USER MOD reduce.3.24.130724 H: found=0, std=0, add=970, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 971 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 491 HIS :FLIP no HE2:sc= -2.76 F(o=-3.9,f=-3.1) USER MOD Set 1.2: A 501 GLN :FLIP amide:sc= -0.371 F(o=-4.6,f=-3.1) USER MOD Set 2.1: A 431 CYS SG : rot 60:sc= -3.48 USER MOD Set 2.2: A 510 MET CE :methyl 158:sc= -0.403 (180deg=-0.833) USER MOD Set 3.1: A 426 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 417 GLN :FLIP amide:sc= -0.193 F(o=-4,f=-1.9) USER MOD Set 4.2: A 503 HIS : no HE2:sc= -1.7 K(o=-1.9,f=-3.3!) USER MOD Single : A 406 SER OG : rot 180:sc=-0.00735 USER MOD Single : A 407 SER OG : rot 180:sc= 0 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 410 SER OG : rot 38:sc= 0.862 USER MOD Single : A 412 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 413 SER OG : rot 21:sc= 0.0574! USER MOD Single : A 415 SER OG : rot 180:sc= 0 USER MOD Single : A 418 LYS NZ :NH3+ -164:sc= -0.0123 (180deg=-0.207) USER MOD Single : A 420 SER OG : rot 61:sc= 0.154 USER MOD Single : A 422 SER OG : rot 180:sc= 0 USER MOD Single : A 424 SER OG : rot 180:sc= -0.0601 USER MOD Single : A 433 TYR OH : rot 150:sc= -0.784 USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 ASN : amide:sc= -0.7 K(o=-0.7,f=-1.4!) USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 HIS : no HD1:sc= 0.102 K(o=0.1,f=-2) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 452 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 459 SER OG : rot -30:sc= -0.27 USER MOD Single : A 461 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 TYR OH : rot 180:sc= 0 USER MOD Single : A 467 ASN : amide:sc=-0.00858 X(o=-0.0086,f=-0.26) USER MOD Single : A 469 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 471 THR OG1 : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 484 TYR OH : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 489 CYS SG : rot 180:sc= 0 USER MOD Single : A 492 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 493 GLN : amide:sc= -0.484 X(o=-0.48,f=-0.48) USER MOD Single : A 494 TYR OH : rot 180:sc= 0 USER MOD Single : A 495 MET CE :methyl 151:sc= -4.49! (180deg=-6.19!) USER MOD Single : A 497 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 506 THR OG1 : rot 180:sc= 0.0227 USER MOD Single : A 507 LYS NZ :NH3+ 176:sc= -4.45! (180deg=-4.77!) USER MOD Single : A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 522 GLN : amide:sc= -0.297 X(o=-0.3,f=-0.63) USER MOD Single : A 523 SER OG : rot 180:sc= 0 USER MOD Single : A 526 SER OG : rot 180:sc= 0 USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 405 4.122 26.864 14.024 1.00 0.00 N ATOM 2 CA GLY A 405 3.129 25.811 13.916 1.00 0.00 C ATOM 3 C GLY A 405 2.235 25.980 12.704 1.00 0.00 C ATOM 4 O GLY A 405 1.903 27.101 12.320 1.00 0.00 O ATOM 0 HA2 GLY A 405 3.632 24.846 13.861 1.00 0.00 H new ATOM 0 HA3 GLY A 405 2.516 25.800 14.817 1.00 0.00 H new ATOM 8 N SER A 406 1.846 24.862 12.098 1.00 0.00 N ATOM 9 CA SER A 406 0.989 24.891 10.918 1.00 0.00 C ATOM 10 C SER A 406 0.055 23.686 10.895 1.00 0.00 C ATOM 11 O SER A 406 0.395 22.613 11.395 1.00 0.00 O ATOM 12 CB SER A 406 1.839 24.917 9.646 1.00 0.00 C ATOM 13 OG SER A 406 2.771 25.983 9.677 1.00 0.00 O ATOM 0 H SER A 406 2.111 23.926 12.404 1.00 0.00 H new ATOM 0 HA SER A 406 0.383 25.796 10.961 1.00 0.00 H new ATOM 0 HB2 SER A 406 2.368 23.970 9.539 1.00 0.00 H new ATOM 0 HB3 SER A 406 1.192 25.021 8.775 1.00 0.00 H new ATOM 0 HG SER A 406 3.303 25.977 8.854 1.00 0.00 H new ATOM 19 N SER A 407 -1.125 23.870 10.311 1.00 0.00 N ATOM 20 CA SER A 407 -2.111 22.799 10.226 1.00 0.00 C ATOM 21 C SER A 407 -3.060 23.027 9.053 1.00 0.00 C ATOM 22 O SER A 407 -3.475 24.154 8.785 1.00 0.00 O ATOM 23 CB SER A 407 -2.906 22.704 11.529 1.00 0.00 C ATOM 24 OG SER A 407 -3.924 23.690 11.579 1.00 0.00 O ATOM 0 H SER A 407 -1.421 24.750 9.890 1.00 0.00 H new ATOM 0 HA SER A 407 -1.580 21.861 10.064 1.00 0.00 H new ATOM 0 HB2 SER A 407 -3.351 21.713 11.616 1.00 0.00 H new ATOM 0 HB3 SER A 407 -2.234 22.827 12.378 1.00 0.00 H new ATOM 0 HG SER A 407 -4.419 23.607 12.421 1.00 0.00 H new ATOM 30 N GLY A 408 -3.401 21.947 8.356 1.00 0.00 N ATOM 31 CA GLY A 408 -4.298 22.049 7.221 1.00 0.00 C ATOM 32 C GLY A 408 -4.271 20.810 6.347 1.00 0.00 C ATOM 33 O GLY A 408 -3.379 19.972 6.475 1.00 0.00 O ATOM 0 H GLY A 408 -3.071 21.003 8.558 1.00 0.00 H new ATOM 0 HA2 GLY A 408 -5.314 22.215 7.579 1.00 0.00 H new ATOM 0 HA3 GLY A 408 -4.024 22.918 6.623 1.00 0.00 H new ATOM 37 N SER A 409 -5.252 20.694 5.458 1.00 0.00 N ATOM 38 CA SER A 409 -5.341 19.545 4.564 1.00 0.00 C ATOM 39 C SER A 409 -5.383 19.994 3.106 1.00 0.00 C ATOM 40 O SER A 409 -6.336 20.642 2.672 1.00 0.00 O ATOM 41 CB SER A 409 -6.583 18.713 4.890 1.00 0.00 C ATOM 42 OG SER A 409 -6.639 18.400 6.271 1.00 0.00 O ATOM 0 H SER A 409 -5.996 21.381 5.337 1.00 0.00 H new ATOM 0 HA SER A 409 -4.453 18.931 4.712 1.00 0.00 H new ATOM 0 HB2 SER A 409 -7.479 19.263 4.602 1.00 0.00 H new ATOM 0 HB3 SER A 409 -6.572 17.793 4.306 1.00 0.00 H new ATOM 0 HG SER A 409 -7.442 17.870 6.454 1.00 0.00 H new ATOM 48 N SER A 410 -4.344 19.644 2.356 1.00 0.00 N ATOM 49 CA SER A 410 -4.259 20.013 0.948 1.00 0.00 C ATOM 50 C SER A 410 -4.903 18.947 0.067 1.00 0.00 C ATOM 51 O SER A 410 -4.315 17.896 -0.185 1.00 0.00 O ATOM 52 CB SER A 410 -2.799 20.215 0.538 1.00 0.00 C ATOM 53 OG SER A 410 -2.048 19.029 0.727 1.00 0.00 O ATOM 0 H SER A 410 -3.549 19.105 2.700 1.00 0.00 H new ATOM 0 HA SER A 410 -4.800 20.949 0.811 1.00 0.00 H new ATOM 0 HB2 SER A 410 -2.750 20.517 -0.508 1.00 0.00 H new ATOM 0 HB3 SER A 410 -2.362 21.023 1.124 1.00 0.00 H new ATOM 0 HG SER A 410 -2.597 18.253 0.489 1.00 0.00 H new ATOM 59 N GLY A 411 -6.117 19.226 -0.399 1.00 0.00 N ATOM 60 CA GLY A 411 -6.822 18.282 -1.246 1.00 0.00 C ATOM 61 C GLY A 411 -8.316 18.535 -1.278 1.00 0.00 C ATOM 62 O GLY A 411 -8.975 18.539 -0.238 1.00 0.00 O ATOM 0 H GLY A 411 -6.625 20.089 -0.205 1.00 0.00 H new ATOM 0 HA2 GLY A 411 -6.425 18.341 -2.259 1.00 0.00 H new ATOM 0 HA3 GLY A 411 -6.636 17.269 -0.889 1.00 0.00 H new ATOM 66 N LYS A 412 -8.853 18.748 -2.474 1.00 0.00 N ATOM 67 CA LYS A 412 -10.279 19.004 -2.639 1.00 0.00 C ATOM 68 C LYS A 412 -10.870 18.111 -3.725 1.00 0.00 C ATOM 69 O LYS A 412 -11.911 17.484 -3.527 1.00 0.00 O ATOM 70 CB LYS A 412 -10.517 20.475 -2.988 1.00 0.00 C ATOM 71 CG LYS A 412 -10.397 21.410 -1.797 1.00 0.00 C ATOM 72 CD LYS A 412 -11.008 22.770 -2.092 1.00 0.00 C ATOM 73 CE LYS A 412 -10.112 23.597 -3.001 1.00 0.00 C ATOM 74 NZ LYS A 412 -10.492 25.037 -2.991 1.00 0.00 N ATOM 0 H LYS A 412 -8.322 18.748 -3.345 1.00 0.00 H new ATOM 0 HA LYS A 412 -10.775 18.776 -1.696 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -9.801 20.779 -3.751 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -11.511 20.580 -3.423 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -10.893 20.967 -0.934 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -9.346 21.532 -1.533 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -11.983 22.638 -2.562 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -11.174 23.306 -1.158 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -9.075 23.493 -2.682 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -10.173 23.212 -4.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -9.858 25.568 -3.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -11.473 25.139 -3.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -10.410 25.411 -2.024 1.00 0.00 H new ATOM 88 N SER A 413 -10.199 18.056 -4.871 1.00 0.00 N ATOM 89 CA SER A 413 -10.659 17.241 -5.989 1.00 0.00 C ATOM 90 C SER A 413 -9.596 16.226 -6.395 1.00 0.00 C ATOM 91 O SER A 413 -8.422 16.555 -6.572 1.00 0.00 O ATOM 92 CB SER A 413 -11.016 18.129 -7.182 1.00 0.00 C ATOM 93 OG SER A 413 -9.851 18.663 -7.787 1.00 0.00 O ATOM 0 H SER A 413 -9.334 18.567 -5.050 1.00 0.00 H new ATOM 0 HA SER A 413 -11.549 16.699 -5.670 1.00 0.00 H new ATOM 0 HB2 SER A 413 -11.578 17.550 -7.915 1.00 0.00 H new ATOM 0 HB3 SER A 413 -11.664 18.942 -6.854 1.00 0.00 H new ATOM 0 HG SER A 413 -9.076 18.113 -7.546 1.00 0.00 H new ATOM 99 N PRO A 414 -10.014 14.960 -6.547 1.00 0.00 N ATOM 100 CA PRO A 414 -9.113 13.870 -6.935 1.00 0.00 C ATOM 101 C PRO A 414 -8.645 13.993 -8.381 1.00 0.00 C ATOM 102 O PRO A 414 -9.456 14.123 -9.298 1.00 0.00 O ATOM 103 CB PRO A 414 -9.975 12.618 -6.757 1.00 0.00 C ATOM 104 CG PRO A 414 -11.377 13.099 -6.907 1.00 0.00 C ATOM 105 CD PRO A 414 -11.398 14.497 -6.353 1.00 0.00 C ATOM 0 HA PRO A 414 -8.200 13.864 -6.340 1.00 0.00 H new ATOM 0 HB2 PRO A 414 -9.734 11.862 -7.504 1.00 0.00 H new ATOM 0 HB3 PRO A 414 -9.815 12.163 -5.780 1.00 0.00 H new ATOM 0 HG2 PRO A 414 -11.683 13.089 -7.953 1.00 0.00 H new ATOM 0 HG3 PRO A 414 -12.070 12.455 -6.366 1.00 0.00 H new ATOM 0 HD2 PRO A 414 -12.111 15.129 -6.882 1.00 0.00 H new ATOM 0 HD3 PRO A 414 -11.682 14.508 -5.301 1.00 0.00 H new ATOM 113 N SER A 415 -7.331 13.950 -8.578 1.00 0.00 N ATOM 114 CA SER A 415 -6.754 14.059 -9.913 1.00 0.00 C ATOM 115 C SER A 415 -5.759 12.931 -10.169 1.00 0.00 C ATOM 116 O SER A 415 -4.571 13.058 -9.879 1.00 0.00 O ATOM 117 CB SER A 415 -6.061 15.412 -10.083 1.00 0.00 C ATOM 118 OG SER A 415 -5.736 15.652 -11.441 1.00 0.00 O ATOM 0 H SER A 415 -6.646 13.840 -7.830 1.00 0.00 H new ATOM 0 HA SER A 415 -7.563 13.979 -10.639 1.00 0.00 H new ATOM 0 HB2 SER A 415 -6.711 16.206 -9.716 1.00 0.00 H new ATOM 0 HB3 SER A 415 -5.154 15.438 -9.479 1.00 0.00 H new ATOM 0 HG SER A 415 -5.296 16.524 -11.523 1.00 0.00 H new ATOM 124 N GLY A 416 -6.256 11.825 -10.715 1.00 0.00 N ATOM 125 CA GLY A 416 -5.399 10.689 -11.001 1.00 0.00 C ATOM 126 C GLY A 416 -6.180 9.475 -11.464 1.00 0.00 C ATOM 127 O GLY A 416 -5.861 8.881 -12.494 1.00 0.00 O ATOM 0 H GLY A 416 -7.237 11.696 -10.964 1.00 0.00 H new ATOM 0 HA2 GLY A 416 -4.677 10.967 -11.769 1.00 0.00 H new ATOM 0 HA3 GLY A 416 -4.831 10.432 -10.107 1.00 0.00 H new ATOM 131 N GLN A 417 -7.204 9.106 -10.702 1.00 0.00 N ATOM 132 CA GLN A 417 -8.031 7.954 -11.040 1.00 0.00 C ATOM 133 C GLN A 417 -9.491 8.206 -10.676 1.00 0.00 C ATOM 134 O GLN A 417 -9.789 8.847 -9.668 1.00 0.00 O ATOM 135 CB GLN A 417 -7.521 6.705 -10.318 1.00 0.00 C ATOM 136 CG GLN A 417 -7.679 6.768 -8.807 1.00 0.00 C ATOM 137 CD GLN A 417 -7.112 5.547 -8.110 1.00 0.00 C ATOM 138 OE1 GLN A 417 -7.933 4.899 -7.292 1.00 0.00 O flip ATOM 139 NE2 GLN A 417 -5.950 5.191 -8.303 1.00 0.00 N flip ATOM 0 H GLN A 417 -7.481 9.588 -9.847 1.00 0.00 H new ATOM 0 HA GLN A 417 -7.967 7.795 -12.116 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -8.057 5.834 -10.695 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -6.468 6.561 -10.559 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -7.180 7.661 -8.430 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -8.736 6.865 -8.560 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -5.354 5.719 -8.941 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -5.583 4.368 -7.826 1.00 0.00 H new ATOM 148 N LYS A 418 -10.398 7.697 -11.503 1.00 0.00 N ATOM 149 CA LYS A 418 -11.827 7.865 -11.269 1.00 0.00 C ATOM 150 C LYS A 418 -12.622 6.744 -11.931 1.00 0.00 C ATOM 151 O LYS A 418 -12.462 6.476 -13.122 1.00 0.00 O ATOM 152 CB LYS A 418 -12.296 9.220 -11.803 1.00 0.00 C ATOM 153 CG LYS A 418 -13.719 9.571 -11.405 1.00 0.00 C ATOM 154 CD LYS A 418 -13.926 11.075 -11.341 1.00 0.00 C ATOM 155 CE LYS A 418 -15.398 11.430 -11.200 1.00 0.00 C ATOM 156 NZ LYS A 418 -16.161 11.134 -12.444 1.00 0.00 N ATOM 0 H LYS A 418 -10.168 7.164 -12.342 1.00 0.00 H new ATOM 0 HA LYS A 418 -12.001 7.825 -10.194 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -11.624 9.997 -11.439 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -12.222 9.218 -12.890 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -14.416 9.137 -12.122 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -13.945 9.130 -10.434 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -13.370 11.484 -10.498 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -13.524 11.537 -12.243 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -15.828 10.872 -10.368 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -15.495 12.488 -10.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -17.077 11.626 -12.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -15.619 11.459 -13.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -16.321 10.109 -12.517 1.00 0.00 H new ATOM 170 N ARG A 419 -13.479 6.093 -11.151 1.00 0.00 N ATOM 171 CA ARG A 419 -14.299 5.001 -11.662 1.00 0.00 C ATOM 172 C ARG A 419 -13.442 3.975 -12.397 1.00 0.00 C ATOM 173 O ARG A 419 -13.824 3.478 -13.457 1.00 0.00 O ATOM 174 CB ARG A 419 -15.381 5.543 -12.598 1.00 0.00 C ATOM 175 CG ARG A 419 -16.522 4.567 -12.840 1.00 0.00 C ATOM 176 CD ARG A 419 -17.663 5.222 -13.602 1.00 0.00 C ATOM 177 NE ARG A 419 -18.218 6.365 -12.881 1.00 0.00 N ATOM 178 CZ ARG A 419 -19.361 6.957 -13.210 1.00 0.00 C ATOM 179 NH1 ARG A 419 -20.067 6.515 -14.242 1.00 0.00 N ATOM 180 NH2 ARG A 419 -19.800 7.992 -12.506 1.00 0.00 N ATOM 0 H ARG A 419 -13.623 6.303 -10.163 1.00 0.00 H new ATOM 0 HA ARG A 419 -14.775 4.509 -10.814 1.00 0.00 H new ATOM 0 HB2 ARG A 419 -15.785 6.464 -12.178 1.00 0.00 H new ATOM 0 HB3 ARG A 419 -14.926 5.801 -13.554 1.00 0.00 H new ATOM 0 HG2 ARG A 419 -16.154 3.708 -13.401 1.00 0.00 H new ATOM 0 HG3 ARG A 419 -16.889 4.191 -11.885 1.00 0.00 H new ATOM 0 HD2 ARG A 419 -17.306 5.548 -14.579 1.00 0.00 H new ATOM 0 HD3 ARG A 419 -18.449 4.488 -13.779 1.00 0.00 H new ATOM 0 HE ARG A 419 -17.700 6.728 -12.081 1.00 0.00 H new ATOM 0 HH11 ARG A 419 -19.733 5.719 -14.785 1.00 0.00 H new ATOM 0 HH12 ARG A 419 -20.944 6.971 -14.493 1.00 0.00 H new ATOM 0 HH21 ARG A 419 -19.260 8.334 -11.711 1.00 0.00 H new ATOM 0 HH22 ARG A 419 -20.678 8.446 -12.759 1.00 0.00 H new ATOM 194 N SER A 420 -12.282 3.664 -11.828 1.00 0.00 N ATOM 195 CA SER A 420 -11.368 2.701 -12.431 1.00 0.00 C ATOM 196 C SER A 420 -10.991 1.611 -11.433 1.00 0.00 C ATOM 197 O SER A 420 -10.413 1.889 -10.382 1.00 0.00 O ATOM 198 CB SER A 420 -10.107 3.407 -12.933 1.00 0.00 C ATOM 199 OG SER A 420 -10.400 4.254 -14.031 1.00 0.00 O ATOM 0 H SER A 420 -11.953 4.065 -10.950 1.00 0.00 H new ATOM 0 HA SER A 420 -11.876 2.236 -13.276 1.00 0.00 H new ATOM 0 HB2 SER A 420 -9.668 3.992 -12.125 1.00 0.00 H new ATOM 0 HB3 SER A 420 -9.365 2.666 -13.229 1.00 0.00 H new ATOM 0 HG SER A 420 -11.040 4.942 -13.752 1.00 0.00 H new ATOM 205 N ARG A 421 -11.324 0.369 -11.769 1.00 0.00 N ATOM 206 CA ARG A 421 -11.022 -0.764 -10.903 1.00 0.00 C ATOM 207 C ARG A 421 -10.490 -1.942 -11.713 1.00 0.00 C ATOM 208 O ARG A 421 -10.632 -1.982 -12.935 1.00 0.00 O ATOM 209 CB ARG A 421 -12.271 -1.187 -10.127 1.00 0.00 C ATOM 210 CG ARG A 421 -13.449 -1.545 -11.018 1.00 0.00 C ATOM 211 CD ARG A 421 -14.736 -1.667 -10.218 1.00 0.00 C ATOM 212 NE ARG A 421 -15.867 -2.055 -11.056 1.00 0.00 N ATOM 213 CZ ARG A 421 -17.024 -2.494 -10.572 1.00 0.00 C ATOM 214 NH1 ARG A 421 -17.201 -2.600 -9.262 1.00 0.00 N ATOM 215 NH2 ARG A 421 -18.006 -2.828 -11.399 1.00 0.00 N ATOM 0 H ARG A 421 -11.803 0.122 -12.635 1.00 0.00 H new ATOM 0 HA ARG A 421 -10.251 -0.454 -10.197 1.00 0.00 H new ATOM 0 HB2 ARG A 421 -12.026 -2.045 -9.501 1.00 0.00 H new ATOM 0 HB3 ARG A 421 -12.565 -0.378 -9.459 1.00 0.00 H new ATOM 0 HG2 ARG A 421 -13.569 -0.783 -11.788 1.00 0.00 H new ATOM 0 HG3 ARG A 421 -13.247 -2.486 -11.530 1.00 0.00 H new ATOM 0 HD2 ARG A 421 -14.602 -2.404 -9.426 1.00 0.00 H new ATOM 0 HD3 ARG A 421 -14.953 -0.715 -9.734 1.00 0.00 H new ATOM 0 HE ARG A 421 -15.763 -1.985 -12.068 1.00 0.00 H new ATOM 0 HH11 ARG A 421 -16.448 -2.344 -8.623 1.00 0.00 H new ATOM 0 HH12 ARG A 421 -18.090 -2.937 -8.893 1.00 0.00 H new ATOM 0 HH21 ARG A 421 -17.873 -2.748 -12.407 1.00 0.00 H new ATOM 0 HH22 ARG A 421 -18.894 -3.165 -11.027 1.00 0.00 H new ATOM 229 N SER A 422 -9.876 -2.899 -11.025 1.00 0.00 N ATOM 230 CA SER A 422 -9.319 -4.076 -11.681 1.00 0.00 C ATOM 231 C SER A 422 -9.226 -5.248 -10.708 1.00 0.00 C ATOM 232 O SER A 422 -8.711 -5.109 -9.599 1.00 0.00 O ATOM 233 CB SER A 422 -7.934 -3.761 -12.250 1.00 0.00 C ATOM 234 OG SER A 422 -7.433 -4.850 -13.005 1.00 0.00 O ATOM 0 H SER A 422 -9.752 -2.882 -10.013 1.00 0.00 H new ATOM 0 HA SER A 422 -9.985 -4.356 -12.497 1.00 0.00 H new ATOM 0 HB2 SER A 422 -7.989 -2.873 -12.880 1.00 0.00 H new ATOM 0 HB3 SER A 422 -7.246 -3.532 -11.436 1.00 0.00 H new ATOM 0 HG SER A 422 -6.548 -4.623 -13.359 1.00 0.00 H new ATOM 240 N ARG A 423 -9.730 -6.402 -11.133 1.00 0.00 N ATOM 241 CA ARG A 423 -9.706 -7.598 -10.300 1.00 0.00 C ATOM 242 C ARG A 423 -9.269 -8.816 -11.110 1.00 0.00 C ATOM 243 O ARG A 423 -9.209 -8.768 -12.338 1.00 0.00 O ATOM 244 CB ARG A 423 -11.086 -7.848 -9.689 1.00 0.00 C ATOM 245 CG ARG A 423 -11.374 -6.992 -8.466 1.00 0.00 C ATOM 246 CD ARG A 423 -12.776 -7.240 -7.930 1.00 0.00 C ATOM 247 NE ARG A 423 -13.806 -6.800 -8.867 1.00 0.00 N ATOM 248 CZ ARG A 423 -14.268 -7.554 -9.859 1.00 0.00 C ATOM 249 NH1 ARG A 423 -13.795 -8.778 -10.041 1.00 0.00 N ATOM 250 NH2 ARG A 423 -15.207 -7.082 -10.670 1.00 0.00 N ATOM 0 H ARG A 423 -10.160 -6.534 -12.049 1.00 0.00 H new ATOM 0 HA ARG A 423 -8.985 -7.437 -9.499 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -11.849 -7.656 -10.444 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -11.167 -8.899 -9.414 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -10.642 -7.209 -7.688 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -11.263 -5.939 -8.723 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -12.903 -8.303 -7.725 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -12.900 -6.715 -6.983 1.00 0.00 H new ATOM 0 HE ARG A 423 -14.192 -5.863 -8.754 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -13.074 -9.144 -9.419 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -14.152 -9.354 -10.803 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -15.574 -6.140 -10.532 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -15.561 -7.661 -11.431 1.00 0.00 H new ATOM 264 N SER A 424 -8.965 -9.906 -10.412 1.00 0.00 N ATOM 265 CA SER A 424 -8.529 -11.134 -11.066 1.00 0.00 C ATOM 266 C SER A 424 -8.938 -12.357 -10.251 1.00 0.00 C ATOM 267 O SER A 424 -8.933 -12.345 -9.020 1.00 0.00 O ATOM 268 CB SER A 424 -7.011 -11.122 -11.261 1.00 0.00 C ATOM 269 OG SER A 424 -6.344 -11.577 -10.097 1.00 0.00 O ATOM 0 H SER A 424 -9.013 -9.963 -9.395 1.00 0.00 H new ATOM 0 HA SER A 424 -9.013 -11.189 -12.041 1.00 0.00 H new ATOM 0 HB2 SER A 424 -6.745 -11.755 -12.107 1.00 0.00 H new ATOM 0 HB3 SER A 424 -6.680 -10.112 -11.502 1.00 0.00 H new ATOM 0 HG SER A 424 -5.376 -11.561 -10.248 1.00 0.00 H new ATOM 275 N PRO A 425 -9.302 -13.440 -10.954 1.00 0.00 N ATOM 276 CA PRO A 425 -9.721 -14.693 -10.318 1.00 0.00 C ATOM 277 C PRO A 425 -8.564 -15.408 -9.628 1.00 0.00 C ATOM 278 O PRO A 425 -8.774 -16.316 -8.822 1.00 0.00 O ATOM 279 CB PRO A 425 -10.244 -15.528 -11.489 1.00 0.00 C ATOM 280 CG PRO A 425 -9.532 -14.994 -12.683 1.00 0.00 C ATOM 281 CD PRO A 425 -9.332 -13.526 -12.424 1.00 0.00 C ATOM 0 HA PRO A 425 -10.459 -14.525 -9.534 1.00 0.00 H new ATOM 0 HB2 PRO A 425 -10.034 -16.588 -11.344 1.00 0.00 H new ATOM 0 HB3 PRO A 425 -11.324 -15.428 -11.595 1.00 0.00 H new ATOM 0 HG2 PRO A 425 -8.577 -15.499 -12.826 1.00 0.00 H new ATOM 0 HG3 PRO A 425 -10.116 -15.154 -13.589 1.00 0.00 H new ATOM 0 HD2 PRO A 425 -8.405 -13.162 -12.867 1.00 0.00 H new ATOM 0 HD3 PRO A 425 -10.141 -12.930 -12.845 1.00 0.00 H new ATOM 289 N HIS A 426 -7.343 -14.993 -9.949 1.00 0.00 N ATOM 290 CA HIS A 426 -6.152 -15.594 -9.358 1.00 0.00 C ATOM 291 C HIS A 426 -6.263 -15.638 -7.837 1.00 0.00 C ATOM 292 O HIS A 426 -6.550 -14.627 -7.198 1.00 0.00 O ATOM 293 CB HIS A 426 -4.904 -14.812 -9.768 1.00 0.00 C ATOM 294 CG HIS A 426 -4.275 -15.307 -11.034 1.00 0.00 C ATOM 295 ND1 HIS A 426 -3.333 -16.314 -11.063 1.00 0.00 N ATOM 296 CD2 HIS A 426 -4.461 -14.930 -12.321 1.00 0.00 C ATOM 297 CE1 HIS A 426 -2.965 -16.533 -12.313 1.00 0.00 C ATOM 298 NE2 HIS A 426 -3.635 -15.706 -13.096 1.00 0.00 N ATOM 0 H HIS A 426 -7.152 -14.244 -10.614 1.00 0.00 H new ATOM 0 HA HIS A 426 -6.069 -16.616 -9.728 1.00 0.00 H new ATOM 0 HB2 HIS A 426 -5.168 -13.761 -9.890 1.00 0.00 H new ATOM 0 HB3 HIS A 426 -4.171 -14.866 -8.963 1.00 0.00 H new ATOM 0 HD2 HIS A 426 -5.134 -14.162 -12.673 1.00 0.00 H new ATOM 0 HE1 HIS A 426 -2.240 -17.264 -12.639 1.00 0.00 H new ATOM 0 HE2 HIS A 426 -3.552 -15.653 -14.111 1.00 0.00 H new ATOM 307 N GLU A 427 -6.033 -16.816 -7.265 1.00 0.00 N ATOM 308 CA GLU A 427 -6.109 -16.991 -5.820 1.00 0.00 C ATOM 309 C GLU A 427 -4.912 -16.343 -5.130 1.00 0.00 C ATOM 310 O GLU A 427 -3.792 -16.385 -5.638 1.00 0.00 O ATOM 311 CB GLU A 427 -6.173 -18.478 -5.466 1.00 0.00 C ATOM 312 CG GLU A 427 -7.365 -19.198 -6.074 1.00 0.00 C ATOM 313 CD GLU A 427 -7.628 -20.543 -5.423 1.00 0.00 C ATOM 314 OE1 GLU A 427 -6.989 -21.535 -5.830 1.00 0.00 O ATOM 315 OE2 GLU A 427 -8.474 -20.602 -4.506 1.00 0.00 O ATOM 0 H GLU A 427 -5.793 -17.663 -7.780 1.00 0.00 H new ATOM 0 HA GLU A 427 -7.018 -16.502 -5.468 1.00 0.00 H new ATOM 0 HB2 GLU A 427 -5.256 -18.963 -5.802 1.00 0.00 H new ATOM 0 HB3 GLU A 427 -6.210 -18.583 -4.382 1.00 0.00 H new ATOM 0 HG2 GLU A 427 -8.252 -18.572 -5.976 1.00 0.00 H new ATOM 0 HG3 GLU A 427 -7.192 -19.342 -7.141 1.00 0.00 H new ATOM 322 N ALA A 428 -5.158 -15.745 -3.969 1.00 0.00 N ATOM 323 CA ALA A 428 -4.101 -15.090 -3.208 1.00 0.00 C ATOM 324 C ALA A 428 -4.596 -14.675 -1.827 1.00 0.00 C ATOM 325 O ALA A 428 -5.793 -14.722 -1.545 1.00 0.00 O ATOM 326 CB ALA A 428 -3.576 -13.881 -3.968 1.00 0.00 C ATOM 0 H ALA A 428 -6.080 -15.701 -3.535 1.00 0.00 H new ATOM 0 HA ALA A 428 -3.287 -15.803 -3.074 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -2.787 -13.401 -3.388 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -3.176 -14.202 -4.930 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -4.388 -13.173 -4.131 1.00 0.00 H new ATOM 332 N GLY A 429 -3.666 -14.268 -0.968 1.00 0.00 N ATOM 333 CA GLY A 429 -4.028 -13.852 0.375 1.00 0.00 C ATOM 334 C GLY A 429 -4.828 -12.564 0.386 1.00 0.00 C ATOM 335 O GLY A 429 -5.789 -12.415 -0.369 1.00 0.00 O ATOM 0 H GLY A 429 -2.669 -14.219 -1.178 1.00 0.00 H new ATOM 0 HA2 GLY A 429 -4.609 -14.641 0.853 1.00 0.00 H new ATOM 0 HA3 GLY A 429 -3.123 -13.719 0.968 1.00 0.00 H new ATOM 339 N PHE A 430 -4.433 -11.632 1.246 1.00 0.00 N ATOM 340 CA PHE A 430 -5.122 -10.351 1.356 1.00 0.00 C ATOM 341 C PHE A 430 -4.131 -9.220 1.616 1.00 0.00 C ATOM 342 O PHE A 430 -3.487 -9.174 2.665 1.00 0.00 O ATOM 343 CB PHE A 430 -6.162 -10.401 2.477 1.00 0.00 C ATOM 344 CG PHE A 430 -6.994 -11.651 2.467 1.00 0.00 C ATOM 345 CD1 PHE A 430 -7.882 -11.900 1.433 1.00 0.00 C ATOM 346 CD2 PHE A 430 -6.887 -12.578 3.492 1.00 0.00 C ATOM 347 CE1 PHE A 430 -8.649 -13.050 1.423 1.00 0.00 C ATOM 348 CE2 PHE A 430 -7.652 -13.730 3.486 1.00 0.00 C ATOM 349 CZ PHE A 430 -8.533 -13.966 2.450 1.00 0.00 C ATOM 0 H PHE A 430 -3.639 -11.739 1.877 1.00 0.00 H new ATOM 0 HA PHE A 430 -5.627 -10.157 0.410 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -5.653 -10.320 3.438 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -6.819 -9.536 2.391 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -7.976 -11.188 0.626 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -6.198 -12.399 4.304 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -9.339 -13.232 0.612 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -7.560 -14.444 4.291 1.00 0.00 H new ATOM 0 HZ PHE A 430 -9.131 -14.866 2.443 1.00 0.00 H new ATOM 359 N CYS A 431 -4.013 -8.312 0.654 1.00 0.00 N ATOM 360 CA CYS A 431 -3.099 -7.182 0.778 1.00 0.00 C ATOM 361 C CYS A 431 -3.786 -5.880 0.377 1.00 0.00 C ATOM 362 O CYS A 431 -4.716 -5.880 -0.430 1.00 0.00 O ATOM 363 CB CYS A 431 -1.858 -7.405 -0.088 1.00 0.00 C ATOM 364 SG CYS A 431 -0.856 -8.825 0.411 1.00 0.00 S ATOM 0 H CYS A 431 -4.538 -8.336 -0.220 1.00 0.00 H new ATOM 0 HA CYS A 431 -2.796 -7.105 1.822 1.00 0.00 H new ATOM 0 HB2 CYS A 431 -2.170 -7.540 -1.124 1.00 0.00 H new ATOM 0 HB3 CYS A 431 -1.240 -6.508 -0.056 1.00 0.00 H new ATOM 0 HG CYS A 431 -1.572 -9.908 0.341 1.00 0.00 H new ATOM 370 N VAL A 432 -3.324 -4.773 0.948 1.00 0.00 N ATOM 371 CA VAL A 432 -3.894 -3.464 0.651 1.00 0.00 C ATOM 372 C VAL A 432 -2.835 -2.516 0.099 1.00 0.00 C ATOM 373 O VAL A 432 -1.735 -2.413 0.642 1.00 0.00 O ATOM 374 CB VAL A 432 -4.531 -2.832 1.902 1.00 0.00 C ATOM 375 CG1 VAL A 432 -5.914 -3.416 2.151 1.00 0.00 C ATOM 376 CG2 VAL A 432 -3.634 -3.031 3.115 1.00 0.00 C ATOM 0 H VAL A 432 -2.556 -4.756 1.619 1.00 0.00 H new ATOM 0 HA VAL A 432 -4.667 -3.619 -0.102 1.00 0.00 H new ATOM 0 HB VAL A 432 -4.640 -1.761 1.730 1.00 0.00 H new ATOM 0 HG11 VAL A 432 -6.348 -2.957 3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 432 -6.553 -3.217 1.291 1.00 0.00 H new ATOM 0 HG13 VAL A 432 -5.833 -4.492 2.302 1.00 0.00 H new ATOM 0 HG21 VAL A 432 -4.100 -2.578 3.990 1.00 0.00 H new ATOM 0 HG22 VAL A 432 -3.491 -4.097 3.291 1.00 0.00 H new ATOM 0 HG23 VAL A 432 -2.668 -2.560 2.934 1.00 0.00 H new ATOM 386 N TYR A 433 -3.175 -1.824 -0.983 1.00 0.00 N ATOM 387 CA TYR A 433 -2.253 -0.884 -1.610 1.00 0.00 C ATOM 388 C TYR A 433 -2.498 0.536 -1.109 1.00 0.00 C ATOM 389 O TYR A 433 -3.612 1.054 -1.194 1.00 0.00 O ATOM 390 CB TYR A 433 -2.400 -0.933 -3.132 1.00 0.00 C ATOM 391 CG TYR A 433 -1.439 -0.022 -3.862 1.00 0.00 C ATOM 392 CD1 TYR A 433 -0.160 0.207 -3.371 1.00 0.00 C ATOM 393 CD2 TYR A 433 -1.811 0.610 -5.042 1.00 0.00 C ATOM 394 CE1 TYR A 433 0.722 1.038 -4.035 1.00 0.00 C ATOM 395 CE2 TYR A 433 -0.936 1.442 -5.713 1.00 0.00 C ATOM 396 CZ TYR A 433 0.329 1.653 -5.205 1.00 0.00 C ATOM 397 OH TYR A 433 1.204 2.483 -5.870 1.00 0.00 O ATOM 0 H TYR A 433 -4.082 -1.896 -1.444 1.00 0.00 H new ATOM 0 HA TYR A 433 -1.238 -1.174 -1.340 1.00 0.00 H new ATOM 0 HB2 TYR A 433 -2.245 -1.957 -3.471 1.00 0.00 H new ATOM 0 HB3 TYR A 433 -3.421 -0.660 -3.399 1.00 0.00 H new ATOM 0 HD1 TYR A 433 0.150 -0.273 -2.455 1.00 0.00 H new ATOM 0 HD2 TYR A 433 -2.801 0.448 -5.441 1.00 0.00 H new ATOM 0 HE1 TYR A 433 1.713 1.205 -3.640 1.00 0.00 H new ATOM 0 HE2 TYR A 433 -1.241 1.924 -6.630 1.00 0.00 H new ATOM 0 HH TYR A 433 1.016 2.454 -6.831 1.00 0.00 H new ATOM 407 N LEU A 434 -1.448 1.161 -0.588 1.00 0.00 N ATOM 408 CA LEU A 434 -1.546 2.522 -0.073 1.00 0.00 C ATOM 409 C LEU A 434 -0.721 3.485 -0.920 1.00 0.00 C ATOM 410 O LEU A 434 0.450 3.233 -1.204 1.00 0.00 O ATOM 411 CB LEU A 434 -1.077 2.573 1.382 1.00 0.00 C ATOM 412 CG LEU A 434 -1.990 1.897 2.406 1.00 0.00 C ATOM 413 CD1 LEU A 434 -1.220 1.578 3.678 1.00 0.00 C ATOM 414 CD2 LEU A 434 -3.192 2.777 2.713 1.00 0.00 C ATOM 0 H LEU A 434 -0.519 0.747 -0.511 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.591 2.828 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.092 2.110 1.442 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.956 3.618 1.667 1.00 0.00 H new ATOM 0 HG LEU A 434 -2.351 0.961 1.980 1.00 0.00 H new ATOM 0 HD11 LEU A 434 -1.885 1.097 4.395 1.00 0.00 H new ATOM 0 HD12 LEU A 434 -0.393 0.907 3.444 1.00 0.00 H new ATOM 0 HD13 LEU A 434 -0.829 2.500 4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -3.830 2.279 3.443 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -2.851 3.730 3.118 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -3.757 2.953 1.798 1.00 0.00 H new ATOM 426 N LYS A 435 -1.338 4.592 -1.319 1.00 0.00 N ATOM 427 CA LYS A 435 -0.660 5.597 -2.130 1.00 0.00 C ATOM 428 C LYS A 435 -0.793 6.982 -1.505 1.00 0.00 C ATOM 429 O LYS A 435 -1.897 7.506 -1.364 1.00 0.00 O ATOM 430 CB LYS A 435 -1.234 5.609 -3.548 1.00 0.00 C ATOM 431 CG LYS A 435 -1.202 4.251 -4.229 1.00 0.00 C ATOM 432 CD LYS A 435 -2.153 4.198 -5.413 1.00 0.00 C ATOM 433 CE LYS A 435 -1.471 4.644 -6.697 1.00 0.00 C ATOM 434 NZ LYS A 435 -2.456 4.974 -7.763 1.00 0.00 N ATOM 0 H LYS A 435 -2.307 4.816 -1.094 1.00 0.00 H new ATOM 0 HA LYS A 435 0.398 5.338 -2.174 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -2.264 5.963 -3.511 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -0.673 6.322 -4.152 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -0.188 4.036 -4.566 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -1.470 3.476 -3.511 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -2.529 3.182 -5.534 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -3.015 4.836 -5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -0.850 5.516 -6.494 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -0.807 3.854 -7.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -1.951 5.273 -8.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -3.032 4.135 -7.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -3.074 5.745 -7.438 1.00 0.00 H new ATOM 448 N GLY A 436 0.340 7.570 -1.133 1.00 0.00 N ATOM 449 CA GLY A 436 0.327 8.889 -0.528 1.00 0.00 C ATOM 450 C GLY A 436 1.334 9.021 0.598 1.00 0.00 C ATOM 451 O GLY A 436 1.732 10.129 0.958 1.00 0.00 O ATOM 0 H GLY A 436 1.266 7.157 -1.240 1.00 0.00 H new ATOM 0 HA2 GLY A 436 0.540 9.637 -1.291 1.00 0.00 H new ATOM 0 HA3 GLY A 436 -0.671 9.100 -0.145 1.00 0.00 H new ATOM 455 N LEU A 437 1.745 7.888 1.157 1.00 0.00 N ATOM 456 CA LEU A 437 2.710 7.881 2.250 1.00 0.00 C ATOM 457 C LEU A 437 3.723 9.010 2.091 1.00 0.00 C ATOM 458 O LEU A 437 4.050 9.431 0.981 1.00 0.00 O ATOM 459 CB LEU A 437 3.435 6.535 2.308 1.00 0.00 C ATOM 460 CG LEU A 437 2.571 5.321 2.652 1.00 0.00 C ATOM 461 CD1 LEU A 437 3.344 4.032 2.419 1.00 0.00 C ATOM 462 CD2 LEU A 437 2.088 5.402 4.093 1.00 0.00 C ATOM 0 H LEU A 437 1.425 6.963 0.871 1.00 0.00 H new ATOM 0 HA LEU A 437 2.166 8.035 3.182 1.00 0.00 H new ATOM 0 HB2 LEU A 437 3.907 6.358 1.342 1.00 0.00 H new ATOM 0 HB3 LEU A 437 4.235 6.607 3.045 1.00 0.00 H new ATOM 0 HG LEU A 437 1.700 5.321 1.997 1.00 0.00 H new ATOM 0 HD11 LEU A 437 2.713 3.179 2.669 1.00 0.00 H new ATOM 0 HD12 LEU A 437 3.640 3.970 1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 437 4.234 4.022 3.049 1.00 0.00 H new ATOM 0 HD21 LEU A 437 1.475 4.530 4.321 1.00 0.00 H new ATOM 0 HD22 LEU A 437 2.947 5.427 4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.496 6.307 4.228 1.00 0.00 H new ATOM 474 N PRO A 438 4.233 9.513 3.225 1.00 0.00 N ATOM 475 CA PRO A 438 5.218 10.598 3.236 1.00 0.00 C ATOM 476 C PRO A 438 6.577 10.154 2.707 1.00 0.00 C ATOM 477 O PRO A 438 6.786 8.976 2.415 1.00 0.00 O ATOM 478 CB PRO A 438 5.317 10.971 4.718 1.00 0.00 C ATOM 479 CG PRO A 438 4.916 9.735 5.447 1.00 0.00 C ATOM 480 CD PRO A 438 3.888 9.060 4.583 1.00 0.00 C ATOM 0 HA PRO A 438 4.920 11.425 2.592 1.00 0.00 H new ATOM 0 HB2 PRO A 438 6.329 11.276 4.983 1.00 0.00 H new ATOM 0 HB3 PRO A 438 4.659 11.805 4.961 1.00 0.00 H new ATOM 0 HG2 PRO A 438 5.774 9.084 5.613 1.00 0.00 H new ATOM 0 HG3 PRO A 438 4.504 9.976 6.427 1.00 0.00 H new ATOM 0 HD2 PRO A 438 3.940 7.975 4.670 1.00 0.00 H new ATOM 0 HD3 PRO A 438 2.875 9.354 4.859 1.00 0.00 H new ATOM 488 N PHE A 439 7.499 11.103 2.584 1.00 0.00 N ATOM 489 CA PHE A 439 8.838 10.809 2.089 1.00 0.00 C ATOM 490 C PHE A 439 9.625 9.987 3.105 1.00 0.00 C ATOM 491 O PHE A 439 10.255 8.989 2.755 1.00 0.00 O ATOM 492 CB PHE A 439 9.586 12.107 1.777 1.00 0.00 C ATOM 493 CG PHE A 439 9.012 12.866 0.615 1.00 0.00 C ATOM 494 CD1 PHE A 439 8.860 12.256 -0.620 1.00 0.00 C ATOM 495 CD2 PHE A 439 8.625 14.188 0.757 1.00 0.00 C ATOM 496 CE1 PHE A 439 8.333 12.952 -1.691 1.00 0.00 C ATOM 497 CE2 PHE A 439 8.097 14.889 -0.311 1.00 0.00 C ATOM 498 CZ PHE A 439 7.950 14.270 -1.536 1.00 0.00 C ATOM 0 H PHE A 439 7.343 12.083 2.821 1.00 0.00 H new ATOM 0 HA PHE A 439 8.740 10.225 1.174 1.00 0.00 H new ATOM 0 HB2 PHE A 439 9.572 12.746 2.660 1.00 0.00 H new ATOM 0 HB3 PHE A 439 10.630 11.874 1.568 1.00 0.00 H new ATOM 0 HD1 PHE A 439 9.157 11.225 -0.747 1.00 0.00 H new ATOM 0 HD2 PHE A 439 8.737 14.677 1.713 1.00 0.00 H new ATOM 0 HE1 PHE A 439 8.221 12.466 -2.649 1.00 0.00 H new ATOM 0 HE2 PHE A 439 7.800 15.920 -0.187 1.00 0.00 H new ATOM 0 HZ PHE A 439 7.536 14.815 -2.372 1.00 0.00 H new ATOM 508 N GLU A 440 9.584 10.414 4.363 1.00 0.00 N ATOM 509 CA GLU A 440 10.295 9.718 5.429 1.00 0.00 C ATOM 510 C GLU A 440 9.369 8.745 6.155 1.00 0.00 C ATOM 511 O GLU A 440 9.518 8.508 7.353 1.00 0.00 O ATOM 512 CB GLU A 440 10.878 10.723 6.424 1.00 0.00 C ATOM 513 CG GLU A 440 9.823 11.493 7.200 1.00 0.00 C ATOM 514 CD GLU A 440 10.357 12.786 7.786 1.00 0.00 C ATOM 515 OE1 GLU A 440 10.615 13.727 7.007 1.00 0.00 O ATOM 516 OE2 GLU A 440 10.518 12.856 9.022 1.00 0.00 O ATOM 0 H GLU A 440 9.066 11.238 4.669 1.00 0.00 H new ATOM 0 HA GLU A 440 11.109 9.150 4.978 1.00 0.00 H new ATOM 0 HB2 GLU A 440 11.520 10.194 7.128 1.00 0.00 H new ATOM 0 HB3 GLU A 440 11.509 11.430 5.886 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.984 11.716 6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 440 9.439 10.865 8.004 1.00 0.00 H new ATOM 523 N ALA A 441 8.414 8.186 5.419 1.00 0.00 N ATOM 524 CA ALA A 441 7.466 7.238 5.991 1.00 0.00 C ATOM 525 C ALA A 441 8.178 5.994 6.511 1.00 0.00 C ATOM 526 O ALA A 441 9.220 5.601 5.987 1.00 0.00 O ATOM 527 CB ALA A 441 6.415 6.855 4.959 1.00 0.00 C ATOM 0 H ALA A 441 8.276 8.373 4.426 1.00 0.00 H new ATOM 0 HA ALA A 441 6.972 7.720 6.835 1.00 0.00 H new ATOM 0 HB1 ALA A 441 5.714 6.147 5.400 1.00 0.00 H new ATOM 0 HB2 ALA A 441 5.877 7.747 4.639 1.00 0.00 H new ATOM 0 HB3 ALA A 441 6.901 6.396 4.098 1.00 0.00 H new ATOM 533 N GLU A 442 7.610 5.381 7.544 1.00 0.00 N ATOM 534 CA GLU A 442 8.193 4.182 8.135 1.00 0.00 C ATOM 535 C GLU A 442 7.112 3.156 8.462 1.00 0.00 C ATOM 536 O GLU A 442 5.938 3.497 8.596 1.00 0.00 O ATOM 537 CB GLU A 442 8.973 4.539 9.402 1.00 0.00 C ATOM 538 CG GLU A 442 10.318 5.188 9.126 1.00 0.00 C ATOM 539 CD GLU A 442 11.410 4.173 8.846 1.00 0.00 C ATOM 540 OE1 GLU A 442 11.209 3.316 7.960 1.00 0.00 O ATOM 541 OE2 GLU A 442 12.464 4.235 9.513 1.00 0.00 O ATOM 0 H GLU A 442 6.747 5.694 7.989 1.00 0.00 H new ATOM 0 HA GLU A 442 8.877 3.744 7.407 1.00 0.00 H new ATOM 0 HB2 GLU A 442 8.371 5.214 10.011 1.00 0.00 H new ATOM 0 HB3 GLU A 442 9.129 3.634 9.989 1.00 0.00 H new ATOM 0 HG2 GLU A 442 10.225 5.860 8.273 1.00 0.00 H new ATOM 0 HG3 GLU A 442 10.605 5.798 9.982 1.00 0.00 H new ATOM 548 N ASN A 443 7.518 1.897 8.588 1.00 0.00 N ATOM 549 CA ASN A 443 6.585 0.819 8.898 1.00 0.00 C ATOM 550 C ASN A 443 5.624 1.235 10.008 1.00 0.00 C ATOM 551 O ASN A 443 4.444 0.886 9.985 1.00 0.00 O ATOM 552 CB ASN A 443 7.348 -0.440 9.314 1.00 0.00 C ATOM 553 CG ASN A 443 8.031 -1.116 8.141 1.00 0.00 C ATOM 554 OD1 ASN A 443 8.921 -0.543 7.512 1.00 0.00 O ATOM 555 ND2 ASN A 443 7.617 -2.341 7.841 1.00 0.00 N ATOM 0 H ASN A 443 8.487 1.598 8.480 1.00 0.00 H new ATOM 0 HA ASN A 443 6.005 0.604 8.001 1.00 0.00 H new ATOM 0 HB2 ASN A 443 8.094 -0.178 10.064 1.00 0.00 H new ATOM 0 HB3 ASN A 443 6.658 -1.142 9.783 1.00 0.00 H new ATOM 0 HD21 ASN A 443 8.040 -2.846 7.062 1.00 0.00 H new ATOM 0 HD22 ASN A 443 6.876 -2.778 8.390 1.00 0.00 H new ATOM 562 N LYS A 444 6.137 1.983 10.978 1.00 0.00 N ATOM 563 CA LYS A 444 5.326 2.449 12.096 1.00 0.00 C ATOM 564 C LYS A 444 4.159 3.299 11.605 1.00 0.00 C ATOM 565 O LYS A 444 3.039 3.182 12.103 1.00 0.00 O ATOM 566 CB LYS A 444 6.183 3.257 13.073 1.00 0.00 C ATOM 567 CG LYS A 444 6.700 4.562 12.493 1.00 0.00 C ATOM 568 CD LYS A 444 7.365 5.420 13.557 1.00 0.00 C ATOM 569 CE LYS A 444 8.719 4.858 13.962 1.00 0.00 C ATOM 570 NZ LYS A 444 9.173 5.396 15.274 1.00 0.00 N ATOM 0 H LYS A 444 7.112 2.280 11.013 1.00 0.00 H new ATOM 0 HA LYS A 444 4.925 1.575 12.610 1.00 0.00 H new ATOM 0 HB2 LYS A 444 5.596 3.473 13.965 1.00 0.00 H new ATOM 0 HB3 LYS A 444 7.030 2.649 13.389 1.00 0.00 H new ATOM 0 HG2 LYS A 444 7.414 4.350 11.697 1.00 0.00 H new ATOM 0 HG3 LYS A 444 5.875 5.114 12.043 1.00 0.00 H new ATOM 0 HD2 LYS A 444 7.489 6.436 13.181 1.00 0.00 H new ATOM 0 HD3 LYS A 444 6.719 5.481 14.433 1.00 0.00 H new ATOM 0 HE2 LYS A 444 8.659 3.771 14.016 1.00 0.00 H new ATOM 0 HE3 LYS A 444 9.456 5.099 13.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 10.099 4.989 15.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 9.254 6.431 15.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 8.483 5.144 16.010 1.00 0.00 H new ATOM 584 N HIS A 445 4.428 4.154 10.623 1.00 0.00 N ATOM 585 CA HIS A 445 3.398 5.022 10.062 1.00 0.00 C ATOM 586 C HIS A 445 2.268 4.200 9.450 1.00 0.00 C ATOM 587 O HIS A 445 1.091 4.473 9.686 1.00 0.00 O ATOM 588 CB HIS A 445 4.002 5.947 9.005 1.00 0.00 C ATOM 589 CG HIS A 445 4.840 7.047 9.580 1.00 0.00 C ATOM 590 ND1 HIS A 445 6.151 6.870 9.968 1.00 0.00 N ATOM 591 CD2 HIS A 445 4.548 8.345 9.829 1.00 0.00 C ATOM 592 CE1 HIS A 445 6.628 8.011 10.434 1.00 0.00 C ATOM 593 NE2 HIS A 445 5.675 8.922 10.360 1.00 0.00 N ATOM 0 H HIS A 445 5.349 4.264 10.200 1.00 0.00 H new ATOM 0 HA HIS A 445 2.987 5.626 10.871 1.00 0.00 H new ATOM 0 HB2 HIS A 445 4.612 5.356 8.322 1.00 0.00 H new ATOM 0 HB3 HIS A 445 3.197 6.385 8.415 1.00 0.00 H new ATOM 0 HD2 HIS A 445 3.604 8.836 9.644 1.00 0.00 H new ATOM 0 HE1 HIS A 445 7.627 8.171 10.811 1.00 0.00 H new ATOM 0 HE2 HIS A 445 5.762 9.896 10.650 1.00 0.00 H new ATOM 602 N VAL A 446 2.634 3.193 8.663 1.00 0.00 N ATOM 603 CA VAL A 446 1.651 2.331 8.018 1.00 0.00 C ATOM 604 C VAL A 446 0.864 1.528 9.047 1.00 0.00 C ATOM 605 O VAL A 446 -0.346 1.344 8.913 1.00 0.00 O ATOM 606 CB VAL A 446 2.321 1.360 7.028 1.00 0.00 C ATOM 607 CG1 VAL A 446 1.280 0.466 6.370 1.00 0.00 C ATOM 608 CG2 VAL A 446 3.113 2.129 5.981 1.00 0.00 C ATOM 0 H VAL A 446 3.604 2.954 8.457 1.00 0.00 H new ATOM 0 HA VAL A 446 0.969 2.982 7.472 1.00 0.00 H new ATOM 0 HB VAL A 446 3.014 0.725 7.581 1.00 0.00 H new ATOM 0 HG11 VAL A 446 1.772 -0.213 5.674 1.00 0.00 H new ATOM 0 HG12 VAL A 446 0.761 -0.111 7.135 1.00 0.00 H new ATOM 0 HG13 VAL A 446 0.561 1.082 5.829 1.00 0.00 H new ATOM 0 HG21 VAL A 446 3.580 1.427 5.290 1.00 0.00 H new ATOM 0 HG22 VAL A 446 2.443 2.789 5.430 1.00 0.00 H new ATOM 0 HG23 VAL A 446 3.885 2.722 6.472 1.00 0.00 H new ATOM 618 N ILE A 447 1.559 1.052 10.075 1.00 0.00 N ATOM 619 CA ILE A 447 0.925 0.269 11.128 1.00 0.00 C ATOM 620 C ILE A 447 -0.254 1.020 11.736 1.00 0.00 C ATOM 621 O ILE A 447 -1.346 0.469 11.883 1.00 0.00 O ATOM 622 CB ILE A 447 1.925 -0.085 12.245 1.00 0.00 C ATOM 623 CG1 ILE A 447 3.002 -1.032 11.714 1.00 0.00 C ATOM 624 CG2 ILE A 447 1.198 -0.710 13.427 1.00 0.00 C ATOM 625 CD1 ILE A 447 4.307 -0.951 12.475 1.00 0.00 C ATOM 0 H ILE A 447 2.561 1.195 10.201 1.00 0.00 H new ATOM 0 HA ILE A 447 0.568 -0.651 10.666 1.00 0.00 H new ATOM 0 HB ILE A 447 2.409 0.831 12.584 1.00 0.00 H new ATOM 0 HG12 ILE A 447 2.628 -2.055 11.758 1.00 0.00 H new ATOM 0 HG13 ILE A 447 3.188 -0.805 10.664 1.00 0.00 H new ATOM 0 HG21 ILE A 447 1.917 -0.955 14.208 1.00 0.00 H new ATOM 0 HG22 ILE A 447 0.464 -0.005 13.817 1.00 0.00 H new ATOM 0 HG23 ILE A 447 0.691 -1.619 13.103 1.00 0.00 H new ATOM 0 HD11 ILE A 447 5.024 -1.650 12.043 1.00 0.00 H new ATOM 0 HD12 ILE A 447 4.704 0.062 12.410 1.00 0.00 H new ATOM 0 HD13 ILE A 447 4.135 -1.207 13.520 1.00 0.00 H new ATOM 637 N ASP A 448 -0.028 2.281 12.087 1.00 0.00 N ATOM 638 CA ASP A 448 -1.073 3.110 12.677 1.00 0.00 C ATOM 639 C ASP A 448 -2.240 3.283 11.710 1.00 0.00 C ATOM 640 O ASP A 448 -3.402 3.125 12.087 1.00 0.00 O ATOM 641 CB ASP A 448 -0.511 4.478 13.067 1.00 0.00 C ATOM 642 CG ASP A 448 -1.270 5.110 14.217 1.00 0.00 C ATOM 643 OD1 ASP A 448 -0.945 4.803 15.383 1.00 0.00 O ATOM 644 OD2 ASP A 448 -2.188 5.913 13.950 1.00 0.00 O ATOM 0 H ASP A 448 0.870 2.752 11.973 1.00 0.00 H new ATOM 0 HA ASP A 448 -1.438 2.607 13.573 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.538 4.371 13.343 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -0.547 5.142 12.203 1.00 0.00 H new ATOM 649 N PHE A 449 -1.924 3.610 10.461 1.00 0.00 N ATOM 650 CA PHE A 449 -2.946 3.807 9.440 1.00 0.00 C ATOM 651 C PHE A 449 -4.060 2.773 9.579 1.00 0.00 C ATOM 652 O PHE A 449 -5.243 3.105 9.504 1.00 0.00 O ATOM 653 CB PHE A 449 -2.326 3.719 8.044 1.00 0.00 C ATOM 654 CG PHE A 449 -3.253 4.159 6.948 1.00 0.00 C ATOM 655 CD1 PHE A 449 -3.341 5.495 6.591 1.00 0.00 C ATOM 656 CD2 PHE A 449 -4.037 3.237 6.273 1.00 0.00 C ATOM 657 CE1 PHE A 449 -4.194 5.902 5.582 1.00 0.00 C ATOM 658 CE2 PHE A 449 -4.891 3.638 5.264 1.00 0.00 C ATOM 659 CZ PHE A 449 -4.969 4.973 4.917 1.00 0.00 C ATOM 0 H PHE A 449 -0.968 3.744 10.132 1.00 0.00 H new ATOM 0 HA PHE A 449 -3.375 4.799 9.578 1.00 0.00 H new ATOM 0 HB2 PHE A 449 -1.426 4.333 8.016 1.00 0.00 H new ATOM 0 HB3 PHE A 449 -2.017 2.691 7.857 1.00 0.00 H new ATOM 0 HD1 PHE A 449 -2.737 6.226 7.107 1.00 0.00 H new ATOM 0 HD2 PHE A 449 -3.980 2.192 6.539 1.00 0.00 H new ATOM 0 HE1 PHE A 449 -4.254 6.947 5.314 1.00 0.00 H new ATOM 0 HE2 PHE A 449 -5.497 2.909 4.747 1.00 0.00 H new ATOM 0 HZ PHE A 449 -5.635 5.289 4.127 1.00 0.00 H new ATOM 669 N PHE A 450 -3.673 1.519 9.783 1.00 0.00 N ATOM 670 CA PHE A 450 -4.638 0.435 9.931 1.00 0.00 C ATOM 671 C PHE A 450 -4.642 -0.098 11.361 1.00 0.00 C ATOM 672 O PHE A 450 -4.542 -1.304 11.587 1.00 0.00 O ATOM 673 CB PHE A 450 -4.319 -0.698 8.954 1.00 0.00 C ATOM 674 CG PHE A 450 -4.626 -0.359 7.523 1.00 0.00 C ATOM 675 CD1 PHE A 450 -5.883 0.096 7.159 1.00 0.00 C ATOM 676 CD2 PHE A 450 -3.658 -0.496 6.541 1.00 0.00 C ATOM 677 CE1 PHE A 450 -6.169 0.409 5.844 1.00 0.00 C ATOM 678 CE2 PHE A 450 -3.938 -0.185 5.224 1.00 0.00 C ATOM 679 CZ PHE A 450 -5.195 0.267 4.875 1.00 0.00 C ATOM 0 H PHE A 450 -2.698 1.227 9.850 1.00 0.00 H new ATOM 0 HA PHE A 450 -5.628 0.831 9.706 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -3.263 -0.955 9.040 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -4.887 -1.584 9.239 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.649 0.207 7.912 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -2.673 -0.850 6.808 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.153 0.764 5.574 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -3.174 -0.295 4.468 1.00 0.00 H new ATOM 0 HZ PHE A 450 -5.416 0.509 3.846 1.00 0.00 H new ATOM 689 N LYS A 451 -4.757 0.811 12.324 1.00 0.00 N ATOM 690 CA LYS A 451 -4.774 0.435 13.733 1.00 0.00 C ATOM 691 C LYS A 451 -5.935 -0.510 14.029 1.00 0.00 C ATOM 692 O LYS A 451 -6.923 -0.545 13.296 1.00 0.00 O ATOM 693 CB LYS A 451 -4.880 1.682 14.613 1.00 0.00 C ATOM 694 CG LYS A 451 -3.534 2.267 15.003 1.00 0.00 C ATOM 695 CD LYS A 451 -3.586 2.922 16.373 1.00 0.00 C ATOM 696 CE LYS A 451 -3.653 1.885 17.484 1.00 0.00 C ATOM 697 NZ LYS A 451 -4.283 2.433 18.717 1.00 0.00 N ATOM 0 H LYS A 451 -4.840 1.813 12.154 1.00 0.00 H new ATOM 0 HA LYS A 451 -3.841 -0.082 13.957 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -5.457 2.441 14.085 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.434 1.432 15.518 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -2.781 1.479 15.004 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -3.226 3.002 14.259 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -2.705 3.549 16.512 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -4.456 3.577 16.432 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -4.220 1.020 17.140 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -2.647 1.535 17.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -4.310 1.696 19.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -3.728 3.243 19.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -5.252 2.744 18.503 1.00 0.00 H new ATOM 711 N LYS A 452 -5.809 -1.274 15.109 1.00 0.00 N ATOM 712 CA LYS A 452 -6.848 -2.217 15.505 1.00 0.00 C ATOM 713 C LYS A 452 -6.932 -3.379 14.521 1.00 0.00 C ATOM 714 O LYS A 452 -7.987 -3.995 14.360 1.00 0.00 O ATOM 715 CB LYS A 452 -8.202 -1.509 15.592 1.00 0.00 C ATOM 716 CG LYS A 452 -9.142 -2.117 16.619 1.00 0.00 C ATOM 717 CD LYS A 452 -8.669 -1.845 18.037 1.00 0.00 C ATOM 718 CE LYS A 452 -9.191 -2.892 19.009 1.00 0.00 C ATOM 719 NZ LYS A 452 -8.721 -2.641 20.400 1.00 0.00 N ATOM 0 H LYS A 452 -4.997 -1.258 15.726 1.00 0.00 H new ATOM 0 HA LYS A 452 -6.589 -2.614 16.487 1.00 0.00 H new ATOM 0 HB2 LYS A 452 -8.039 -0.460 15.838 1.00 0.00 H new ATOM 0 HB3 LYS A 452 -8.680 -1.536 14.613 1.00 0.00 H new ATOM 0 HG2 LYS A 452 -10.144 -1.709 16.484 1.00 0.00 H new ATOM 0 HG3 LYS A 452 -9.212 -3.193 16.458 1.00 0.00 H new ATOM 0 HD2 LYS A 452 -7.579 -1.834 18.063 1.00 0.00 H new ATOM 0 HD3 LYS A 452 -9.005 -0.856 18.350 1.00 0.00 H new ATOM 0 HE2 LYS A 452 -10.281 -2.895 18.989 1.00 0.00 H new ATOM 0 HE3 LYS A 452 -8.864 -3.881 18.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 452 -9.098 -3.376 21.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 452 -7.682 -2.663 20.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 452 -9.055 -1.708 20.716 1.00 0.00 H new ATOM 733 N LEU A 453 -5.815 -3.674 13.865 1.00 0.00 N ATOM 734 CA LEU A 453 -5.762 -4.764 12.897 1.00 0.00 C ATOM 735 C LEU A 453 -4.472 -5.564 13.047 1.00 0.00 C ATOM 736 O LEU A 453 -3.537 -5.131 13.721 1.00 0.00 O ATOM 737 CB LEU A 453 -5.872 -4.214 11.474 1.00 0.00 C ATOM 738 CG LEU A 453 -7.011 -3.225 11.222 1.00 0.00 C ATOM 739 CD1 LEU A 453 -6.950 -2.691 9.800 1.00 0.00 C ATOM 740 CD2 LEU A 453 -8.357 -3.882 11.490 1.00 0.00 C ATOM 0 H LEU A 453 -4.934 -3.174 13.986 1.00 0.00 H new ATOM 0 HA LEU A 453 -6.604 -5.429 13.089 1.00 0.00 H new ATOM 0 HB2 LEU A 453 -4.931 -3.725 11.221 1.00 0.00 H new ATOM 0 HB3 LEU A 453 -5.989 -5.054 10.789 1.00 0.00 H new ATOM 0 HG LEU A 453 -6.896 -2.386 11.908 1.00 0.00 H new ATOM 0 HD11 LEU A 453 -7.768 -1.989 9.640 1.00 0.00 H new ATOM 0 HD12 LEU A 453 -5.999 -2.182 9.643 1.00 0.00 H new ATOM 0 HD13 LEU A 453 -7.039 -3.519 9.096 1.00 0.00 H new ATOM 0 HD21 LEU A 453 -9.156 -3.164 11.306 1.00 0.00 H new ATOM 0 HD22 LEU A 453 -8.481 -4.740 10.829 1.00 0.00 H new ATOM 0 HD23 LEU A 453 -8.400 -4.214 12.527 1.00 0.00 H new ATOM 752 N ASP A 454 -4.428 -6.730 12.413 1.00 0.00 N ATOM 753 CA ASP A 454 -3.251 -7.589 12.473 1.00 0.00 C ATOM 754 C ASP A 454 -2.395 -7.426 11.221 1.00 0.00 C ATOM 755 O ASP A 454 -2.656 -8.052 10.193 1.00 0.00 O ATOM 756 CB ASP A 454 -3.668 -9.052 12.634 1.00 0.00 C ATOM 757 CG ASP A 454 -4.080 -9.383 14.055 1.00 0.00 C ATOM 758 OD1 ASP A 454 -5.103 -8.837 14.519 1.00 0.00 O ATOM 759 OD2 ASP A 454 -3.380 -10.189 14.703 1.00 0.00 O ATOM 0 H ASP A 454 -5.194 -7.102 11.851 1.00 0.00 H new ATOM 0 HA ASP A 454 -2.658 -7.291 13.338 1.00 0.00 H new ATOM 0 HB2 ASP A 454 -4.496 -9.267 11.959 1.00 0.00 H new ATOM 0 HB3 ASP A 454 -2.841 -9.697 12.339 1.00 0.00 H new ATOM 764 N ILE A 455 -1.373 -6.582 11.314 1.00 0.00 N ATOM 765 CA ILE A 455 -0.480 -6.337 10.189 1.00 0.00 C ATOM 766 C ILE A 455 0.907 -6.914 10.453 1.00 0.00 C ATOM 767 O ILE A 455 1.592 -6.508 11.392 1.00 0.00 O ATOM 768 CB ILE A 455 -0.349 -4.832 9.890 1.00 0.00 C ATOM 769 CG1 ILE A 455 -1.724 -4.226 9.603 1.00 0.00 C ATOM 770 CG2 ILE A 455 0.592 -4.604 8.716 1.00 0.00 C ATOM 771 CD1 ILE A 455 -1.758 -2.718 9.729 1.00 0.00 C ATOM 0 H ILE A 455 -1.143 -6.056 12.157 1.00 0.00 H new ATOM 0 HA ILE A 455 -0.920 -6.833 9.324 1.00 0.00 H new ATOM 0 HB ILE A 455 0.070 -4.338 10.767 1.00 0.00 H new ATOM 0 HG12 ILE A 455 -2.032 -4.505 8.595 1.00 0.00 H new ATOM 0 HG13 ILE A 455 -2.452 -4.657 10.290 1.00 0.00 H new ATOM 0 HG21 ILE A 455 0.674 -3.535 8.517 1.00 0.00 H new ATOM 0 HG22 ILE A 455 1.577 -5.005 8.956 1.00 0.00 H new ATOM 0 HG23 ILE A 455 0.200 -5.108 7.833 1.00 0.00 H new ATOM 0 HD11 ILE A 455 -2.763 -2.357 9.512 1.00 0.00 H new ATOM 0 HD12 ILE A 455 -1.481 -2.431 10.743 1.00 0.00 H new ATOM 0 HD13 ILE A 455 -1.054 -2.278 9.023 1.00 0.00 H new ATOM 783 N VAL A 456 1.317 -7.862 9.616 1.00 0.00 N ATOM 784 CA VAL A 456 2.624 -8.493 9.756 1.00 0.00 C ATOM 785 C VAL A 456 3.746 -7.505 9.458 1.00 0.00 C ATOM 786 O VAL A 456 3.975 -7.140 8.306 1.00 0.00 O ATOM 787 CB VAL A 456 2.763 -9.709 8.821 1.00 0.00 C ATOM 788 CG1 VAL A 456 3.891 -10.616 9.289 1.00 0.00 C ATOM 789 CG2 VAL A 456 1.451 -10.474 8.743 1.00 0.00 C ATOM 0 H VAL A 456 0.763 -8.210 8.834 1.00 0.00 H new ATOM 0 HA VAL A 456 2.705 -8.828 10.790 1.00 0.00 H new ATOM 0 HB VAL A 456 3.008 -9.350 7.821 1.00 0.00 H new ATOM 0 HG11 VAL A 456 3.974 -11.470 8.616 1.00 0.00 H new ATOM 0 HG12 VAL A 456 4.829 -10.060 9.288 1.00 0.00 H new ATOM 0 HG13 VAL A 456 3.679 -10.969 10.298 1.00 0.00 H new ATOM 0 HG21 VAL A 456 1.568 -11.330 8.078 1.00 0.00 H new ATOM 0 HG22 VAL A 456 1.173 -10.823 9.738 1.00 0.00 H new ATOM 0 HG23 VAL A 456 0.670 -9.819 8.357 1.00 0.00 H new ATOM 799 N GLU A 457 4.443 -7.076 10.506 1.00 0.00 N ATOM 800 CA GLU A 457 5.542 -6.129 10.355 1.00 0.00 C ATOM 801 C GLU A 457 6.412 -6.492 9.155 1.00 0.00 C ATOM 802 O GLU A 457 6.973 -5.617 8.495 1.00 0.00 O ATOM 803 CB GLU A 457 6.395 -6.097 11.626 1.00 0.00 C ATOM 804 CG GLU A 457 5.907 -5.098 12.661 1.00 0.00 C ATOM 805 CD GLU A 457 6.876 -4.934 13.815 1.00 0.00 C ATOM 806 OE1 GLU A 457 7.513 -5.937 14.201 1.00 0.00 O ATOM 807 OE2 GLU A 457 6.998 -3.804 14.333 1.00 0.00 O ATOM 0 H GLU A 457 4.267 -7.369 11.467 1.00 0.00 H new ATOM 0 HA GLU A 457 5.115 -5.140 10.187 1.00 0.00 H new ATOM 0 HB2 GLU A 457 6.407 -7.092 12.071 1.00 0.00 H new ATOM 0 HB3 GLU A 457 7.424 -5.856 11.357 1.00 0.00 H new ATOM 0 HG2 GLU A 457 5.751 -4.131 12.182 1.00 0.00 H new ATOM 0 HG3 GLU A 457 4.940 -5.423 13.046 1.00 0.00 H new ATOM 814 N ASP A 458 6.519 -7.787 8.879 1.00 0.00 N ATOM 815 CA ASP A 458 7.319 -8.266 7.758 1.00 0.00 C ATOM 816 C ASP A 458 6.652 -7.927 6.429 1.00 0.00 C ATOM 817 O ASP A 458 7.260 -7.305 5.559 1.00 0.00 O ATOM 818 CB ASP A 458 7.532 -9.777 7.865 1.00 0.00 C ATOM 819 CG ASP A 458 8.589 -10.141 8.890 1.00 0.00 C ATOM 820 OD1 ASP A 458 8.230 -10.329 10.071 1.00 0.00 O ATOM 821 OD2 ASP A 458 9.774 -10.239 8.510 1.00 0.00 O ATOM 0 H ASP A 458 6.062 -8.524 9.416 1.00 0.00 H new ATOM 0 HA ASP A 458 8.287 -7.766 7.795 1.00 0.00 H new ATOM 0 HB2 ASP A 458 6.590 -10.256 8.133 1.00 0.00 H new ATOM 0 HB3 ASP A 458 7.824 -10.170 6.891 1.00 0.00 H new ATOM 826 N SER A 459 5.398 -8.342 6.280 1.00 0.00 N ATOM 827 CA SER A 459 4.649 -8.087 5.055 1.00 0.00 C ATOM 828 C SER A 459 4.763 -6.622 4.643 1.00 0.00 C ATOM 829 O SER A 459 5.081 -6.312 3.495 1.00 0.00 O ATOM 830 CB SER A 459 3.178 -8.462 5.244 1.00 0.00 C ATOM 831 OG SER A 459 2.599 -7.734 6.314 1.00 0.00 O ATOM 0 H SER A 459 4.879 -8.856 6.992 1.00 0.00 H new ATOM 0 HA SER A 459 5.075 -8.703 4.263 1.00 0.00 H new ATOM 0 HB2 SER A 459 2.628 -8.263 4.325 1.00 0.00 H new ATOM 0 HB3 SER A 459 3.094 -9.531 5.440 1.00 0.00 H new ATOM 0 HG SER A 459 3.287 -7.531 6.982 1.00 0.00 H new ATOM 837 N ILE A 460 4.502 -5.727 5.589 1.00 0.00 N ATOM 838 CA ILE A 460 4.577 -4.295 5.326 1.00 0.00 C ATOM 839 C ILE A 460 5.747 -3.965 4.406 1.00 0.00 C ATOM 840 O ILE A 460 6.909 -4.079 4.797 1.00 0.00 O ATOM 841 CB ILE A 460 4.722 -3.490 6.631 1.00 0.00 C ATOM 842 CG1 ILE A 460 3.679 -3.944 7.655 1.00 0.00 C ATOM 843 CG2 ILE A 460 4.585 -2.000 6.353 1.00 0.00 C ATOM 844 CD1 ILE A 460 3.459 -2.950 8.774 1.00 0.00 C ATOM 0 H ILE A 460 4.237 -5.968 6.544 1.00 0.00 H new ATOM 0 HA ILE A 460 3.644 -4.015 4.837 1.00 0.00 H new ATOM 0 HB ILE A 460 5.714 -3.673 7.045 1.00 0.00 H new ATOM 0 HG12 ILE A 460 2.732 -4.119 7.144 1.00 0.00 H new ATOM 0 HG13 ILE A 460 3.992 -4.897 8.082 1.00 0.00 H new ATOM 0 HG21 ILE A 460 4.690 -1.445 7.285 1.00 0.00 H new ATOM 0 HG22 ILE A 460 5.362 -1.687 5.655 1.00 0.00 H new ATOM 0 HG23 ILE A 460 3.605 -1.799 5.919 1.00 0.00 H new ATOM 0 HD11 ILE A 460 2.707 -3.337 9.462 1.00 0.00 H new ATOM 0 HD12 ILE A 460 4.395 -2.793 9.310 1.00 0.00 H new ATOM 0 HD13 ILE A 460 3.116 -2.003 8.357 1.00 0.00 H new ATOM 856 N TYR A 461 5.432 -3.555 3.182 1.00 0.00 N ATOM 857 CA TYR A 461 6.457 -3.208 2.205 1.00 0.00 C ATOM 858 C TYR A 461 6.233 -1.804 1.654 1.00 0.00 C ATOM 859 O TYR A 461 5.130 -1.463 1.225 1.00 0.00 O ATOM 860 CB TYR A 461 6.464 -4.223 1.060 1.00 0.00 C ATOM 861 CG TYR A 461 7.660 -4.094 0.144 1.00 0.00 C ATOM 862 CD1 TYR A 461 7.839 -2.963 -0.642 1.00 0.00 C ATOM 863 CD2 TYR A 461 8.610 -5.104 0.065 1.00 0.00 C ATOM 864 CE1 TYR A 461 8.930 -2.842 -1.481 1.00 0.00 C ATOM 865 CE2 TYR A 461 9.705 -4.991 -0.770 1.00 0.00 C ATOM 866 CZ TYR A 461 9.860 -3.858 -1.541 1.00 0.00 C ATOM 867 OH TYR A 461 10.949 -3.741 -2.375 1.00 0.00 O ATOM 0 H TYR A 461 4.475 -3.455 2.843 1.00 0.00 H new ATOM 0 HA TYR A 461 7.424 -3.230 2.708 1.00 0.00 H new ATOM 0 HB2 TYR A 461 6.444 -5.230 1.478 1.00 0.00 H new ATOM 0 HB3 TYR A 461 5.553 -4.103 0.474 1.00 0.00 H new ATOM 0 HD1 TYR A 461 7.113 -2.165 -0.597 1.00 0.00 H new ATOM 0 HD2 TYR A 461 8.491 -5.993 0.667 1.00 0.00 H new ATOM 0 HE1 TYR A 461 9.054 -1.956 -2.087 1.00 0.00 H new ATOM 0 HE2 TYR A 461 10.435 -5.785 -0.819 1.00 0.00 H new ATOM 0 HH TYR A 461 11.508 -4.542 -2.298 1.00 0.00 H new ATOM 877 N ILE A 462 7.286 -0.994 1.669 1.00 0.00 N ATOM 878 CA ILE A 462 7.205 0.373 1.170 1.00 0.00 C ATOM 879 C ILE A 462 8.256 0.629 0.095 1.00 0.00 C ATOM 880 O ILE A 462 9.428 0.293 0.267 1.00 0.00 O ATOM 881 CB ILE A 462 7.386 1.399 2.304 1.00 0.00 C ATOM 882 CG1 ILE A 462 6.247 1.276 3.319 1.00 0.00 C ATOM 883 CG2 ILE A 462 7.448 2.810 1.738 1.00 0.00 C ATOM 884 CD1 ILE A 462 6.496 2.037 4.602 1.00 0.00 C ATOM 0 H ILE A 462 8.205 -1.261 2.021 1.00 0.00 H new ATOM 0 HA ILE A 462 6.211 0.493 0.739 1.00 0.00 H new ATOM 0 HB ILE A 462 8.327 1.192 2.814 1.00 0.00 H new ATOM 0 HG12 ILE A 462 5.325 1.639 2.864 1.00 0.00 H new ATOM 0 HG13 ILE A 462 6.093 0.223 3.555 1.00 0.00 H new ATOM 0 HG21 ILE A 462 7.576 3.523 2.552 1.00 0.00 H new ATOM 0 HG22 ILE A 462 8.290 2.889 1.050 1.00 0.00 H new ATOM 0 HG23 ILE A 462 6.523 3.029 1.206 1.00 0.00 H new ATOM 0 HD11 ILE A 462 5.648 1.905 5.274 1.00 0.00 H new ATOM 0 HD12 ILE A 462 7.400 1.659 5.080 1.00 0.00 H new ATOM 0 HD13 ILE A 462 6.620 3.097 4.378 1.00 0.00 H new ATOM 896 N ALA A 463 7.830 1.228 -1.012 1.00 0.00 N ATOM 897 CA ALA A 463 8.735 1.533 -2.113 1.00 0.00 C ATOM 898 C ALA A 463 9.501 2.825 -1.851 1.00 0.00 C ATOM 899 O ALA A 463 8.911 3.849 -1.506 1.00 0.00 O ATOM 900 CB ALA A 463 7.963 1.630 -3.420 1.00 0.00 C ATOM 0 H ALA A 463 6.863 1.512 -1.170 1.00 0.00 H new ATOM 0 HA ALA A 463 9.459 0.722 -2.192 1.00 0.00 H new ATOM 0 HB1 ALA A 463 8.652 1.858 -4.233 1.00 0.00 H new ATOM 0 HB2 ALA A 463 7.466 0.681 -3.621 1.00 0.00 H new ATOM 0 HB3 ALA A 463 7.217 2.421 -3.344 1.00 0.00 H new ATOM 906 N TYR A 464 10.818 2.770 -2.017 1.00 0.00 N ATOM 907 CA TYR A 464 11.666 3.936 -1.796 1.00 0.00 C ATOM 908 C TYR A 464 12.365 4.353 -3.086 1.00 0.00 C ATOM 909 O TYR A 464 12.704 3.516 -3.921 1.00 0.00 O ATOM 910 CB TYR A 464 12.704 3.640 -0.712 1.00 0.00 C ATOM 911 CG TYR A 464 12.097 3.233 0.612 1.00 0.00 C ATOM 912 CD1 TYR A 464 11.211 4.070 1.279 1.00 0.00 C ATOM 913 CD2 TYR A 464 12.411 2.013 1.197 1.00 0.00 C ATOM 914 CE1 TYR A 464 10.655 3.703 2.489 1.00 0.00 C ATOM 915 CE2 TYR A 464 11.859 1.637 2.406 1.00 0.00 C ATOM 916 CZ TYR A 464 10.982 2.486 3.048 1.00 0.00 C ATOM 917 OH TYR A 464 10.431 2.115 4.253 1.00 0.00 O ATOM 0 H TYR A 464 11.322 1.931 -2.304 1.00 0.00 H new ATOM 0 HA TYR A 464 11.031 4.758 -1.466 1.00 0.00 H new ATOM 0 HB2 TYR A 464 13.364 2.845 -1.060 1.00 0.00 H new ATOM 0 HB3 TYR A 464 13.323 4.525 -0.562 1.00 0.00 H new ATOM 0 HD1 TYR A 464 10.953 5.024 0.844 1.00 0.00 H new ATOM 0 HD2 TYR A 464 13.099 1.347 0.698 1.00 0.00 H new ATOM 0 HE1 TYR A 464 9.968 4.366 2.994 1.00 0.00 H new ATOM 0 HE2 TYR A 464 12.113 0.684 2.846 1.00 0.00 H new ATOM 0 HH TYR A 464 10.764 1.229 4.506 1.00 0.00 H new ATOM 927 N GLY A 465 12.579 5.657 -3.241 1.00 0.00 N ATOM 928 CA GLY A 465 13.238 6.164 -4.430 1.00 0.00 C ATOM 929 C GLY A 465 14.749 6.118 -4.320 1.00 0.00 C ATOM 930 O GLY A 465 15.307 5.815 -3.265 1.00 0.00 O ATOM 0 H GLY A 465 12.308 6.370 -2.564 1.00 0.00 H new ATOM 0 HA2 GLY A 465 12.922 5.579 -5.294 1.00 0.00 H new ATOM 0 HA3 GLY A 465 12.921 7.192 -4.607 1.00 0.00 H new ATOM 934 N PRO A 466 15.437 6.421 -5.431 1.00 0.00 N ATOM 935 CA PRO A 466 16.902 6.419 -5.481 1.00 0.00 C ATOM 936 C PRO A 466 17.511 7.560 -4.674 1.00 0.00 C ATOM 937 O PRO A 466 18.711 7.569 -4.402 1.00 0.00 O ATOM 938 CB PRO A 466 17.206 6.595 -6.971 1.00 0.00 C ATOM 939 CG PRO A 466 16.009 7.290 -7.522 1.00 0.00 C ATOM 940 CD PRO A 466 14.837 6.791 -6.724 1.00 0.00 C ATOM 0 HA PRO A 466 17.324 5.511 -5.051 1.00 0.00 H new ATOM 0 HB2 PRO A 466 18.111 7.183 -7.124 1.00 0.00 H new ATOM 0 HB3 PRO A 466 17.365 5.633 -7.459 1.00 0.00 H new ATOM 0 HG2 PRO A 466 16.110 8.372 -7.432 1.00 0.00 H new ATOM 0 HG3 PRO A 466 15.882 7.068 -8.582 1.00 0.00 H new ATOM 0 HD2 PRO A 466 14.074 7.560 -6.607 1.00 0.00 H new ATOM 0 HD3 PRO A 466 14.358 5.937 -7.204 1.00 0.00 H new ATOM 948 N ASN A 467 16.676 8.522 -4.294 1.00 0.00 N ATOM 949 CA ASN A 467 17.134 9.669 -3.518 1.00 0.00 C ATOM 950 C ASN A 467 16.685 9.555 -2.064 1.00 0.00 C ATOM 951 O ASN A 467 16.404 10.559 -1.410 1.00 0.00 O ATOM 952 CB ASN A 467 16.603 10.968 -4.127 1.00 0.00 C ATOM 953 CG ASN A 467 16.484 10.892 -5.637 1.00 0.00 C ATOM 954 OD1 ASN A 467 17.390 10.413 -6.319 1.00 0.00 O ATOM 955 ND2 ASN A 467 15.362 11.365 -6.167 1.00 0.00 N ATOM 0 H ASN A 467 15.679 8.530 -4.511 1.00 0.00 H new ATOM 0 HA ASN A 467 18.224 9.683 -3.544 1.00 0.00 H new ATOM 0 HB2 ASN A 467 15.626 11.194 -3.699 1.00 0.00 H new ATOM 0 HB3 ASN A 467 17.267 11.790 -3.858 1.00 0.00 H new ATOM 0 HD21 ASN A 467 15.225 11.340 -7.177 1.00 0.00 H new ATOM 0 HD22 ASN A 467 14.637 11.753 -5.564 1.00 0.00 H new ATOM 962 N GLY A 468 16.620 8.325 -1.564 1.00 0.00 N ATOM 963 CA GLY A 468 16.206 8.103 -0.191 1.00 0.00 C ATOM 964 C GLY A 468 14.891 8.783 0.134 1.00 0.00 C ATOM 965 O GLY A 468 14.679 9.237 1.259 1.00 0.00 O ATOM 0 H GLY A 468 16.847 7.478 -2.085 1.00 0.00 H new ATOM 0 HA2 GLY A 468 16.112 7.032 -0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 468 16.979 8.472 0.483 1.00 0.00 H new ATOM 969 N LYS A 469 14.004 8.855 -0.852 1.00 0.00 N ATOM 970 CA LYS A 469 12.702 9.485 -0.667 1.00 0.00 C ATOM 971 C LYS A 469 11.576 8.535 -1.063 1.00 0.00 C ATOM 972 O LYS A 469 11.447 8.163 -2.229 1.00 0.00 O ATOM 973 CB LYS A 469 12.612 10.771 -1.491 1.00 0.00 C ATOM 974 CG LYS A 469 13.495 11.891 -0.970 1.00 0.00 C ATOM 975 CD LYS A 469 12.787 12.707 0.099 1.00 0.00 C ATOM 976 CE LYS A 469 13.428 14.075 0.272 1.00 0.00 C ATOM 977 NZ LYS A 469 12.783 14.857 1.363 1.00 0.00 N ATOM 0 H LYS A 469 14.163 8.484 -1.789 1.00 0.00 H new ATOM 0 HA LYS A 469 12.592 9.730 0.390 1.00 0.00 H new ATOM 0 HB2 LYS A 469 12.889 10.552 -2.522 1.00 0.00 H new ATOM 0 HB3 LYS A 469 11.577 11.112 -1.504 1.00 0.00 H new ATOM 0 HG2 LYS A 469 14.413 11.471 -0.560 1.00 0.00 H new ATOM 0 HG3 LYS A 469 13.783 12.542 -1.795 1.00 0.00 H new ATOM 0 HD2 LYS A 469 11.737 12.827 -0.169 1.00 0.00 H new ATOM 0 HD3 LYS A 469 12.814 12.169 1.047 1.00 0.00 H new ATOM 0 HE2 LYS A 469 14.489 13.954 0.491 1.00 0.00 H new ATOM 0 HE3 LYS A 469 13.357 14.630 -0.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 13.249 15.783 1.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 11.776 14.995 1.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 12.873 14.340 2.261 1.00 0.00 H new ATOM 991 N ALA A 470 10.764 8.147 -0.085 1.00 0.00 N ATOM 992 CA ALA A 470 9.647 7.243 -0.333 1.00 0.00 C ATOM 993 C ALA A 470 8.804 7.723 -1.509 1.00 0.00 C ATOM 994 O ALA A 470 8.230 8.812 -1.473 1.00 0.00 O ATOM 995 CB ALA A 470 8.788 7.110 0.916 1.00 0.00 C ATOM 0 H ALA A 470 10.859 8.444 0.886 1.00 0.00 H new ATOM 0 HA ALA A 470 10.053 6.264 -0.587 1.00 0.00 H new ATOM 0 HB1 ALA A 470 7.958 6.432 0.716 1.00 0.00 H new ATOM 0 HB2 ALA A 470 9.392 6.714 1.732 1.00 0.00 H new ATOM 0 HB3 ALA A 470 8.398 8.089 1.195 1.00 0.00 H new ATOM 1001 N THR A 471 8.732 6.903 -2.554 1.00 0.00 N ATOM 1002 CA THR A 471 7.960 7.245 -3.742 1.00 0.00 C ATOM 1003 C THR A 471 6.498 7.496 -3.394 1.00 0.00 C ATOM 1004 O THR A 471 5.815 8.271 -4.061 1.00 0.00 O ATOM 1005 CB THR A 471 8.040 6.131 -4.803 1.00 0.00 C ATOM 1006 OG1 THR A 471 7.143 5.067 -4.465 1.00 0.00 O ATOM 1007 CG2 THR A 471 9.458 5.590 -4.914 1.00 0.00 C ATOM 0 H THR A 471 9.199 5.998 -2.601 1.00 0.00 H new ATOM 0 HA THR A 471 8.395 8.157 -4.150 1.00 0.00 H new ATOM 0 HB THR A 471 7.754 6.555 -5.765 1.00 0.00 H new ATOM 0 HG1 THR A 471 7.199 4.364 -5.145 1.00 0.00 H new ATOM 0 HG21 THR A 471 9.490 4.805 -5.669 1.00 0.00 H new ATOM 0 HG22 THR A 471 10.134 6.396 -5.200 1.00 0.00 H new ATOM 0 HG23 THR A 471 9.768 5.181 -3.952 1.00 0.00 H new ATOM 1015 N GLY A 472 6.022 6.834 -2.343 1.00 0.00 N ATOM 1016 CA GLY A 472 4.643 6.999 -1.924 1.00 0.00 C ATOM 1017 C GLY A 472 3.792 5.783 -2.235 1.00 0.00 C ATOM 1018 O GLY A 472 2.591 5.903 -2.470 1.00 0.00 O ATOM 0 H GLY A 472 6.568 6.186 -1.775 1.00 0.00 H new ATOM 0 HA2 GLY A 472 4.613 7.195 -0.852 1.00 0.00 H new ATOM 0 HA3 GLY A 472 4.218 7.872 -2.419 1.00 0.00 H new ATOM 1022 N GLU A 473 4.418 4.610 -2.236 1.00 0.00 N ATOM 1023 CA GLU A 473 3.710 3.368 -2.523 1.00 0.00 C ATOM 1024 C GLU A 473 4.012 2.313 -1.463 1.00 0.00 C ATOM 1025 O GLU A 473 5.138 1.830 -1.354 1.00 0.00 O ATOM 1026 CB GLU A 473 4.098 2.842 -3.907 1.00 0.00 C ATOM 1027 CG GLU A 473 3.910 3.859 -5.020 1.00 0.00 C ATOM 1028 CD GLU A 473 4.669 3.491 -6.280 1.00 0.00 C ATOM 1029 OE1 GLU A 473 4.973 2.294 -6.463 1.00 0.00 O ATOM 1030 OE2 GLU A 473 4.958 4.402 -7.084 1.00 0.00 O ATOM 0 H GLU A 473 5.413 4.494 -2.042 1.00 0.00 H new ATOM 0 HA GLU A 473 2.640 3.577 -2.509 1.00 0.00 H new ATOM 0 HB2 GLU A 473 5.141 2.527 -3.887 1.00 0.00 H new ATOM 0 HB3 GLU A 473 3.502 1.957 -4.130 1.00 0.00 H new ATOM 0 HG2 GLU A 473 2.849 3.946 -5.252 1.00 0.00 H new ATOM 0 HG3 GLU A 473 4.242 4.838 -4.673 1.00 0.00 H new ATOM 1037 N GLY A 474 2.995 1.961 -0.681 1.00 0.00 N ATOM 1038 CA GLY A 474 3.171 0.966 0.361 1.00 0.00 C ATOM 1039 C GLY A 474 2.196 -0.187 0.233 1.00 0.00 C ATOM 1040 O GLY A 474 1.179 -0.077 -0.454 1.00 0.00 O ATOM 0 H GLY A 474 2.053 2.347 -0.751 1.00 0.00 H new ATOM 0 HA2 GLY A 474 4.190 0.582 0.323 1.00 0.00 H new ATOM 0 HA3 GLY A 474 3.044 1.438 1.335 1.00 0.00 H new ATOM 1044 N PHE A 475 2.506 -1.298 0.892 1.00 0.00 N ATOM 1045 CA PHE A 475 1.650 -2.478 0.847 1.00 0.00 C ATOM 1046 C PHE A 475 1.584 -3.156 2.212 1.00 0.00 C ATOM 1047 O PHE A 475 2.587 -3.252 2.919 1.00 0.00 O ATOM 1048 CB PHE A 475 2.165 -3.467 -0.201 1.00 0.00 C ATOM 1049 CG PHE A 475 2.433 -2.838 -1.539 1.00 0.00 C ATOM 1050 CD1 PHE A 475 1.390 -2.542 -2.402 1.00 0.00 C ATOM 1051 CD2 PHE A 475 3.728 -2.541 -1.932 1.00 0.00 C ATOM 1052 CE1 PHE A 475 1.635 -1.964 -3.633 1.00 0.00 C ATOM 1053 CE2 PHE A 475 3.978 -1.963 -3.162 1.00 0.00 C ATOM 1054 CZ PHE A 475 2.930 -1.673 -4.013 1.00 0.00 C ATOM 0 H PHE A 475 3.344 -1.406 1.464 1.00 0.00 H new ATOM 0 HA PHE A 475 0.645 -2.157 0.572 1.00 0.00 H new ATOM 0 HB2 PHE A 475 3.083 -3.927 0.165 1.00 0.00 H new ATOM 0 HB3 PHE A 475 1.435 -4.267 -0.324 1.00 0.00 H new ATOM 0 HD1 PHE A 475 0.375 -2.765 -2.109 1.00 0.00 H new ATOM 0 HD2 PHE A 475 4.551 -2.764 -1.270 1.00 0.00 H new ATOM 0 HE1 PHE A 475 0.814 -1.740 -4.298 1.00 0.00 H new ATOM 0 HE2 PHE A 475 4.992 -1.738 -3.457 1.00 0.00 H new ATOM 0 HZ PHE A 475 3.123 -1.219 -4.974 1.00 0.00 H new ATOM 1064 N VAL A 476 0.395 -3.623 2.578 1.00 0.00 N ATOM 1065 CA VAL A 476 0.196 -4.292 3.858 1.00 0.00 C ATOM 1066 C VAL A 476 -0.655 -5.546 3.696 1.00 0.00 C ATOM 1067 O VAL A 476 -1.537 -5.603 2.840 1.00 0.00 O ATOM 1068 CB VAL A 476 -0.475 -3.358 4.881 1.00 0.00 C ATOM 1069 CG1 VAL A 476 -1.049 -4.158 6.040 1.00 0.00 C ATOM 1070 CG2 VAL A 476 0.515 -2.316 5.381 1.00 0.00 C ATOM 0 H VAL A 476 -0.446 -3.550 2.005 1.00 0.00 H new ATOM 0 HA VAL A 476 1.183 -4.572 4.226 1.00 0.00 H new ATOM 0 HB VAL A 476 -1.297 -2.839 4.387 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -1.519 -3.480 6.753 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -1.792 -4.861 5.664 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -0.248 -4.707 6.535 1.00 0.00 H new ATOM 0 HG21 VAL A 476 0.024 -1.664 6.103 1.00 0.00 H new ATOM 0 HG22 VAL A 476 1.359 -2.815 5.858 1.00 0.00 H new ATOM 0 HG23 VAL A 476 0.873 -1.721 4.541 1.00 0.00 H new ATOM 1080 N GLU A 477 -0.385 -6.550 4.526 1.00 0.00 N ATOM 1081 CA GLU A 477 -1.127 -7.804 4.474 1.00 0.00 C ATOM 1082 C GLU A 477 -1.693 -8.158 5.846 1.00 0.00 C ATOM 1083 O GLU A 477 -0.972 -8.165 6.844 1.00 0.00 O ATOM 1084 CB GLU A 477 -0.226 -8.935 3.974 1.00 0.00 C ATOM 1085 CG GLU A 477 -0.839 -10.316 4.132 1.00 0.00 C ATOM 1086 CD GLU A 477 -0.110 -11.374 3.326 1.00 0.00 C ATOM 1087 OE1 GLU A 477 0.360 -11.054 2.215 1.00 0.00 O ATOM 1088 OE2 GLU A 477 -0.011 -12.522 3.807 1.00 0.00 O ATOM 0 H GLU A 477 0.341 -6.519 5.241 1.00 0.00 H new ATOM 0 HA GLU A 477 -1.957 -7.677 3.779 1.00 0.00 H new ATOM 0 HB2 GLU A 477 0.004 -8.767 2.922 1.00 0.00 H new ATOM 0 HB3 GLU A 477 0.719 -8.902 4.516 1.00 0.00 H new ATOM 0 HG2 GLU A 477 -0.828 -10.596 5.185 1.00 0.00 H new ATOM 0 HG3 GLU A 477 -1.883 -10.284 3.821 1.00 0.00 H new ATOM 1095 N PHE A 478 -2.988 -8.451 5.888 1.00 0.00 N ATOM 1096 CA PHE A 478 -3.652 -8.804 7.137 1.00 0.00 C ATOM 1097 C PHE A 478 -3.775 -10.319 7.279 1.00 0.00 C ATOM 1098 O PHE A 478 -4.524 -10.963 6.544 1.00 0.00 O ATOM 1099 CB PHE A 478 -5.039 -8.161 7.202 1.00 0.00 C ATOM 1100 CG PHE A 478 -5.007 -6.660 7.157 1.00 0.00 C ATOM 1101 CD1 PHE A 478 -4.562 -5.931 8.248 1.00 0.00 C ATOM 1102 CD2 PHE A 478 -5.420 -5.979 6.024 1.00 0.00 C ATOM 1103 CE1 PHE A 478 -4.532 -4.550 8.209 1.00 0.00 C ATOM 1104 CE2 PHE A 478 -5.392 -4.598 5.979 1.00 0.00 C ATOM 1105 CZ PHE A 478 -4.946 -3.882 7.073 1.00 0.00 C ATOM 0 H PHE A 478 -3.599 -8.451 5.071 1.00 0.00 H new ATOM 0 HA PHE A 478 -3.045 -8.427 7.960 1.00 0.00 H new ATOM 0 HB2 PHE A 478 -5.640 -8.529 6.371 1.00 0.00 H new ATOM 0 HB3 PHE A 478 -5.535 -8.478 8.119 1.00 0.00 H new ATOM 0 HD1 PHE A 478 -4.235 -6.448 9.138 1.00 0.00 H new ATOM 0 HD2 PHE A 478 -5.768 -6.534 5.165 1.00 0.00 H new ATOM 0 HE1 PHE A 478 -4.185 -3.993 9.067 1.00 0.00 H new ATOM 0 HE2 PHE A 478 -5.718 -4.079 5.090 1.00 0.00 H new ATOM 0 HZ PHE A 478 -4.921 -2.803 7.040 1.00 0.00 H new ATOM 1115 N ARG A 479 -3.032 -10.880 8.227 1.00 0.00 N ATOM 1116 CA ARG A 479 -3.055 -12.319 8.464 1.00 0.00 C ATOM 1117 C ARG A 479 -4.472 -12.869 8.331 1.00 0.00 C ATOM 1118 O ARG A 479 -4.716 -13.803 7.568 1.00 0.00 O ATOM 1119 CB ARG A 479 -2.502 -12.637 9.854 1.00 0.00 C ATOM 1120 CG ARG A 479 -0.990 -12.793 9.887 1.00 0.00 C ATOM 1121 CD ARG A 479 -0.514 -13.319 11.232 1.00 0.00 C ATOM 1122 NE ARG A 479 -0.452 -12.266 12.241 1.00 0.00 N ATOM 1123 CZ ARG A 479 0.289 -12.344 13.341 1.00 0.00 C ATOM 1124 NH1 ARG A 479 1.028 -13.421 13.571 1.00 0.00 N ATOM 1125 NH2 ARG A 479 0.293 -11.344 14.213 1.00 0.00 N ATOM 0 H ARG A 479 -2.407 -10.361 8.843 1.00 0.00 H new ATOM 0 HA ARG A 479 -2.426 -12.796 7.712 1.00 0.00 H new ATOM 0 HB2 ARG A 479 -2.792 -11.842 10.542 1.00 0.00 H new ATOM 0 HB3 ARG A 479 -2.962 -13.556 10.217 1.00 0.00 H new ATOM 0 HG2 ARG A 479 -0.676 -13.475 9.097 1.00 0.00 H new ATOM 0 HG3 ARG A 479 -0.519 -11.831 9.684 1.00 0.00 H new ATOM 0 HD2 ARG A 479 -1.186 -14.107 11.571 1.00 0.00 H new ATOM 0 HD3 ARG A 479 0.472 -13.769 11.117 1.00 0.00 H new ATOM 0 HE ARG A 479 -1.008 -11.424 12.093 1.00 0.00 H new ATOM 0 HH11 ARG A 479 1.028 -14.192 12.903 1.00 0.00 H new ATOM 0 HH12 ARG A 479 1.596 -13.479 14.416 1.00 0.00 H new ATOM 0 HH21 ARG A 479 -0.273 -10.514 14.039 1.00 0.00 H new ATOM 0 HH22 ARG A 479 0.862 -11.406 15.057 1.00 0.00 H new ATOM 1139 N ASN A 480 -5.402 -12.283 9.078 1.00 0.00 N ATOM 1140 CA ASN A 480 -6.794 -12.716 9.044 1.00 0.00 C ATOM 1141 C ASN A 480 -7.530 -12.090 7.863 1.00 0.00 C ATOM 1142 O ASN A 480 -7.097 -11.075 7.318 1.00 0.00 O ATOM 1143 CB ASN A 480 -7.497 -12.345 10.352 1.00 0.00 C ATOM 1144 CG ASN A 480 -6.735 -12.820 11.573 1.00 0.00 C ATOM 1145 OD1 ASN A 480 -6.256 -13.954 11.618 1.00 0.00 O ATOM 1146 ND2 ASN A 480 -6.618 -11.953 12.572 1.00 0.00 N ATOM 0 H ASN A 480 -5.217 -11.507 9.714 1.00 0.00 H new ATOM 0 HA ASN A 480 -6.809 -13.799 8.925 1.00 0.00 H new ATOM 0 HB2 ASN A 480 -7.619 -11.263 10.401 1.00 0.00 H new ATOM 0 HB3 ASN A 480 -8.497 -12.779 10.360 1.00 0.00 H new ATOM 0 HD21 ASN A 480 -6.115 -12.216 13.420 1.00 0.00 H new ATOM 0 HD22 ASN A 480 -7.031 -11.024 12.492 1.00 0.00 H new ATOM 1153 N GLU A 481 -8.644 -12.702 7.474 1.00 0.00 N ATOM 1154 CA GLU A 481 -9.439 -12.204 6.358 1.00 0.00 C ATOM 1155 C GLU A 481 -10.526 -11.252 6.846 1.00 0.00 C ATOM 1156 O GLU A 481 -10.980 -10.380 6.106 1.00 0.00 O ATOM 1157 CB GLU A 481 -10.071 -13.370 5.594 1.00 0.00 C ATOM 1158 CG GLU A 481 -10.923 -12.933 4.414 1.00 0.00 C ATOM 1159 CD GLU A 481 -12.000 -13.942 4.067 1.00 0.00 C ATOM 1160 OE1 GLU A 481 -11.655 -15.111 3.798 1.00 0.00 O ATOM 1161 OE2 GLU A 481 -13.190 -13.561 4.066 1.00 0.00 O ATOM 0 H GLU A 481 -9.016 -13.543 7.915 1.00 0.00 H new ATOM 0 HA GLU A 481 -8.776 -11.657 5.688 1.00 0.00 H new ATOM 0 HB2 GLU A 481 -9.281 -14.030 5.236 1.00 0.00 H new ATOM 0 HB3 GLU A 481 -10.686 -13.952 6.280 1.00 0.00 H new ATOM 0 HG2 GLU A 481 -11.389 -11.974 4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 481 -10.282 -12.778 3.546 1.00 0.00 H new ATOM 1168 N ALA A 482 -10.940 -11.427 8.097 1.00 0.00 N ATOM 1169 CA ALA A 482 -11.973 -10.584 8.685 1.00 0.00 C ATOM 1170 C ALA A 482 -11.490 -9.144 8.829 1.00 0.00 C ATOM 1171 O ALA A 482 -12.196 -8.203 8.467 1.00 0.00 O ATOM 1172 CB ALA A 482 -12.399 -11.137 10.037 1.00 0.00 C ATOM 0 H ALA A 482 -10.575 -12.145 8.723 1.00 0.00 H new ATOM 0 HA ALA A 482 -12.834 -10.586 8.016 1.00 0.00 H new ATOM 0 HB1 ALA A 482 -13.171 -10.497 10.465 1.00 0.00 H new ATOM 0 HB2 ALA A 482 -12.793 -12.146 9.910 1.00 0.00 H new ATOM 0 HB3 ALA A 482 -11.539 -11.165 10.706 1.00 0.00 H new ATOM 1178 N ASP A 483 -10.284 -8.980 9.361 1.00 0.00 N ATOM 1179 CA ASP A 483 -9.706 -7.655 9.553 1.00 0.00 C ATOM 1180 C ASP A 483 -9.333 -7.026 8.214 1.00 0.00 C ATOM 1181 O ASP A 483 -9.323 -5.803 8.073 1.00 0.00 O ATOM 1182 CB ASP A 483 -8.472 -7.738 10.453 1.00 0.00 C ATOM 1183 CG ASP A 483 -7.392 -8.630 9.873 1.00 0.00 C ATOM 1184 OD1 ASP A 483 -7.697 -9.401 8.939 1.00 0.00 O ATOM 1185 OD2 ASP A 483 -6.241 -8.555 10.352 1.00 0.00 O ATOM 0 H ASP A 483 -9.687 -9.748 9.667 1.00 0.00 H new ATOM 0 HA ASP A 483 -10.455 -7.026 10.034 1.00 0.00 H new ATOM 0 HB2 ASP A 483 -8.069 -6.737 10.606 1.00 0.00 H new ATOM 0 HB3 ASP A 483 -8.765 -8.117 11.432 1.00 0.00 H new ATOM 1190 N TYR A 484 -9.027 -7.870 7.235 1.00 0.00 N ATOM 1191 CA TYR A 484 -8.650 -7.397 5.908 1.00 0.00 C ATOM 1192 C TYR A 484 -9.757 -6.541 5.300 1.00 0.00 C ATOM 1193 O TYR A 484 -9.504 -5.451 4.785 1.00 0.00 O ATOM 1194 CB TYR A 484 -8.343 -8.580 4.990 1.00 0.00 C ATOM 1195 CG TYR A 484 -8.589 -8.292 3.526 1.00 0.00 C ATOM 1196 CD1 TYR A 484 -8.008 -7.192 2.907 1.00 0.00 C ATOM 1197 CD2 TYR A 484 -9.402 -9.120 2.762 1.00 0.00 C ATOM 1198 CE1 TYR A 484 -8.232 -6.924 1.571 1.00 0.00 C ATOM 1199 CE2 TYR A 484 -9.630 -8.860 1.424 1.00 0.00 C ATOM 1200 CZ TYR A 484 -9.043 -7.761 0.833 1.00 0.00 C ATOM 1201 OH TYR A 484 -9.267 -7.498 -0.499 1.00 0.00 O ATOM 0 H TYR A 484 -9.033 -8.885 7.335 1.00 0.00 H new ATOM 0 HA TYR A 484 -7.755 -6.783 6.010 1.00 0.00 H new ATOM 0 HB2 TYR A 484 -7.301 -8.872 5.124 1.00 0.00 H new ATOM 0 HB3 TYR A 484 -8.954 -9.431 5.292 1.00 0.00 H new ATOM 0 HD1 TYR A 484 -7.370 -6.535 3.480 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -9.864 -9.981 3.222 1.00 0.00 H new ATOM 0 HE1 TYR A 484 -7.774 -6.063 1.106 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -10.265 -9.514 0.844 1.00 0.00 H new ATOM 0 HH TYR A 484 -9.859 -8.184 -0.873 1.00 0.00 H new ATOM 1211 N LYS A 485 -10.986 -7.042 5.363 1.00 0.00 N ATOM 1212 CA LYS A 485 -12.134 -6.325 4.822 1.00 0.00 C ATOM 1213 C LYS A 485 -12.319 -4.984 5.525 1.00 0.00 C ATOM 1214 O LYS A 485 -12.656 -3.983 4.893 1.00 0.00 O ATOM 1215 CB LYS A 485 -13.403 -7.168 4.967 1.00 0.00 C ATOM 1216 CG LYS A 485 -13.450 -8.363 4.030 1.00 0.00 C ATOM 1217 CD LYS A 485 -14.698 -9.200 4.255 1.00 0.00 C ATOM 1218 CE LYS A 485 -14.911 -10.198 3.128 1.00 0.00 C ATOM 1219 NZ LYS A 485 -15.949 -11.209 3.471 1.00 0.00 N ATOM 0 H LYS A 485 -11.212 -7.943 5.784 1.00 0.00 H new ATOM 0 HA LYS A 485 -11.948 -6.138 3.764 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -13.479 -7.520 5.996 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -14.272 -6.537 4.781 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -13.424 -8.017 2.997 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -12.565 -8.980 4.182 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -14.614 -9.732 5.203 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -15.567 -8.546 4.332 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -15.207 -9.667 2.223 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -13.971 -10.703 2.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -16.065 -11.871 2.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -15.655 -11.734 4.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -16.853 -10.729 3.656 1.00 0.00 H new ATOM 1233 N ALA A 486 -12.096 -4.972 6.835 1.00 0.00 N ATOM 1234 CA ALA A 486 -12.234 -3.753 7.622 1.00 0.00 C ATOM 1235 C ALA A 486 -11.311 -2.656 7.102 1.00 0.00 C ATOM 1236 O ALA A 486 -11.728 -1.511 6.931 1.00 0.00 O ATOM 1237 CB ALA A 486 -11.947 -4.036 9.089 1.00 0.00 C ATOM 0 H ALA A 486 -11.819 -5.793 7.374 1.00 0.00 H new ATOM 0 HA ALA A 486 -13.262 -3.403 7.526 1.00 0.00 H new ATOM 0 HB1 ALA A 486 -12.054 -3.117 9.665 1.00 0.00 H new ATOM 0 HB2 ALA A 486 -12.651 -4.781 9.460 1.00 0.00 H new ATOM 0 HB3 ALA A 486 -10.930 -4.414 9.194 1.00 0.00 H new ATOM 1243 N ALA A 487 -10.056 -3.013 6.854 1.00 0.00 N ATOM 1244 CA ALA A 487 -9.074 -2.059 6.353 1.00 0.00 C ATOM 1245 C ALA A 487 -9.666 -1.194 5.245 1.00 0.00 C ATOM 1246 O ALA A 487 -9.512 0.028 5.249 1.00 0.00 O ATOM 1247 CB ALA A 487 -7.837 -2.789 5.852 1.00 0.00 C ATOM 0 H ALA A 487 -9.694 -3.957 6.992 1.00 0.00 H new ATOM 0 HA ALA A 487 -8.787 -1.404 7.176 1.00 0.00 H new ATOM 0 HB1 ALA A 487 -7.112 -2.064 5.481 1.00 0.00 H new ATOM 0 HB2 ALA A 487 -7.395 -3.359 6.669 1.00 0.00 H new ATOM 0 HB3 ALA A 487 -8.116 -3.468 5.046 1.00 0.00 H new ATOM 1253 N LEU A 488 -10.342 -1.835 4.298 1.00 0.00 N ATOM 1254 CA LEU A 488 -10.957 -1.123 3.183 1.00 0.00 C ATOM 1255 C LEU A 488 -11.836 0.018 3.683 1.00 0.00 C ATOM 1256 O LEU A 488 -11.798 1.126 3.145 1.00 0.00 O ATOM 1257 CB LEU A 488 -11.787 -2.087 2.333 1.00 0.00 C ATOM 1258 CG LEU A 488 -11.006 -2.953 1.344 1.00 0.00 C ATOM 1259 CD1 LEU A 488 -10.093 -2.091 0.485 1.00 0.00 C ATOM 1260 CD2 LEU A 488 -10.203 -4.014 2.082 1.00 0.00 C ATOM 0 H LEU A 488 -10.478 -2.846 4.280 1.00 0.00 H new ATOM 0 HA LEU A 488 -10.161 -0.701 2.570 1.00 0.00 H new ATOM 0 HB2 LEU A 488 -12.341 -2.745 3.002 1.00 0.00 H new ATOM 0 HB3 LEU A 488 -12.522 -1.507 1.775 1.00 0.00 H new ATOM 0 HG LEU A 488 -11.718 -3.456 0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 488 -9.545 -2.724 -0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 488 -10.691 -1.370 -0.072 1.00 0.00 H new ATOM 0 HD13 LEU A 488 -9.387 -1.560 1.124 1.00 0.00 H new ATOM 0 HD21 LEU A 488 -9.654 -4.621 1.362 1.00 0.00 H new ATOM 0 HD22 LEU A 488 -9.500 -3.531 2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 488 -10.879 -4.651 2.652 1.00 0.00 H new ATOM 1272 N CYS A 489 -12.624 -0.258 4.716 1.00 0.00 N ATOM 1273 CA CYS A 489 -13.512 0.746 5.290 1.00 0.00 C ATOM 1274 C CYS A 489 -12.748 2.026 5.615 1.00 0.00 C ATOM 1275 O CYS A 489 -13.320 3.116 5.629 1.00 0.00 O ATOM 1276 CB CYS A 489 -14.181 0.203 6.553 1.00 0.00 C ATOM 1277 SG CYS A 489 -15.567 1.204 7.144 1.00 0.00 S ATOM 0 H CYS A 489 -12.666 -1.169 5.173 1.00 0.00 H new ATOM 0 HA CYS A 489 -14.280 0.980 4.553 1.00 0.00 H new ATOM 0 HB2 CYS A 489 -14.535 -0.809 6.357 1.00 0.00 H new ATOM 0 HB3 CYS A 489 -13.435 0.132 7.344 1.00 0.00 H new ATOM 0 HG CYS A 489 -16.068 0.663 8.214 1.00 0.00 H new ATOM 1283 N ARG A 490 -11.453 1.885 5.877 1.00 0.00 N ATOM 1284 CA ARG A 490 -10.611 3.029 6.205 1.00 0.00 C ATOM 1285 C ARG A 490 -10.046 3.669 4.939 1.00 0.00 C ATOM 1286 O ARG A 490 -8.831 3.796 4.784 1.00 0.00 O ATOM 1287 CB ARG A 490 -9.467 2.600 7.126 1.00 0.00 C ATOM 1288 CG ARG A 490 -9.932 1.868 8.374 1.00 0.00 C ATOM 1289 CD ARG A 490 -8.980 2.091 9.538 1.00 0.00 C ATOM 1290 NE ARG A 490 -8.891 3.501 9.910 1.00 0.00 N ATOM 1291 CZ ARG A 490 -8.397 3.925 11.068 1.00 0.00 C ATOM 1292 NH1 ARG A 490 -7.949 3.054 11.961 1.00 0.00 N ATOM 1293 NH2 ARG A 490 -8.350 5.224 11.334 1.00 0.00 N ATOM 0 H ARG A 490 -10.964 0.990 5.869 1.00 0.00 H new ATOM 0 HA ARG A 490 -11.227 3.766 6.721 1.00 0.00 H new ATOM 0 HB2 ARG A 490 -8.786 1.956 6.570 1.00 0.00 H new ATOM 0 HB3 ARG A 490 -8.900 3.482 7.423 1.00 0.00 H new ATOM 0 HG2 ARG A 490 -10.930 2.211 8.648 1.00 0.00 H new ATOM 0 HG3 ARG A 490 -10.008 0.801 8.164 1.00 0.00 H new ATOM 0 HD2 ARG A 490 -9.315 1.510 10.397 1.00 0.00 H new ATOM 0 HD3 ARG A 490 -7.989 1.723 9.272 1.00 0.00 H new ATOM 0 HE ARG A 490 -9.226 4.198 9.245 1.00 0.00 H new ATOM 0 HH11 ARG A 490 -7.983 2.055 11.760 1.00 0.00 H new ATOM 0 HH12 ARG A 490 -7.570 3.383 12.849 1.00 0.00 H new ATOM 0 HH21 ARG A 490 -8.693 5.898 10.649 1.00 0.00 H new ATOM 0 HH22 ARG A 490 -7.971 5.549 12.223 1.00 0.00 H new ATOM 1307 N HIS A 491 -10.937 4.069 4.037 1.00 0.00 N ATOM 1308 CA HIS A 491 -10.528 4.696 2.786 1.00 0.00 C ATOM 1309 C HIS A 491 -10.557 6.217 2.905 1.00 0.00 C ATOM 1310 O HIS A 491 -11.444 6.784 3.542 1.00 0.00 O ATOM 1311 CB HIS A 491 -11.438 4.245 1.643 1.00 0.00 C ATOM 1312 CG HIS A 491 -11.113 4.886 0.329 1.00 0.00 C ATOM 1313 ND1 HIS A 491 -11.918 5.298 -0.678 1.00 0.00 N flip ATOM 1314 CD2 HIS A 491 -9.825 5.169 -0.072 1.00 0.00 C flip ATOM 1315 CE1 HIS A 491 -11.110 5.818 -1.659 1.00 0.00 C flip ATOM 1316 NE2 HIS A 491 -9.851 5.729 -1.268 1.00 0.00 N flip ATOM 0 H HIS A 491 -11.946 3.970 4.149 1.00 0.00 H new ATOM 0 HA HIS A 491 -9.506 4.385 2.571 1.00 0.00 H new ATOM 0 HB2 HIS A 491 -11.365 3.163 1.537 1.00 0.00 H new ATOM 0 HB3 HIS A 491 -12.472 4.471 1.902 1.00 0.00 H new ATOM 0 HD1 HIS A 491 -12.936 5.234 -0.703 1.00 0.00 H new ATOM 0 HD2 HIS A 491 -8.933 4.965 0.502 1.00 0.00 H new ATOM 0 HE1 HIS A 491 -11.448 6.232 -2.597 1.00 0.00 H new ATOM 1325 N LYS A 492 -9.579 6.873 2.288 1.00 0.00 N ATOM 1326 CA LYS A 492 -9.492 8.328 2.323 1.00 0.00 C ATOM 1327 C LYS A 492 -9.057 8.813 3.703 1.00 0.00 C ATOM 1328 O LYS A 492 -9.717 9.657 4.309 1.00 0.00 O ATOM 1329 CB LYS A 492 -10.841 8.949 1.954 1.00 0.00 C ATOM 1330 CG LYS A 492 -11.506 8.292 0.757 1.00 0.00 C ATOM 1331 CD LYS A 492 -12.450 9.249 0.049 1.00 0.00 C ATOM 1332 CE LYS A 492 -13.314 8.525 -0.973 1.00 0.00 C ATOM 1333 NZ LYS A 492 -14.639 9.183 -1.144 1.00 0.00 N ATOM 0 H LYS A 492 -8.835 6.419 1.758 1.00 0.00 H new ATOM 0 HA LYS A 492 -8.744 8.641 1.594 1.00 0.00 H new ATOM 0 HB2 LYS A 492 -11.509 8.882 2.812 1.00 0.00 H new ATOM 0 HB3 LYS A 492 -10.698 10.009 1.743 1.00 0.00 H new ATOM 0 HG2 LYS A 492 -10.743 7.949 0.058 1.00 0.00 H new ATOM 0 HG3 LYS A 492 -12.058 7.411 1.084 1.00 0.00 H new ATOM 0 HD2 LYS A 492 -13.088 9.742 0.783 1.00 0.00 H new ATOM 0 HD3 LYS A 492 -11.874 10.029 -0.448 1.00 0.00 H new ATOM 0 HE2 LYS A 492 -12.796 8.497 -1.932 1.00 0.00 H new ATOM 0 HE3 LYS A 492 -13.460 7.491 -0.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 -15.198 8.660 -1.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 -15.144 9.188 -0.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 -14.501 10.161 -1.468 1.00 0.00 H new ATOM 1347 N GLN A 493 -7.944 8.276 4.190 1.00 0.00 N ATOM 1348 CA GLN A 493 -7.422 8.655 5.498 1.00 0.00 C ATOM 1349 C GLN A 493 -6.212 9.573 5.355 1.00 0.00 C ATOM 1350 O GLN A 493 -5.561 9.601 4.310 1.00 0.00 O ATOM 1351 CB GLN A 493 -7.040 7.410 6.299 1.00 0.00 C ATOM 1352 CG GLN A 493 -8.226 6.720 6.954 1.00 0.00 C ATOM 1353 CD GLN A 493 -9.061 7.667 7.793 1.00 0.00 C ATOM 1354 OE1 GLN A 493 -8.631 8.116 8.856 1.00 0.00 O ATOM 1355 NE2 GLN A 493 -10.263 7.976 7.320 1.00 0.00 N ATOM 0 H GLN A 493 -7.386 7.577 3.699 1.00 0.00 H new ATOM 0 HA GLN A 493 -8.205 9.195 6.031 1.00 0.00 H new ATOM 0 HB2 GLN A 493 -6.538 6.703 5.638 1.00 0.00 H new ATOM 0 HB3 GLN A 493 -6.322 7.690 7.070 1.00 0.00 H new ATOM 0 HG2 GLN A 493 -8.854 6.274 6.182 1.00 0.00 H new ATOM 0 HG3 GLN A 493 -7.866 5.905 7.582 1.00 0.00 H new ATOM 0 HE21 GLN A 493 -10.580 7.581 6.434 1.00 0.00 H new ATOM 0 HE22 GLN A 493 -10.869 8.608 7.842 1.00 0.00 H new ATOM 1364 N TYR A 494 -5.917 10.323 6.411 1.00 0.00 N ATOM 1365 CA TYR A 494 -4.787 11.245 6.402 1.00 0.00 C ATOM 1366 C TYR A 494 -3.737 10.829 7.429 1.00 0.00 C ATOM 1367 O TYR A 494 -4.055 10.582 8.592 1.00 0.00 O ATOM 1368 CB TYR A 494 -5.262 12.670 6.690 1.00 0.00 C ATOM 1369 CG TYR A 494 -5.928 13.337 5.507 1.00 0.00 C ATOM 1370 CD1 TYR A 494 -7.199 12.958 5.096 1.00 0.00 C ATOM 1371 CD2 TYR A 494 -5.284 14.347 4.802 1.00 0.00 C ATOM 1372 CE1 TYR A 494 -7.811 13.564 4.016 1.00 0.00 C ATOM 1373 CE2 TYR A 494 -5.889 14.960 3.721 1.00 0.00 C ATOM 1374 CZ TYR A 494 -7.152 14.565 3.332 1.00 0.00 C ATOM 1375 OH TYR A 494 -7.758 15.172 2.256 1.00 0.00 O ATOM 0 H TYR A 494 -6.444 10.311 7.284 1.00 0.00 H new ATOM 0 HA TYR A 494 -4.333 11.214 5.412 1.00 0.00 H new ATOM 0 HB2 TYR A 494 -5.961 12.649 7.526 1.00 0.00 H new ATOM 0 HB3 TYR A 494 -4.409 13.272 7.003 1.00 0.00 H new ATOM 0 HD1 TYR A 494 -7.718 12.176 5.630 1.00 0.00 H new ATOM 0 HD2 TYR A 494 -4.295 14.658 5.104 1.00 0.00 H new ATOM 0 HE1 TYR A 494 -8.800 13.256 3.709 1.00 0.00 H new ATOM 0 HE2 TYR A 494 -5.376 15.744 3.184 1.00 0.00 H new ATOM 0 HH TYR A 494 -7.161 15.856 1.887 1.00 0.00 H new ATOM 1385 N MET A 495 -2.486 10.756 6.989 1.00 0.00 N ATOM 1386 CA MET A 495 -1.388 10.372 7.869 1.00 0.00 C ATOM 1387 C MET A 495 -0.763 11.600 8.525 1.00 0.00 C ATOM 1388 O MET A 495 0.244 12.124 8.051 1.00 0.00 O ATOM 1389 CB MET A 495 -0.324 9.601 7.086 1.00 0.00 C ATOM 1390 CG MET A 495 0.517 8.677 7.952 1.00 0.00 C ATOM 1391 SD MET A 495 -0.396 7.226 8.510 1.00 0.00 S ATOM 1392 CE MET A 495 0.045 6.040 7.242 1.00 0.00 C ATOM 0 H MET A 495 -2.207 10.957 6.029 1.00 0.00 H new ATOM 0 HA MET A 495 -1.790 9.728 8.651 1.00 0.00 H new ATOM 0 HB2 MET A 495 -0.812 9.013 6.309 1.00 0.00 H new ATOM 0 HB3 MET A 495 0.332 10.312 6.584 1.00 0.00 H new ATOM 0 HG2 MET A 495 1.393 8.356 7.389 1.00 0.00 H new ATOM 0 HG3 MET A 495 0.880 9.229 8.819 1.00 0.00 H new ATOM 0 HE1 MET A 495 0.021 5.034 7.661 1.00 0.00 H new ATOM 0 HE2 MET A 495 -0.666 6.107 6.418 1.00 0.00 H new ATOM 0 HE3 MET A 495 1.048 6.257 6.874 1.00 0.00 H new ATOM 1402 N GLY A 496 -1.368 12.053 9.619 1.00 0.00 N ATOM 1403 CA GLY A 496 -0.857 13.215 10.322 1.00 0.00 C ATOM 1404 C GLY A 496 -1.099 14.505 9.562 1.00 0.00 C ATOM 1405 O GLY A 496 -2.012 15.262 9.886 1.00 0.00 O ATOM 0 H GLY A 496 -2.203 11.636 10.031 1.00 0.00 H new ATOM 0 HA2 GLY A 496 -1.330 13.280 11.302 1.00 0.00 H new ATOM 0 HA3 GLY A 496 0.213 13.092 10.492 1.00 0.00 H new ATOM 1409 N ASN A 497 -0.276 14.756 8.549 1.00 0.00 N ATOM 1410 CA ASN A 497 -0.403 15.964 7.742 1.00 0.00 C ATOM 1411 C ASN A 497 -0.547 15.618 6.263 1.00 0.00 C ATOM 1412 O ASN A 497 -0.979 16.446 5.461 1.00 0.00 O ATOM 1413 CB ASN A 497 0.812 16.871 7.949 1.00 0.00 C ATOM 1414 CG ASN A 497 0.634 17.817 9.121 1.00 0.00 C ATOM 1415 OD1 ASN A 497 0.178 18.948 8.956 1.00 0.00 O ATOM 1416 ND2 ASN A 497 0.996 17.357 10.313 1.00 0.00 N ATOM 0 H ASN A 497 0.486 14.139 8.268 1.00 0.00 H new ATOM 0 HA ASN A 497 -1.301 16.492 8.062 1.00 0.00 H new ATOM 0 HB2 ASN A 497 1.697 16.256 8.113 1.00 0.00 H new ATOM 0 HB3 ASN A 497 0.989 17.449 7.042 1.00 0.00 H new ATOM 0 HD21 ASN A 497 0.901 17.949 11.138 1.00 0.00 H new ATOM 0 HD22 ASN A 497 1.369 16.412 10.403 1.00 0.00 H new ATOM 1423 N ARG A 498 -0.184 14.390 5.910 1.00 0.00 N ATOM 1424 CA ARG A 498 -0.272 13.934 4.528 1.00 0.00 C ATOM 1425 C ARG A 498 -1.543 13.119 4.305 1.00 0.00 C ATOM 1426 O ARG A 498 -2.267 12.808 5.250 1.00 0.00 O ATOM 1427 CB ARG A 498 0.955 13.096 4.166 1.00 0.00 C ATOM 1428 CG ARG A 498 2.252 13.888 4.153 1.00 0.00 C ATOM 1429 CD ARG A 498 2.530 14.481 2.781 1.00 0.00 C ATOM 1430 NE ARG A 498 3.666 15.398 2.800 1.00 0.00 N ATOM 1431 CZ ARG A 498 4.178 15.957 1.709 1.00 0.00 C ATOM 1432 NH1 ARG A 498 3.658 15.693 0.519 1.00 0.00 N ATOM 1433 NH2 ARG A 498 5.212 16.782 1.808 1.00 0.00 N ATOM 0 H ARG A 498 0.174 13.692 6.562 1.00 0.00 H new ATOM 0 HA ARG A 498 -0.306 14.812 3.883 1.00 0.00 H new ATOM 0 HB2 ARG A 498 1.047 12.276 4.878 1.00 0.00 H new ATOM 0 HB3 ARG A 498 0.802 12.649 3.184 1.00 0.00 H new ATOM 0 HG2 ARG A 498 2.199 14.688 4.892 1.00 0.00 H new ATOM 0 HG3 ARG A 498 3.078 13.240 4.444 1.00 0.00 H new ATOM 0 HD2 ARG A 498 2.725 13.677 2.072 1.00 0.00 H new ATOM 0 HD3 ARG A 498 1.644 15.009 2.428 1.00 0.00 H new ATOM 0 HE ARG A 498 4.090 15.622 3.700 1.00 0.00 H new ATOM 0 HH11 ARG A 498 2.863 15.059 0.439 1.00 0.00 H new ATOM 0 HH12 ARG A 498 4.053 16.124 -0.317 1.00 0.00 H new ATOM 0 HH21 ARG A 498 5.615 16.988 2.722 1.00 0.00 H new ATOM 0 HH22 ARG A 498 5.604 17.211 0.970 1.00 0.00 H new ATOM 1447 N PHE A 499 -1.806 12.777 3.048 1.00 0.00 N ATOM 1448 CA PHE A 499 -2.990 11.999 2.700 1.00 0.00 C ATOM 1449 C PHE A 499 -2.604 10.732 1.941 1.00 0.00 C ATOM 1450 O PHE A 499 -1.698 10.747 1.108 1.00 0.00 O ATOM 1451 CB PHE A 499 -3.949 12.841 1.855 1.00 0.00 C ATOM 1452 CG PHE A 499 -5.133 12.070 1.345 1.00 0.00 C ATOM 1453 CD1 PHE A 499 -6.169 11.722 2.197 1.00 0.00 C ATOM 1454 CD2 PHE A 499 -5.209 11.693 0.014 1.00 0.00 C ATOM 1455 CE1 PHE A 499 -7.260 11.013 1.730 1.00 0.00 C ATOM 1456 CE2 PHE A 499 -6.297 10.984 -0.458 1.00 0.00 C ATOM 1457 CZ PHE A 499 -7.323 10.643 0.401 1.00 0.00 C ATOM 0 H PHE A 499 -1.216 13.026 2.254 1.00 0.00 H new ATOM 0 HA PHE A 499 -3.489 11.710 3.625 1.00 0.00 H new ATOM 0 HB2 PHE A 499 -4.303 13.682 2.451 1.00 0.00 H new ATOM 0 HB3 PHE A 499 -3.404 13.257 1.008 1.00 0.00 H new ATOM 0 HD1 PHE A 499 -6.124 12.008 3.237 1.00 0.00 H new ATOM 0 HD2 PHE A 499 -4.409 11.956 -0.662 1.00 0.00 H new ATOM 0 HE1 PHE A 499 -8.062 10.749 2.404 1.00 0.00 H new ATOM 0 HE2 PHE A 499 -6.345 10.697 -1.498 1.00 0.00 H new ATOM 0 HZ PHE A 499 -8.174 10.088 0.034 1.00 0.00 H new ATOM 1467 N ILE A 500 -3.298 9.639 2.237 1.00 0.00 N ATOM 1468 CA ILE A 500 -3.030 8.364 1.583 1.00 0.00 C ATOM 1469 C ILE A 500 -4.315 7.734 1.057 1.00 0.00 C ATOM 1470 O ILE A 500 -5.388 7.917 1.632 1.00 0.00 O ATOM 1471 CB ILE A 500 -2.342 7.374 2.542 1.00 0.00 C ATOM 1472 CG1 ILE A 500 -0.907 7.822 2.830 1.00 0.00 C ATOM 1473 CG2 ILE A 500 -2.356 5.971 1.953 1.00 0.00 C ATOM 1474 CD1 ILE A 500 -0.817 8.950 3.834 1.00 0.00 C ATOM 0 H ILE A 500 -4.050 9.610 2.925 1.00 0.00 H new ATOM 0 HA ILE A 500 -2.362 8.573 0.747 1.00 0.00 H new ATOM 0 HB ILE A 500 -2.893 7.359 3.482 1.00 0.00 H new ATOM 0 HG12 ILE A 500 -0.336 6.970 3.200 1.00 0.00 H new ATOM 0 HG13 ILE A 500 -0.439 8.138 1.897 1.00 0.00 H new ATOM 0 HG21 ILE A 500 -1.866 5.282 2.642 1.00 0.00 H new ATOM 0 HG22 ILE A 500 -3.387 5.654 1.794 1.00 0.00 H new ATOM 0 HG23 ILE A 500 -1.825 5.971 1.001 1.00 0.00 H new ATOM 0 HD11 ILE A 500 0.229 9.216 3.990 1.00 0.00 H new ATOM 0 HD12 ILE A 500 -1.360 9.817 3.457 1.00 0.00 H new ATOM 0 HD13 ILE A 500 -1.255 8.631 4.780 1.00 0.00 H new ATOM 1486 N GLN A 501 -4.198 6.991 -0.039 1.00 0.00 N ATOM 1487 CA GLN A 501 -5.351 6.333 -0.642 1.00 0.00 C ATOM 1488 C GLN A 501 -5.338 4.836 -0.350 1.00 0.00 C ATOM 1489 O GLN A 501 -4.280 4.208 -0.323 1.00 0.00 O ATOM 1490 CB GLN A 501 -5.367 6.571 -2.153 1.00 0.00 C ATOM 1491 CG GLN A 501 -6.023 7.881 -2.556 1.00 0.00 C ATOM 1492 CD GLN A 501 -7.531 7.852 -2.402 1.00 0.00 C ATOM 1493 OE1 GLN A 501 -8.007 8.104 -1.188 1.00 0.00 O flip ATOM 1494 NE2 GLN A 501 -8.260 7.604 -3.362 1.00 0.00 N flip ATOM 0 H GLN A 501 -3.317 6.830 -0.527 1.00 0.00 H new ATOM 0 HA GLN A 501 -6.253 6.761 -0.204 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -4.343 6.558 -2.525 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -5.892 5.747 -2.636 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -5.615 8.689 -1.948 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -5.772 8.104 -3.593 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -7.851 7.416 -4.278 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -9.273 7.586 -3.242 1.00 0.00 H new ATOM 1503 N VAL A 502 -6.521 4.271 -0.133 1.00 0.00 N ATOM 1504 CA VAL A 502 -6.646 2.847 0.156 1.00 0.00 C ATOM 1505 C VAL A 502 -7.294 2.105 -1.007 1.00 0.00 C ATOM 1506 O VAL A 502 -8.367 2.483 -1.479 1.00 0.00 O ATOM 1507 CB VAL A 502 -7.475 2.604 1.431 1.00 0.00 C ATOM 1508 CG1 VAL A 502 -7.644 1.113 1.682 1.00 0.00 C ATOM 1509 CG2 VAL A 502 -6.824 3.283 2.627 1.00 0.00 C ATOM 0 H VAL A 502 -7.406 4.777 -0.152 1.00 0.00 H new ATOM 0 HA VAL A 502 -5.637 2.465 0.309 1.00 0.00 H new ATOM 0 HB VAL A 502 -8.464 3.039 1.289 1.00 0.00 H new ATOM 0 HG11 VAL A 502 -8.232 0.961 2.587 1.00 0.00 H new ATOM 0 HG12 VAL A 502 -8.157 0.657 0.835 1.00 0.00 H new ATOM 0 HG13 VAL A 502 -6.664 0.651 1.804 1.00 0.00 H new ATOM 0 HG21 VAL A 502 -7.423 3.101 3.519 1.00 0.00 H new ATOM 0 HG22 VAL A 502 -5.822 2.879 2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 502 -6.760 4.356 2.446 1.00 0.00 H new ATOM 1519 N HIS A 503 -6.636 1.045 -1.466 1.00 0.00 N ATOM 1520 CA HIS A 503 -7.148 0.248 -2.575 1.00 0.00 C ATOM 1521 C HIS A 503 -6.818 -1.229 -2.381 1.00 0.00 C ATOM 1522 O HIS A 503 -5.687 -1.601 -2.069 1.00 0.00 O ATOM 1523 CB HIS A 503 -6.566 0.743 -3.899 1.00 0.00 C ATOM 1524 CG HIS A 503 -6.772 2.208 -4.134 1.00 0.00 C ATOM 1525 ND1 HIS A 503 -8.020 2.786 -4.229 1.00 0.00 N ATOM 1526 CD2 HIS A 503 -5.880 3.214 -4.292 1.00 0.00 C ATOM 1527 CE1 HIS A 503 -7.887 4.084 -4.436 1.00 0.00 C ATOM 1528 NE2 HIS A 503 -6.598 4.369 -4.478 1.00 0.00 N ATOM 0 H HIS A 503 -5.747 0.718 -1.087 1.00 0.00 H new ATOM 0 HA HIS A 503 -8.232 0.360 -2.599 1.00 0.00 H new ATOM 0 HB2 HIS A 503 -5.498 0.527 -3.920 1.00 0.00 H new ATOM 0 HB3 HIS A 503 -7.021 0.185 -4.717 1.00 0.00 H new ATOM 0 HD1 HIS A 503 -8.907 2.289 -4.152 1.00 0.00 H new ATOM 0 HD2 HIS A 503 -4.804 3.124 -4.275 1.00 0.00 H new ATOM 0 HE1 HIS A 503 -8.695 4.792 -4.551 1.00 0.00 H new ATOM 1537 N PRO A 504 -7.828 -2.091 -2.569 1.00 0.00 N ATOM 1538 CA PRO A 504 -7.669 -3.541 -2.419 1.00 0.00 C ATOM 1539 C PRO A 504 -6.815 -4.148 -3.527 1.00 0.00 C ATOM 1540 O PRO A 504 -7.030 -3.876 -4.708 1.00 0.00 O ATOM 1541 CB PRO A 504 -9.104 -4.065 -2.502 1.00 0.00 C ATOM 1542 CG PRO A 504 -9.839 -3.035 -3.288 1.00 0.00 C ATOM 1543 CD PRO A 504 -9.202 -1.718 -2.942 1.00 0.00 C ATOM 0 HA PRO A 504 -7.158 -3.802 -1.492 1.00 0.00 H new ATOM 0 HB2 PRO A 504 -9.142 -5.038 -2.991 1.00 0.00 H new ATOM 0 HB3 PRO A 504 -9.538 -4.190 -1.510 1.00 0.00 H new ATOM 0 HG2 PRO A 504 -9.766 -3.235 -4.357 1.00 0.00 H new ATOM 0 HG3 PRO A 504 -10.899 -3.034 -3.035 1.00 0.00 H new ATOM 0 HD2 PRO A 504 -9.216 -1.030 -3.788 1.00 0.00 H new ATOM 0 HD3 PRO A 504 -9.721 -1.224 -2.121 1.00 0.00 H new ATOM 1551 N ILE A 505 -5.846 -4.970 -3.138 1.00 0.00 N ATOM 1552 CA ILE A 505 -4.961 -5.616 -4.099 1.00 0.00 C ATOM 1553 C ILE A 505 -4.617 -7.036 -3.661 1.00 0.00 C ATOM 1554 O ILE A 505 -4.400 -7.297 -2.478 1.00 0.00 O ATOM 1555 CB ILE A 505 -3.657 -4.819 -4.288 1.00 0.00 C ATOM 1556 CG1 ILE A 505 -2.867 -5.367 -5.478 1.00 0.00 C ATOM 1557 CG2 ILE A 505 -2.818 -4.868 -3.020 1.00 0.00 C ATOM 1558 CD1 ILE A 505 -1.771 -4.439 -5.954 1.00 0.00 C ATOM 0 H ILE A 505 -5.654 -5.204 -2.164 1.00 0.00 H new ATOM 0 HA ILE A 505 -5.497 -5.650 -5.048 1.00 0.00 H new ATOM 0 HB ILE A 505 -3.910 -3.779 -4.492 1.00 0.00 H new ATOM 0 HG12 ILE A 505 -2.426 -6.325 -5.201 1.00 0.00 H new ATOM 0 HG13 ILE A 505 -3.554 -5.558 -6.303 1.00 0.00 H new ATOM 0 HG21 ILE A 505 -1.900 -4.300 -3.169 1.00 0.00 H new ATOM 0 HG22 ILE A 505 -3.382 -4.435 -2.194 1.00 0.00 H new ATOM 0 HG23 ILE A 505 -2.570 -5.904 -2.787 1.00 0.00 H new ATOM 0 HD11 ILE A 505 -1.253 -4.892 -6.799 1.00 0.00 H new ATOM 0 HD12 ILE A 505 -2.207 -3.489 -6.262 1.00 0.00 H new ATOM 0 HD13 ILE A 505 -1.062 -4.267 -5.144 1.00 0.00 H new ATOM 1570 N THR A 506 -4.567 -7.951 -4.625 1.00 0.00 N ATOM 1571 CA THR A 506 -4.249 -9.344 -4.340 1.00 0.00 C ATOM 1572 C THR A 506 -2.778 -9.508 -3.974 1.00 0.00 C ATOM 1573 O THR A 506 -1.936 -8.697 -4.363 1.00 0.00 O ATOM 1574 CB THR A 506 -4.571 -10.251 -5.542 1.00 0.00 C ATOM 1575 OG1 THR A 506 -3.785 -9.862 -6.674 1.00 0.00 O ATOM 1576 CG2 THR A 506 -6.049 -10.177 -5.895 1.00 0.00 C ATOM 0 H THR A 506 -4.743 -7.751 -5.610 1.00 0.00 H new ATOM 0 HA THR A 506 -4.867 -9.642 -3.493 1.00 0.00 H new ATOM 0 HB THR A 506 -4.330 -11.278 -5.269 1.00 0.00 H new ATOM 0 HG1 THR A 506 -3.994 -10.445 -7.434 1.00 0.00 H new ATOM 0 HG21 THR A 506 -6.253 -10.826 -6.747 1.00 0.00 H new ATOM 0 HG22 THR A 506 -6.644 -10.502 -5.041 1.00 0.00 H new ATOM 0 HG23 THR A 506 -6.311 -9.150 -6.150 1.00 0.00 H new ATOM 1584 N LYS A 507 -2.473 -10.562 -3.224 1.00 0.00 N ATOM 1585 CA LYS A 507 -1.103 -10.834 -2.807 1.00 0.00 C ATOM 1586 C LYS A 507 -0.188 -10.997 -4.017 1.00 0.00 C ATOM 1587 O LYS A 507 0.901 -10.424 -4.065 1.00 0.00 O ATOM 1588 CB LYS A 507 -1.053 -12.096 -1.943 1.00 0.00 C ATOM 1589 CG LYS A 507 0.061 -12.083 -0.911 1.00 0.00 C ATOM 1590 CD LYS A 507 1.389 -12.502 -1.518 1.00 0.00 C ATOM 1591 CE LYS A 507 2.380 -12.932 -0.447 1.00 0.00 C ATOM 1592 NZ LYS A 507 3.709 -13.275 -1.027 1.00 0.00 N ATOM 0 H LYS A 507 -3.157 -11.242 -2.893 1.00 0.00 H new ATOM 0 HA LYS A 507 -0.752 -9.985 -2.220 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -2.009 -12.215 -1.432 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -0.927 -12.964 -2.590 1.00 0.00 H new ATOM 0 HG2 LYS A 507 0.153 -11.083 -0.487 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -0.193 -12.755 -0.091 1.00 0.00 H new ATOM 0 HD2 LYS A 507 1.228 -13.323 -2.217 1.00 0.00 H new ATOM 0 HD3 LYS A 507 1.806 -11.673 -2.090 1.00 0.00 H new ATOM 0 HE2 LYS A 507 2.498 -12.130 0.282 1.00 0.00 H new ATOM 0 HE3 LYS A 507 1.984 -13.795 0.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 4.375 -13.498 -0.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 3.612 -14.100 -1.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 4.068 -12.467 -1.574 1.00 0.00 H new ATOM 1606 N LYS A 508 -0.637 -11.779 -4.992 1.00 0.00 N ATOM 1607 CA LYS A 508 0.139 -12.015 -6.203 1.00 0.00 C ATOM 1608 C LYS A 508 0.463 -10.701 -6.906 1.00 0.00 C ATOM 1609 O LYS A 508 1.629 -10.353 -7.086 1.00 0.00 O ATOM 1610 CB LYS A 508 -0.627 -12.938 -7.153 1.00 0.00 C ATOM 1611 CG LYS A 508 0.272 -13.753 -8.067 1.00 0.00 C ATOM 1612 CD LYS A 508 -0.418 -15.021 -8.542 1.00 0.00 C ATOM 1613 CE LYS A 508 -0.426 -16.089 -7.460 1.00 0.00 C ATOM 1614 NZ LYS A 508 -1.002 -17.372 -7.951 1.00 0.00 N ATOM 0 H LYS A 508 -1.536 -12.261 -4.967 1.00 0.00 H new ATOM 0 HA LYS A 508 1.075 -12.494 -5.917 1.00 0.00 H new ATOM 0 HB2 LYS A 508 -1.245 -13.617 -6.566 1.00 0.00 H new ATOM 0 HB3 LYS A 508 -1.303 -12.338 -7.763 1.00 0.00 H new ATOM 0 HG2 LYS A 508 0.560 -13.150 -8.928 1.00 0.00 H new ATOM 0 HG3 LYS A 508 1.190 -14.013 -7.539 1.00 0.00 H new ATOM 0 HD2 LYS A 508 -1.442 -14.791 -8.836 1.00 0.00 H new ATOM 0 HD3 LYS A 508 0.089 -15.403 -9.428 1.00 0.00 H new ATOM 0 HE2 LYS A 508 0.592 -16.259 -7.110 1.00 0.00 H new ATOM 0 HE3 LYS A 508 -1.003 -15.736 -6.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 -0.990 -18.074 -7.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 -1.982 -17.216 -8.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 -0.437 -17.723 -8.751 1.00 0.00 H new ATOM 1628 N GLY A 509 -0.578 -9.973 -7.301 1.00 0.00 N ATOM 1629 CA GLY A 509 -0.382 -8.705 -7.978 1.00 0.00 C ATOM 1630 C GLY A 509 0.516 -7.764 -7.200 1.00 0.00 C ATOM 1631 O GLY A 509 1.343 -7.062 -7.781 1.00 0.00 O ATOM 0 H GLY A 509 -1.553 -10.239 -7.164 1.00 0.00 H new ATOM 0 HA2 GLY A 509 0.052 -8.885 -8.962 1.00 0.00 H new ATOM 0 HA3 GLY A 509 -1.349 -8.229 -8.138 1.00 0.00 H new ATOM 1635 N MET A 510 0.352 -7.748 -5.881 1.00 0.00 N ATOM 1636 CA MET A 510 1.155 -6.886 -5.022 1.00 0.00 C ATOM 1637 C MET A 510 2.643 -7.166 -5.208 1.00 0.00 C ATOM 1638 O MET A 510 3.456 -6.242 -5.268 1.00 0.00 O ATOM 1639 CB MET A 510 0.766 -7.086 -3.556 1.00 0.00 C ATOM 1640 CG MET A 510 1.582 -6.242 -2.590 1.00 0.00 C ATOM 1641 SD MET A 510 1.420 -6.790 -0.880 1.00 0.00 S ATOM 1642 CE MET A 510 2.205 -8.398 -0.964 1.00 0.00 C ATOM 0 H MET A 510 -0.329 -8.322 -5.384 1.00 0.00 H new ATOM 0 HA MET A 510 0.960 -5.851 -5.304 1.00 0.00 H new ATOM 0 HB2 MET A 510 -0.290 -6.846 -3.433 1.00 0.00 H new ATOM 0 HB3 MET A 510 0.886 -8.138 -3.297 1.00 0.00 H new ATOM 0 HG2 MET A 510 2.632 -6.277 -2.881 1.00 0.00 H new ATOM 0 HG3 MET A 510 1.265 -5.202 -2.666 1.00 0.00 H new ATOM 0 HE1 MET A 510 2.536 -8.694 0.031 1.00 0.00 H new ATOM 0 HE2 MET A 510 1.493 -9.131 -1.342 1.00 0.00 H new ATOM 0 HE3 MET A 510 3.064 -8.349 -1.633 1.00 0.00 H new ATOM 1652 N LEU A 511 2.993 -8.444 -5.298 1.00 0.00 N ATOM 1653 CA LEU A 511 4.384 -8.846 -5.477 1.00 0.00 C ATOM 1654 C LEU A 511 4.914 -8.382 -6.830 1.00 0.00 C ATOM 1655 O LEU A 511 6.057 -7.941 -6.941 1.00 0.00 O ATOM 1656 CB LEU A 511 4.516 -10.365 -5.358 1.00 0.00 C ATOM 1657 CG LEU A 511 4.235 -10.957 -3.976 1.00 0.00 C ATOM 1658 CD1 LEU A 511 3.916 -12.439 -4.085 1.00 0.00 C ATOM 1659 CD2 LEU A 511 5.420 -10.731 -3.049 1.00 0.00 C ATOM 0 H LEU A 511 2.333 -9.220 -5.250 1.00 0.00 H new ATOM 0 HA LEU A 511 4.977 -8.374 -4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 511 3.835 -10.826 -6.074 1.00 0.00 H new ATOM 0 HB3 LEU A 511 5.527 -10.646 -5.653 1.00 0.00 H new ATOM 0 HG LEU A 511 3.367 -10.450 -3.554 1.00 0.00 H new ATOM 0 HD11 LEU A 511 3.719 -12.843 -3.092 1.00 0.00 H new ATOM 0 HD12 LEU A 511 3.036 -12.577 -4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 511 4.764 -12.962 -4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 511 5.203 -11.158 -2.070 1.00 0.00 H new ATOM 0 HD22 LEU A 511 6.305 -11.211 -3.466 1.00 0.00 H new ATOM 0 HD23 LEU A 511 5.602 -9.661 -2.945 1.00 0.00 H new ATOM 1671 N GLU A 512 4.075 -8.485 -7.856 1.00 0.00 N ATOM 1672 CA GLU A 512 4.460 -8.075 -9.201 1.00 0.00 C ATOM 1673 C GLU A 512 5.233 -6.759 -9.169 1.00 0.00 C ATOM 1674 O GLU A 512 6.359 -6.675 -9.659 1.00 0.00 O ATOM 1675 CB GLU A 512 3.222 -7.929 -10.088 1.00 0.00 C ATOM 1676 CG GLU A 512 2.489 -9.238 -10.330 1.00 0.00 C ATOM 1677 CD GLU A 512 3.217 -10.143 -11.304 1.00 0.00 C ATOM 1678 OE1 GLU A 512 3.362 -9.752 -12.482 1.00 0.00 O ATOM 1679 OE2 GLU A 512 3.642 -11.242 -10.890 1.00 0.00 O ATOM 0 H GLU A 512 3.125 -8.849 -7.781 1.00 0.00 H new ATOM 0 HA GLU A 512 5.107 -8.847 -9.616 1.00 0.00 H new ATOM 0 HB2 GLU A 512 2.536 -7.218 -9.626 1.00 0.00 H new ATOM 0 HB3 GLU A 512 3.521 -7.507 -11.047 1.00 0.00 H new ATOM 0 HG2 GLU A 512 2.362 -9.759 -9.381 1.00 0.00 H new ATOM 0 HG3 GLU A 512 1.491 -9.026 -10.714 1.00 0.00 H new ATOM 1686 N LYS A 513 4.620 -5.734 -8.588 1.00 0.00 N ATOM 1687 CA LYS A 513 5.249 -4.422 -8.489 1.00 0.00 C ATOM 1688 C LYS A 513 6.545 -4.499 -7.689 1.00 0.00 C ATOM 1689 O LYS A 513 7.614 -4.144 -8.187 1.00 0.00 O ATOM 1690 CB LYS A 513 4.292 -3.423 -7.835 1.00 0.00 C ATOM 1691 CG LYS A 513 3.068 -3.112 -8.679 1.00 0.00 C ATOM 1692 CD LYS A 513 2.083 -2.230 -7.929 1.00 0.00 C ATOM 1693 CE LYS A 513 0.855 -1.923 -8.772 1.00 0.00 C ATOM 1694 NZ LYS A 513 1.128 -0.864 -9.783 1.00 0.00 N ATOM 0 H LYS A 513 3.687 -5.786 -8.178 1.00 0.00 H new ATOM 0 HA LYS A 513 5.485 -4.083 -9.498 1.00 0.00 H new ATOM 0 HB2 LYS A 513 3.968 -3.819 -6.873 1.00 0.00 H new ATOM 0 HB3 LYS A 513 4.829 -2.496 -7.634 1.00 0.00 H new ATOM 0 HG2 LYS A 513 3.376 -2.615 -9.599 1.00 0.00 H new ATOM 0 HG3 LYS A 513 2.578 -4.042 -8.968 1.00 0.00 H new ATOM 0 HD2 LYS A 513 1.778 -2.726 -7.007 1.00 0.00 H new ATOM 0 HD3 LYS A 513 2.572 -1.298 -7.643 1.00 0.00 H new ATOM 0 HE2 LYS A 513 0.525 -2.831 -9.277 1.00 0.00 H new ATOM 0 HE3 LYS A 513 0.039 -1.604 -8.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 0.267 -0.683 -10.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 1.419 0.010 -9.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 1.889 -1.178 -10.418 1.00 0.00 H new ATOM 1708 N ILE A 514 6.443 -4.964 -6.449 1.00 0.00 N ATOM 1709 CA ILE A 514 7.608 -5.090 -5.582 1.00 0.00 C ATOM 1710 C ILE A 514 8.838 -5.524 -6.373 1.00 0.00 C ATOM 1711 O ILE A 514 9.954 -5.083 -6.097 1.00 0.00 O ATOM 1712 CB ILE A 514 7.359 -6.100 -4.447 1.00 0.00 C ATOM 1713 CG1 ILE A 514 6.149 -5.675 -3.612 1.00 0.00 C ATOM 1714 CG2 ILE A 514 8.596 -6.227 -3.570 1.00 0.00 C ATOM 1715 CD1 ILE A 514 5.785 -6.664 -2.528 1.00 0.00 C ATOM 0 H ILE A 514 5.565 -5.260 -6.022 1.00 0.00 H new ATOM 0 HA ILE A 514 7.786 -4.106 -5.149 1.00 0.00 H new ATOM 0 HB ILE A 514 7.148 -7.074 -4.888 1.00 0.00 H new ATOM 0 HG12 ILE A 514 6.355 -4.707 -3.155 1.00 0.00 H new ATOM 0 HG13 ILE A 514 5.292 -5.540 -4.272 1.00 0.00 H new ATOM 0 HG21 ILE A 514 8.404 -6.945 -2.772 1.00 0.00 H new ATOM 0 HG22 ILE A 514 9.436 -6.571 -4.173 1.00 0.00 H new ATOM 0 HG23 ILE A 514 8.835 -5.256 -3.135 1.00 0.00 H new ATOM 0 HD11 ILE A 514 4.919 -6.297 -1.977 1.00 0.00 H new ATOM 0 HD12 ILE A 514 5.547 -7.627 -2.979 1.00 0.00 H new ATOM 0 HD13 ILE A 514 6.626 -6.781 -1.845 1.00 0.00 H new ATOM 1727 N ASP A 515 8.625 -6.389 -7.359 1.00 0.00 N ATOM 1728 CA ASP A 515 9.716 -6.880 -8.193 1.00 0.00 C ATOM 1729 C ASP A 515 10.343 -5.743 -8.994 1.00 0.00 C ATOM 1730 O ASP A 515 11.558 -5.553 -8.972 1.00 0.00 O ATOM 1731 CB ASP A 515 9.210 -7.970 -9.140 1.00 0.00 C ATOM 1732 CG ASP A 515 10.302 -8.945 -9.536 1.00 0.00 C ATOM 1733 OD1 ASP A 515 10.980 -9.476 -8.631 1.00 0.00 O ATOM 1734 OD2 ASP A 515 10.477 -9.177 -10.750 1.00 0.00 O ATOM 0 H ASP A 515 7.708 -6.764 -7.600 1.00 0.00 H new ATOM 0 HA ASP A 515 10.479 -7.302 -7.539 1.00 0.00 H new ATOM 0 HB2 ASP A 515 8.397 -8.515 -8.661 1.00 0.00 H new ATOM 0 HB3 ASP A 515 8.798 -7.506 -10.036 1.00 0.00 H new ATOM 1739 N MET A 516 9.505 -4.992 -9.700 1.00 0.00 N ATOM 1740 CA MET A 516 9.977 -3.874 -10.508 1.00 0.00 C ATOM 1741 C MET A 516 10.632 -2.809 -9.633 1.00 0.00 C ATOM 1742 O MET A 516 11.528 -2.091 -10.079 1.00 0.00 O ATOM 1743 CB MET A 516 8.819 -3.261 -11.297 1.00 0.00 C ATOM 1744 CG MET A 516 7.874 -2.431 -10.442 1.00 0.00 C ATOM 1745 SD MET A 516 7.077 -1.107 -11.372 1.00 0.00 S ATOM 1746 CE MET A 516 5.979 -0.433 -10.128 1.00 0.00 C ATOM 0 H MET A 516 8.496 -5.137 -9.729 1.00 0.00 H new ATOM 0 HA MET A 516 10.722 -4.253 -11.207 1.00 0.00 H new ATOM 0 HB2 MET A 516 9.223 -2.634 -12.091 1.00 0.00 H new ATOM 0 HB3 MET A 516 8.254 -4.060 -11.778 1.00 0.00 H new ATOM 0 HG2 MET A 516 7.110 -3.081 -10.016 1.00 0.00 H new ATOM 0 HG3 MET A 516 8.428 -2.001 -9.608 1.00 0.00 H new ATOM 0 HE1 MET A 516 5.415 0.398 -10.552 1.00 0.00 H new ATOM 0 HE2 MET A 516 5.289 -1.208 -9.794 1.00 0.00 H new ATOM 0 HE3 MET A 516 6.564 -0.078 -9.280 1.00 0.00 H new ATOM 1756 N ILE A 517 10.179 -2.713 -8.388 1.00 0.00 N ATOM 1757 CA ILE A 517 10.721 -1.736 -7.451 1.00 0.00 C ATOM 1758 C ILE A 517 12.190 -2.017 -7.154 1.00 0.00 C ATOM 1759 O ILE A 517 13.016 -1.104 -7.134 1.00 0.00 O ATOM 1760 CB ILE A 517 9.934 -1.728 -6.128 1.00 0.00 C ATOM 1761 CG1 ILE A 517 8.476 -1.337 -6.379 1.00 0.00 C ATOM 1762 CG2 ILE A 517 10.580 -0.774 -5.134 1.00 0.00 C ATOM 1763 CD1 ILE A 517 7.562 -1.632 -5.211 1.00 0.00 C ATOM 0 H ILE A 517 9.438 -3.300 -8.004 1.00 0.00 H new ATOM 0 HA ILE A 517 10.628 -0.759 -7.925 1.00 0.00 H new ATOM 0 HB ILE A 517 9.953 -2.732 -5.704 1.00 0.00 H new ATOM 0 HG12 ILE A 517 8.428 -0.272 -6.608 1.00 0.00 H new ATOM 0 HG13 ILE A 517 8.112 -1.869 -7.258 1.00 0.00 H new ATOM 0 HG21 ILE A 517 10.013 -0.779 -4.203 1.00 0.00 H new ATOM 0 HG22 ILE A 517 11.604 -1.092 -4.937 1.00 0.00 H new ATOM 0 HG23 ILE A 517 10.587 0.234 -5.549 1.00 0.00 H new ATOM 0 HD11 ILE A 517 6.545 -1.329 -5.459 1.00 0.00 H new ATOM 0 HD12 ILE A 517 7.580 -2.700 -4.995 1.00 0.00 H new ATOM 0 HD13 ILE A 517 7.901 -1.079 -4.335 1.00 0.00 H new ATOM 1775 N ARG A 518 12.510 -3.287 -6.925 1.00 0.00 N ATOM 1776 CA ARG A 518 13.880 -3.689 -6.629 1.00 0.00 C ATOM 1777 C ARG A 518 14.774 -3.513 -7.853 1.00 0.00 C ATOM 1778 O ARG A 518 15.724 -2.730 -7.833 1.00 0.00 O ATOM 1779 CB ARG A 518 13.917 -5.145 -6.162 1.00 0.00 C ATOM 1780 CG ARG A 518 13.034 -5.421 -4.957 1.00 0.00 C ATOM 1781 CD ARG A 518 12.764 -6.909 -4.792 1.00 0.00 C ATOM 1782 NE ARG A 518 13.879 -7.599 -4.150 1.00 0.00 N ATOM 1783 CZ ARG A 518 14.183 -7.465 -2.864 1.00 0.00 C ATOM 1784 NH1 ARG A 518 13.460 -6.671 -2.087 1.00 0.00 N ATOM 1785 NH2 ARG A 518 15.213 -8.128 -2.352 1.00 0.00 N ATOM 0 H ARG A 518 11.839 -4.055 -6.939 1.00 0.00 H new ATOM 0 HA ARG A 518 14.256 -3.049 -5.831 1.00 0.00 H new ATOM 0 HB2 ARG A 518 13.606 -5.789 -6.984 1.00 0.00 H new ATOM 0 HB3 ARG A 518 14.945 -5.413 -5.918 1.00 0.00 H new ATOM 0 HG2 ARG A 518 13.514 -5.035 -4.057 1.00 0.00 H new ATOM 0 HG3 ARG A 518 12.089 -4.889 -5.068 1.00 0.00 H new ATOM 0 HD2 ARG A 518 11.860 -7.050 -4.199 1.00 0.00 H new ATOM 0 HD3 ARG A 518 12.576 -7.354 -5.769 1.00 0.00 H new ATOM 0 HE ARG A 518 14.456 -8.218 -4.720 1.00 0.00 H new ATOM 0 HH11 ARG A 518 12.667 -6.161 -2.476 1.00 0.00 H new ATOM 0 HH12 ARG A 518 13.696 -6.570 -1.100 1.00 0.00 H new ATOM 0 HH21 ARG A 518 15.771 -8.741 -2.946 1.00 0.00 H new ATOM 0 HH22 ARG A 518 15.446 -8.025 -1.364 1.00 0.00 H new ATOM 1799 N LYS A 519 14.464 -4.246 -8.916 1.00 0.00 N ATOM 1800 CA LYS A 519 15.238 -4.172 -10.150 1.00 0.00 C ATOM 1801 C LYS A 519 15.695 -2.741 -10.420 1.00 0.00 C ATOM 1802 O LYS A 519 16.872 -2.494 -10.679 1.00 0.00 O ATOM 1803 CB LYS A 519 14.408 -4.685 -11.329 1.00 0.00 C ATOM 1804 CG LYS A 519 13.986 -6.137 -11.189 1.00 0.00 C ATOM 1805 CD LYS A 519 12.888 -6.496 -12.176 1.00 0.00 C ATOM 1806 CE LYS A 519 13.462 -6.917 -13.520 1.00 0.00 C ATOM 1807 NZ LYS A 519 12.399 -7.365 -14.462 1.00 0.00 N ATOM 0 H LYS A 519 13.681 -4.899 -8.948 1.00 0.00 H new ATOM 0 HA LYS A 519 16.120 -4.801 -10.035 1.00 0.00 H new ATOM 0 HB2 LYS A 519 13.518 -4.065 -11.433 1.00 0.00 H new ATOM 0 HB3 LYS A 519 14.985 -4.570 -12.246 1.00 0.00 H new ATOM 0 HG2 LYS A 519 14.848 -6.785 -11.351 1.00 0.00 H new ATOM 0 HG3 LYS A 519 13.637 -6.319 -10.173 1.00 0.00 H new ATOM 0 HD2 LYS A 519 12.282 -7.305 -11.769 1.00 0.00 H new ATOM 0 HD3 LYS A 519 12.227 -5.640 -12.314 1.00 0.00 H new ATOM 0 HE2 LYS A 519 14.008 -6.082 -13.959 1.00 0.00 H new ATOM 0 HE3 LYS A 519 14.179 -7.724 -13.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 12.831 -7.643 -15.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 11.894 -8.178 -14.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 11.728 -6.587 -14.624 1.00 0.00 H new ATOM 1821 N ARG A 520 14.755 -1.803 -10.356 1.00 0.00 N ATOM 1822 CA ARG A 520 15.062 -0.398 -10.594 1.00 0.00 C ATOM 1823 C ARG A 520 16.220 0.062 -9.713 1.00 0.00 C ATOM 1824 O ARG A 520 17.137 0.740 -10.179 1.00 0.00 O ATOM 1825 CB ARG A 520 13.829 0.467 -10.327 1.00 0.00 C ATOM 1826 CG ARG A 520 12.951 0.671 -11.551 1.00 0.00 C ATOM 1827 CD ARG A 520 12.029 1.869 -11.382 1.00 0.00 C ATOM 1828 NE ARG A 520 11.057 1.968 -12.467 1.00 0.00 N ATOM 1829 CZ ARG A 520 10.366 3.070 -12.736 1.00 0.00 C ATOM 1830 NH1 ARG A 520 10.540 4.161 -12.003 1.00 0.00 N ATOM 1831 NH2 ARG A 520 9.499 3.082 -13.740 1.00 0.00 N ATOM 0 H ARG A 520 13.776 -1.991 -10.142 1.00 0.00 H new ATOM 0 HA ARG A 520 15.356 -0.287 -11.638 1.00 0.00 H new ATOM 0 HB2 ARG A 520 13.236 0.005 -9.538 1.00 0.00 H new ATOM 0 HB3 ARG A 520 14.152 1.440 -9.956 1.00 0.00 H new ATOM 0 HG2 ARG A 520 13.579 0.815 -12.430 1.00 0.00 H new ATOM 0 HG3 ARG A 520 12.356 -0.225 -11.727 1.00 0.00 H new ATOM 0 HD2 ARG A 520 11.503 1.791 -10.430 1.00 0.00 H new ATOM 0 HD3 ARG A 520 12.624 2.782 -11.343 1.00 0.00 H new ATOM 0 HE ARG A 520 10.900 1.146 -13.050 1.00 0.00 H new ATOM 0 HH11 ARG A 520 11.206 4.155 -11.230 1.00 0.00 H new ATOM 0 HH12 ARG A 520 10.008 5.006 -12.212 1.00 0.00 H new ATOM 0 HH21 ARG A 520 9.363 2.245 -14.306 1.00 0.00 H new ATOM 0 HH22 ARG A 520 8.969 3.929 -13.946 1.00 0.00 H new ATOM 1845 N LEU A 521 16.172 -0.310 -8.439 1.00 0.00 N ATOM 1846 CA LEU A 521 17.216 0.065 -7.492 1.00 0.00 C ATOM 1847 C LEU A 521 18.504 -0.704 -7.770 1.00 0.00 C ATOM 1848 O LEU A 521 19.570 -0.111 -7.932 1.00 0.00 O ATOM 1849 CB LEU A 521 16.751 -0.197 -6.059 1.00 0.00 C ATOM 1850 CG LEU A 521 15.590 0.665 -5.562 1.00 0.00 C ATOM 1851 CD1 LEU A 521 15.019 0.098 -4.271 1.00 0.00 C ATOM 1852 CD2 LEU A 521 16.041 2.104 -5.362 1.00 0.00 C ATOM 0 H LEU A 521 15.421 -0.871 -8.038 1.00 0.00 H new ATOM 0 HA LEU A 521 17.417 1.130 -7.613 1.00 0.00 H new ATOM 0 HB2 LEU A 521 16.460 -1.244 -5.978 1.00 0.00 H new ATOM 0 HB3 LEU A 521 17.599 -0.049 -5.390 1.00 0.00 H new ATOM 0 HG LEU A 521 14.805 0.654 -6.318 1.00 0.00 H new ATOM 0 HD11 LEU A 521 14.194 0.724 -3.932 1.00 0.00 H new ATOM 0 HD12 LEU A 521 14.657 -0.915 -4.447 1.00 0.00 H new ATOM 0 HD13 LEU A 521 15.796 0.078 -3.507 1.00 0.00 H new ATOM 0 HD21 LEU A 521 15.202 2.703 -5.008 1.00 0.00 H new ATOM 0 HD22 LEU A 521 16.844 2.135 -4.626 1.00 0.00 H new ATOM 0 HD23 LEU A 521 16.401 2.507 -6.309 1.00 0.00 H new ATOM 1864 N GLN A 522 18.396 -2.028 -7.825 1.00 0.00 N ATOM 1865 CA GLN A 522 19.552 -2.878 -8.084 1.00 0.00 C ATOM 1866 C GLN A 522 20.489 -2.228 -9.098 1.00 0.00 C ATOM 1867 O GLN A 522 20.075 -1.873 -10.201 1.00 0.00 O ATOM 1868 CB GLN A 522 19.101 -4.248 -8.594 1.00 0.00 C ATOM 1869 CG GLN A 522 18.637 -5.184 -7.491 1.00 0.00 C ATOM 1870 CD GLN A 522 19.708 -5.433 -6.447 1.00 0.00 C ATOM 1871 OE1 GLN A 522 20.897 -5.490 -6.762 1.00 0.00 O ATOM 1872 NE2 GLN A 522 19.291 -5.582 -5.195 1.00 0.00 N ATOM 0 H GLN A 522 17.520 -2.535 -7.694 1.00 0.00 H new ATOM 0 HA GLN A 522 20.093 -3.008 -7.147 1.00 0.00 H new ATOM 0 HB2 GLN A 522 18.289 -4.111 -9.309 1.00 0.00 H new ATOM 0 HB3 GLN A 522 19.925 -4.715 -9.133 1.00 0.00 H new ATOM 0 HG2 GLN A 522 17.756 -4.762 -7.008 1.00 0.00 H new ATOM 0 HG3 GLN A 522 18.335 -6.135 -7.930 1.00 0.00 H new ATOM 0 HE21 GLN A 522 18.296 -5.527 -4.979 1.00 0.00 H new ATOM 0 HE22 GLN A 522 19.966 -5.751 -4.449 1.00 0.00 H new ATOM 1881 N SER A 523 21.753 -2.076 -8.716 1.00 0.00 N ATOM 1882 CA SER A 523 22.748 -1.466 -9.590 1.00 0.00 C ATOM 1883 C SER A 523 23.062 -2.375 -10.774 1.00 0.00 C ATOM 1884 O SER A 523 22.981 -1.960 -11.929 1.00 0.00 O ATOM 1885 CB SER A 523 24.028 -1.165 -8.809 1.00 0.00 C ATOM 1886 OG SER A 523 24.936 -0.407 -9.589 1.00 0.00 O ATOM 0 H SER A 523 22.112 -2.367 -7.807 1.00 0.00 H new ATOM 0 HA SER A 523 22.336 -0.532 -9.972 1.00 0.00 H new ATOM 0 HB2 SER A 523 23.782 -0.619 -7.899 1.00 0.00 H new ATOM 0 HB3 SER A 523 24.499 -2.099 -8.503 1.00 0.00 H new ATOM 0 HG SER A 523 25.745 -0.227 -9.066 1.00 0.00 H new ATOM 1892 N GLY A 524 23.422 -3.620 -10.476 1.00 0.00 N ATOM 1893 CA GLY A 524 23.744 -4.570 -11.525 1.00 0.00 C ATOM 1894 C GLY A 524 24.241 -5.893 -10.977 1.00 0.00 C ATOM 1895 O GLY A 524 24.909 -5.950 -9.944 1.00 0.00 O ATOM 0 H GLY A 524 23.496 -3.987 -9.527 1.00 0.00 H new ATOM 0 HA2 GLY A 524 22.859 -4.743 -12.138 1.00 0.00 H new ATOM 0 HA3 GLY A 524 24.505 -4.142 -12.178 1.00 0.00 H new ATOM 1899 N PRO A 525 23.911 -6.989 -11.676 1.00 0.00 N ATOM 1900 CA PRO A 525 24.317 -8.338 -11.271 1.00 0.00 C ATOM 1901 C PRO A 525 25.816 -8.566 -11.434 1.00 0.00 C ATOM 1902 O PRO A 525 26.324 -8.642 -12.553 1.00 0.00 O ATOM 1903 CB PRO A 525 23.532 -9.245 -12.222 1.00 0.00 C ATOM 1904 CG PRO A 525 23.274 -8.402 -13.423 1.00 0.00 C ATOM 1905 CD PRO A 525 23.117 -6.996 -12.916 1.00 0.00 C ATOM 0 HA PRO A 525 24.114 -8.525 -10.217 1.00 0.00 H new ATOM 0 HB2 PRO A 525 24.103 -10.137 -12.480 1.00 0.00 H new ATOM 0 HB3 PRO A 525 22.600 -9.583 -11.768 1.00 0.00 H new ATOM 0 HG2 PRO A 525 24.098 -8.471 -14.133 1.00 0.00 H new ATOM 0 HG3 PRO A 525 22.376 -8.731 -13.945 1.00 0.00 H new ATOM 0 HD2 PRO A 525 23.489 -6.266 -13.635 1.00 0.00 H new ATOM 0 HD3 PRO A 525 22.072 -6.752 -12.725 1.00 0.00 H new ATOM 1913 N SER A 526 26.519 -8.675 -10.311 1.00 0.00 N ATOM 1914 CA SER A 526 27.961 -8.891 -10.330 1.00 0.00 C ATOM 1915 C SER A 526 28.630 -8.003 -11.374 1.00 0.00 C ATOM 1916 O SER A 526 29.491 -8.454 -12.129 1.00 0.00 O ATOM 1917 CB SER A 526 28.274 -10.361 -10.618 1.00 0.00 C ATOM 1918 OG SER A 526 28.274 -11.126 -9.425 1.00 0.00 O ATOM 0 H SER A 526 26.113 -8.617 -9.377 1.00 0.00 H new ATOM 0 HA SER A 526 28.356 -8.628 -9.349 1.00 0.00 H new ATOM 0 HB2 SER A 526 27.536 -10.764 -11.312 1.00 0.00 H new ATOM 0 HB3 SER A 526 29.246 -10.440 -11.105 1.00 0.00 H new ATOM 0 HG SER A 526 28.475 -12.062 -9.636 1.00 0.00 H new ATOM 1924 N SER A 527 28.226 -6.737 -11.411 1.00 0.00 N ATOM 1925 CA SER A 527 28.783 -5.784 -12.365 1.00 0.00 C ATOM 1926 C SER A 527 30.200 -5.382 -11.967 1.00 0.00 C ATOM 1927 O SER A 527 31.126 -5.449 -12.774 1.00 0.00 O ATOM 1928 CB SER A 527 27.894 -4.542 -12.455 1.00 0.00 C ATOM 1929 OG SER A 527 28.395 -3.626 -13.413 1.00 0.00 O ATOM 0 H SER A 527 27.515 -6.347 -10.792 1.00 0.00 H new ATOM 0 HA SER A 527 28.822 -6.266 -13.342 1.00 0.00 H new ATOM 0 HB2 SER A 527 26.879 -4.836 -12.724 1.00 0.00 H new ATOM 0 HB3 SER A 527 27.838 -4.059 -11.479 1.00 0.00 H new ATOM 0 HG SER A 527 27.809 -2.842 -13.453 1.00 0.00 H new ATOM 1935 N GLY A 528 30.360 -4.963 -10.715 1.00 0.00 N ATOM 1936 CA GLY A 528 31.665 -4.555 -10.231 1.00 0.00 C ATOM 1937 C GLY A 528 31.576 -3.573 -9.079 1.00 0.00 C ATOM 1938 O GLY A 528 32.585 -3.245 -8.455 1.00 0.00 O ATOM 0 H GLY A 528 29.609 -4.899 -10.028 1.00 0.00 H new ATOM 0 HA2 GLY A 528 32.222 -5.436 -9.911 1.00 0.00 H new ATOM 0 HA3 GLY A 528 32.227 -4.102 -11.048 1.00 0.00 H new TER 1942 GLY A 528