 0.00 C ATOM 876 C MET B 338 -0.502 -6.614 -3.574 1.00 0.00 C ATOM 877 O MET B 338 -0.385 -6.821 -2.371 1.00 0.00 O ATOM 878 CB MET B 338 0.959 -7.993 -5.002 1.00 0.00 C ATOM 879 CG MET B 338 1.956 -8.722 -4.101 1.00 0.00 C ATOM 880 SD MET B 338 2.324 -10.348 -4.799 1.00 0.00 S ATOM 881 CE MET B 338 2.747 -11.179 -3.250 1.00 0.00 C ATOM 0 H MET B 338 1.996 -6.182 -2.858 1.00 0.00 H new ATOM 0 HA MET B 338 0.467 -5.879 -5.296 1.00 0.00 H new ATOM 0 HB2 MET B 338 0.021 -8.547 -5.037 1.00 0.00 H new ATOM 0 HB3 MET B 338 1.344 -7.953 -6.021 1.00 0.00 H new ATOM 0 HG2 MET B 338 2.872 -8.139 -4.008 1.00 0.00 H new ATOM 0 HG3 MET B 338 1.544 -8.830 -3.098 1.00 0.00 H new ATOM 0 HE1 MET B 338 3.244 -12.124 -3.468 1.00 0.00 H new ATOM 0 HE2 MET B 338 3.414 -10.544 -2.667 1.00 0.00 H new ATOM 0 HE3 MET B 338 1.838 -11.370 -2.680 1.00 0.00 H new ATOM 891 N ARG B 339 -1.677 -6.492 -4.188 1.00 0.00 N ATOM 892 CA ARG B 339 -2.923 -6.590 -3.455 1.00 0.00 C ATOM 893 C ARG B 339 -3.438 -8.009 -3.576 1.00 0.00 C ATOM 894 O ARG B 339 -3.898 -8.430 -4.641 1.00 0.00 O ATOM 895 CB ARG B 339 -3.962 -5.628 -4.015 1.00 0.00 C ATOM 896 CG ARG B 339 -3.383 -4.215 -4.049 1.00 0.00 C ATOM 897 CD ARG B 339 -4.402 -3.257 -4.675 1.00 0.00 C ATOM 898 NE ARG B 339 -5.610 -3.982 -5.056 1.00 0.00 N ATOM 899 CZ ARG B 339 -6.466 -3.484 -5.941 1.00 0.00 C ATOM 900 NH1 ARG B 339 -6.229 -2.334 -6.507 1.00 0.00 N ATOM 901 NH2 ARG B 339 -7.537 -4.160 -6.257 1.00 0.00 N1+ ATOM 0 H ARG B 339 -1.785 -6.326 -5.189 1.00 0.00 H new ATOM 0 HA ARG B 339 -2.745 -6.330 -2.412 1.00 0.00 H new ATOM 0 HB2 ARG B 339 -4.255 -5.936 -5.019 1.00 0.00 H new ATOM 0 HB3 ARG B 339 -4.861 -5.649 -3.400 1.00 0.00 H new ATOM 0 HG2 ARG B 339 -3.134 -3.889 -3.039 1.00 0.00 H new ATOM 0 HG3 ARG B 339 -2.457 -4.204 -4.624 1.00 0.00 H new ATOM 0 HD2 ARG B 339 -4.652 -2.467 -3.967 1.00 0.00 H new ATOM 0 HD3 ARG B 339 -3.968 -2.774 -5.551 1.00 0.00 H new ATOM 0 HE ARG B 339 -5.801 -4.891 -4.634 1.00 0.00 H new ATOM 0 HH11 ARG B 339 -5.384 -1.814 -6.271 1.00 0.00 H new ATOM 0 HH12 ARG B 339 -6.888 -1.954 -7.186 1.00 0.00 H new ATOM 0 HH21 ARG B 339 -7.714 -5.067 -5.825 1.00 0.00 H new ATOM 0 HH22 ARG B 339 -8.197 -3.781 -6.936 1.00 0.00 H new ATOM 915 N VAL B 340 -3.323 -8.741 -2.487 1.00 0.00 N ATOM 916 CA VAL B 340 -3.742 -10.123 -2.445 1.00 0.00 C ATOM 917 C VAL B 340 -5.145 -10.257 -1.879 1.00 0.00 C ATOM 918 O VAL B 340 -5.584 -9.448 -1.065 1.00 0.00 O ATOM 919 CB VAL B 340 -2.738 -10.933 -1.636 1.00 0.00 C ATOM 920 CG1 VAL B 340 -2.908 -12.400 -1.958 1.00 0.00 C ATOM 921 CG2 VAL B 340 -1.332 -10.497 -2.004 1.00 0.00 C ATOM 0 H VAL B 340 -2.937 -8.394 -1.609 1.00 0.00 H new ATOM 0 HA VAL B 340 -3.772 -10.514 -3.462 1.00 0.00 H new ATOM 0 HB VAL B 340 -2.905 -10.770 -0.571 1.00 0.00 H new ATOM 0 HG11 VAL B 340 -2.191 -12.985 -1.381 1.00 0.00 H new ATOM 0 HG12 VAL B 340 -3.920 -12.713 -1.703 1.00 0.00 H new ATOM 0 HG13 VAL B 340 -2.735 -12.561 -3.022 1.00 0.00 H new ATOM 0 HG21 VAL B 340 -0.609 -11.074 -1.427 1.00 0.00 H new ATOM 0 HG22 VAL B 340 -1.165 -10.666 -3.068 1.00 0.00 H new ATOM 0 HG23 VAL B 340 -1.210 -9.437 -1.782 1.00 0.00 H new ATOM 931 N ASP B 341 -5.852 -11.277 -2.350 1.00 0.00 N ATOM 932 CA ASP B 341 -7.220 -11.510 -1.924 1.00 0.00 C ATOM 933 C ASP B 341 -7.257 -12.356 -0.666 1.00 0.00 C ATOM 934 O ASP B 341 -7.306 -13.575 -0.732 1.00 0.00 O ATOM 935 CB ASP B 341 -8.001 -12.209 -3.036 1.00 0.00 C ATOM 936 CG ASP B 341 -9.496 -12.148 -2.737 1.00 0.00 C ATOM 937 OD1 ASP B 341 -9.847 -11.670 -1.671 1.00 0.00 O1- ATOM 938 OD2 ASP B 341 -10.266 -12.579 -3.579 1.00 0.00 O ATOM 0 H ASP B 341 -5.498 -11.954 -3.026 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.679 -10.545 -1.708 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -7.793 -11.732 -3.994 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.680 -13.247 -3.121 1.00 0.00 H new ATOM 943 N GLU B 342 -7.242 -11.684 0.470 1.00 0.00 N ATOM 944 CA GLU B 342 -7.283 -12.348 1.770 1.00 0.00 C ATOM 945 C GLU B 342 -8.166 -13.584 1.714 1.00 0.00 C ATOM 946 O GLU B 342 -7.970 -14.546 2.455 1.00 0.00 O ATOM 947 CB GLU B 342 -7.862 -11.360 2.795 1.00 0.00 C ATOM 948 CG GLU B 342 -7.236 -11.558 4.175 1.00 0.00 C ATOM 949 CD GLU B 342 -8.312 -11.457 5.249 1.00 0.00 C ATOM 950 OE1 GLU B 342 -9.159 -10.587 5.131 1.00 0.00 O1- ATOM 951 OE2 GLU B 342 -8.272 -12.250 6.176 1.00 0.00 O ATOM 0 H GLU B 342 -7.201 -10.666 0.523 1.00 0.00 H new ATOM 0 HA GLU B 342 -6.276 -12.656 2.052 1.00 0.00 H new ATOM 0 HB2 GLU B 342 -7.687 -10.339 2.457 1.00 0.00 H new ATOM 0 HB3 GLU B 342 -8.942 -11.493 2.861 1.00 0.00 H new ATOM 0 HG2 GLU B 342 -6.748 -12.531 4.227 1.00 0.00 H new ATOM 0 HG3 GLU B 342 -6.466 -10.806 4.347 1.00 0.00 H new ATOM 958 N LYS B 343 -9.132 -13.536 0.821 1.00 0.00 N ATOM 959 CA LYS B 343 -10.063 -14.634 0.637 1.00 0.00 C ATOM 960 C LYS B 343 -9.388 -15.841 -0.004 1.00 0.00 C ATOM 961 O LYS B 343 -9.630 -16.980 0.398 1.00 0.00 O ATOM 962 CB LYS B 343 -11.202 -14.177 -0.265 1.00 0.00 C ATOM 963 CG LYS B 343 -11.982 -13.059 0.423 1.00 0.00 C ATOM 964 CD LYS B 343 -12.850 -12.337 -0.608 1.00 0.00 C ATOM 965 CE LYS B 343 -14.062 -11.715 0.086 1.00 0.00 C ATOM 966 NZ LYS B 343 -13.700 -11.347 1.484 1.00 0.00 N1+ ATOM 0 H LYS B 343 -9.295 -12.740 0.204 1.00 0.00 H new ATOM 0 HA LYS B 343 -10.436 -14.927 1.618 1.00 0.00 H new ATOM 0 HB2 LYS B 343 -10.806 -13.825 -1.218 1.00 0.00 H new ATOM 0 HB3 LYS B 343 -11.864 -15.015 -0.485 1.00 0.00 H new ATOM 0 HG2 LYS B 343 -12.606 -13.471 1.216 1.00 0.00 H new ATOM 0 HG3 LYS B 343 -11.294 -12.356 0.892 1.00 0.00 H new ATOM 0 HD2 LYS B 343 -12.269 -11.563 -1.109 1.00 0.00 H new ATOM 0 HD3 LYS B 343 -13.178 -13.037 -1.376 1.00 0.00 H new ATOM 0 HE2 LYS B 343 -14.393 -10.831 -0.460 1.00 0.00 H new ATOM 0 HE3 LYS B 343 -14.894 -12.419 0.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 343 -14.364 -10.628 1.837 1.00 0.00 H new ATOM 0 HZ2 LYS B 343 -13.750 -12.191 2.089 1.00 0.00 H new ATOM 0 HZ3 LYS B 343 -12.733 -10.965 1.503 1.00 0.00 H new ATOM 980 N THR B 344 -8.579 -15.587 -1.029 1.00 0.00 N ATOM 981 CA THR B 344 -7.917 -16.664 -1.752 1.00 0.00 C ATOM 982 C THR B 344 -6.402 -16.632 -1.580 1.00 0.00 C ATOM 983 O THR B 344 -5.732 -17.626 -1.856 1.00 0.00 O ATOM 984 CB THR B 344 -8.262 -16.556 -3.233 1.00 0.00 C ATOM 985 OG1 THR B 344 -7.233 -15.852 -3.905 1.00 0.00 O ATOM 986 CG2 THR B 344 -9.591 -15.815 -3.398 1.00 0.00 C ATOM 0 H THR B 344 -8.368 -14.651 -1.374 1.00 0.00 H new ATOM 0 HA THR B 344 -8.272 -17.609 -1.340 1.00 0.00 H new ATOM 0 HB THR B 344 -8.355 -17.555 -3.660 1.00 0.00 H new ATOM 0 HG1 THR B 344 -7.105 -14.977 -3.482 1.00 0.00 H new ATOM 0 HG21 THR B 344 -9.836 -15.739 -4.457 1.00 0.00 H new ATOM 0 HG22 THR B 344 -10.379 -16.363 -2.882 1.00 0.00 H new ATOM 0 HG23 THR B 344 -9.505 -14.815 -2.973 1.00 0.00 H new ATOM 994 N LYS B 345 -5.863 -15.499 -1.141 1.00 0.00 N ATOM 995 CA LYS B 345 -4.427 -15.376 -0.961 1.00 0.00 C ATOM 996 C LYS B 345 -3.750 -15.175 -2.310 1.00 0.00 C ATOM 997 O LYS B 345 -2.531 -15.023 -2.389 1.00 0.00 O ATOM 998 CB LYS B 345 -3.882 -16.627 -0.288 1.00 0.00 C ATOM 999 CG LYS B 345 -2.660 -16.273 0.564 1.00 0.00 C ATOM 1000 CD LYS B 345 -2.109 -17.544 1.216 1.00 0.00 C ATOM 1001 CE LYS B 345 -1.328 -17.177 2.479 1.00 0.00 C ATOM 1002 NZ LYS B 345 -2.237 -17.237 3.660 1.00 0.00 N1+ ATOM 0 H LYS B 345 -6.396 -14.662 -0.906 1.00 0.00 H new ATOM 0 HA LYS B 345 -4.220 -14.513 -0.329 1.00 0.00 H new ATOM 0 HB2 LYS B 345 -4.653 -17.079 0.337 1.00 0.00 H new ATOM 0 HB3 LYS B 345 -3.609 -17.366 -1.042 1.00 0.00 H new ATOM 0 HG2 LYS B 345 -1.894 -15.807 -0.056 1.00 0.00 H new ATOM 0 HG3 LYS B 345 -2.935 -15.548 1.330 1.00 0.00 H new ATOM 0 HD2 LYS B 345 -2.927 -18.220 1.466 1.00 0.00 H new ATOM 0 HD3 LYS B 345 -1.461 -18.072 0.516 1.00 0.00 H new ATOM 0 HE2 LYS B 345 -0.492 -17.863 2.615 1.00 0.00 H new ATOM 0 HE3 LYS B 345 -0.907 -16.176 2.381 1.00 0.00 H new ATOM 0 HZ1 LYS B 345 -1.707 -16.988 4.519 1.00 0.00 H new ATOM 0 HZ2 LYS B 345 -3.020 -16.566 3.530 1.00 0.00 H new ATOM 0 HZ3 LYS B 345 -2.618 -18.200 3.756 1.00 0.00 H new ATOM 1016 N GLU B 346 -4.554 -15.148 -3.372 1.00 0.00 N ATOM 1017 CA GLU B 346 -4.025 -14.931 -4.703 1.00 0.00 C ATOM 1018 C GLU B 346 -3.836 -13.447 -4.930 1.00 0.00 C ATOM 1019 O GLU B 346 -4.443 -12.619 -4.253 1.00 0.00 O ATOM 1020 CB GLU B 346 -4.977 -15.486 -5.748 1.00 0.00 C ATOM 1021 CG GLU B 346 -6.141 -14.515 -5.947 1.00 0.00 C ATOM 1022 CD GLU B 346 -7.369 -15.261 -6.458 1.00 0.00 C ATOM 1023 OE1 GLU B 346 -7.209 -16.379 -6.919 1.00 0.00 O ATOM 1024 OE2 GLU B 346 -8.451 -14.704 -6.383 1.00 0.00 O1- ATOM 0 H GLU B 346 -5.565 -15.273 -3.330 1.00 0.00 H new ATOM 0 HA GLU B 346 -3.068 -15.445 -4.792 1.00 0.00 H new ATOM 0 HB2 GLU B 346 -4.451 -15.637 -6.691 1.00 0.00 H new ATOM 0 HB3 GLU B 346 -5.352 -16.460 -5.433 1.00 0.00 H new ATOM 0 HG2 GLU B 346 -6.374 -14.018 -5.005 1.00 0.00 H new ATOM 0 HG3 GLU B 346 -5.858 -13.737 -6.656 1.00 0.00 H new ATOM 1031 N VAL B 347 -2.973 -13.119 -5.864 1.00 0.00 N ATOM 1032 CA VAL B 347 -2.684 -11.720 -6.148 1.00 0.00 C ATOM 1033 C VAL B 347 -3.640 -11.129 -7.158 1.00 0.00 C ATOM 1034 O VAL B 347 -3.876 -11.694 -8.227 1.00 0.00 O ATOM 1035 CB VAL B 347 -1.253 -11.548 -6.628 1.00 0.00 C ATOM 1036 CG1 VAL B 347 -1.031 -10.084 -7.024 1.00 0.00 C ATOM 1037 CG2 VAL B 347 -0.322 -11.898 -5.473 1.00 0.00 C ATOM 0 H VAL B 347 -2.461 -13.789 -6.438 1.00 0.00 H new ATOM 0 HA VAL B 347 -2.816 -11.179 -5.211 1.00 0.00 H new ATOM 0 HB VAL B 347 -1.057 -12.192 -7.485 1.00 0.00 H new ATOM 0 HG11 VAL B 347 -0.006 -9.952 -7.370 1.00 0.00 H new ATOM 0 HG12 VAL B 347 -1.721 -9.815 -7.824 1.00 0.00 H new ATOM 0 HG13 VAL B 347 -1.208 -9.443 -6.161 1.00 0.00 H new ATOM 0 HG21 VAL B 347 0.714 -11.782 -5.793 1.00 0.00 H new ATOM 0 HG22 VAL B 347 -0.519 -11.233 -4.632 1.00 0.00 H new ATOM 0 HG23 VAL B 347 -0.494 -12.930 -5.167 1.00 0.00 H new ATOM 1047 N ILE B 348 -4.162 -9.962 -6.815 1.00 0.00 N ATOM 1048 CA ILE B 348 -5.066 -9.258 -7.694 1.00 0.00 C ATOM 1049 C ILE B 348 -4.297 -8.154 -8.388 1.00 0.00 C ATOM 1050 O ILE B 348 -4.617 -7.765 -9.512 1.00 0.00 O ATOM 1051 CB ILE B 348 -6.229 -8.661 -6.898 1.00 0.00 C ATOM 1052 CG1 ILE B 348 -7.020 -9.789 -6.227 1.00 0.00 C ATOM 1053 CG2 ILE B 348 -7.149 -7.885 -7.842 1.00 0.00 C ATOM 1054 CD1 ILE B 348 -7.841 -9.220 -5.067 1.00 0.00 C ATOM 0 H ILE B 348 -3.972 -9.487 -5.933 1.00 0.00 H new ATOM 0 HA ILE B 348 -5.476 -9.951 -8.429 1.00 0.00 H new ATOM 0 HB ILE B 348 -5.839 -7.986 -6.136 1.00 0.00 H new ATOM 0 HG12 ILE B 348 -7.679 -10.266 -6.952 1.00 0.00 H new ATOM 0 HG13 ILE B 348 -6.339 -10.557 -5.861 1.00 0.00 H new ATOM 0 HG21 ILE B 348 -7.977 -7.460 -7.275 1.00 0.00 H new ATOM 0 HG22 ILE B 348 -6.587 -7.083 -8.320 1.00 0.00 H new ATOM 0 HG23 ILE B 348 -7.539 -8.559 -8.605 1.00 0.00 H new ATOM 0 HD11 ILE B 348 -8.403 -10.023 -4.591 1.00 0.00 H new ATOM 0 HD12 ILE B 348 -7.172 -8.763 -4.338 1.00 0.00 H new ATOM 0 HD13 ILE B 348 -8.533 -8.468 -5.446 1.00 0.00 H new ATOM 1066 N GLN B 349 -3.280 -7.637 -7.698 1.00 0.00 N ATOM 1067 CA GLN B 349 -2.486 -6.565 -8.253 1.00 0.00 C ATOM 1068 C GLN B 349 -1.021 -6.733 -7.930 1.00 0.00 C ATOM 1069 O GLN B 349 -0.658 -7.382 -6.956 1.00 0.00 O ATOM 1070 CB GLN B 349 -2.944 -5.274 -7.643 1.00 0.00 C ATOM 1071 CG GLN B 349 -2.185 -4.108 -8.255 1.00 0.00 C ATOM 1072 CD GLN B 349 -2.904 -2.804 -7.939 1.00 0.00 C ATOM 1073 OE1 GLN B 349 -2.433 -2.018 -7.118 1.00 0.00 O ATOM 1074 NE2 GLN B 349 -4.026 -2.520 -8.549 1.00 0.00 N ATOM 0 H GLN B 349 -2.997 -7.945 -6.768 1.00 0.00 H new ATOM 0 HA GLN B 349 -2.610 -6.573 -9.336 1.00 0.00 H new ATOM 0 HB2 GLN B 349 -4.014 -5.146 -7.805 1.00 0.00 H new ATOM 0 HB3 GLN B 349 -2.785 -5.296 -6.565 1.00 0.00 H new ATOM 0 HG2 GLN B 349 -1.168 -4.078 -7.863 1.00 0.00 H new ATOM 0 HG3 GLN B 349 -2.107 -4.239 -9.334 1.00 0.00 H new ATOM 0 HE21 GLN B 349 -4.416 -3.172 -9.230 1.00 0.00 H new ATOM 0 HE22 GLN B 349 -4.511 -1.646 -8.344 1.00 0.00 H new ATOM 1083 N GLU B 350 -0.192 -6.093 -8.737 1.00 0.00 N ATOM 1084 CA GLU B 350 1.246 -6.123 -8.531 1.00 0.00 C ATOM 1085 C GLU B 350 1.877 -4.798 -8.886 1.00 0.00 C ATOM 1086 O GLU B 350 1.404 -4.077 -9.764 1.00 0.00 O ATOM 1087 CB GLU B 350 1.929 -7.182 -9.387 1.00 0.00 C ATOM 1088 CG GLU B 350 1.405 -8.567 -9.036 1.00 0.00 C ATOM 1089 CD GLU B 350 1.945 -9.602 -10.015 1.00 0.00 C ATOM 1090 OE1 GLU B 350 3.020 -10.121 -9.765 1.00 0.00 O1- ATOM 1091 OE2 GLU B 350 1.273 -9.864 -10.999 1.00 0.00 O ATOM 0 H GLU B 350 -0.491 -5.545 -9.543 1.00 0.00 H new ATOM 0 HA GLU B 350 1.385 -6.352 -7.474 1.00 0.00 H new ATOM 0 HB2 GLU B 350 1.751 -6.976 -10.442 1.00 0.00 H new ATOM 0 HB3 GLU B 350 3.007 -7.144 -9.232 1.00 0.00 H new ATOM 0 HG2 GLU B 350 1.701 -8.828 -8.020 1.00 0.00 H new ATOM 0 HG3 GLU B 350 0.315 -8.568 -9.060 1.00 0.00 H new ATOM 1098 N TRP B 351 2.978 -4.510 -8.221 1.00 0.00 N ATOM 1099 CA TRP B 351 3.717 -3.284 -8.499 1.00 0.00 C ATOM 1100 C TRP B 351 5.149 -3.380 -7.998 1.00 0.00 C ATOM 1101 O TRP B 351 5.386 -3.660 -6.833 1.00 0.00 O ATOM 1102 CB TRP B 351 3.019 -2.092 -7.870 1.00 0.00 C ATOM 1103 CG TRP B 351 2.607 -1.156 -8.953 1.00 0.00 C ATOM 1104 CD1 TRP B 351 3.445 -0.566 -9.832 1.00 0.00 C ATOM 1105 CD2 TRP B 351 1.268 -0.709 -9.303 1.00 0.00 C ATOM 1106 NE1 TRP B 351 2.702 0.222 -10.689 1.00 0.00 N ATOM 1107 CE2 TRP B 351 1.361 0.172 -10.403 1.00 0.00 C ATOM 1108 CE3 TRP B 351 -0.003 -0.963 -8.767 1.00 0.00 C ATOM 1109 CZ2 TRP B 351 0.236 0.769 -10.965 1.00 0.00 C ATOM 1110 CZ3 TRP B 351 -1.143 -0.364 -9.333 1.00 0.00 C ATOM 1111 CH2 TRP B 351 -1.020 0.502 -10.428 1.00 0.00 C ATOM 0 H TRP B 351 3.381 -5.098 -7.491 1.00 0.00 H new ATOM 0 HA TRP B 351 3.745 -3.147 -9.580 1.00 0.00 H new ATOM 0 HB2 TRP B 351 2.148 -2.420 -7.302 1.00 0.00 H new ATOM 0 HB3 TRP B 351 3.686 -1.590 -7.169 1.00 0.00 H new ATOM 0 HD1 TRP B 351 4.518 -0.690 -9.860 1.00 0.00 H new ATOM 0 HE1 TRP B 351 3.103 0.776 -11.446 1.00 0.00 H new ATOM 0 HE3 TRP B 351 -0.107 -1.621 -7.917 1.00 0.00 H new ATOM 0 HZ2 TRP B 351 0.337 1.434 -11.810 1.00 0.00 H new ATOM 0 HZ3 TRP B 351 -2.119 -0.573 -8.921 1.00 0.00 H new ATOM 0 HH2 TRP B 351 -1.899 0.962 -10.855 1.00 0.00 H new ATOM 1122 N SER B 352 6.103 -3.150 -8.896 1.00 0.00 N ATOM 1123 CA SER B 352 7.503 -3.237 -8.546 1.00 0.00 C ATOM 1124 C SER B 352 7.799 -2.501 -7.259 1.00 0.00 C ATOM 1125 O SER B 352 7.310 -1.396 -7.024 1.00 0.00 O ATOM 1126 CB SER B 352 8.373 -2.661 -9.652 1.00 0.00 C ATOM 1127 OG SER B 352 7.554 -1.992 -10.601 1.00 0.00 O ATOM 0 H SER B 352 5.924 -2.903 -9.869 1.00 0.00 H new ATOM 0 HA SER B 352 7.732 -4.294 -8.411 1.00 0.00 H new ATOM 0 HB2 SER B 352 9.102 -1.968 -9.232 1.00 0.00 H new ATOM 0 HB3 SER B 352 8.935 -3.458 -10.139 1.00 0.00 H new ATOM 0 HG SER B 352 7.736 -2.345 -11.497 1.00 0.00 H new ATOM 1133 N LEU B 353 8.640 -3.111 -6.451 1.00 0.00 N ATOM 1134 CA LEU B 353 9.056 -2.521 -5.215 1.00 0.00 C ATOM 1135 C LEU B 353 10.187 -1.570 -5.556 1.00 0.00 C ATOM 1136 O LEU B 353 10.304 -0.476 -5.006 1.00 0.00 O ATOM 1137 CB LEU B 353 9.523 -3.647 -4.288 1.00 0.00 C ATOM 1138 CG LEU B 353 9.252 -3.319 -2.821 1.00 0.00 C ATOM 1139 CD1 LEU B 353 9.389 -4.581 -2.002 1.00 0.00 C ATOM 1140 CD2 LEU B 353 10.279 -2.333 -2.315 1.00 0.00 C ATOM 0 H LEU B 353 9.048 -4.026 -6.639 1.00 0.00 H new ATOM 0 HA LEU B 353 8.259 -1.976 -4.709 1.00 0.00 H new ATOM 0 HB2 LEU B 353 9.013 -4.573 -4.554 1.00 0.00 H new ATOM 0 HB3 LEU B 353 10.590 -3.818 -4.432 1.00 0.00 H new ATOM 0 HG LEU B 353 8.250 -2.899 -2.733 1.00 0.00 H new ATOM 0 HD11 LEU B 353 9.197 -4.356 -0.953 1.00 0.00 H new ATOM 0 HD12 LEU B 353 8.670 -5.322 -2.352 1.00 0.00 H new ATOM 0 HD13 LEU B 353 10.399 -4.977 -2.110 1.00 0.00 H new ATOM 0 HD21 LEU B 353 10.079 -2.104 -1.268 1.00 0.00 H new ATOM 0 HD22 LEU B 353 11.275 -2.765 -2.408 1.00 0.00 H new ATOM 0 HD23 LEU B 353 10.225 -1.417 -2.903 1.00 0.00 H new ATOM 1152 N THR B 354 10.982 -1.988 -6.538 1.00 0.00 N ATOM 1153 CA THR B 354 12.080 -1.165 -7.022 1.00 0.00 C ATOM 1154 C THR B 354 11.541 -0.025 -7.856 1.00 0.00 C ATOM 1155 O THR B 354 12.304 0.703 -8.491 1.00 0.00 O ATOM 1156 CB THR B 354 13.041 -2.005 -7.860 1.00 0.00 C ATOM 1157 OG1 THR B 354 14.282 -1.323 -7.983 1.00 0.00 O ATOM 1158 CG2 THR B 354 12.440 -2.229 -9.248 1.00 0.00 C ATOM 0 H THR B 354 10.885 -2.887 -7.010 1.00 0.00 H new ATOM 0 HA THR B 354 12.618 -0.761 -6.164 1.00 0.00 H new ATOM 0 HB THR B 354 13.204 -2.967 -7.375 1.00 0.00 H new ATOM 0 HG1 THR B 354 14.118 -0.382 -8.202 1.00 0.00 H new ATOM 0 HG21 THR B 354 13.124 -2.829 -9.848 1.00 0.00 H new ATOM 0 HG22 THR B 354 11.488 -2.751 -9.152 1.00 0.00 H new ATOM 0 HG23 THR B 354 12.279 -1.267 -9.734 1.00 0.00 H new ATOM 1166 N ASN B 355 10.222 0.143 -7.832 1.00 0.00 N ATOM 1167 CA ASN B 355 9.604 1.227 -8.580 1.00 0.00 C ATOM 1168 C ASN B 355 9.040 2.257 -7.627 1.00 0.00 C ATOM 1169 O ASN B 355 8.598 3.320 -8.044 1.00 0.00 O ATOM 1170 CB ASN B 355 8.481 0.704 -9.473 1.00 0.00 C ATOM 1171 CG ASN B 355 9.070 0.130 -10.757 1.00 0.00 C ATOM 1172 OD1 ASN B 355 10.255 -0.199 -10.802 1.00 0.00 O ATOM 1173 ND2 ASN B 355 8.310 -0.012 -11.808 1.00 0.00 N ATOM 0 H ASN B 355 9.572 -0.447 -7.312 1.00 0.00 H new ATOM 0 HA ASN B 355 10.370 1.683 -9.207 1.00 0.00 H new ATOM 0 HB2 ASN B 355 7.913 -0.063 -8.947 1.00 0.00 H new ATOM 0 HB3 ASN B 355 7.786 1.510 -9.709 1.00 0.00 H new ATOM 0 HD21 ASN B 355 8.698 -0.396 -12.670 1.00 0.00 H new ATOM 0 HD22 ASN B 355 7.328 0.261 -11.768 1.00 0.00 H new ATOM 1180 N ILE B 356 9.054 1.940 -6.341 1.00 0.00 N ATOM 1181 CA ILE B 356 8.519 2.852 -5.357 1.00 0.00 C ATOM 1182 C ILE B 356 9.194 4.221 -5.425 1.00 0.00 C ATOM 1183 O ILE B 356 10.384 4.318 -5.726 1.00 0.00 O ATOM 1184 CB ILE B 356 8.690 2.234 -3.991 1.00 0.00 C ATOM 1185 CG1 ILE B 356 7.774 1.011 -3.898 1.00 0.00 C ATOM 1186 CG2 ILE B 356 8.307 3.263 -2.941 1.00 0.00 C ATOM 1187 CD1 ILE B 356 7.992 0.288 -2.570 1.00 0.00 C ATOM 0 H ILE B 356 9.426 1.068 -5.964 1.00 0.00 H new ATOM 0 HA ILE B 356 7.461 3.018 -5.562 1.00 0.00 H new ATOM 0 HB ILE B 356 9.722 1.926 -3.827 1.00 0.00 H new ATOM 0 HG12 ILE B 356 6.732 1.320 -3.985 1.00 0.00 H new ATOM 0 HG13 ILE B 356 7.976 0.333 -4.727 1.00 0.00 H new ATOM 0 HG21 ILE B 356 8.426 2.831 -1.948 1.00 0.00 H new ATOM 0 HG22 ILE B 356 8.952 4.137 -3.036 1.00 0.00 H new ATOM 0 HG23 ILE B 356 7.269 3.561 -3.085 1.00 0.00 H new ATOM 0 HD11 ILE B 356 7.335 -0.580 -2.516 1.00 0.00 H new ATOM 0 HD12 ILE B 356 9.030 -0.038 -2.499 1.00 0.00 H new ATOM 0 HD13 ILE B 356 7.767 0.965 -1.746 1.00 0.00 H new ATOM 1199 N LYS B 357 8.425 5.279 -5.131 1.00 0.00 N ATOM 1200 CA LYS B 357 8.970 6.637 -5.152 1.00 0.00 C ATOM 1201 C LYS B 357 9.106 7.139 -3.722 1.00 0.00 C ATOM 1202 O LYS B 357 10.141 7.672 -3.323 1.00 0.00 O ATOM 1203 CB LYS B 357 8.066 7.566 -5.978 1.00 0.00 C ATOM 1204 CG LYS B 357 8.920 8.661 -6.622 1.00 0.00 C ATOM 1205 CD LYS B 357 9.480 8.156 -7.954 1.00 0.00 C ATOM 1206 CE LYS B 357 10.831 8.819 -8.227 1.00 0.00 C ATOM 1207 NZ LYS B 357 11.352 8.361 -9.545 1.00 0.00 N1+ ATOM 0 H LYS B 357 7.438 5.220 -4.880 1.00 0.00 H new ATOM 0 HA LYS B 357 9.953 6.630 -5.622 1.00 0.00 H new ATOM 0 HB2 LYS B 357 7.545 6.996 -6.747 1.00 0.00 H new ATOM 0 HB3 LYS B 357 7.303 8.012 -5.340 1.00 0.00 H new ATOM 0 HG2 LYS B 357 8.320 9.557 -6.784 1.00 0.00 H new ATOM 0 HG3 LYS B 357 9.736 8.940 -5.955 1.00 0.00 H new ATOM 0 HD2 LYS B 357 9.595 7.072 -7.924 1.00 0.00 H new ATOM 0 HD3 LYS B 357 8.783 8.381 -8.762 1.00 0.00 H new ATOM 0 HE2 LYS B 357 10.723 9.904 -8.224 1.00 0.00 H new ATOM 0 HE3 LYS B 357 11.538 8.567 -7.437 1.00 0.00 H new ATOM 0 HZ1 LYS B 357 12.271 8.812 -9.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 357 11.470 7.328 -9.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 357 10.680 8.623 -10.294 1.00 0.00 H new ATOM 1221 N ARG B 358 8.062 6.905 -2.947 1.00 0.00 N ATOM 1222 CA ARG B 358 8.045 7.262 -1.541 1.00 0.00 C ATOM 1223 C ARG B 358 6.762 6.710 -0.935 1.00 0.00 C ATOM 1224 O ARG B 358 5.706 6.774 -1.541 1.00 0.00 O ATOM 1225 CB ARG B 358 8.137 8.776 -1.352 1.00 0.00 C ATOM 1226 CG ARG B 358 7.153 9.480 -2.270 1.00 0.00 C ATOM 1227 CD ARG B 358 7.472 10.965 -2.326 1.00 0.00 C ATOM 1228 NE ARG B 358 6.243 11.732 -2.488 1.00 0.00 N ATOM 1229 CZ ARG B 358 6.269 13.041 -2.708 1.00 0.00 C ATOM 1230 NH1 ARG B 358 7.412 13.668 -2.775 1.00 0.00 N ATOM 1231 NH2 ARG B 358 5.153 13.700 -2.859 1.00 0.00 N1+ ATOM 0 H ARG B 358 7.203 6.463 -3.275 1.00 0.00 H new ATOM 0 HA ARG B 358 8.911 6.833 -1.038 1.00 0.00 H new ATOM 0 HB2 ARG B 358 7.926 9.034 -0.314 1.00 0.00 H new ATOM 0 HB3 ARG B 358 9.151 9.115 -1.565 1.00 0.00 H new ATOM 0 HG2 ARG B 358 7.203 9.050 -3.270 1.00 0.00 H new ATOM 0 HG3 ARG B 358 6.135 9.331 -1.910 1.00 0.00 H new ATOM 0 HD2 ARG B 358 7.984 11.270 -1.413 1.00 0.00 H new ATOM 0 HD3 ARG B 358 8.150 11.169 -3.155 1.00 0.00 H new ATOM 0 HE ARG B 358 5.344 11.253 -2.431 1.00 0.00 H new ATOM 0 HH11 ARG B 358 8.284 13.152 -2.658 1.00 0.00 H new ATOM 0 HH12 ARG B 358 7.433 14.674 -2.944 1.00 0.00 H new ATOM 0 HH21 ARG B 358 4.260 13.209 -2.808 1.00 0.00 H new ATOM 0 HH22 ARG B 358 5.173 14.706 -3.028 1.00 0.00 H new ATOM 1245 N TRP B 359 6.871 6.122 0.229 1.00 0.00 N ATOM 1246 CA TRP B 359 5.733 5.510 0.881 1.00 0.00 C ATOM 1247 C TRP B 359 5.470 6.181 2.217 1.00 0.00 C ATOM 1248 O TRP B 359 6.199 7.095 2.601 1.00 0.00 O ATOM 1249 CB TRP B 359 6.018 4.017 1.042 1.00 0.00 C ATOM 1250 CG TRP B 359 7.311 3.812 1.752 1.00 0.00 C ATOM 1251 CD1 TRP B 359 7.435 3.366 3.013 1.00 0.00 C ATOM 1252 CD2 TRP B 359 8.658 4.034 1.265 1.00 0.00 C ATOM 1253 NE1 TRP B 359 8.780 3.293 3.336 1.00 0.00 N ATOM 1254 CE2 TRP B 359 9.574 3.714 2.291 1.00 0.00 C ATOM 1255 CE3 TRP B 359 9.161 4.488 0.047 1.00 0.00 C ATOM 1256 CZ2 TRP B 359 10.952 3.848 2.110 1.00 0.00 C ATOM 1257 CZ3 TRP B 359 10.543 4.624 -0.145 1.00 0.00 C ATOM 1258 CH2 TRP B 359 11.437 4.306 0.887 1.00 0.00 C ATOM 0 H TRP B 359 7.744 6.052 0.752 1.00 0.00 H new ATOM 0 HA TRP B 359 4.833 5.636 0.279 1.00 0.00 H new ATOM 0 HB2 TRP B 359 5.210 3.544 1.600 1.00 0.00 H new ATOM 0 HB3 TRP B 359 6.053 3.539 0.063 1.00 0.00 H new ATOM 0 HD1 TRP B 359 6.618 3.106 3.669 1.00 0.00 H new ATOM 0 HE1 TRP B 359 9.138 2.968 4.234 1.00 0.00 H new ATOM 0 HE3 TRP B 359 8.481 4.737 -0.755 1.00 0.00 H new ATOM 0 HZ2 TRP B 359 11.634 3.599 2.909 1.00 0.00 H new ATOM 0 HZ3 TRP B 359 10.921 4.976 -1.093 1.00 0.00 H new ATOM 0 HH2 TRP B 359 12.500 4.416 0.734 1.00 0.00 H new ATOM 1269 N ALA B 360 4.419 5.768 2.915 1.00 0.00 N ATOM 1270 CA ALA B 360 4.110 6.410 4.180 1.00 0.00 C ATOM 1271 C ALA B 360 3.256 5.534 5.069 1.00 0.00 C ATOM 1272 O ALA B 360 2.036 5.462 4.922 1.00 0.00 O ATOM 1273 CB ALA B 360 3.385 7.721 3.927 1.00 0.00 C ATOM 0 H ALA B 360 3.787 5.017 2.637 1.00 0.00 H new ATOM 0 HA ALA B 360 5.055 6.591 4.693 1.00 0.00 H new ATOM 0 HB1 ALA B 360 3.155 8.199 4.879 1.00 0.00 H new ATOM 0 HB2 ALA B 360 4.020 8.379 3.334 1.00 0.00 H new ATOM 0 HB3 ALA B 360 2.459 7.526 3.386 1.00 0.00 H new ATOM 1279 N ALA B 361 3.919 4.888 5.998 1.00 0.00 N ATOM 1280 CA ALA B 361 3.259 4.022 6.943 1.00 0.00 C ATOM 1281 C ALA B 361 2.649 4.833 8.080 1.00 0.00 C ATOM 1282 O ALA B 361 3.191 5.865 8.476 1.00 0.00 O ATOM 1283 CB ALA B 361 4.248 3.021 7.511 1.00 0.00 C ATOM 0 H ALA B 361 4.930 4.948 6.119 1.00 0.00 H new ATOM 0 HA ALA B 361 2.463 3.491 6.421 1.00 0.00 H new ATOM 0 HB1 ALA B 361 3.740 2.372 8.224 1.00 0.00 H new ATOM 0 HB2 ALA B 361 4.661 2.419 6.702 1.00 0.00 H new ATOM 0 HB3 ALA B 361 5.054 3.553 8.016 1.00 0.00 H new ATOM 1289 N SER B 362 1.524 4.360 8.606 1.00 0.00 N ATOM 1290 CA SER B 362 0.858 5.050 9.701 1.00 0.00 C ATOM 1291 C SER B 362 0.423 4.035 10.760 1.00 0.00 C ATOM 1292 O SER B 362 0.571 2.829 10.560 1.00 0.00 O ATOM 1293 CB SER B 362 -0.347 5.817 9.154 1.00 0.00 C ATOM 1294 OG SER B 362 -1.544 5.196 9.600 1.00 0.00 O ATOM 0 H SER B 362 1.058 3.508 8.294 1.00 0.00 H new ATOM 0 HA SER B 362 1.543 5.759 10.167 1.00 0.00 H new ATOM 0 HB2 SER B 362 -0.315 6.853 9.490 1.00 0.00 H new ATOM 0 HB3 SER B 362 -0.317 5.834 8.065 1.00 0.00 H new ATOM 0 HG SER B 362 -2.310 5.584 9.127 1.00 0.00 H new ATOM 1300 N PRO B 363 -0.083 4.484 11.881 1.00 0.00 N ATOM 1301 CA PRO B 363 -0.523 3.571 12.972 1.00 0.00 C ATOM 1302 C PRO B 363 -1.862 2.919 12.673 1.00 0.00 C ATOM 1303 O PRO B 363 -2.311 2.035 13.397 1.00 0.00 O ATOM 1304 CB PRO B 363 -0.632 4.477 14.196 1.00 0.00 C ATOM 1305 CG PRO B 363 -0.781 5.874 13.682 1.00 0.00 C ATOM 1306 CD PRO B 363 -0.315 5.894 12.224 1.00 0.00 C ATOM 0 HA PRO B 363 0.175 2.745 13.108 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -1.488 4.197 14.810 1.00 0.00 H new ATOM 0 HB3 PRO B 363 0.254 4.388 14.824 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -1.819 6.198 13.755 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -0.189 6.566 14.281 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -1.069 6.340 11.575 1.00 0.00 H new ATOM 0 HD3 PRO B 363 0.594 6.483 12.108 1.00 0.00 H new ATOM 1314 N LYS B 364 -2.497 3.381 11.608 1.00 0.00 N ATOM 1315 CA LYS B 364 -3.799 2.863 11.203 1.00 0.00 C ATOM 1316 C LYS B 364 -3.811 2.513 9.730 1.00 0.00 C ATOM 1317 O LYS B 364 -4.650 1.744 9.269 1.00 0.00 O ATOM 1318 CB LYS B 364 -4.873 3.909 11.449 1.00 0.00 C ATOM 1319 CG LYS B 364 -4.685 4.506 12.839 1.00 0.00 C ATOM 1320 CD LYS B 364 -5.889 5.381 13.192 1.00 0.00 C ATOM 1321 CE LYS B 364 -5.399 6.714 13.759 1.00 0.00 C ATOM 1322 NZ LYS B 364 -4.514 6.460 14.930 1.00 0.00 N1+ ATOM 0 H LYS B 364 -2.132 4.117 11.004 1.00 0.00 H new ATOM 0 HA LYS B 364 -3.995 1.967 11.791 1.00 0.00 H new ATOM 0 HB2 LYS B 364 -4.814 4.692 10.693 1.00 0.00 H new ATOM 0 HB3 LYS B 364 -5.862 3.458 11.365 1.00 0.00 H new ATOM 0 HG2 LYS B 364 -4.574 3.710 13.575 1.00 0.00 H new ATOM 0 HG3 LYS B 364 -3.771 5.099 12.870 1.00 0.00 H new ATOM 0 HD2 LYS B 364 -6.500 5.553 12.306 1.00 0.00 H new ATOM 0 HD3 LYS B 364 -6.520 4.873 13.921 1.00 0.00 H new ATOM 0 HE2 LYS B 364 -4.857 7.270 12.994 1.00 0.00 H new ATOM 0 HE3 LYS B 364 -6.248 7.328 14.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 364 -4.918 6.912 15.775 1.00 0.00 H new ATOM 0 HZ2 LYS B 364 -4.435 5.435 15.090 1.00 0.00 H new ATOM 0 HZ3 LYS B 364 -3.570 6.855 14.744 1.00 0.00 H new ATOM 1336 N SER B 365 -2.886 3.092 8.990 1.00 0.00 N ATOM 1337 CA SER B 365 -2.826 2.841 7.563 1.00 0.00 C ATOM 1338 C SER B 365 -1.429 3.001 7.024 1.00 0.00 C ATOM 1339 O SER B 365 -0.538 3.520 7.691 1.00 0.00 O ATOM 1340 CB SER B 365 -3.762 3.786 6.822 1.00 0.00 C ATOM 1341 OG SER B 365 -3.434 5.130 7.149 1.00 0.00 O ATOM 0 H SER B 365 -2.175 3.731 9.346 1.00 0.00 H new ATOM 0 HA SER B 365 -3.137 1.809 7.403 1.00 0.00 H new ATOM 0 HB2 SER B 365 -3.676 3.631 5.747 1.00 0.00 H new ATOM 0 HB3 SER B 365 -4.797 3.577 7.093 1.00 0.00 H new ATOM 0 HG SER B 365 -4.035 5.739 6.671 1.00 0.00 H new ATOM 1347 N PHE B 366 -1.257 2.544 5.801 1.00 0.00 N ATOM 1348 CA PHE B 366 0.026 2.635 5.148 1.00 0.00 C ATOM 1349 C PHE B 366 -0.188 3.021 3.709 1.00 0.00 C ATOM 1350 O PHE B 366 -1.296 2.885 3.189 1.00 0.00 O ATOM 1351 CB PHE B 366 0.776 1.319 5.313 1.00 0.00 C ATOM 1352 CG PHE B 366 1.532 0.953 4.071 1.00 0.00 C ATOM 1353 CD1 PHE B 366 2.810 1.474 3.855 1.00 0.00 C ATOM 1354 CD2 PHE B 366 0.968 0.059 3.157 1.00 0.00 C ATOM 1355 CE1 PHE B 366 3.530 1.093 2.715 1.00 0.00 C ATOM 1356 CE2 PHE B 366 1.679 -0.315 2.017 1.00 0.00 C ATOM 1357 CZ PHE B 366 2.958 0.197 1.796 1.00 0.00 C ATOM 0 H PHE B 366 -1.990 2.107 5.242 1.00 0.00 H new ATOM 0 HA PHE B 366 0.647 3.407 5.603 1.00 0.00 H new ATOM 0 HB2 PHE B 366 1.469 1.397 6.151 1.00 0.00 H new ATOM 0 HB3 PHE B 366 0.070 0.525 5.556 1.00 0.00 H new ATOM 0 HD1 PHE B 366 3.241 2.167 4.563 1.00 0.00 H new ATOM 0 HD2 PHE B 366 -0.019 -0.342 3.333 1.00 0.00 H new ATOM 0 HE1 PHE B 366 4.521 1.487 2.543 1.00 0.00 H new ATOM 0 HE2 PHE B 366 1.240 -1.000 1.306 1.00 0.00 H new ATOM 0 HZ PHE B 366 3.510 -0.096 0.916 1.00 0.00 H new ATOM 1367 N THR B 367 0.825 3.600 3.091 1.00 0.00 N ATOM 1368 CA THR B 367 0.637 4.098 1.745 1.00 0.00 C ATOM 1369 C THR B 367 1.895 4.030 0.903 1.00 0.00 C ATOM 1370 O THR B 367 3.003 4.028 1.418 1.00 0.00 O ATOM 1371 CB THR B 367 0.167 5.545 1.841 1.00 0.00 C ATOM 1372 OG1 THR B 367 -1.145 5.586 2.384 1.00 0.00 O ATOM 1373 CG2 THR B 367 0.174 6.182 0.460 1.00 0.00 C ATOM 0 H THR B 367 1.756 3.734 3.485 1.00 0.00 H new ATOM 0 HA THR B 367 -0.100 3.465 1.251 1.00 0.00 H new ATOM 0 HB THR B 367 0.842 6.100 2.492 1.00 0.00 H new ATOM 0 HG1 THR B 367 -1.445 6.517 2.446 1.00 0.00 H new ATOM 0 HG21 THR B 367 -0.163 7.216 0.535 1.00 0.00 H new ATOM 0 HG22 THR B 367 1.185 6.158 0.053 1.00 0.00 H new ATOM 0 HG23 THR B 367 -0.495 5.629 -0.199 1.00 0.00 H new ATOM 1381 N LEU B 368 1.687 3.978 -0.405 1.00 0.00 N ATOM 1382 CA LEU B 368 2.773 3.907 -1.360 1.00 0.00 C ATOM 1383 C LEU B 368 2.665 5.002 -2.389 1.00 0.00 C ATOM 1384 O LEU B 368 1.575 5.243 -2.881 1.00 0.00 O ATOM 1385 CB LEU B 368 2.673 2.596 -2.107 1.00 0.00 C ATOM 1386 CG LEU B 368 3.419 1.549 -1.316 1.00 0.00 C ATOM 1387 CD1 LEU B 368 2.855 0.165 -1.644 1.00 0.00 C ATOM 1388 CD2 LEU B 368 4.909 1.622 -1.645 1.00 0.00 C ATOM 0 H LEU B 368 0.760 3.984 -0.829 1.00 0.00 H new ATOM 0 HA LEU B 368 3.711 4.003 -0.813 1.00 0.00 H new ATOM 0 HB2 LEU B 368 1.629 2.307 -2.232 1.00 0.00 H new ATOM 0 HB3 LEU B 368 3.098 2.693 -3.106 1.00 0.00 H new ATOM 0 HG LEU B 368 3.293 1.732 -0.249 1.00 0.00 H new ATOM 0 HD11 LEU B 368 3.393 -0.592 -1.073 1.00 0.00 H new ATOM 0 HD12 LEU B 368 1.797 0.132 -1.383 1.00 0.00 H new ATOM 0 HD13 LEU B 368 2.972 -0.033 -2.709 1.00 0.00 H new ATOM 0 HD21 LEU B 368 5.445 0.865 -1.073 1.00 0.00 H new ATOM 0 HD22 LEU B 368 5.056 1.443 -2.710 1.00 0.00 H new ATOM 0 HD23 LEU B 368 5.291 2.610 -1.387 1.00 0.00 H new ATOM 1400 N ASP B 369 3.792 5.608 -2.778 1.00 0.00 N ATOM 1401 CA ASP B 369 3.738 6.611 -3.824 1.00 0.00 C ATOM 1402 C ASP B 369 4.549 6.173 -5.021 1.00 0.00 C ATOM 1403 O ASP B 369 5.753 6.402 -5.093 1.00 0.00 O ATOM 1404 CB ASP B 369 4.283 7.955 -3.363 1.00 0.00 C ATOM 1405 CG ASP B 369 3.737 9.064 -4.248 1.00 0.00 C ATOM 1406 OD1 ASP B 369 3.746 8.883 -5.454 1.00 0.00 O1- ATOM 1407 OD2 ASP B 369 3.320 10.076 -3.711 1.00 0.00 O ATOM 0 H ASP B 369 4.719 5.424 -2.394 1.00 0.00 H new ATOM 0 HA ASP B 369 2.686 6.722 -4.086 1.00 0.00 H new ATOM 0 HB2 ASP B 369 4.003 8.135 -2.325 1.00 0.00 H new ATOM 0 HB3 ASP B 369 5.372 7.949 -3.403 1.00 0.00 H new ATOM 1412 N PHE B 370 3.863 5.584 -5.971 1.00 0.00 N ATOM 1413 CA PHE B 370 4.511 5.189 -7.220 1.00 0.00 C ATOM 1414 C PHE B 370 3.653 5.505 -8.427 1.00 0.00 C ATOM 1415 O PHE B 370 2.806 4.704 -8.826 1.00 0.00 O ATOM 1416 CB PHE B 370 4.848 3.712 -7.278 1.00 0.00 C ATOM 1417 CG PHE B 370 5.344 3.398 -8.681 1.00 0.00 C ATOM 1418 CD1 PHE B 370 6.439 4.100 -9.219 1.00 0.00 C ATOM 1419 CD2 PHE B 370 4.702 2.424 -9.456 1.00 0.00 C ATOM 1420 CE1 PHE B 370 6.885 3.825 -10.515 1.00 0.00 C ATOM 1421 CE2 PHE B 370 5.157 2.151 -10.757 1.00 0.00 C ATOM 1422 CZ PHE B 370 6.246 2.853 -11.284 1.00 0.00 C ATOM 0 H PHE B 370 2.868 5.365 -5.915 1.00 0.00 H new ATOM 0 HA PHE B 370 5.434 5.769 -7.243 1.00 0.00 H new ATOM 0 HB2 PHE B 370 5.611 3.466 -6.540 1.00 0.00 H new ATOM 0 HB3 PHE B 370 3.970 3.111 -7.041 1.00 0.00 H new ATOM 0 HD1 PHE B 370 6.937 4.854 -8.628 1.00 0.00 H new ATOM 0 HD2 PHE B 370 3.858 1.883 -9.054 1.00 0.00 H new ATOM 0 HE1 PHE B 370 7.726 4.367 -10.922 1.00 0.00 H new ATOM 0 HE2 PHE B 370 4.664 1.396 -11.352 1.00 0.00 H new ATOM 0 HZ PHE B 370 6.592 2.642 -12.285 1.00 0.00 H new ATOM 1432 N GLY B 371 3.897 6.660 -9.025 1.00 0.00 N ATOM 1433 CA GLY B 371 3.155 7.056 -10.218 1.00 0.00 C ATOM 1434 C GLY B 371 2.648 8.474 -10.084 1.00 0.00 C ATOM 1435 O GLY B 371 1.799 8.921 -10.846 1.00 0.00 O ATOM 0 H GLY B 371 4.594 7.335 -8.711 1.00 0.00 H new ATOM 0 HA2 GLY B 371 3.797 6.975 -11.095 1.00 0.00 H new ATOM 0 HA3 GLY B 371 2.316 6.377 -10.373 1.00 0.00 H new ATOM 1439 N ASP B 372 3.161 9.155 -9.080 1.00 0.00 N ATOM 1440 CA ASP B 372 2.757 10.528 -8.805 1.00 0.00 C ATOM 1441 C ASP B 372 2.621 11.342 -10.079 1.00 0.00 C ATOM 1442 O ASP B 372 1.995 12.402 -10.077 1.00 0.00 O ATOM 1443 CB ASP B 372 3.785 11.189 -7.891 1.00 0.00 C ATOM 1444 CG ASP B 372 3.196 12.438 -7.247 1.00 0.00 C ATOM 1445 OD1 ASP B 372 2.675 13.267 -7.975 1.00 0.00 O1- ATOM 1446 OD2 ASP B 372 3.275 12.549 -6.035 1.00 0.00 O ATOM 0 H ASP B 372 3.860 8.784 -8.437 1.00 0.00 H new ATOM 0 HA ASP B 372 1.782 10.497 -8.319 1.00 0.00 H new ATOM 0 HB2 ASP B 372 4.099 10.487 -7.118 1.00 0.00 H new ATOM 0 HB3 ASP B 372 4.675 11.452 -8.463 1.00 0.00 H new ATOM 1451 N TYR B 373 3.179 10.846 -11.167 1.00 0.00 N ATOM 1452 CA TYR B 373 3.067 11.550 -12.420 1.00 0.00 C ATOM 1453 C TYR B 373 1.602 11.795 -12.692 1.00 0.00 C ATOM 1454 O TYR B 373 1.196 12.858 -13.156 1.00 0.00 O ATOM 1455 CB TYR B 373 3.692 10.710 -13.522 1.00 0.00 C ATOM 1456 CG TYR B 373 4.828 9.915 -12.929 1.00 0.00 C ATOM 1457 CD1 TYR B 373 5.918 10.581 -12.365 1.00 0.00 C ATOM 1458 CD2 TYR B 373 4.795 8.518 -12.947 1.00 0.00 C ATOM 1459 CE1 TYR B 373 6.980 9.852 -11.817 1.00 0.00 C ATOM 1460 CE2 TYR B 373 5.860 7.785 -12.403 1.00 0.00 C ATOM 1461 CZ TYR B 373 6.953 8.454 -11.839 1.00 0.00 C ATOM 1462 OH TYR B 373 8.003 7.735 -11.304 1.00 0.00 O ATOM 0 H TYR B 373 3.705 9.973 -11.205 1.00 0.00 H new ATOM 0 HA TYR B 373 3.590 12.505 -12.381 1.00 0.00 H new ATOM 0 HB2 TYR B 373 2.949 10.042 -13.958 1.00 0.00 H new ATOM 0 HB3 TYR B 373 4.056 11.350 -14.326 1.00 0.00 H new ATOM 0 HD1 TYR B 373 5.942 11.661 -12.352 1.00 0.00 H new ATOM 0 HD2 TYR B 373 3.950 8.003 -13.380 1.00 0.00 H new ATOM 0 HE1 TYR B 373 7.820 10.369 -11.377 1.00 0.00 H new ATOM 0 HE2 TYR B 373 5.837 6.705 -12.419 1.00 0.00 H new ATOM 0 HH TYR B 373 7.825 6.776 -11.400 1.00 0.00 H new ATOM 1472 N GLN B 374 0.819 10.804 -12.326 1.00 0.00 N ATOM 1473 CA GLN B 374 -0.620 10.876 -12.444 1.00 0.00 C ATOM 1474 C GLN B 374 -1.197 10.568 -11.078 1.00 0.00 C ATOM 1475 O GLN B 374 -1.277 11.439 -10.214 1.00 0.00 O ATOM 1476 CB GLN B 374 -1.119 9.858 -13.465 1.00 0.00 C ATOM 1477 CG GLN B 374 -0.229 8.611 -13.431 1.00 0.00 C ATOM 1478 CD GLN B 374 -1.049 7.381 -13.813 1.00 0.00 C ATOM 1479 OE1 GLN B 374 -2.184 7.227 -13.363 1.00 0.00 O ATOM 1480 NE2 GLN B 374 -0.540 6.493 -14.624 1.00 0.00 N ATOM 0 H GLN B 374 1.163 9.925 -11.938 1.00 0.00 H new ATOM 0 HA GLN B 374 -0.929 11.865 -12.782 1.00 0.00 H new ATOM 0 HB2 GLN B 374 -2.151 9.585 -13.246 1.00 0.00 H new ATOM 0 HB3 GLN B 374 -1.110 10.296 -14.463 1.00 0.00 H new ATOM 0 HG2 GLN B 374 0.607 8.731 -14.120 1.00 0.00 H new ATOM 0 HG3 GLN B 374 0.195 8.482 -12.435 1.00 0.00 H new ATOM 0 HE21 GLN B 374 0.401 6.622 -14.996 1.00 0.00 H new ATOM 0 HE22 GLN B 374 -1.083 5.670 -14.885 1.00 0.00 H new ATOM 1489 N ASP B 375 -1.497 9.301 -10.865 1.00 0.00 N ATOM 1490 CA ASP B 375 -1.946 8.849 -9.572 1.00 0.00 C ATOM 1491 C ASP B 375 -1.106 7.653 -9.183 1.00 0.00 C ATOM 1492 O ASP B 375 -1.371 6.525 -9.596 1.00 0.00 O ATOM 1493 CB ASP B 375 -3.417 8.465 -9.627 1.00 0.00 C ATOM 1494 CG ASP B 375 -4.035 8.567 -8.236 1.00 0.00 C ATOM 1495 OD1 ASP B 375 -3.974 7.589 -7.510 1.00 0.00 O ATOM 1496 OD2 ASP B 375 -4.560 9.621 -7.919 1.00 0.00 O1- ATOM 0 H ASP B 375 -1.436 8.570 -11.574 1.00 0.00 H new ATOM 0 HA ASP B 375 -1.837 9.645 -8.835 1.00 0.00 H new ATOM 0 HB2 ASP B 375 -3.947 9.120 -10.318 1.00 0.00 H new ATOM 0 HB3 ASP B 375 -3.522 7.449 -10.007 1.00 0.00 H new ATOM 1501 N GLY B 376 -0.082 7.918 -8.409 1.00 0.00 N ATOM 1502 CA GLY B 376 0.828 6.869 -7.976 1.00 0.00 C ATOM 1503 C GLY B 376 0.551 6.419 -6.555 1.00 0.00 C ATOM 1504 O GLY B 376 1.242 5.549 -6.027 1.00 0.00 O ATOM 0 H GLY B 376 0.148 8.849 -8.062 1.00 0.00 H new ATOM 0 HA2 GLY B 376 0.742 6.016 -8.649 1.00 0.00 H new ATOM 0 HA3 GLY B 376 1.854 7.229 -8.047 1.00 0.00 H new ATOM 1508 N TYR B 377 -0.395 7.070 -5.916 1.00 0.00 N ATOM 1509 CA TYR B 377 -0.675 6.783 -4.520 1.00 0.00 C ATOM 1510 C TYR B 377 -1.603 5.607 -4.306 1.00 0.00 C ATOM 1511 O TYR B 377 -2.817 5.714 -4.478 1.00 0.00 O ATOM 1512 CB TYR B 377 -1.250 8.016 -3.855 1.00 0.00 C ATOM 1513 CG TYR B 377 -0.748 9.226 -4.597 1.00 0.00 C ATOM 1514 CD1 TYR B 377 0.594 9.289 -4.995 1.00 0.00 C ATOM 1515 CD2 TYR B 377 -1.623 10.269 -4.911 1.00 0.00 C ATOM 1516 CE1 TYR B 377 1.059 10.394 -5.705 1.00 0.00 C ATOM 1517 CE2 TYR B 377 -1.156 11.382 -5.619 1.00 0.00 C ATOM 1518 CZ TYR B 377 0.186 11.444 -6.018 1.00 0.00 C ATOM 1519 OH TYR B 377 0.642 12.538 -6.723 1.00 0.00 O ATOM 0 H TYR B 377 -0.980 7.795 -6.332 1.00 0.00 H new ATOM 0 HA TYR B 377 0.277 6.504 -4.067 1.00 0.00 H new ATOM 0 HB2 TYR B 377 -2.339 7.984 -3.872 1.00 0.00 H new ATOM 0 HB3 TYR B 377 -0.949 8.059 -2.808 1.00 0.00 H new ATOM 0 HD1 TYR B 377 1.268 8.481 -4.751 1.00 0.00 H new ATOM 0 HD2 TYR B 377 -2.658 10.216 -4.608 1.00 0.00 H new ATOM 0 HE1 TYR B 377 2.093 10.441 -6.014 1.00 0.00 H new ATOM 0 HE2 TYR B 377 -1.829 12.192 -5.858 1.00 0.00 H new ATOM 0 HH TYR B 377 -0.094 13.172 -6.855 1.00 0.00 H new ATOM 1529 N TYR B 378 -1.015 4.509 -3.848 1.00 0.00 N ATOM 1530 CA TYR B 378 -1.798 3.322 -3.510 1.00 0.00 C ATOM 1531 C TYR B 378 -1.705 3.086 -2.016 1.00 0.00 C ATOM 1532 O TYR B 378 -0.610 2.949 -1.469 1.00 0.00 O ATOM 1533 CB TYR B 378 -1.311 2.093 -4.265 1.00 0.00 C ATOM 1534 CG TYR B 378 -2.291 1.794 -5.371 1.00 0.00 C ATOM 1535 CD1 TYR B 378 -3.589 1.365 -5.059 1.00 0.00 C ATOM 1536 CD2 TYR B 378 -1.910 1.954 -6.706 1.00 0.00 C ATOM 1537 CE1 TYR B 378 -4.503 1.094 -6.085 1.00 0.00 C ATOM 1538 CE2 TYR B 378 -2.822 1.684 -7.731 1.00 0.00 C ATOM 1539 CZ TYR B 378 -4.119 1.254 -7.421 1.00 0.00 C ATOM 1540 OH TYR B 378 -5.017 0.987 -8.434 1.00 0.00 O ATOM 0 H TYR B 378 -0.010 4.413 -3.702 1.00 0.00 H new ATOM 0 HA TYR B 378 -2.834 3.493 -3.802 1.00 0.00 H new ATOM 0 HB2 TYR B 378 -0.317 2.270 -4.677 1.00 0.00 H new ATOM 0 HB3 TYR B 378 -1.229 1.241 -3.590 1.00 0.00 H new ATOM 0 HD1 TYR B 378 -3.884 1.244 -4.027 1.00 0.00 H new ATOM 0 HD2 TYR B 378 -0.911 2.286 -6.946 1.00 0.00 H new ATOM 0 HE1 TYR B 378 -5.502 0.762 -5.845 1.00 0.00 H new ATOM 0 HE2 TYR B 378 -2.526 1.807 -8.762 1.00 0.00 H new ATOM 0 HH TYR B 378 -4.590 1.150 -9.301 1.00 0.00 H new ATOM 1550 N SER B 379 -2.851 3.099 -1.352 1.00 0.00 N ATOM 1551 CA SER B 379 -2.869 2.942 0.088 1.00 0.00 C ATOM 1552 C SER B 379 -3.980 2.045 0.566 1.00 0.00 C ATOM 1553 O SER B 379 -4.946 1.777 -0.147 1.00 0.00 O ATOM 1554 CB SER B 379 -3.039 4.298 0.745 1.00 0.00 C ATOM 1555 OG SER B 379 -2.985 4.137 2.150 1.00 0.00 O ATOM 0 H SER B 379 -3.768 3.215 -1.784 1.00 0.00 H new ATOM 0 HA SER B 379 -1.920 2.481 0.364 1.00 0.00 H new ATOM 0 HB2 SER B 379 -2.255 4.978 0.413 1.00 0.00 H new ATOM 0 HB3 SER B 379 -3.991 4.742 0.453 1.00 0.00 H new ATOM 0 HG SER B 379 -2.051 4.160 2.446 1.00 0.00 H new ATOM 1561 N VAL B 380 -3.833 1.611 1.807 1.00 0.00 N ATOM 1562 CA VAL B 380 -4.817 0.767 2.427 1.00 0.00 C ATOM 1563 C VAL B 380 -4.826 0.993 3.935 1.00 0.00 C ATOM 1564 O VAL B 380 -3.994 1.740 4.451 1.00 0.00 O ATOM 1565 CB VAL B 380 -4.458 -0.669 2.141 1.00 0.00 C ATOM 1566 CG1 VAL B 380 -4.948 -1.083 0.760 1.00 0.00 C ATOM 1567 CG2 VAL B 380 -2.939 -0.809 2.207 1.00 0.00 C ATOM 0 H VAL B 380 -3.034 1.836 2.400 1.00 0.00 H new ATOM 0 HA VAL B 380 -5.805 1.001 2.031 1.00 0.00 H new ATOM 0 HB VAL B 380 -4.934 -1.314 2.879 1.00 0.00 H new ATOM 0 HG11 VAL B 380 -4.678 -2.123 0.575 1.00 0.00 H new ATOM 0 HG12 VAL B 380 -6.032 -0.975 0.711 1.00 0.00 H new ATOM 0 HG13 VAL B 380 -4.486 -0.448 0.004 1.00 0.00 H new ATOM 0 HG21 VAL B 380 -2.660 -1.843 2.003 1.00 0.00 H new ATOM 0 HG22 VAL B 380 -2.481 -0.156 1.465 1.00 0.00 H new ATOM 0 HG23 VAL B 380 -2.591 -0.529 3.201 1.00 0.00 H new ATOM 1577 N GLN B 381 -5.754 0.345 4.647 1.00 0.00 N ATOM 1578 CA GLN B 381 -5.814 0.504 6.095 1.00 0.00 C ATOM 1579 C GLN B 381 -5.192 -0.683 6.791 1.00 0.00 C ATOM 1580 O GLN B 381 -5.565 -1.833 6.579 1.00 0.00 O ATOM 1581 CB GLN B 381 -7.247 0.650 6.556 1.00 0.00 C ATOM 1582 CG GLN B 381 -7.366 1.774 7.577 1.00 0.00 C ATOM 1583 CD GLN B 381 -8.832 1.997 7.932 1.00 0.00 C ATOM 1584 OE1 GLN B 381 -9.469 2.909 7.405 1.00 0.00 O ATOM 1585 NE2 GLN B 381 -9.412 1.210 8.798 1.00 0.00 N ATOM 0 H GLN B 381 -6.457 -0.280 4.252 1.00 0.00 H new ATOM 0 HA GLN B 381 -5.256 1.405 6.352 1.00 0.00 H new ATOM 0 HB2 GLN B 381 -7.891 0.857 5.701 1.00 0.00 H new ATOM 0 HB3 GLN B 381 -7.591 -0.286 6.995 1.00 0.00 H new ATOM 0 HG2 GLN B 381 -6.799 1.524 8.474 1.00 0.00 H new ATOM 0 HG3 GLN B 381 -6.937 2.691 7.174 1.00 0.00 H new ATOM 0 HE21 GLN B 381 -8.884 0.454 9.234 1.00 0.00 H new ATOM 0 HE22 GLN B 381 -10.393 1.351 9.038 1.00 0.00 H new ATOM 1594 N THR B 382 -4.243 -0.368 7.631 1.00 0.00 N ATOM 1595 CA THR B 382 -3.534 -1.371 8.408 1.00 0.00 C ATOM 1596 C THR B 382 -2.973 -0.743 9.669 1.00 0.00 C ATOM 1597 O THR B 382 -2.410 0.349 9.620 1.00 0.00 O ATOM 1598 CB THR B 382 -2.407 -1.981 7.585 1.00 0.00 C ATOM 1599 OG1 THR B 382 -1.428 -2.523 8.458 1.00 0.00 O ATOM 1600 CG2 THR B 382 -1.769 -0.911 6.704 1.00 0.00 C ATOM 0 H THR B 382 -3.933 0.589 7.802 1.00 0.00 H new ATOM 0 HA THR B 382 -4.233 -2.162 8.681 1.00 0.00 H new ATOM 0 HB THR B 382 -2.811 -2.771 6.951 1.00 0.00 H new ATOM 0 HG1 THR B 382 -0.543 -2.188 8.205 1.00 0.00 H new ATOM 0 HG21 THR B 382 -0.964 -1.355 6.118 1.00 0.00 H new ATOM 0 HG22 THR B 382 -2.521 -0.497 6.032 1.00 0.00 H new ATOM 0 HG23 THR B 382 -1.366 -0.116 7.331 1.00 0.00 H new ATOM 1608 N THR B 383 -3.104 -1.422 10.792 1.00 0.00 N ATOM 1609 CA THR B 383 -2.582 -0.873 12.029 1.00 0.00 C ATOM 1610 C THR B 383 -1.126 -1.246 12.222 1.00 0.00 C ATOM 1611 O THR B 383 -0.561 -1.077 13.304 1.00 0.00 O ATOM 1612 CB THR B 383 -3.442 -1.293 13.210 1.00 0.00 C ATOM 1613 OG1 THR B 383 -3.998 -2.578 12.964 1.00 0.00 O ATOM 1614 CG2 THR B 383 -4.552 -0.255 13.342 1.00 0.00 C ATOM 0 H THR B 383 -3.556 -2.333 10.875 1.00 0.00 H new ATOM 0 HA THR B 383 -2.625 0.214 11.967 1.00 0.00 H new ATOM 0 HB THR B 383 -2.855 -1.349 14.127 1.00 0.00 H new ATOM 0 HG1 THR B 383 -4.550 -2.847 13.727 1.00 0.00 H new ATOM 0 HG21 THR B 383 -5.197 -0.517 14.181 1.00 0.00 H new ATOM 0 HG22 THR B 383 -4.113 0.727 13.515 1.00 0.00 H new ATOM 0 HG23 THR B 383 -5.141 -0.233 12.425 1.00 0.00 H new ATOM 1622 N GLU B 384 -0.504 -1.661 11.130 1.00 0.00 N ATOM 1623 CA GLU B 384 0.921 -1.949 11.142 1.00 0.00 C ATOM 1624 C GLU B 384 1.521 -1.532 9.805 1.00 0.00 C ATOM 1625 O GLU B 384 1.714 -2.340 8.896 1.00 0.00 O ATOM 1626 CB GLU B 384 1.189 -3.442 11.391 1.00 0.00 C ATOM 1627 CG GLU B 384 -0.088 -4.128 11.884 1.00 0.00 C ATOM 1628 CD GLU B 384 0.171 -5.614 12.111 1.00 0.00 C ATOM 1629 OE1 GLU B 384 0.351 -6.320 11.133 1.00 0.00 O ATOM 1630 OE2 GLU B 384 0.185 -6.023 13.259 1.00 0.00 O1- ATOM 0 H GLU B 384 -0.960 -1.805 10.229 1.00 0.00 H new ATOM 0 HA GLU B 384 1.383 -1.388 11.954 1.00 0.00 H new ATOM 0 HB2 GLU B 384 1.535 -3.916 10.472 1.00 0.00 H new ATOM 0 HB3 GLU B 384 1.983 -3.559 12.129 1.00 0.00 H new ATOM 0 HG2 GLU B 384 -0.425 -3.664 12.811 1.00 0.00 H new ATOM 0 HG3 GLU B 384 -0.886 -3.997 11.153 1.00 0.00 H new ATOM 1637 N GLY B 385 1.842 -0.258 9.712 1.00 0.00 N ATOM 1638 CA GLY B 385 2.458 0.281 8.517 1.00 0.00 C ATOM 1639 C GLY B 385 3.962 0.101 8.576 1.00 0.00 C ATOM 1640 O GLY B 385 4.566 -0.515 7.709 1.00 0.00 O ATOM 0 H GLY B 385 1.686 0.426 10.453 1.00 0.00 H new ATOM 0 HA2 GLY B 385 2.059 -0.221 7.635 1.00 0.00 H new ATOM 0 HA3 GLY B 385 2.215 1.339 8.419 1.00 0.00 H new ATOM 1644 N GLU B 386 4.550 0.676 9.615 1.00 0.00 N ATOM 1645 CA GLU B 386 5.992 0.623 9.819 1.00 0.00 C ATOM 1646 C GLU B 386 6.523 -0.767 9.571 1.00 0.00 C ATOM 1647 O GLU B 386 7.696 -0.955 9.303 1.00 0.00 O ATOM 1648 CB GLU B 386 6.318 1.036 11.245 1.00 0.00 C ATOM 1649 CG GLU B 386 5.397 0.292 12.210 1.00 0.00 C ATOM 1650 CD GLU B 386 5.752 0.653 13.648 1.00 0.00 C ATOM 1651 OE1 GLU B 386 6.821 0.264 14.090 1.00 0.00 O1- ATOM 1652 OE2 GLU B 386 4.952 1.317 14.287 1.00 0.00 O ATOM 0 H GLU B 386 4.045 1.190 10.337 1.00 0.00 H new ATOM 0 HA GLU B 386 6.463 1.306 9.113 1.00 0.00 H new ATOM 0 HB2 GLU B 386 7.360 0.810 11.472 1.00 0.00 H new ATOM 0 HB3 GLU B 386 6.192 2.112 11.362 1.00 0.00 H new ATOM 0 HG2 GLU B 386 4.358 0.551 12.007 1.00 0.00 H new ATOM 0 HG3 GLU B 386 5.493 -0.784 12.062 1.00 0.00 H new ATOM 1659 N GLN B 387 5.646 -1.730 9.647 1.00 0.00 N ATOM 1660 CA GLN B 387 6.045 -3.108 9.414 1.00 0.00 C ATOM 1661 C GLN B 387 6.074 -3.368 7.930 1.00 0.00 C ATOM 1662 O GLN B 387 6.968 -4.027 7.413 1.00 0.00 O ATOM 1663 CB GLN B 387 5.073 -4.069 10.094 1.00 0.00 C ATOM 1664 CG GLN B 387 5.106 -3.856 11.608 1.00 0.00 C ATOM 1665 CD GLN B 387 4.548 -5.086 12.316 1.00 0.00 C ATOM 1666 OE1 GLN B 387 5.215 -5.669 13.169 1.00 0.00 O ATOM 1667 NE2 GLN B 387 3.354 -5.518 12.009 1.00 0.00 N ATOM 0 H GLN B 387 4.658 -1.598 9.865 1.00 0.00 H new ATOM 0 HA GLN B 387 7.037 -3.270 9.836 1.00 0.00 H new ATOM 0 HB2 GLN B 387 4.063 -3.906 9.717 1.00 0.00 H new ATOM 0 HB3 GLN B 387 5.340 -5.099 9.857 1.00 0.00 H new ATOM 0 HG2 GLN B 387 6.129 -3.669 11.936 1.00 0.00 H new ATOM 0 HG3 GLN B 387 4.521 -2.976 11.873 1.00 0.00 H new ATOM 0 HE21 GLN B 387 2.802 -5.033 11.301 1.00 0.00 H new ATOM 0 HE22 GLN B 387 2.973 -6.340 12.477 1.00 0.00 H new ATOM 1676 N ILE B 388 5.099 -2.807 7.257 1.00 0.00 N ATOM 1677 CA ILE B 388 5.000 -2.920 5.815 1.00 0.00 C ATOM 1678 C ILE B 388 6.007 -1.986 5.160 1.00 0.00 C ATOM 1679 O ILE B 388 6.646 -2.318 4.161 1.00 0.00 O ATOM 1680 CB ILE B 388 3.605 -2.489 5.389 1.00 0.00 C ATOM 1681 CG1 ILE B 388 2.585 -3.559 5.756 1.00 0.00 C ATOM 1682 CG2 ILE B 388 3.575 -2.260 3.881 1.00 0.00 C ATOM 1683 CD1 ILE B 388 1.191 -2.934 5.733 1.00 0.00 C ATOM 0 H ILE B 388 4.353 -2.261 7.687 1.00 0.00 H new ATOM 0 HA ILE B 388 5.198 -3.949 5.515 1.00 0.00 H new ATOM 0 HB ILE B 388 3.353 -1.564 5.907 1.00 0.00 H new ATOM 0 HG12 ILE B 388 2.639 -4.390 5.052 1.00 0.00 H new ATOM 0 HG13 ILE B 388 2.801 -3.964 6.744 1.00 0.00 H new ATOM 0 HG21 ILE B 388 2.574 -1.951 3.580 1.00 0.00 H new ATOM 0 HG22 ILE B 388 4.290 -1.481 3.617 1.00 0.00 H new ATOM 0 HG23 ILE B 388 3.840 -3.184 3.367 1.00 0.00 H new ATOM 0 HD11 ILE B 388 0.449 -3.689 5.994 1.00 0.00 H new ATOM 0 HD12 ILE B 388 1.147 -2.117 6.453 1.00 0.00 H new ATOM 0 HD13 ILE B 388 0.981 -2.549 4.735 1.00 0.00 H new ATOM 1695 N ALA B 389 6.089 -0.792 5.723 1.00 0.00 N ATOM 1696 CA ALA B 389 6.954 0.262 5.208 1.00 0.00 C ATOM 1697 C ALA B 389 8.429 0.029 5.491 1.00 0.00 C ATOM 1698 O ALA B 389 9.261 0.282 4.633 1.00 0.00 O ATOM 1699 CB ALA B 389 6.546 1.580 5.840 1.00 0.00 C ATOM 0 H ALA B 389 5.558 -0.524 6.551 1.00 0.00 H new ATOM 0 HA ALA B 389 6.831 0.271 4.125 1.00 0.00 H new ATOM 0 HB1 ALA B 389 7.186 2.378 5.463 1.00 0.00 H new ATOM 0 HB2 ALA B 389 5.508 1.798 5.589 1.00 0.00 H new ATOM 0 HB3 ALA B 389 6.651 1.512 6.923 1.00 0.00 H new ATOM 1705 N GLN B 390 8.765 -0.412 6.694 1.00 0.00 N ATOM 1706 CA GLN B 390 10.182 -0.597 7.025 1.00 0.00 C ATOM 1707 C GLN B 390 10.806 -1.659 6.161 1.00 0.00 C ATOM 1708 O GLN B 390 11.981 -1.599 5.797 1.00 0.00 O ATOM 1709 CB GLN B 390 10.354 -1.004 8.479 1.00 0.00 C ATOM 1710 CG GLN B 390 9.768 -2.402 8.698 1.00 0.00 C ATOM 1711 CD GLN B 390 10.830 -3.467 8.433 1.00 0.00 C ATOM 1712 OE1 GLN B 390 12.004 -3.271 8.749 1.00 0.00 O ATOM 1713 NE2 GLN B 390 10.485 -4.594 7.875 1.00 0.00 N ATOM 0 H GLN B 390 8.107 -0.643 7.438 1.00 0.00 H new ATOM 0 HA GLN B 390 10.676 0.358 6.848 1.00 0.00 H new ATOM 0 HB2 GLN B 390 11.411 -0.997 8.746 1.00 0.00 H new ATOM 0 HB3 GLN B 390 9.856 -0.285 9.129 1.00 0.00 H new ATOM 0 HG2 GLN B 390 9.398 -2.493 9.719 1.00 0.00 H new ATOM 0 HG3 GLN B 390 8.916 -2.555 8.036 1.00 0.00 H new ATOM 0 HE21 GLN B 390 9.513 -4.757 7.613 1.00 0.00 H new ATOM 0 HE22 GLN B 390 11.187 -5.313 7.700 1.00 0.00 H new ATOM 1722 N LEU B 391 10.001 -2.631 5.858 1.00 0.00 N ATOM 1723 CA LEU B 391 10.418 -3.748 5.045 1.00 0.00 C ATOM 1724 C LEU B 391 10.526 -3.288 3.604 1.00 0.00 C ATOM 1725 O LEU B 391 11.579 -3.405 2.980 1.00 0.00 O ATOM 1726 CB LEU B 391 9.398 -4.858 5.277 1.00 0.00 C ATOM 1727 CG LEU B 391 8.568 -5.200 4.034 1.00 0.00 C ATOM 1728 CD1 LEU B 391 9.419 -5.959 3.006 1.00 0.00 C ATOM 1729 CD2 LEU B 391 7.401 -6.065 4.486 1.00 0.00 C ATOM 0 H LEU B 391 9.030 -2.678 6.166 1.00 0.00 H new ATOM 0 HA LEU B 391 11.403 -4.136 5.306 1.00 0.00 H new ATOM 0 HB2 LEU B 391 9.919 -5.754 5.613 1.00 0.00 H new ATOM 0 HB3 LEU B 391 8.726 -4.560 6.081 1.00 0.00 H new ATOM 0 HG LEU B 391 8.211 -4.287 3.558 1.00 0.00 H new ATOM 0 HD11 LEU B 391 8.811 -6.192 2.132 1.00 0.00 H new ATOM 0 HD12 LEU B 391 10.265 -5.340 2.706 1.00 0.00 H new ATOM 0 HD13 LEU B 391 9.786 -6.884 3.450 1.00 0.00 H new ATOM 0 HD21 LEU B 391 6.788 -6.328 3.624 1.00 0.00 H new ATOM 0 HD22 LEU B 391 7.781 -6.974 4.952 1.00 0.00 H new ATOM 0 HD23 LEU B 391 6.797 -5.514 5.207 1.00 0.00 H new ATOM 1741 N ILE B 392 9.453 -2.698 3.108 1.00 0.00 N ATOM 1742 CA ILE B 392 9.446 -2.145 1.789 1.00 0.00 C ATOM 1743 C ILE B 392 10.683 -1.307 1.696 1.00 0.00 C ATOM 1744 O ILE B 392 11.542 -1.514 0.851 1.00 0.00 O ATOM 1745 CB ILE B 392 8.207 -1.265 1.652 1.00 0.00 C ATOM 1746 CG1 ILE B 392 7.072 -2.082 1.039 1.00 0.00 C ATOM 1747 CG2 ILE B 392 8.506 -0.031 0.788 1.00 0.00 C ATOM 1748 CD1 ILE B 392 5.783 -1.269 1.072 1.00 0.00 C ATOM 0 H ILE B 392 8.573 -2.595 3.614 1.00 0.00 H new ATOM 0 HA ILE B 392 9.427 -2.905 1.008 1.00 0.00 H new ATOM 0 HB ILE B 392 7.909 -0.916 2.641 1.00 0.00 H new ATOM 0 HG12 ILE B 392 7.318 -2.352 0.012 1.00 0.00 H new ATOM 0 HG13 ILE B 392 6.941 -3.013 1.591 1.00 0.00 H new ATOM 0 HG21 ILE B 392 7.608 0.581 0.705 1.00 0.00 H new ATOM 0 HG22 ILE B 392 9.302 0.553 1.251 1.00 0.00 H new ATOM 0 HG23 ILE B 392 8.821 -0.350 -0.205 1.00 0.00 H new ATOM 0 HD11 ILE B 392 4.973 -1.853 0.634 1.00 0.00 H new ATOM 0 HD12 ILE B 392 5.535 -1.022 2.104 1.00 0.00 H new ATOM 0 HD13 ILE B 392 5.918 -0.350 0.501 1.00 0.00 H new ATOM 1760 N ALA B 393 10.755 -0.394 2.648 1.00 0.00 N ATOM 1761 CA ALA B 393 11.884 0.507 2.784 1.00 0.00 C ATOM 1762 C ALA B 393 13.186 -0.268 2.807 1.00 0.00 C ATOM 1763 O ALA B 393 14.220 0.211 2.341 1.00 0.00 O ATOM 1764 CB ALA B 393 11.781 1.255 4.095 1.00 0.00 C ATOM 0 H ALA B 393 10.029 -0.257 3.351 1.00 0.00 H new ATOM 0 HA ALA B 393 11.870 1.193 1.937 1.00 0.00 H new ATOM 0 HB1 ALA B 393 12.630 1.931 4.196 1.00 0.00 H new ATOM 0 HB2 ALA B 393 10.855 1.830 4.114 1.00 0.00 H new ATOM 0 HB3 ALA B 393 11.784 0.544 4.921 1.00 0.00 H new ATOM 1770 N GLY B 394 13.133 -1.461 3.389 1.00 0.00 N ATOM 1771 CA GLY B 394 14.327 -2.283 3.505 1.00 0.00 C ATOM 1772 C GLY B 394 14.548 -3.089 2.252 1.00 0.00 C ATOM 1773 O GLY B 394 15.641 -3.588 1.999 1.00 0.00 O ATOM 0 H GLY B 394 12.287 -1.874 3.782 1.00 0.00 H new ATOM 0 HA2 GLY B 394 15.193 -1.649 3.692 1.00 0.00 H new ATOM 0 HA3 GLY B 394 14.231 -2.952 4.360 1.00 0.00 H new ATOM 1777 N TYR B 395 13.497 -3.208 1.478 1.00 0.00 N ATOM 1778 CA TYR B 395 13.550 -3.948 0.245 1.00 0.00 C ATOM 1779 C TYR B 395 14.025 -3.033 -0.870 1.00 0.00 C ATOM 1780 O TYR B 395 14.817 -3.441 -1.714 1.00 0.00 O ATOM 1781 CB TYR B 395 12.168 -4.526 -0.019 1.00 0.00 C ATOM 1782 CG TYR B 395 11.949 -5.817 0.781 1.00 0.00 C ATOM 1783 CD1 TYR B 395 12.736 -6.147 1.914 1.00 0.00 C ATOM 1784 CD2 TYR B 395 10.951 -6.707 0.367 1.00 0.00 C ATOM 1785 CE1 TYR B 395 12.511 -7.348 2.598 1.00 0.00 C ATOM 1786 CE2 TYR B 395 10.737 -7.908 1.052 1.00 0.00 C ATOM 1787 CZ TYR B 395 11.517 -8.230 2.165 1.00 0.00 C ATOM 1788 OH TYR B 395 11.303 -9.415 2.838 1.00 0.00 O ATOM 0 H TYR B 395 12.587 -2.797 1.685 1.00 0.00 H new ATOM 0 HA TYR B 395 14.259 -4.774 0.302 1.00 0.00 H new ATOM 0 HB2 TYR B 395 11.406 -3.794 0.250 1.00 0.00 H new ATOM 0 HB3 TYR B 395 12.053 -4.730 -1.084 1.00 0.00 H new ATOM 0 HD1 TYR B 395 13.509 -5.472 2.249 1.00 0.00 H new ATOM 0 HD2 TYR B 395 10.340 -6.464 -0.490 1.00 0.00 H new ATOM 0 HE1 TYR B 395 13.108 -7.594 3.464 1.00 0.00 H new ATOM 0 HE2 TYR B 395 9.967 -8.588 0.719 1.00 0.00 H new ATOM 0 HH TYR B 395 10.575 -9.909 2.406 1.00 0.00 H new ATOM 1798 N ILE B 396 13.607 -1.775 -0.830 1.00 0.00 N ATOM 1799 CA ILE B 396 14.096 -0.821 -1.827 1.00 0.00 C ATOM 1800 C ILE B 396 15.557 -0.564 -1.593 1.00 0.00 C ATOM 1801 O ILE B 396 16.265 0.001 -2.426 1.00 0.00 O ATOM 1802 CB ILE B 396 13.356 0.514 -1.828 1.00 0.00 C ATOM 1803 CG1 ILE B 396 12.183 0.456 -0.879 1.00 0.00 C ATOM 1804 CG2 ILE B 396 12.859 0.800 -3.244 1.00 0.00 C ATOM 1805 CD1 ILE B 396 11.389 1.758 -0.957 1.00 0.00 C ATOM 0 H ILE B 396 12.953 -1.396 -0.145 1.00 0.00 H new ATOM 0 HA ILE B 396 13.917 -1.279 -2.800 1.00 0.00 H new ATOM 0 HB ILE B 396 14.030 1.306 -1.503 1.00 0.00 H new ATOM 0 HG12 ILE B 396 11.541 -0.388 -1.131 1.00 0.00 H new ATOM 0 HG13 ILE B 396 12.535 0.295 0.140 1.00 0.00 H new ATOM 0 HG21 ILE B 396 12.328 1.752 -3.258 1.00 0.00 H new ATOM 0 HG22 ILE B 396 13.709 0.848 -3.925 1.00 0.00 H new ATOM 0 HG23 ILE B 396 12.185 0.004 -3.561 1.00 0.00 H new ATOM 0 HD11 ILE B 396 10.544 1.710 -0.270 1.00 0.00 H new ATOM 0 HD12 ILE B 396 12.033 2.594 -0.683 1.00 0.00 H new ATOM 0 HD13 ILE B 396 11.023 1.900 -1.974 1.00 0.00 H new ATOM 1817 N ASP B 397 15.987 -0.999 -0.442 1.00 0.00 N ATOM 1818 CA ASP B 397 17.370 -0.823 -0.034 1.00 0.00 C ATOM 1819 C ASP B 397 18.232 -1.849 -0.722 1.00 0.00 C ATOM 1820 O ASP B 397 19.447 -1.697 -0.853 1.00 0.00 O ATOM 1821 CB ASP B 397 17.471 -0.995 1.478 1.00 0.00 C ATOM 1822 CG ASP B 397 18.433 0.033 2.062 1.00 0.00 C ATOM 1823 OD1 ASP B 397 19.629 -0.195 1.986 1.00 0.00 O1- ATOM 1824 OD2 ASP B 397 17.961 1.032 2.578 1.00 0.00 O ATOM 0 H ASP B 397 15.403 -1.482 0.240 1.00 0.00 H new ATOM 0 HA ASP B 397 17.712 0.174 -0.311 1.00 0.00 H new ATOM 0 HB2 ASP B 397 16.486 -0.881 1.931 1.00 0.00 H new ATOM 0 HB3 ASP B 397 17.816 -2.002 1.715 1.00 0.00 H new ATOM 1829 N ILE B 398 17.578 -2.909 -1.122 1.00 0.00 N ATOM 1830 CA ILE B 398 18.221 -4.018 -1.766 1.00 0.00 C ATOM 1831 C ILE B 398 18.222 -3.876 -3.272 1.00 0.00 C ATOM 1832 O ILE B 398 19.265 -3.853 -3.927 1.00 0.00 O ATOM 1833 CB ILE B 398 17.427 -5.245 -1.385 1.00 0.00 C ATOM 1834 CG1 ILE B 398 17.451 -5.393 0.142 1.00 0.00 C ATOM 1835 CG2 ILE B 398 18.032 -6.463 -2.054 1.00 0.00 C ATOM 1836 CD1 ILE B 398 16.360 -6.359 0.620 1.00 0.00 C ATOM 0 H ILE B 398 16.571 -3.025 -1.007 1.00 0.00 H new ATOM 0 HA ILE B 398 19.263 -4.076 -1.451 1.00 0.00 H new ATOM 0 HB ILE B 398 16.393 -5.149 -1.716 1.00 0.00 H new ATOM 0 HG12 ILE B 398 18.428 -5.757 0.460 1.00 0.00 H new ATOM 0 HG13 ILE B 398 17.307 -4.418 0.607 1.00 0.00 H new ATOM 0 HG21 ILE B 398 17.460 -7.350 -1.780 1.00 0.00 H new ATOM 0 HG22 ILE B 398 18.006 -6.334 -3.136 1.00 0.00 H new ATOM 0 HG23 ILE B 398 19.065 -6.582 -1.727 1.00 0.00 H new ATOM 0 HD11 ILE B 398 16.400 -6.445 1.706 1.00 0.00 H new ATOM 0 HD12 ILE B 398 15.382 -5.980 0.322 1.00 0.00 H new ATOM 0 HD13 ILE B 398 16.521 -7.340 0.172 1.00 0.00 H new ATOM 1848 N ILE B 399 17.015 -3.848 -3.794 1.00 0.00 N ATOM 1849 CA ILE B 399 16.782 -3.783 -5.221 1.00 0.00 C ATOM 1850 C ILE B 399 17.287 -2.485 -5.832 1.00 0.00 C ATOM 1851 O ILE B 399 17.487 -2.410 -7.045 1.00 0.00 O ATOM 1852 CB ILE B 399 15.289 -3.903 -5.447 1.00 0.00 C ATOM 1853 CG1 ILE B 399 14.634 -2.632 -4.923 1.00 0.00 C ATOM 1854 CG2 ILE B 399 14.766 -5.101 -4.657 1.00 0.00 C ATOM 1855 CD1 ILE B 399 13.211 -2.940 -4.428 1.00 0.00 C ATOM 0 H ILE B 399 16.161 -3.870 -3.236 1.00 0.00 H new ATOM 0 HA ILE B 399 17.329 -4.593 -5.704 1.00 0.00 H new ATOM 0 HB ILE B 399 15.066 -4.039 -6.505 1.00 0.00 H new ATOM 0 HG12 ILE B 399 15.229 -2.215 -4.110 1.00 0.00 H new ATOM 0 HG13 ILE B 399 14.599 -1.880 -5.711 1.00 0.00 H new ATOM 0 HG21 ILE B 399 13.691 -5.198 -4.812 1.00 0.00 H new ATOM 0 HG22 ILE B 399 15.265 -6.008 -4.999 1.00 0.00 H new ATOM 0 HG23 ILE B 399 14.968 -4.953 -3.596 1.00 0.00 H new ATOM 0 HD11 ILE B 399 12.750 -2.026 -4.055 1.00 0.00 H new ATOM 0 HD12 ILE B 399 12.617 -3.336 -5.252 1.00 0.00 H new ATOM 0 HD13 ILE B 399 13.256 -3.677 -3.626 1.00 0.00 H new ATOM 1867 N LEU B 400 17.471 -1.454 -5.014 1.00 0.00 N ATOM 1868 CA LEU B 400 17.934 -0.175 -5.564 1.00 0.00 C ATOM 1869 C LEU B 400 19.132 -0.386 -6.487 1.00 0.00 C ATOM 1870 O LEU B 400 19.564 0.581 -7.091 1.00 0.00 O ATOM 1871 CB LEU B 400 18.313 0.815 -4.461 1.00 0.00 C ATOM 1872 CG LEU B 400 19.116 0.116 -3.365 1.00 0.00 C ATOM 1873 CD1 LEU B 400 20.460 -0.372 -3.916 1.00 0.00 C ATOM 1874 CD2 LEU B 400 19.369 1.103 -2.225 1.00 0.00 C ATOM 1875 OXT LEU B 400 19.600 -1.510 -6.578 1.00 0.00 O ATOM 0 H LEU B 400 17.315 -1.469 -4.006 1.00 0.00 H new ATOM 0 HA LEU B 400 17.104 0.245 -6.133 1.00 0.00 H new ATOM 0 HB2 LEU B 400 18.898 1.632 -4.883 1.00 0.00 H new ATOM 0 HB3 LEU B 400 17.412 1.255 -4.035 1.00 0.00 H new ATOM 0 HG LEU B 400 18.550 -0.742 -3.003 1.00 0.00 H new ATOM 0 HD11 LEU B 400 21.020 -0.868 -3.123 1.00 0.00 H new ATOM 0 HD12 LEU B 400 20.286 -1.075 -4.731 1.00 0.00 H new ATOM 0 HD13 LEU B 400 21.032 0.479 -4.287 1.00 0.00 H new ATOM 0 HD21 LEU B 400 19.942 0.611 -1.439 1.00 0.00 H new ATOM 0 HD22 LEU B 400 19.930 1.958 -2.602 1.00 0.00 H new ATOM 0 HD23 LEU B 400 18.416 1.444 -1.821 1.00 0.00 H new