USER MOD reduce.3.24.130724 H: found=0, std=0, add=841, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 841 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 459 HIS : no HD1:sc= -0.282 X(o=-0.31,f=-0.026) USER MOD Set 1.2: A 472 TYR OH : rot 180:sc= -0.0262 USER MOD Single : A 420 SER OG : rot 180:sc= 0 USER MOD Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 424 SER OG : rot 30:sc= 0.399 USER MOD Single : A 426 SER OG : rot 155:sc= 0.717 USER MOD Single : A 428 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.272) USER MOD Single : A 444 THR OG1 : rot 153:sc= 0.126 USER MOD Single : A 446 SER OG : rot 69:sc= 0.0872 USER MOD Single : A 460 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 62:sc= 1.19 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot -56:sc= 0.112 USER MOD Single : A 484 GLN : amide:sc=-0.00519 X(o=-0.0052,f=-0.078) USER MOD Single : A 490 CYS SG : rot 65:sc= -0.676 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 180:sc= 0 USER MOD Single : A 500 CYS SG : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= 0 USER MOD Single : A 503 SER OG : rot -90:sc= 0 USER MOD Single : A 505 THR OG1 : rot -140:sc= -0.0307 USER MOD Single : A 507 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 517 ASN : amide:sc= 0.269 K(o=0.27,f=-1.5!) USER MOD Single : A 519 SER OG : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 530 SER OG : rot -57:sc= 0.392 USER MOD Single : A 531 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 419 -17.045 28.452 4.319 1.00 0.00 N ATOM 2 CA GLY A 419 -15.884 28.042 3.551 1.00 0.00 C ATOM 3 C GLY A 419 -16.195 26.910 2.591 1.00 0.00 C ATOM 4 O GLY A 419 -17.164 26.976 1.836 1.00 0.00 O ATOM 0 HA2 GLY A 419 -15.503 28.896 2.990 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -15.093 27.729 4.233 1.00 0.00 H new ATOM 8 N SER A 420 -15.369 25.869 2.620 1.00 0.00 N ATOM 9 CA SER A 420 -15.558 24.720 1.742 1.00 0.00 C ATOM 10 C SER A 420 -15.193 23.423 2.458 1.00 0.00 C ATOM 11 O SER A 420 -14.348 23.412 3.354 1.00 0.00 O ATOM 12 CB SER A 420 -14.710 24.873 0.477 1.00 0.00 C ATOM 13 OG SER A 420 -15.255 24.124 -0.595 1.00 0.00 O ATOM 0 H SER A 420 -14.563 25.798 3.241 1.00 0.00 H new ATOM 0 HA SER A 420 -16.611 24.677 1.463 1.00 0.00 H new ATOM 0 HB2 SER A 420 -14.654 25.925 0.198 1.00 0.00 H new ATOM 0 HB3 SER A 420 -13.691 24.541 0.676 1.00 0.00 H new ATOM 0 HG SER A 420 -14.696 24.239 -1.392 1.00 0.00 H new ATOM 19 N SER A 421 -15.836 22.331 2.057 1.00 0.00 N ATOM 20 CA SER A 421 -15.583 21.029 2.663 1.00 0.00 C ATOM 21 C SER A 421 -14.087 20.736 2.715 1.00 0.00 C ATOM 22 O SER A 421 -13.567 20.280 3.733 1.00 0.00 O ATOM 23 CB SER A 421 -16.303 19.930 1.879 1.00 0.00 C ATOM 24 OG SER A 421 -16.068 18.656 2.453 1.00 0.00 O ATOM 0 H SER A 421 -16.536 22.322 1.315 1.00 0.00 H new ATOM 0 HA SER A 421 -15.967 21.049 3.683 1.00 0.00 H new ATOM 0 HB2 SER A 421 -17.374 20.133 1.862 1.00 0.00 H new ATOM 0 HB3 SER A 421 -15.962 19.934 0.844 1.00 0.00 H new ATOM 0 HG SER A 421 -16.540 17.971 1.934 1.00 0.00 H new ATOM 30 N GLY A 422 -13.399 21.001 1.608 1.00 0.00 N ATOM 31 CA GLY A 422 -11.969 20.759 1.548 1.00 0.00 C ATOM 32 C GLY A 422 -11.616 19.595 0.643 1.00 0.00 C ATOM 33 O GLY A 422 -12.212 18.523 0.739 1.00 0.00 O ATOM 0 H GLY A 422 -13.806 21.379 0.752 1.00 0.00 H new ATOM 0 HA2 GLY A 422 -11.466 21.658 1.192 1.00 0.00 H new ATOM 0 HA3 GLY A 422 -11.595 20.561 2.552 1.00 0.00 H new ATOM 37 N SER A 423 -10.644 19.806 -0.238 1.00 0.00 N ATOM 38 CA SER A 423 -10.215 18.768 -1.167 1.00 0.00 C ATOM 39 C SER A 423 -8.824 18.256 -0.807 1.00 0.00 C ATOM 40 O SER A 423 -7.912 19.039 -0.540 1.00 0.00 O ATOM 41 CB SER A 423 -10.218 19.303 -2.601 1.00 0.00 C ATOM 42 OG SER A 423 -9.117 20.165 -2.826 1.00 0.00 O ATOM 0 H SER A 423 -10.138 20.687 -0.328 1.00 0.00 H new ATOM 0 HA SER A 423 -10.918 17.939 -1.094 1.00 0.00 H new ATOM 0 HB2 SER A 423 -10.181 18.470 -3.303 1.00 0.00 H new ATOM 0 HB3 SER A 423 -11.148 19.839 -2.791 1.00 0.00 H new ATOM 0 HG SER A 423 -9.141 20.492 -3.750 1.00 0.00 H new ATOM 48 N SER A 424 -8.669 16.936 -0.800 1.00 0.00 N ATOM 49 CA SER A 424 -7.390 16.318 -0.469 1.00 0.00 C ATOM 50 C SER A 424 -7.277 14.932 -1.097 1.00 0.00 C ATOM 51 O SER A 424 -8.274 14.231 -1.264 1.00 0.00 O ATOM 52 CB SER A 424 -7.227 16.217 1.049 1.00 0.00 C ATOM 53 OG SER A 424 -6.661 17.402 1.581 1.00 0.00 O ATOM 0 H SER A 424 -9.413 16.274 -1.020 1.00 0.00 H new ATOM 0 HA SER A 424 -6.596 16.946 -0.872 1.00 0.00 H new ATOM 0 HB2 SER A 424 -8.197 16.035 1.511 1.00 0.00 H new ATOM 0 HB3 SER A 424 -6.592 15.365 1.294 1.00 0.00 H new ATOM 0 HG SER A 424 -6.916 18.166 1.022 1.00 0.00 H new ATOM 59 N GLY A 425 -6.054 14.544 -1.443 1.00 0.00 N ATOM 60 CA GLY A 425 -5.832 13.244 -2.050 1.00 0.00 C ATOM 61 C GLY A 425 -4.431 13.098 -2.610 1.00 0.00 C ATOM 62 O GLY A 425 -4.078 13.745 -3.595 1.00 0.00 O ATOM 0 H GLY A 425 -5.213 15.106 -1.314 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -6.006 12.465 -1.308 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -6.557 13.091 -2.849 1.00 0.00 H new ATOM 66 N SER A 426 -3.629 12.245 -1.979 1.00 0.00 N ATOM 67 CA SER A 426 -2.257 12.020 -2.417 1.00 0.00 C ATOM 68 C SER A 426 -2.106 10.635 -3.039 1.00 0.00 C ATOM 69 O SER A 426 -3.067 9.869 -3.117 1.00 0.00 O ATOM 70 CB SER A 426 -1.292 12.171 -1.240 1.00 0.00 C ATOM 71 OG SER A 426 -0.917 13.525 -1.058 1.00 0.00 O ATOM 0 H SER A 426 -3.906 11.699 -1.163 1.00 0.00 H new ATOM 0 HA SER A 426 -2.016 12.767 -3.173 1.00 0.00 H new ATOM 0 HB2 SER A 426 -1.761 11.795 -0.331 1.00 0.00 H new ATOM 0 HB3 SER A 426 -0.403 11.565 -1.414 1.00 0.00 H new ATOM 0 HG SER A 426 -0.658 13.670 -0.124 1.00 0.00 H new ATOM 77 N ARG A 427 -0.892 10.321 -3.481 1.00 0.00 N ATOM 78 CA ARG A 427 -0.614 9.029 -4.097 1.00 0.00 C ATOM 79 C ARG A 427 -0.531 7.930 -3.042 1.00 0.00 C ATOM 80 O ARG A 427 -1.070 6.838 -3.223 1.00 0.00 O ATOM 81 CB ARG A 427 0.693 9.089 -4.890 1.00 0.00 C ATOM 82 CG ARG A 427 0.647 10.049 -6.068 1.00 0.00 C ATOM 83 CD ARG A 427 2.016 10.208 -6.710 1.00 0.00 C ATOM 84 NE ARG A 427 2.857 11.151 -5.978 1.00 0.00 N ATOM 85 CZ ARG A 427 2.710 12.470 -6.040 1.00 0.00 C ATOM 86 NH1 ARG A 427 1.758 12.999 -6.797 1.00 0.00 N ATOM 87 NH2 ARG A 427 3.515 13.263 -5.345 1.00 0.00 N ATOM 0 H ARG A 427 -0.086 10.943 -3.424 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.433 8.795 -4.777 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.501 9.386 -4.221 1.00 0.00 H new ATOM 0 HB3 ARG A 427 0.933 8.090 -5.255 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.064 9.683 -6.809 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.286 11.021 -5.733 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.511 9.238 -6.753 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.897 10.551 -7.738 1.00 0.00 H new ATOM 0 HE ARG A 427 3.598 10.776 -5.386 1.00 0.00 H new ATOM 0 HH11 ARG A 427 1.137 12.393 -7.333 1.00 0.00 H new ATOM 0 HH12 ARG A 427 1.647 14.012 -6.843 1.00 0.00 H new ATOM 0 HH21 ARG A 427 4.248 12.860 -4.762 1.00 0.00 H new ATOM 0 HH22 ARG A 427 3.400 14.275 -5.394 1.00 0.00 H new ATOM 101 N LYS A 428 0.148 8.225 -1.939 1.00 0.00 N ATOM 102 CA LYS A 428 0.302 7.264 -0.854 1.00 0.00 C ATOM 103 C LYS A 428 -1.017 6.557 -0.562 1.00 0.00 C ATOM 104 O LYS A 428 -2.089 7.157 -0.655 1.00 0.00 O ATOM 105 CB LYS A 428 0.807 7.966 0.409 1.00 0.00 C ATOM 106 CG LYS A 428 1.549 7.044 1.362 1.00 0.00 C ATOM 107 CD LYS A 428 2.595 7.798 2.165 1.00 0.00 C ATOM 108 CE LYS A 428 3.016 7.020 3.402 1.00 0.00 C ATOM 109 NZ LYS A 428 4.111 6.056 3.105 1.00 0.00 N ATOM 0 H LYS A 428 0.601 9.124 -1.773 1.00 0.00 H new ATOM 0 HA LYS A 428 1.033 6.518 -1.165 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.467 8.784 0.121 1.00 0.00 H new ATOM 0 HB3 LYS A 428 -0.041 8.409 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.838 6.572 2.041 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.029 6.245 0.797 1.00 0.00 H new ATOM 0 HD2 LYS A 428 3.467 7.989 1.540 1.00 0.00 H new ATOM 0 HD3 LYS A 428 2.197 8.768 2.462 1.00 0.00 H new ATOM 0 HE2 LYS A 428 3.344 7.716 4.174 1.00 0.00 H new ATOM 0 HE3 LYS A 428 2.157 6.482 3.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 4.231 5.408 3.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 3.871 5.509 2.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.997 6.576 2.944 1.00 0.00 H new ATOM 123 N VAL A 429 -0.933 5.278 -0.208 1.00 0.00 N ATOM 124 CA VAL A 429 -2.120 4.490 0.100 1.00 0.00 C ATOM 125 C VAL A 429 -1.876 3.570 1.291 1.00 0.00 C ATOM 126 O VAL A 429 -0.907 2.812 1.314 1.00 0.00 O ATOM 127 CB VAL A 429 -2.560 3.642 -1.108 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.757 2.777 -0.746 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.877 4.535 -2.299 1.00 0.00 C ATOM 0 H VAL A 429 -0.055 4.766 -0.128 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.913 5.196 0.347 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.737 2.983 -1.386 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.053 2.185 -1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.490 2.111 0.074 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.587 3.414 -0.441 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.186 3.919 -3.143 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.683 5.220 -2.036 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -1.990 5.106 -2.572 1.00 0.00 H new ATOM 139 N PHE A 430 -2.762 3.643 2.279 1.00 0.00 N ATOM 140 CA PHE A 430 -2.642 2.817 3.475 1.00 0.00 C ATOM 141 C PHE A 430 -3.326 1.467 3.274 1.00 0.00 C ATOM 142 O PHE A 430 -4.494 1.401 2.891 1.00 0.00 O ATOM 143 CB PHE A 430 -3.252 3.536 4.680 1.00 0.00 C ATOM 144 CG PHE A 430 -3.081 2.789 5.972 1.00 0.00 C ATOM 145 CD1 PHE A 430 -1.862 2.220 6.303 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.140 2.657 6.856 1.00 0.00 C ATOM 147 CE1 PHE A 430 -1.703 1.532 7.491 1.00 0.00 C ATOM 148 CE2 PHE A 430 -3.987 1.971 8.046 1.00 0.00 C ATOM 149 CZ PHE A 430 -2.766 1.408 8.364 1.00 0.00 C ATOM 0 H PHE A 430 -3.570 4.265 2.275 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.582 2.644 3.662 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.795 4.521 4.775 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.315 3.694 4.499 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.027 2.315 5.625 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.096 3.095 6.612 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -0.748 1.092 7.737 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -4.820 1.875 8.726 1.00 0.00 H new ATOM 0 HZ PHE A 430 -2.643 0.872 9.293 1.00 0.00 H new ATOM 159 N VAL A 431 -2.588 0.392 3.535 1.00 0.00 N ATOM 160 CA VAL A 431 -3.122 -0.956 3.384 1.00 0.00 C ATOM 161 C VAL A 431 -2.944 -1.764 4.664 1.00 0.00 C ATOM 162 O VAL A 431 -1.822 -2.021 5.098 1.00 0.00 O ATOM 163 CB VAL A 431 -2.442 -1.702 2.220 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.161 -3.011 1.932 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.398 -0.824 0.979 1.00 0.00 C ATOM 0 H VAL A 431 -1.619 0.429 3.852 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.185 -0.853 3.168 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.417 -1.935 2.509 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.667 -3.524 1.107 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.135 -3.643 2.820 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.197 -2.805 1.663 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -1.914 -1.366 0.167 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.413 -0.559 0.685 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -1.834 0.084 1.195 1.00 0.00 H new ATOM 175 N GLY A 432 -4.061 -2.164 5.266 1.00 0.00 N ATOM 176 CA GLY A 432 -4.006 -2.940 6.491 1.00 0.00 C ATOM 177 C GLY A 432 -4.642 -4.307 6.340 1.00 0.00 C ATOM 178 O GLY A 432 -5.523 -4.501 5.503 1.00 0.00 O ATOM 0 H GLY A 432 -5.002 -1.964 4.927 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -2.966 -3.058 6.796 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.512 -2.393 7.287 1.00 0.00 H new ATOM 182 N GLY A 433 -4.193 -5.260 7.151 1.00 0.00 N ATOM 183 CA GLY A 433 -4.734 -6.605 7.086 1.00 0.00 C ATOM 184 C GLY A 433 -4.041 -7.459 6.044 1.00 0.00 C ATOM 185 O GLY A 433 -4.675 -8.284 5.384 1.00 0.00 O ATOM 0 H GLY A 433 -3.464 -5.125 7.852 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.638 -7.080 8.063 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.799 -6.554 6.860 1.00 0.00 H new ATOM 189 N LEU A 434 -2.736 -7.262 5.892 1.00 0.00 N ATOM 190 CA LEU A 434 -1.955 -8.020 4.920 1.00 0.00 C ATOM 191 C LEU A 434 -1.625 -9.411 5.453 1.00 0.00 C ATOM 192 O LEU A 434 -1.352 -9.600 6.639 1.00 0.00 O ATOM 193 CB LEU A 434 -0.665 -7.273 4.579 1.00 0.00 C ATOM 194 CG LEU A 434 -0.809 -6.089 3.621 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.434 -5.214 3.664 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.070 -6.579 2.204 1.00 0.00 C ATOM 0 H LEU A 434 -2.196 -6.584 6.429 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.554 -8.130 4.016 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.221 -6.912 5.507 1.00 0.00 H new ATOM 0 HB3 LEU A 434 0.039 -7.983 4.144 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.662 -5.489 3.940 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.314 -4.377 2.976 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.577 -4.835 4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.303 -5.802 3.371 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.170 -5.724 1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.238 -7.201 1.875 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -1.990 -7.164 2.185 1.00 0.00 H new ATOM 208 N PRO A 435 -1.648 -10.409 4.557 1.00 0.00 N ATOM 209 CA PRO A 435 -1.350 -11.799 4.913 1.00 0.00 C ATOM 210 C PRO A 435 -0.086 -11.924 5.758 1.00 0.00 C ATOM 211 O PRO A 435 0.871 -11.166 5.601 1.00 0.00 O ATOM 212 CB PRO A 435 -1.155 -12.479 3.556 1.00 0.00 C ATOM 213 CG PRO A 435 -1.979 -11.677 2.609 1.00 0.00 C ATOM 214 CD PRO A 435 -1.965 -10.256 3.127 1.00 0.00 C ATOM 0 HA PRO A 435 -2.141 -12.243 5.518 1.00 0.00 H new ATOM 0 HB2 PRO A 435 -0.105 -12.483 3.262 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.482 -13.518 3.583 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.569 -11.726 1.600 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.998 -12.062 2.559 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.218 -9.650 2.614 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.928 -9.767 2.980 1.00 0.00 H new ATOM 222 N PRO A 436 -0.081 -12.902 6.675 1.00 0.00 N ATOM 223 CA PRO A 436 1.060 -13.149 7.562 1.00 0.00 C ATOM 224 C PRO A 436 2.177 -13.920 6.868 1.00 0.00 C ATOM 225 O PRO A 436 3.197 -14.240 7.479 1.00 0.00 O ATOM 226 CB PRO A 436 0.456 -13.986 8.693 1.00 0.00 C ATOM 227 CG PRO A 436 -0.694 -14.696 8.066 1.00 0.00 C ATOM 228 CD PRO A 436 -1.188 -13.843 6.917 1.00 0.00 C ATOM 0 HA PRO A 436 1.522 -12.221 7.900 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.184 -14.690 9.096 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.129 -13.356 9.520 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.388 -15.679 7.709 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.489 -14.855 8.794 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.401 -14.446 6.034 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -2.109 -13.319 7.175 1.00 0.00 H new ATOM 236 N ASP A 437 1.979 -14.216 5.588 1.00 0.00 N ATOM 237 CA ASP A 437 2.972 -14.948 4.810 1.00 0.00 C ATOM 238 C ASP A 437 3.237 -14.255 3.477 1.00 0.00 C ATOM 239 O ASP A 437 3.536 -14.906 2.476 1.00 0.00 O ATOM 240 CB ASP A 437 2.503 -16.384 4.567 1.00 0.00 C ATOM 241 CG ASP A 437 2.755 -17.284 5.761 1.00 0.00 C ATOM 242 OD1 ASP A 437 3.925 -17.398 6.181 1.00 0.00 O ATOM 243 OD2 ASP A 437 1.782 -17.875 6.274 1.00 0.00 O ATOM 0 H ASP A 437 1.140 -13.960 5.067 1.00 0.00 H new ATOM 0 HA ASP A 437 3.901 -14.968 5.380 1.00 0.00 H new ATOM 0 HB2 ASP A 437 1.438 -16.381 4.336 1.00 0.00 H new ATOM 0 HB3 ASP A 437 3.017 -16.789 3.695 1.00 0.00 H new ATOM 248 N ILE A 438 3.124 -12.931 3.472 1.00 0.00 N ATOM 249 CA ILE A 438 3.351 -12.150 2.262 1.00 0.00 C ATOM 250 C ILE A 438 4.606 -11.292 2.389 1.00 0.00 C ATOM 251 O ILE A 438 4.974 -10.873 3.487 1.00 0.00 O ATOM 252 CB ILE A 438 2.150 -11.239 1.946 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.309 -10.612 0.559 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.009 -10.160 3.009 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.013 -10.091 -0.021 1.00 0.00 C ATOM 0 H ILE A 438 2.877 -12.377 4.292 1.00 0.00 H new ATOM 0 HA ILE A 438 3.481 -12.862 1.447 1.00 0.00 H new ATOM 0 HB ILE A 438 1.243 -11.844 1.949 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.026 -9.793 0.619 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.729 -11.354 -0.120 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.156 -9.524 2.771 1.00 0.00 H new ATOM 0 HG22 ILE A 438 1.854 -10.626 3.982 1.00 0.00 H new ATOM 0 HG23 ILE A 438 2.915 -9.555 3.036 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.202 -9.661 -1.005 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.301 -10.911 -0.114 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.602 -9.326 0.637 1.00 0.00 H new ATOM 267 N ASP A 439 5.256 -11.034 1.260 1.00 0.00 N ATOM 268 CA ASP A 439 6.468 -10.223 1.244 1.00 0.00 C ATOM 269 C ASP A 439 6.270 -8.966 0.403 1.00 0.00 C ATOM 270 O ASP A 439 5.175 -8.710 -0.098 1.00 0.00 O ATOM 271 CB ASP A 439 7.644 -11.036 0.700 1.00 0.00 C ATOM 272 CG ASP A 439 7.510 -12.517 0.996 1.00 0.00 C ATOM 273 OD1 ASP A 439 6.895 -12.862 2.026 1.00 0.00 O ATOM 274 OD2 ASP A 439 8.020 -13.330 0.196 1.00 0.00 O ATOM 0 H ASP A 439 4.964 -11.375 0.344 1.00 0.00 H new ATOM 0 HA ASP A 439 6.688 -9.922 2.268 1.00 0.00 H new ATOM 0 HB2 ASP A 439 7.716 -10.889 -0.378 1.00 0.00 H new ATOM 0 HB3 ASP A 439 8.571 -10.664 1.135 1.00 0.00 H new ATOM 279 N GLU A 440 7.336 -8.186 0.253 1.00 0.00 N ATOM 280 CA GLU A 440 7.277 -6.955 -0.526 1.00 0.00 C ATOM 281 C GLU A 440 6.771 -7.229 -1.939 1.00 0.00 C ATOM 282 O GLU A 440 5.627 -6.917 -2.272 1.00 0.00 O ATOM 283 CB GLU A 440 8.657 -6.296 -0.585 1.00 0.00 C ATOM 284 CG GLU A 440 8.676 -4.991 -1.363 1.00 0.00 C ATOM 285 CD GLU A 440 9.010 -5.190 -2.829 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.043 -5.828 -3.121 1.00 0.00 O ATOM 287 OE2 GLU A 440 8.238 -4.707 -3.683 1.00 0.00 O ATOM 0 H GLU A 440 8.250 -8.385 0.660 1.00 0.00 H new ATOM 0 HA GLU A 440 6.579 -6.277 -0.034 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.004 -6.108 0.431 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.363 -6.991 -1.040 1.00 0.00 H new ATOM 0 HG2 GLU A 440 7.703 -4.508 -1.278 1.00 0.00 H new ATOM 0 HG3 GLU A 440 9.407 -4.317 -0.916 1.00 0.00 H new ATOM 294 N ASP A 441 7.631 -7.813 -2.766 1.00 0.00 N ATOM 295 CA ASP A 441 7.273 -8.130 -4.144 1.00 0.00 C ATOM 296 C ASP A 441 5.801 -8.520 -4.246 1.00 0.00 C ATOM 297 O ASP A 441 5.030 -7.884 -4.964 1.00 0.00 O ATOM 298 CB ASP A 441 8.152 -9.264 -4.674 1.00 0.00 C ATOM 299 CG ASP A 441 8.209 -9.291 -6.189 1.00 0.00 C ATOM 300 OD1 ASP A 441 8.889 -8.422 -6.772 1.00 0.00 O ATOM 301 OD2 ASP A 441 7.574 -10.182 -6.791 1.00 0.00 O ATOM 0 H ASP A 441 8.581 -8.077 -2.506 1.00 0.00 H new ATOM 0 HA ASP A 441 7.438 -7.240 -4.751 1.00 0.00 H new ATOM 0 HB2 ASP A 441 9.161 -9.154 -4.277 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.769 -10.217 -4.310 1.00 0.00 H new ATOM 306 N GLU A 442 5.421 -9.569 -3.524 1.00 0.00 N ATOM 307 CA GLU A 442 4.042 -10.045 -3.536 1.00 0.00 C ATOM 308 C GLU A 442 3.063 -8.874 -3.543 1.00 0.00 C ATOM 309 O GLU A 442 2.230 -8.753 -4.441 1.00 0.00 O ATOM 310 CB GLU A 442 3.777 -10.939 -2.323 1.00 0.00 C ATOM 311 CG GLU A 442 4.656 -12.177 -2.276 1.00 0.00 C ATOM 312 CD GLU A 442 4.149 -13.287 -3.177 1.00 0.00 C ATOM 313 OE1 GLU A 442 4.123 -13.085 -4.409 1.00 0.00 O ATOM 314 OE2 GLU A 442 3.777 -14.356 -2.650 1.00 0.00 O ATOM 0 H GLU A 442 6.048 -10.105 -2.924 1.00 0.00 H new ATOM 0 HA GLU A 442 3.893 -10.627 -4.446 1.00 0.00 H new ATOM 0 HB2 GLU A 442 3.932 -10.359 -1.414 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.731 -11.246 -2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 442 5.670 -11.909 -2.571 1.00 0.00 H new ATOM 0 HG3 GLU A 442 4.709 -12.542 -1.250 1.00 0.00 H new ATOM 321 N ILE A 443 3.170 -8.016 -2.534 1.00 0.00 N ATOM 322 CA ILE A 443 2.295 -6.855 -2.423 1.00 0.00 C ATOM 323 C ILE A 443 2.222 -6.094 -3.743 1.00 0.00 C ATOM 324 O ILE A 443 1.137 -5.816 -4.254 1.00 0.00 O ATOM 325 CB ILE A 443 2.770 -5.895 -1.316 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.765 -6.604 0.040 1.00 0.00 C ATOM 327 CG2 ILE A 443 1.889 -4.656 -1.275 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.592 -5.900 1.093 1.00 0.00 C ATOM 0 H ILE A 443 3.854 -8.103 -1.782 1.00 0.00 H new ATOM 0 HA ILE A 443 1.304 -7.230 -2.167 1.00 0.00 H new ATOM 0 HB ILE A 443 3.791 -5.584 -1.539 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.737 -6.688 0.393 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.142 -7.619 -0.088 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.238 -3.988 -0.488 1.00 0.00 H new ATOM 0 HG22 ILE A 443 1.938 -4.142 -2.235 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.859 -4.949 -1.073 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.542 -6.458 2.028 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.628 -5.839 0.761 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.202 -4.894 1.250 1.00 0.00 H new ATOM 340 N THR A 444 3.386 -5.760 -4.293 1.00 0.00 N ATOM 341 CA THR A 444 3.455 -5.032 -5.553 1.00 0.00 C ATOM 342 C THR A 444 2.554 -5.669 -6.606 1.00 0.00 C ATOM 343 O THR A 444 1.723 -4.996 -7.214 1.00 0.00 O ATOM 344 CB THR A 444 4.896 -4.977 -6.093 1.00 0.00 C ATOM 345 OG1 THR A 444 5.807 -4.681 -5.028 1.00 0.00 O ATOM 346 CG2 THR A 444 5.026 -3.927 -7.185 1.00 0.00 C ATOM 0 H THR A 444 4.294 -5.983 -3.885 1.00 0.00 H new ATOM 0 HA THR A 444 3.112 -4.017 -5.350 1.00 0.00 H new ATOM 0 HB THR A 444 5.138 -5.951 -6.518 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.688 -5.054 -5.238 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.053 -3.907 -7.550 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.353 -4.172 -8.007 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.766 -2.948 -6.782 1.00 0.00 H new ATOM 354 N ALA A 445 2.725 -6.970 -6.815 1.00 0.00 N ATOM 355 CA ALA A 445 1.926 -7.698 -7.793 1.00 0.00 C ATOM 356 C ALA A 445 0.437 -7.577 -7.484 1.00 0.00 C ATOM 357 O ALA A 445 -0.394 -7.541 -8.391 1.00 0.00 O ATOM 358 CB ALA A 445 2.342 -9.161 -7.830 1.00 0.00 C ATOM 0 H ALA A 445 3.410 -7.542 -6.320 1.00 0.00 H new ATOM 0 HA ALA A 445 2.104 -7.256 -8.773 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.737 -9.693 -8.565 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.394 -9.233 -8.106 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.193 -9.607 -6.846 1.00 0.00 H new ATOM 364 N SER A 446 0.108 -7.516 -6.198 1.00 0.00 N ATOM 365 CA SER A 446 -1.282 -7.403 -5.769 1.00 0.00 C ATOM 366 C SER A 446 -1.869 -6.055 -6.177 1.00 0.00 C ATOM 367 O SER A 446 -3.074 -5.930 -6.395 1.00 0.00 O ATOM 368 CB SER A 446 -1.386 -7.581 -4.253 1.00 0.00 C ATOM 369 OG SER A 446 -0.928 -8.862 -3.857 1.00 0.00 O ATOM 0 H SER A 446 0.784 -7.543 -5.435 1.00 0.00 H new ATOM 0 HA SER A 446 -1.853 -8.191 -6.260 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.799 -6.811 -3.752 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.421 -7.448 -3.938 1.00 0.00 H new ATOM 0 HG SER A 446 0.042 -8.918 -3.988 1.00 0.00 H new ATOM 375 N PHE A 447 -1.007 -5.048 -6.276 1.00 0.00 N ATOM 376 CA PHE A 447 -1.439 -3.708 -6.656 1.00 0.00 C ATOM 377 C PHE A 447 -0.656 -3.207 -7.866 1.00 0.00 C ATOM 378 O PHE A 447 -0.505 -2.001 -8.066 1.00 0.00 O ATOM 379 CB PHE A 447 -1.263 -2.741 -5.484 1.00 0.00 C ATOM 380 CG PHE A 447 -2.140 -3.059 -4.307 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.818 -4.095 -3.446 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.287 -2.321 -4.062 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.624 -4.390 -2.363 1.00 0.00 C ATOM 384 CE2 PHE A 447 -4.097 -2.611 -2.980 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.764 -3.647 -2.129 1.00 0.00 C ATOM 0 H PHE A 447 -0.006 -5.134 -6.099 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.495 -3.756 -6.923 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.221 -2.756 -5.165 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.478 -1.728 -5.824 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.927 -4.679 -3.623 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.551 -1.510 -4.724 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.362 -5.201 -1.700 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.989 -2.029 -2.800 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.394 -3.875 -1.282 1.00 0.00 H new ATOM 395 N ARG A 448 -0.159 -4.141 -8.670 1.00 0.00 N ATOM 396 CA ARG A 448 0.611 -3.795 -9.859 1.00 0.00 C ATOM 397 C ARG A 448 -0.309 -3.575 -11.057 1.00 0.00 C ATOM 398 O ARG A 448 -0.136 -2.624 -11.818 1.00 0.00 O ATOM 399 CB ARG A 448 1.624 -4.897 -10.176 1.00 0.00 C ATOM 400 CG ARG A 448 2.405 -4.657 -11.457 1.00 0.00 C ATOM 401 CD ARG A 448 3.606 -3.756 -11.217 1.00 0.00 C ATOM 402 NE ARG A 448 4.709 -4.473 -10.583 1.00 0.00 N ATOM 403 CZ ARG A 448 5.877 -3.913 -10.288 1.00 0.00 C ATOM 404 NH1 ARG A 448 6.092 -2.635 -10.569 1.00 0.00 N ATOM 405 NH2 ARG A 448 6.833 -4.631 -9.712 1.00 0.00 N ATOM 0 H ARG A 448 -0.276 -5.143 -8.520 1.00 0.00 H new ATOM 0 HA ARG A 448 1.146 -2.867 -9.657 1.00 0.00 H new ATOM 0 HB2 ARG A 448 2.324 -4.985 -9.345 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.100 -5.849 -10.253 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.740 -5.611 -11.864 1.00 0.00 H new ATOM 0 HG3 ARG A 448 1.752 -4.204 -12.203 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.942 -3.339 -12.166 1.00 0.00 H new ATOM 0 HD3 ARG A 448 3.310 -2.917 -10.588 1.00 0.00 H new ATOM 0 HE ARG A 448 4.575 -5.458 -10.354 1.00 0.00 H new ATOM 0 HH11 ARG A 448 5.360 -2.080 -11.012 1.00 0.00 H new ATOM 0 HH12 ARG A 448 6.989 -2.207 -10.342 1.00 0.00 H new ATOM 0 HH21 ARG A 448 6.672 -5.615 -9.495 1.00 0.00 H new ATOM 0 HH22 ARG A 448 7.729 -4.199 -9.486 1.00 0.00 H new ATOM 419 N ARG A 449 -1.285 -4.462 -11.217 1.00 0.00 N ATOM 420 CA ARG A 449 -2.231 -4.366 -12.323 1.00 0.00 C ATOM 421 C ARG A 449 -2.580 -2.910 -12.614 1.00 0.00 C ATOM 422 O ARG A 449 -2.523 -2.464 -13.761 1.00 0.00 O ATOM 423 CB ARG A 449 -3.503 -5.153 -12.003 1.00 0.00 C ATOM 424 CG ARG A 449 -4.327 -4.549 -10.878 1.00 0.00 C ATOM 425 CD ARG A 449 -5.341 -5.543 -10.334 1.00 0.00 C ATOM 426 NE ARG A 449 -6.518 -4.877 -9.781 1.00 0.00 N ATOM 427 CZ ARG A 449 -7.547 -5.526 -9.249 1.00 0.00 C ATOM 428 NH1 ARG A 449 -7.545 -6.850 -9.198 1.00 0.00 N ATOM 429 NH2 ARG A 449 -8.581 -4.849 -8.766 1.00 0.00 N ATOM 0 H ARG A 449 -1.442 -5.255 -10.595 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.761 -4.793 -13.209 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.118 -5.213 -12.901 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.231 -6.174 -11.735 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.666 -4.226 -10.074 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.845 -3.661 -11.241 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -5.649 -6.220 -11.131 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -4.873 -6.152 -9.561 1.00 0.00 H new ATOM 0 HE ARG A 449 -6.551 -3.858 -9.805 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -6.752 -7.373 -9.568 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -8.337 -7.346 -8.789 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -8.586 -3.830 -8.803 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -9.371 -5.348 -8.357 1.00 0.00 H new ATOM 443 N PHE A 450 -2.942 -2.173 -11.569 1.00 0.00 N ATOM 444 CA PHE A 450 -3.302 -0.767 -11.713 1.00 0.00 C ATOM 445 C PHE A 450 -2.181 0.015 -12.391 1.00 0.00 C ATOM 446 O PHE A 450 -2.431 0.872 -13.237 1.00 0.00 O ATOM 447 CB PHE A 450 -3.612 -0.156 -10.345 1.00 0.00 C ATOM 448 CG PHE A 450 -4.604 -0.949 -9.544 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.963 -0.825 -9.781 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.177 -1.820 -8.555 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.878 -1.553 -9.044 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.087 -2.552 -7.815 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.440 -2.419 -8.061 1.00 0.00 C ATOM 0 H PHE A 450 -2.994 -2.526 -10.613 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.192 -0.707 -12.340 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.686 -0.069 -9.777 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.996 0.854 -10.486 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.312 -0.152 -10.550 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.120 -1.929 -8.360 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.935 -1.445 -9.237 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -4.741 -3.227 -7.046 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.153 -2.991 -7.486 1.00 0.00 H new ATOM 463 N GLY A 451 -0.943 -0.287 -12.011 1.00 0.00 N ATOM 464 CA GLY A 451 0.198 0.396 -12.591 1.00 0.00 C ATOM 465 C GLY A 451 1.456 0.232 -11.760 1.00 0.00 C ATOM 466 O GLY A 451 1.509 -0.571 -10.828 1.00 0.00 O ATOM 0 H GLY A 451 -0.710 -0.992 -11.312 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.377 0.011 -13.595 1.00 0.00 H new ATOM 0 HA3 GLY A 451 -0.031 1.457 -12.693 1.00 0.00 H new ATOM 470 N PRO A 452 2.498 1.004 -12.099 1.00 0.00 N ATOM 471 CA PRO A 452 3.781 0.958 -11.391 1.00 0.00 C ATOM 472 C PRO A 452 3.727 1.674 -10.046 1.00 0.00 C ATOM 473 O PRO A 452 3.324 2.836 -9.965 1.00 0.00 O ATOM 474 CB PRO A 452 4.738 1.679 -12.343 1.00 0.00 C ATOM 475 CG PRO A 452 3.874 2.621 -13.108 1.00 0.00 C ATOM 476 CD PRO A 452 2.505 1.983 -13.199 1.00 0.00 C ATOM 0 HA PRO A 452 4.081 -0.064 -11.157 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.515 2.211 -11.795 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.241 0.975 -13.007 1.00 0.00 H new ATOM 0 HG2 PRO A 452 3.818 3.587 -12.607 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.284 2.801 -14.102 1.00 0.00 H new ATOM 0 HD2 PRO A 452 1.711 2.721 -13.082 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.352 1.501 -14.164 1.00 0.00 H new ATOM 484 N LEU A 453 4.135 0.976 -8.992 1.00 0.00 N ATOM 485 CA LEU A 453 4.133 1.546 -7.649 1.00 0.00 C ATOM 486 C LEU A 453 5.256 0.953 -6.805 1.00 0.00 C ATOM 487 O LEU A 453 5.995 0.080 -7.260 1.00 0.00 O ATOM 488 CB LEU A 453 2.785 1.300 -6.971 1.00 0.00 C ATOM 489 CG LEU A 453 2.504 -0.139 -6.538 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.385 -0.179 -5.509 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.153 -1.000 -7.743 1.00 0.00 C ATOM 0 H LEU A 453 4.471 0.014 -9.041 1.00 0.00 H new ATOM 0 HA LEU A 453 4.297 2.620 -7.736 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.720 1.942 -6.092 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.995 1.614 -7.653 1.00 0.00 H new ATOM 0 HG LEU A 453 3.407 -0.542 -6.079 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.200 -1.212 -5.213 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.674 0.403 -4.634 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.478 0.243 -5.941 1.00 0.00 H new ATOM 0 HD21 LEU A 453 1.956 -2.021 -7.416 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.265 -0.598 -8.231 1.00 0.00 H new ATOM 0 HD23 LEU A 453 2.986 -0.999 -8.446 1.00 0.00 H new ATOM 503 N VAL A 454 5.378 1.432 -5.570 1.00 0.00 N ATOM 504 CA VAL A 454 6.408 0.947 -4.660 1.00 0.00 C ATOM 505 C VAL A 454 5.847 0.730 -3.260 1.00 0.00 C ATOM 506 O VAL A 454 5.075 1.546 -2.755 1.00 0.00 O ATOM 507 CB VAL A 454 7.593 1.927 -4.580 1.00 0.00 C ATOM 508 CG1 VAL A 454 7.116 3.308 -4.156 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.654 1.404 -3.623 1.00 0.00 C ATOM 0 H VAL A 454 4.776 2.156 -5.178 1.00 0.00 H new ATOM 0 HA VAL A 454 6.759 -0.005 -5.059 1.00 0.00 H new ATOM 0 HB VAL A 454 8.040 2.011 -5.571 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.967 3.987 -4.105 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.396 3.683 -4.883 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.643 3.245 -3.176 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.484 2.109 -3.579 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.222 1.289 -2.629 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.017 0.438 -3.975 1.00 0.00 H new ATOM 519 N VAL A 455 6.240 -0.376 -2.635 1.00 0.00 N ATOM 520 CA VAL A 455 5.777 -0.700 -1.291 1.00 0.00 C ATOM 521 C VAL A 455 6.734 -0.159 -0.235 1.00 0.00 C ATOM 522 O VAL A 455 7.953 -0.229 -0.393 1.00 0.00 O ATOM 523 CB VAL A 455 5.627 -2.221 -1.101 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.857 -2.526 0.175 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.941 -2.843 -2.308 1.00 0.00 C ATOM 0 H VAL A 455 6.878 -1.062 -3.038 1.00 0.00 H new ATOM 0 HA VAL A 455 4.802 -0.228 -1.169 1.00 0.00 H new ATOM 0 HB VAL A 455 6.621 -2.658 -1.011 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.761 -3.605 0.293 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.392 -2.114 1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.865 -2.077 0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.843 -3.918 -2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.952 -2.402 -2.431 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.536 -2.655 -3.202 1.00 0.00 H new ATOM 535 N ASP A 456 6.174 0.379 0.843 1.00 0.00 N ATOM 536 CA ASP A 456 6.978 0.931 1.927 1.00 0.00 C ATOM 537 C ASP A 456 6.232 0.844 3.255 1.00 0.00 C ATOM 538 O ASP A 456 5.259 1.563 3.480 1.00 0.00 O ATOM 539 CB ASP A 456 7.345 2.386 1.629 1.00 0.00 C ATOM 540 CG ASP A 456 8.244 2.986 2.693 1.00 0.00 C ATOM 541 OD1 ASP A 456 8.993 2.222 3.336 1.00 0.00 O ATOM 542 OD2 ASP A 456 8.199 4.219 2.880 1.00 0.00 O ATOM 0 H ASP A 456 5.167 0.445 0.989 1.00 0.00 H new ATOM 0 HA ASP A 456 7.892 0.342 2.004 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.845 2.441 0.662 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.434 2.979 1.551 1.00 0.00 H new ATOM 547 N TRP A 457 6.695 -0.042 4.130 1.00 0.00 N ATOM 548 CA TRP A 457 6.071 -0.224 5.436 1.00 0.00 C ATOM 549 C TRP A 457 6.852 0.510 6.520 1.00 0.00 C ATOM 550 O TRP A 457 8.070 0.669 6.440 1.00 0.00 O ATOM 551 CB TRP A 457 5.977 -1.712 5.776 1.00 0.00 C ATOM 552 CG TRP A 457 7.217 -2.480 5.431 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.160 -2.948 6.301 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.650 -2.866 4.122 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.153 -3.602 5.611 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.863 -3.566 4.273 1.00 0.00 C ATOM 557 CE3 TRP A 457 7.130 -2.690 2.837 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.561 -4.088 3.188 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.824 -3.208 1.760 1.00 0.00 C ATOM 560 CH2 TRP A 457 9.029 -3.901 1.941 1.00 0.00 C ATOM 0 H TRP A 457 7.500 -0.645 3.959 1.00 0.00 H new ATOM 0 HA TRP A 457 5.066 0.196 5.392 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.775 -1.822 6.841 1.00 0.00 H new ATOM 0 HB3 TRP A 457 5.130 -2.146 5.245 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.130 -2.823 7.373 1.00 0.00 H new ATOM 0 HE1 TRP A 457 9.973 -4.043 6.028 1.00 0.00 H new ATOM 0 HE3 TRP A 457 6.202 -2.158 2.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.490 -4.622 3.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.431 -3.077 0.762 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.548 -4.295 1.080 1.00 0.00 H new ATOM 571 N PRO A 458 6.138 0.968 7.558 1.00 0.00 N ATOM 572 CA PRO A 458 6.745 1.692 8.679 1.00 0.00 C ATOM 573 C PRO A 458 7.985 0.989 9.220 1.00 0.00 C ATOM 574 O PRO A 458 9.060 1.583 9.308 1.00 0.00 O ATOM 575 CB PRO A 458 5.636 1.708 9.734 1.00 0.00 C ATOM 576 CG PRO A 458 4.370 1.631 8.953 1.00 0.00 C ATOM 577 CD PRO A 458 4.682 0.815 7.719 1.00 0.00 C ATOM 0 HA PRO A 458 7.087 2.685 8.385 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.730 0.866 10.420 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.675 2.616 10.336 1.00 0.00 H new ATOM 0 HG2 PRO A 458 3.579 1.163 9.539 1.00 0.00 H new ATOM 0 HG3 PRO A 458 4.019 2.627 8.682 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.401 -0.230 7.849 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.142 1.185 6.847 1.00 0.00 H new ATOM 585 N HIS A 459 7.829 -0.281 9.580 1.00 0.00 N ATOM 586 CA HIS A 459 8.938 -1.066 10.112 1.00 0.00 C ATOM 587 C HIS A 459 9.871 -1.517 8.992 1.00 0.00 C ATOM 588 O HIS A 459 10.107 -2.711 8.809 1.00 0.00 O ATOM 589 CB HIS A 459 8.410 -2.284 10.872 1.00 0.00 C ATOM 590 CG HIS A 459 7.784 -1.942 12.189 1.00 0.00 C ATOM 591 ND1 HIS A 459 7.945 -2.713 13.321 1.00 0.00 N ATOM 592 CD2 HIS A 459 6.994 -0.904 12.552 1.00 0.00 C ATOM 593 CE1 HIS A 459 7.280 -2.165 14.323 1.00 0.00 C ATOM 594 NE2 HIS A 459 6.695 -1.066 13.882 1.00 0.00 N ATOM 0 H HIS A 459 6.947 -0.788 9.513 1.00 0.00 H new ATOM 0 HA HIS A 459 9.501 -0.434 10.799 1.00 0.00 H new ATOM 0 HB2 HIS A 459 7.675 -2.798 10.252 1.00 0.00 H new ATOM 0 HB3 HIS A 459 9.231 -2.982 11.039 1.00 0.00 H new ATOM 0 HD2 HIS A 459 6.661 -0.099 11.914 1.00 0.00 H new ATOM 0 HE1 HIS A 459 7.224 -2.550 15.330 1.00 0.00 H new ATOM 0 HE2 HIS A 459 6.115 -0.439 14.439 1.00 0.00 H new ATOM 602 N LYS A 460 10.398 -0.553 8.244 1.00 0.00 N ATOM 603 CA LYS A 460 11.306 -0.849 7.142 1.00 0.00 C ATOM 604 C LYS A 460 12.521 0.072 7.176 1.00 0.00 C ATOM 605 O LYS A 460 13.662 -0.389 7.160 1.00 0.00 O ATOM 606 CB LYS A 460 10.579 -0.704 5.803 1.00 0.00 C ATOM 607 CG LYS A 460 11.287 -1.393 4.649 1.00 0.00 C ATOM 608 CD LYS A 460 11.004 -0.700 3.328 1.00 0.00 C ATOM 609 CE LYS A 460 11.717 -1.387 2.173 1.00 0.00 C ATOM 610 NZ LYS A 460 11.064 -1.097 0.866 1.00 0.00 N ATOM 0 H LYS A 460 10.212 0.440 8.381 1.00 0.00 H new ATOM 0 HA LYS A 460 11.649 -1.878 7.253 1.00 0.00 H new ATOM 0 HB2 LYS A 460 9.574 -1.114 5.899 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.470 0.355 5.571 1.00 0.00 H new ATOM 0 HG2 LYS A 460 12.361 -1.402 4.833 1.00 0.00 H new ATOM 0 HG3 LYS A 460 10.965 -2.433 4.592 1.00 0.00 H new ATOM 0 HD2 LYS A 460 9.930 -0.694 3.142 1.00 0.00 H new ATOM 0 HD3 LYS A 460 11.323 0.341 3.386 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.756 -1.058 2.141 1.00 0.00 H new ATOM 0 HE3 LYS A 460 11.728 -2.464 2.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 11.580 -1.583 0.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 10.080 -1.433 0.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 11.076 -0.072 0.692 1.00 0.00 H new ATOM 624 N ALA A 461 12.268 1.376 7.223 1.00 0.00 N ATOM 625 CA ALA A 461 13.341 2.362 7.263 1.00 0.00 C ATOM 626 C ALA A 461 14.221 2.166 8.493 1.00 0.00 C ATOM 627 O ALA A 461 15.444 2.078 8.384 1.00 0.00 O ATOM 628 CB ALA A 461 12.766 3.770 7.241 1.00 0.00 C ATOM 0 H ALA A 461 11.329 1.774 7.234 1.00 0.00 H new ATOM 0 HA ALA A 461 13.962 2.222 6.378 1.00 0.00 H new ATOM 0 HB1 ALA A 461 13.579 4.496 7.271 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.187 3.912 6.329 1.00 0.00 H new ATOM 0 HB3 ALA A 461 12.120 3.913 8.107 1.00 0.00 H new ATOM 634 N GLU A 462 13.591 2.100 9.661 1.00 0.00 N ATOM 635 CA GLU A 462 14.318 1.917 10.911 1.00 0.00 C ATOM 636 C GLU A 462 14.873 0.499 11.015 1.00 0.00 C ATOM 637 O GLU A 462 16.064 0.303 11.254 1.00 0.00 O ATOM 638 CB GLU A 462 13.407 2.208 12.105 1.00 0.00 C ATOM 639 CG GLU A 462 13.427 3.662 12.546 1.00 0.00 C ATOM 640 CD GLU A 462 12.153 4.074 13.258 1.00 0.00 C ATOM 641 OE1 GLU A 462 11.598 3.246 14.008 1.00 0.00 O ATOM 642 OE2 GLU A 462 11.712 5.227 13.063 1.00 0.00 O ATOM 0 H GLU A 462 12.579 2.171 9.768 1.00 0.00 H new ATOM 0 HA GLU A 462 15.153 2.618 10.921 1.00 0.00 H new ATOM 0 HB2 GLU A 462 12.385 1.929 11.848 1.00 0.00 H new ATOM 0 HB3 GLU A 462 13.708 1.579 12.943 1.00 0.00 H new ATOM 0 HG2 GLU A 462 14.278 3.825 13.208 1.00 0.00 H new ATOM 0 HG3 GLU A 462 13.574 4.300 11.675 1.00 0.00 H new ATOM 649 N SER A 463 13.999 -0.487 10.834 1.00 0.00 N ATOM 650 CA SER A 463 14.399 -1.887 10.912 1.00 0.00 C ATOM 651 C SER A 463 14.236 -2.574 9.560 1.00 0.00 C ATOM 652 O SER A 463 13.260 -3.288 9.327 1.00 0.00 O ATOM 653 CB SER A 463 13.573 -2.617 11.972 1.00 0.00 C ATOM 654 OG SER A 463 13.673 -1.974 13.230 1.00 0.00 O ATOM 0 H SER A 463 13.010 -0.342 10.632 1.00 0.00 H new ATOM 0 HA SER A 463 15.451 -1.924 11.194 1.00 0.00 H new ATOM 0 HB2 SER A 463 12.529 -2.654 11.661 1.00 0.00 H new ATOM 0 HB3 SER A 463 13.917 -3.648 12.059 1.00 0.00 H new ATOM 0 HG SER A 463 13.134 -2.460 13.889 1.00 0.00 H new ATOM 660 N LYS A 464 15.198 -2.353 8.671 1.00 0.00 N ATOM 661 CA LYS A 464 15.164 -2.951 7.341 1.00 0.00 C ATOM 662 C LYS A 464 14.718 -4.408 7.411 1.00 0.00 C ATOM 663 O LYS A 464 15.048 -5.123 8.358 1.00 0.00 O ATOM 664 CB LYS A 464 16.542 -2.859 6.683 1.00 0.00 C ATOM 665 CG LYS A 464 17.530 -3.893 7.193 1.00 0.00 C ATOM 666 CD LYS A 464 18.216 -3.428 8.467 1.00 0.00 C ATOM 667 CE LYS A 464 19.485 -2.646 8.162 1.00 0.00 C ATOM 668 NZ LYS A 464 19.927 -1.831 9.328 1.00 0.00 N ATOM 0 H LYS A 464 16.012 -1.764 8.847 1.00 0.00 H new ATOM 0 HA LYS A 464 14.443 -2.398 6.739 1.00 0.00 H new ATOM 0 HB2 LYS A 464 16.429 -2.977 5.605 1.00 0.00 H new ATOM 0 HB3 LYS A 464 16.951 -1.863 6.853 1.00 0.00 H new ATOM 0 HG2 LYS A 464 17.010 -4.833 7.381 1.00 0.00 H new ATOM 0 HG3 LYS A 464 18.279 -4.091 6.427 1.00 0.00 H new ATOM 0 HD2 LYS A 464 17.532 -2.804 9.043 1.00 0.00 H new ATOM 0 HD3 LYS A 464 18.459 -4.291 9.087 1.00 0.00 H new ATOM 0 HE2 LYS A 464 20.279 -3.338 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 464 19.313 -1.993 7.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 20.794 -1.313 9.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 19.180 -1.154 9.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 20.116 -2.457 10.137 1.00 0.00 H new ATOM 682 N SER A 465 13.969 -4.842 6.403 1.00 0.00 N ATOM 683 CA SER A 465 13.477 -6.214 6.351 1.00 0.00 C ATOM 684 C SER A 465 12.751 -6.482 5.036 1.00 0.00 C ATOM 685 O SER A 465 12.664 -5.608 4.173 1.00 0.00 O ATOM 686 CB SER A 465 12.539 -6.486 7.529 1.00 0.00 C ATOM 687 OG SER A 465 13.265 -6.898 8.674 1.00 0.00 O ATOM 0 H SER A 465 13.689 -4.264 5.611 1.00 0.00 H new ATOM 0 HA SER A 465 14.334 -6.884 6.415 1.00 0.00 H new ATOM 0 HB2 SER A 465 11.970 -5.586 7.760 1.00 0.00 H new ATOM 0 HB3 SER A 465 11.819 -7.257 7.254 1.00 0.00 H new ATOM 0 HG SER A 465 13.876 -6.183 8.949 1.00 0.00 H new ATOM 693 N TYR A 466 12.232 -7.696 4.891 1.00 0.00 N ATOM 694 CA TYR A 466 11.515 -8.081 3.681 1.00 0.00 C ATOM 695 C TYR A 466 10.062 -8.425 3.995 1.00 0.00 C ATOM 696 O TYR A 466 9.193 -8.354 3.126 1.00 0.00 O ATOM 697 CB TYR A 466 12.202 -9.275 3.015 1.00 0.00 C ATOM 698 CG TYR A 466 12.564 -10.381 3.980 1.00 0.00 C ATOM 699 CD1 TYR A 466 13.533 -10.189 4.957 1.00 0.00 C ATOM 700 CD2 TYR A 466 11.935 -11.619 3.916 1.00 0.00 C ATOM 701 CE1 TYR A 466 13.867 -11.197 5.840 1.00 0.00 C ATOM 702 CE2 TYR A 466 12.262 -12.632 4.796 1.00 0.00 C ATOM 703 CZ TYR A 466 13.229 -12.417 5.756 1.00 0.00 C ATOM 704 OH TYR A 466 13.558 -13.423 6.634 1.00 0.00 O ATOM 0 H TYR A 466 12.294 -8.430 5.596 1.00 0.00 H new ATOM 0 HA TYR A 466 11.528 -7.234 2.995 1.00 0.00 H new ATOM 0 HB2 TYR A 466 11.545 -9.678 2.244 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.107 -8.930 2.515 1.00 0.00 H new ATOM 0 HD1 TYR A 466 14.034 -9.235 5.027 1.00 0.00 H new ATOM 0 HD2 TYR A 466 11.178 -11.792 3.165 1.00 0.00 H new ATOM 0 HE1 TYR A 466 14.624 -11.031 6.592 1.00 0.00 H new ATOM 0 HE2 TYR A 466 11.763 -13.588 4.733 1.00 0.00 H new ATOM 0 HH TYR A 466 13.016 -14.216 6.441 1.00 0.00 H new ATOM 714 N PHE A 467 9.806 -8.800 5.244 1.00 0.00 N ATOM 715 CA PHE A 467 8.459 -9.156 5.674 1.00 0.00 C ATOM 716 C PHE A 467 7.777 -7.976 6.360 1.00 0.00 C ATOM 717 O PHE A 467 8.125 -7.588 7.476 1.00 0.00 O ATOM 718 CB PHE A 467 8.505 -10.355 6.624 1.00 0.00 C ATOM 719 CG PHE A 467 8.381 -11.679 5.924 1.00 0.00 C ATOM 720 CD1 PHE A 467 7.230 -12.001 5.223 1.00 0.00 C ATOM 721 CD2 PHE A 467 9.415 -12.599 5.967 1.00 0.00 C ATOM 722 CE1 PHE A 467 7.114 -13.219 4.579 1.00 0.00 C ATOM 723 CE2 PHE A 467 9.304 -13.818 5.325 1.00 0.00 C ATOM 724 CZ PHE A 467 8.152 -14.128 4.629 1.00 0.00 C ATOM 0 H PHE A 467 10.513 -8.865 5.976 1.00 0.00 H new ATOM 0 HA PHE A 467 7.881 -9.423 4.789 1.00 0.00 H new ATOM 0 HB2 PHE A 467 9.443 -10.333 7.179 1.00 0.00 H new ATOM 0 HB3 PHE A 467 7.700 -10.262 7.353 1.00 0.00 H new ATOM 0 HD1 PHE A 467 6.415 -11.293 5.179 1.00 0.00 H new ATOM 0 HD2 PHE A 467 10.319 -12.361 6.508 1.00 0.00 H new ATOM 0 HE1 PHE A 467 6.211 -13.459 4.037 1.00 0.00 H new ATOM 0 HE2 PHE A 467 10.117 -14.527 5.368 1.00 0.00 H new ATOM 0 HZ PHE A 467 8.063 -15.079 4.125 1.00 0.00 H new ATOM 734 N PRO A 468 6.783 -7.389 5.677 1.00 0.00 N ATOM 735 CA PRO A 468 6.031 -6.245 6.200 1.00 0.00 C ATOM 736 C PRO A 468 5.560 -6.467 7.633 1.00 0.00 C ATOM 737 O PRO A 468 5.483 -7.596 8.119 1.00 0.00 O ATOM 738 CB PRO A 468 4.832 -6.145 5.253 1.00 0.00 C ATOM 739 CG PRO A 468 5.314 -6.728 3.970 1.00 0.00 C ATOM 740 CD PRO A 468 6.316 -7.799 4.342 1.00 0.00 C ATOM 0 HA PRO A 468 6.639 -5.341 6.237 1.00 0.00 H new ATOM 0 HB2 PRO A 468 3.974 -6.695 5.640 1.00 0.00 H new ATOM 0 HB3 PRO A 468 4.515 -5.110 5.123 1.00 0.00 H new ATOM 0 HG2 PRO A 468 4.487 -7.150 3.399 1.00 0.00 H new ATOM 0 HG3 PRO A 468 5.775 -5.964 3.344 1.00 0.00 H new ATOM 0 HD2 PRO A 468 5.857 -8.787 4.364 1.00 0.00 H new ATOM 0 HD3 PRO A 468 7.137 -7.845 3.627 1.00 0.00 H new ATOM 748 N PRO A 469 5.236 -5.366 8.328 1.00 0.00 N ATOM 749 CA PRO A 469 4.766 -5.415 9.715 1.00 0.00 C ATOM 750 C PRO A 469 3.698 -6.483 9.928 1.00 0.00 C ATOM 751 O PRO A 469 3.293 -7.167 8.988 1.00 0.00 O ATOM 752 CB PRO A 469 4.178 -4.020 9.941 1.00 0.00 C ATOM 753 CG PRO A 469 4.929 -3.138 9.004 1.00 0.00 C ATOM 754 CD PRO A 469 5.303 -3.989 7.812 1.00 0.00 C ATOM 0 HA PRO A 469 5.568 -5.672 10.407 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.109 -4.002 9.731 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.305 -3.699 10.975 1.00 0.00 H new ATOM 0 HG2 PRO A 469 4.317 -2.290 8.697 1.00 0.00 H new ATOM 0 HG3 PRO A 469 5.819 -2.732 9.484 1.00 0.00 H new ATOM 0 HD2 PRO A 469 4.613 -3.839 6.981 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.301 -3.747 7.445 1.00 0.00 H new ATOM 762 N LYS A 470 3.245 -6.621 11.170 1.00 0.00 N ATOM 763 CA LYS A 470 2.223 -7.605 11.507 1.00 0.00 C ATOM 764 C LYS A 470 1.164 -7.687 10.411 1.00 0.00 C ATOM 765 O LYS A 470 0.671 -8.767 10.091 1.00 0.00 O ATOM 766 CB LYS A 470 1.564 -7.249 12.841 1.00 0.00 C ATOM 767 CG LYS A 470 2.275 -7.839 14.047 1.00 0.00 C ATOM 768 CD LYS A 470 3.514 -7.038 14.411 1.00 0.00 C ATOM 769 CE LYS A 470 3.149 -5.692 15.018 1.00 0.00 C ATOM 770 NZ LYS A 470 4.335 -5.007 15.602 1.00 0.00 N ATOM 0 H LYS A 470 3.570 -6.063 11.960 1.00 0.00 H new ATOM 0 HA LYS A 470 2.706 -8.578 11.595 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.532 -6.164 12.943 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.532 -7.598 12.831 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.593 -7.862 14.897 1.00 0.00 H new ATOM 0 HG3 LYS A 470 2.557 -8.871 13.836 1.00 0.00 H new ATOM 0 HD2 LYS A 470 4.120 -7.605 15.118 1.00 0.00 H new ATOM 0 HD3 LYS A 470 4.123 -6.884 13.521 1.00 0.00 H new ATOM 0 HE2 LYS A 470 2.704 -5.057 14.252 1.00 0.00 H new ATOM 0 HE3 LYS A 470 2.395 -5.835 15.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 4.045 -4.093 16.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 4.745 -5.601 16.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 5.045 -4.847 14.859 1.00 0.00 H new ATOM 784 N GLY A 471 0.821 -6.537 9.839 1.00 0.00 N ATOM 785 CA GLY A 471 -0.175 -6.501 8.784 1.00 0.00 C ATOM 786 C GLY A 471 -0.612 -5.089 8.447 1.00 0.00 C ATOM 787 O GLY A 471 -1.762 -4.715 8.679 1.00 0.00 O ATOM 0 H GLY A 471 1.215 -5.630 10.087 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.230 -6.976 7.890 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -1.044 -7.084 9.089 1.00 0.00 H new ATOM 791 N TYR A 472 0.308 -4.302 7.899 1.00 0.00 N ATOM 792 CA TYR A 472 0.013 -2.922 7.533 1.00 0.00 C ATOM 793 C TYR A 472 1.199 -2.284 6.816 1.00 0.00 C ATOM 794 O TYR A 472 2.311 -2.248 7.342 1.00 0.00 O ATOM 795 CB TYR A 472 -0.344 -2.107 8.777 1.00 0.00 C ATOM 796 CG TYR A 472 0.725 -2.134 9.846 1.00 0.00 C ATOM 797 CD1 TYR A 472 0.834 -3.208 10.721 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.627 -1.086 9.980 1.00 0.00 C ATOM 799 CE1 TYR A 472 1.809 -3.236 11.699 1.00 0.00 C ATOM 800 CE2 TYR A 472 2.606 -1.106 10.954 1.00 0.00 C ATOM 801 CZ TYR A 472 2.693 -2.183 11.811 1.00 0.00 C ATOM 802 OH TYR A 472 3.666 -2.207 12.784 1.00 0.00 O ATOM 0 H TYR A 472 1.264 -4.596 7.699 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.840 -2.927 6.854 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.527 -1.073 8.484 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.275 -2.489 9.196 1.00 0.00 H new ATOM 0 HD1 TYR A 472 0.145 -4.035 10.635 1.00 0.00 H new ATOM 0 HD2 TYR A 472 1.562 -0.241 9.311 1.00 0.00 H new ATOM 0 HE1 TYR A 472 1.879 -4.078 12.372 1.00 0.00 H new ATOM 0 HE2 TYR A 472 3.299 -0.283 11.044 1.00 0.00 H new ATOM 0 HH TYR A 472 4.206 -1.391 12.727 1.00 0.00 H new ATOM 812 N ALA A 473 0.951 -1.779 5.612 1.00 0.00 N ATOM 813 CA ALA A 473 1.996 -1.139 4.822 1.00 0.00 C ATOM 814 C ALA A 473 1.431 0.005 3.988 1.00 0.00 C ATOM 815 O ALA A 473 0.215 0.175 3.891 1.00 0.00 O ATOM 816 CB ALA A 473 2.681 -2.160 3.926 1.00 0.00 C ATOM 0 H ALA A 473 0.036 -1.801 5.162 1.00 0.00 H new ATOM 0 HA ALA A 473 2.733 -0.723 5.509 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.459 -1.668 3.342 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.128 -2.941 4.540 1.00 0.00 H new ATOM 0 HB3 ALA A 473 1.947 -2.603 3.253 1.00 0.00 H new ATOM 822 N PHE A 474 2.320 0.789 3.387 1.00 0.00 N ATOM 823 CA PHE A 474 1.910 1.919 2.562 1.00 0.00 C ATOM 824 C PHE A 474 2.369 1.734 1.119 1.00 0.00 C ATOM 825 O PHE A 474 3.490 1.292 0.864 1.00 0.00 O ATOM 826 CB PHE A 474 2.477 3.223 3.127 1.00 0.00 C ATOM 827 CG PHE A 474 1.859 3.630 4.434 1.00 0.00 C ATOM 828 CD1 PHE A 474 2.239 3.015 5.616 1.00 0.00 C ATOM 829 CD2 PHE A 474 0.897 4.626 4.481 1.00 0.00 C ATOM 830 CE1 PHE A 474 1.672 3.387 6.821 1.00 0.00 C ATOM 831 CE2 PHE A 474 0.328 5.003 5.682 1.00 0.00 C ATOM 832 CZ PHE A 474 0.715 4.381 6.854 1.00 0.00 C ATOM 0 H PHE A 474 3.330 0.662 3.456 1.00 0.00 H new ATOM 0 HA PHE A 474 0.821 1.969 2.574 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.553 3.113 3.262 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.326 4.020 2.399 1.00 0.00 H new ATOM 0 HD1 PHE A 474 2.987 2.236 5.596 1.00 0.00 H new ATOM 0 HD2 PHE A 474 0.588 5.113 3.568 1.00 0.00 H new ATOM 0 HE1 PHE A 474 1.978 2.900 7.735 1.00 0.00 H new ATOM 0 HE2 PHE A 474 -0.419 5.783 5.705 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.269 4.672 7.794 1.00 0.00 H new ATOM 842 N LEU A 475 1.495 2.075 0.178 1.00 0.00 N ATOM 843 CA LEU A 475 1.810 1.947 -1.241 1.00 0.00 C ATOM 844 C LEU A 475 1.914 3.317 -1.901 1.00 0.00 C ATOM 845 O LEU A 475 1.023 4.156 -1.761 1.00 0.00 O ATOM 846 CB LEU A 475 0.742 1.108 -1.946 1.00 0.00 C ATOM 847 CG LEU A 475 0.449 -0.261 -1.330 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.798 -0.869 -1.951 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.642 -1.190 -1.505 1.00 0.00 C ATOM 0 H LEU A 475 0.563 2.442 0.372 1.00 0.00 H new ATOM 0 HA LEU A 475 2.774 1.447 -1.331 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.185 1.680 -1.968 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.050 0.960 -2.981 1.00 0.00 H new ATOM 0 HG LEU A 475 0.271 -0.128 -0.263 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -0.991 -1.843 -1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.650 -0.212 -1.774 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.649 -0.989 -3.024 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.416 -2.160 -1.061 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.851 -1.317 -2.567 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.514 -0.759 -1.012 1.00 0.00 H new ATOM 861 N LEU A 476 3.007 3.538 -2.624 1.00 0.00 N ATOM 862 CA LEU A 476 3.228 4.807 -3.309 1.00 0.00 C ATOM 863 C LEU A 476 3.127 4.634 -4.821 1.00 0.00 C ATOM 864 O LEU A 476 4.094 4.248 -5.478 1.00 0.00 O ATOM 865 CB LEU A 476 4.598 5.377 -2.940 1.00 0.00 C ATOM 866 CG LEU A 476 4.858 5.587 -1.448 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.351 5.693 -1.176 1.00 0.00 C ATOM 868 CD2 LEU A 476 4.134 6.829 -0.950 1.00 0.00 C ATOM 0 H LEU A 476 3.754 2.855 -2.751 1.00 0.00 H new ATOM 0 HA LEU A 476 2.454 5.504 -2.989 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.365 4.708 -3.331 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.720 6.334 -3.448 1.00 0.00 H new ATOM 0 HG LEU A 476 4.471 4.724 -0.906 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.517 5.842 -0.109 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.845 4.775 -1.495 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.762 6.538 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.330 6.963 0.114 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.490 7.702 -1.497 1.00 0.00 H new ATOM 0 HD23 LEU A 476 3.062 6.714 -1.109 1.00 0.00 H new ATOM 880 N PHE A 477 1.950 4.923 -5.368 1.00 0.00 N ATOM 881 CA PHE A 477 1.723 4.800 -6.803 1.00 0.00 C ATOM 882 C PHE A 477 2.421 5.925 -7.562 1.00 0.00 C ATOM 883 O PHE A 477 2.336 7.092 -7.179 1.00 0.00 O ATOM 884 CB PHE A 477 0.224 4.818 -7.107 1.00 0.00 C ATOM 885 CG PHE A 477 -0.494 3.579 -6.655 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.822 3.400 -5.320 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.842 2.593 -7.564 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.483 2.260 -4.901 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.503 1.452 -7.151 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.823 1.285 -5.818 1.00 0.00 C ATOM 0 H PHE A 477 1.139 5.244 -4.839 1.00 0.00 H new ATOM 0 HA PHE A 477 2.142 3.849 -7.132 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.226 5.686 -6.624 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.081 4.940 -8.181 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.558 4.160 -4.599 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.594 2.718 -8.608 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.733 2.132 -3.858 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.769 0.691 -7.870 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.338 0.393 -5.493 1.00 0.00 H new ATOM 900 N GLN A 478 3.111 5.565 -8.639 1.00 0.00 N ATOM 901 CA GLN A 478 3.824 6.543 -9.451 1.00 0.00 C ATOM 902 C GLN A 478 2.850 7.483 -10.154 1.00 0.00 C ATOM 903 O GLN A 478 2.901 8.698 -9.967 1.00 0.00 O ATOM 904 CB GLN A 478 4.704 5.836 -10.484 1.00 0.00 C ATOM 905 CG GLN A 478 5.796 6.722 -11.062 1.00 0.00 C ATOM 906 CD GLN A 478 6.754 5.959 -11.955 1.00 0.00 C ATOM 907 OE1 GLN A 478 6.652 4.740 -12.097 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.693 6.674 -12.564 1.00 0.00 N ATOM 0 H GLN A 478 3.191 4.603 -8.969 1.00 0.00 H new ATOM 0 HA GLN A 478 4.456 7.134 -8.789 1.00 0.00 H new ATOM 0 HB2 GLN A 478 5.163 4.963 -10.021 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.075 5.472 -11.296 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.339 7.530 -11.633 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.354 7.183 -10.247 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.741 7.682 -12.418 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.366 6.215 -13.178 1.00 0.00 H new ATOM 917 N GLU A 479 1.963 6.910 -10.962 1.00 0.00 N ATOM 918 CA GLU A 479 0.977 7.698 -11.693 1.00 0.00 C ATOM 919 C GLU A 479 -0.271 7.930 -10.846 1.00 0.00 C ATOM 920 O GLU A 479 -1.042 7.005 -10.593 1.00 0.00 O ATOM 921 CB GLU A 479 0.597 6.996 -12.999 1.00 0.00 C ATOM 922 CG GLU A 479 1.472 7.389 -14.178 1.00 0.00 C ATOM 923 CD GLU A 479 2.884 6.848 -14.062 1.00 0.00 C ATOM 924 OE1 GLU A 479 3.734 7.536 -13.458 1.00 0.00 O ATOM 925 OE2 GLU A 479 3.139 5.739 -14.575 1.00 0.00 O ATOM 0 H GLU A 479 1.907 5.905 -11.127 1.00 0.00 H new ATOM 0 HA GLU A 479 1.423 8.665 -11.925 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.660 5.918 -12.854 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.442 7.225 -13.236 1.00 0.00 H new ATOM 0 HG2 GLU A 479 1.020 7.021 -15.099 1.00 0.00 H new ATOM 0 HG3 GLU A 479 1.508 8.476 -14.253 1.00 0.00 H new ATOM 932 N GLU A 480 -0.461 9.172 -10.411 1.00 0.00 N ATOM 933 CA GLU A 480 -1.614 9.525 -9.591 1.00 0.00 C ATOM 934 C GLU A 480 -2.880 8.853 -10.114 1.00 0.00 C ATOM 935 O GLU A 480 -3.678 8.322 -9.342 1.00 0.00 O ATOM 936 CB GLU A 480 -1.803 11.043 -9.564 1.00 0.00 C ATOM 937 CG GLU A 480 -1.051 11.731 -8.438 1.00 0.00 C ATOM 938 CD GLU A 480 -1.554 13.136 -8.172 1.00 0.00 C ATOM 939 OE1 GLU A 480 -1.704 13.906 -9.144 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.797 13.466 -6.993 1.00 0.00 O ATOM 0 H GLU A 480 0.168 9.949 -10.613 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.428 9.171 -8.577 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.473 11.458 -10.516 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.866 11.267 -9.469 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.144 11.138 -7.528 1.00 0.00 H new ATOM 0 HG3 GLU A 480 0.010 11.770 -8.686 1.00 0.00 H new ATOM 947 N SER A 481 -3.057 8.881 -11.431 1.00 0.00 N ATOM 948 CA SER A 481 -4.227 8.278 -12.059 1.00 0.00 C ATOM 949 C SER A 481 -4.538 6.920 -11.437 1.00 0.00 C ATOM 950 O SER A 481 -5.643 6.689 -10.945 1.00 0.00 O ATOM 951 CB SER A 481 -4.002 8.123 -13.564 1.00 0.00 C ATOM 952 OG SER A 481 -5.095 7.461 -14.177 1.00 0.00 O ATOM 0 H SER A 481 -2.405 9.315 -12.084 1.00 0.00 H new ATOM 0 HA SER A 481 -5.078 8.938 -11.893 1.00 0.00 H new ATOM 0 HB2 SER A 481 -3.866 9.105 -14.018 1.00 0.00 H new ATOM 0 HB3 SER A 481 -3.086 7.560 -13.742 1.00 0.00 H new ATOM 0 HG SER A 481 -4.928 7.375 -15.139 1.00 0.00 H new ATOM 958 N SER A 482 -3.556 6.025 -11.463 1.00 0.00 N ATOM 959 CA SER A 482 -3.725 4.688 -10.906 1.00 0.00 C ATOM 960 C SER A 482 -4.519 4.738 -9.605 1.00 0.00 C ATOM 961 O SER A 482 -5.517 4.035 -9.446 1.00 0.00 O ATOM 962 CB SER A 482 -2.361 4.040 -10.660 1.00 0.00 C ATOM 963 OG SER A 482 -1.630 4.748 -9.674 1.00 0.00 O ATOM 0 H SER A 482 -2.635 6.201 -11.864 1.00 0.00 H new ATOM 0 HA SER A 482 -4.280 4.088 -11.627 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.498 3.006 -10.343 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.793 4.016 -11.590 1.00 0.00 H new ATOM 0 HG SER A 482 -1.542 5.686 -9.943 1.00 0.00 H new ATOM 969 N VAL A 483 -4.069 5.576 -8.676 1.00 0.00 N ATOM 970 CA VAL A 483 -4.737 5.720 -7.388 1.00 0.00 C ATOM 971 C VAL A 483 -6.253 5.659 -7.545 1.00 0.00 C ATOM 972 O VAL A 483 -6.929 4.909 -6.843 1.00 0.00 O ATOM 973 CB VAL A 483 -4.356 7.046 -6.703 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.105 7.202 -5.388 1.00 0.00 C ATOM 975 CG2 VAL A 483 -2.853 7.118 -6.482 1.00 0.00 C ATOM 0 H VAL A 483 -3.245 6.165 -8.792 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.405 4.889 -6.765 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.644 7.869 -7.357 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -4.823 8.144 -4.918 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.178 7.198 -5.578 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -4.851 6.376 -4.724 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.601 8.061 -5.997 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.538 6.289 -5.848 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.341 7.056 -7.442 1.00 0.00 H new ATOM 985 N GLN A 484 -6.778 6.453 -8.472 1.00 0.00 N ATOM 986 CA GLN A 484 -8.214 6.489 -8.721 1.00 0.00 C ATOM 987 C GLN A 484 -8.747 5.096 -9.039 1.00 0.00 C ATOM 988 O GLN A 484 -9.628 4.586 -8.347 1.00 0.00 O ATOM 989 CB GLN A 484 -8.529 7.443 -9.875 1.00 0.00 C ATOM 990 CG GLN A 484 -10.016 7.586 -10.158 1.00 0.00 C ATOM 991 CD GLN A 484 -10.741 8.378 -9.088 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.352 9.499 -8.759 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.802 7.799 -8.539 1.00 0.00 N ATOM 0 H GLN A 484 -6.231 7.080 -9.063 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.705 6.848 -7.816 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.115 8.425 -9.647 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.029 7.088 -10.776 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.153 8.076 -11.122 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.464 6.595 -10.237 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -12.089 6.868 -8.842 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.330 8.285 -7.814 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.207 4.486 -10.089 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.627 3.151 -10.496 1.00 0.00 C ATOM 1004 C ALA A 485 -8.689 2.206 -9.301 1.00 0.00 C ATOM 1005 O ALA A 485 -9.540 1.317 -9.243 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.684 2.602 -11.557 1.00 0.00 C ATOM 0 H ALA A 485 -7.478 4.895 -10.673 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.629 3.226 -10.919 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -8.009 1.604 -11.852 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.693 3.259 -12.427 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.673 2.549 -11.153 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.784 2.404 -8.349 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.735 1.568 -7.154 1.00 0.00 C ATOM 1014 C LEU A 486 -8.986 1.761 -6.304 1.00 0.00 C ATOM 1015 O LEU A 486 -9.683 0.799 -5.979 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.489 1.895 -6.330 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.216 0.980 -5.135 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.798 -0.404 -5.606 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.148 1.584 -4.234 1.00 0.00 C ATOM 0 H LEU A 486 -7.074 3.136 -8.381 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.690 0.526 -7.471 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.623 1.865 -6.991 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.577 2.919 -5.966 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.136 0.882 -4.559 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.608 -1.041 -4.742 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.595 -0.839 -6.209 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.891 -0.326 -6.205 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -4.967 0.920 -3.389 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.225 1.712 -4.799 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.487 2.553 -3.867 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.267 3.011 -5.948 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.436 3.330 -5.139 1.00 0.00 C ATOM 1033 C ILE A 487 -11.701 2.724 -5.737 1.00 0.00 C ATOM 1034 O ILE A 487 -12.464 2.048 -5.046 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.626 4.852 -5.000 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.388 5.486 -4.361 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -11.869 5.158 -4.177 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.380 6.997 -4.431 1.00 0.00 C ATOM 0 H ILE A 487 -8.701 3.819 -6.208 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.263 2.902 -4.152 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.758 5.279 -5.994 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.330 5.178 -3.317 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.496 5.102 -4.857 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -11.990 6.238 -4.088 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.745 4.735 -4.669 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.764 4.721 -3.184 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.474 7.378 -3.959 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.407 7.313 -5.474 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.253 7.390 -3.910 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.916 2.968 -7.024 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.087 2.444 -7.717 1.00 0.00 C ATOM 1052 C ASP A 488 -13.196 0.934 -7.534 1.00 0.00 C ATOM 1053 O ASP A 488 -14.279 0.406 -7.282 1.00 0.00 O ATOM 1054 CB ASP A 488 -13.021 2.786 -9.207 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.261 2.345 -9.958 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -14.617 1.152 -9.866 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.876 3.193 -10.638 1.00 0.00 O ATOM 0 H ASP A 488 -11.294 3.526 -7.609 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.973 2.910 -7.284 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.892 3.862 -9.324 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.145 2.310 -9.647 1.00 0.00 H new ATOM 1062 N ALA A 489 -12.067 0.244 -7.663 1.00 0.00 N ATOM 1063 CA ALA A 489 -12.036 -1.205 -7.510 1.00 0.00 C ATOM 1064 C ALA A 489 -12.293 -1.611 -6.063 1.00 0.00 C ATOM 1065 O ALA A 489 -13.025 -2.565 -5.796 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.700 -1.757 -7.986 1.00 0.00 C ATOM 0 H ALA A 489 -11.162 0.666 -7.873 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.831 -1.627 -8.124 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.690 -2.840 -7.866 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.557 -1.507 -9.037 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.895 -1.320 -7.396 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.688 -0.881 -5.133 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.850 -1.166 -3.711 1.00 0.00 C ATOM 1074 C CYS A 490 -13.294 -0.941 -3.273 1.00 0.00 C ATOM 1075 O CYS A 490 -13.764 0.196 -3.207 1.00 0.00 O ATOM 1076 CB CYS A 490 -10.910 -0.289 -2.883 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.164 -0.463 -3.317 1.00 0.00 S ATOM 0 H CYS A 490 -11.081 -0.087 -5.337 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.598 -2.213 -3.544 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.202 0.754 -3.006 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.037 -0.534 -1.828 1.00 0.00 H new ATOM 0 HG CYS A 490 -8.976 -0.048 -4.534 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.993 -2.031 -2.977 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.385 -1.953 -2.547 1.00 0.00 C ATOM 1085 C LEU A 491 -15.543 -0.971 -1.390 1.00 0.00 C ATOM 1086 O LEU A 491 -14.576 -0.345 -0.959 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.888 -3.336 -2.129 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.758 -4.442 -3.176 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.842 -5.811 -2.520 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.832 -4.294 -4.244 1.00 0.00 C ATOM 0 H LEU A 491 -13.619 -2.979 -3.027 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.980 -1.595 -3.387 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.345 -3.643 -1.236 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.938 -3.249 -1.849 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.783 -4.350 -3.654 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.747 -6.586 -3.281 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -15.037 -5.916 -1.793 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.802 -5.914 -2.015 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.724 -5.090 -4.981 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.817 -4.359 -3.781 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.725 -3.327 -4.736 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.769 -0.844 -0.892 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.053 0.062 0.215 1.00 0.00 C ATOM 1104 C GLU A 492 -18.165 -0.494 1.100 1.00 0.00 C ATOM 1105 O GLU A 492 -19.124 -1.089 0.609 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.449 1.442 -0.314 1.00 0.00 C ATOM 1107 CG GLU A 492 -17.578 2.496 0.773 1.00 0.00 C ATOM 1108 CD GLU A 492 -18.267 3.755 0.285 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -17.565 4.659 -0.216 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -19.507 3.838 0.403 1.00 0.00 O ATOM 0 H GLU A 492 -17.581 -1.356 -1.237 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.148 0.158 0.814 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -16.706 1.770 -1.041 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.398 1.360 -0.844 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -18.138 2.081 1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -16.586 2.751 1.147 1.00 0.00 H new ATOM 1117 N GLU A 493 -18.028 -0.295 2.408 1.00 0.00 N ATOM 1118 CA GLU A 493 -19.020 -0.777 3.361 1.00 0.00 C ATOM 1119 C GLU A 493 -19.519 0.360 4.249 1.00 0.00 C ATOM 1120 O GLU A 493 -20.664 0.797 4.131 1.00 0.00 O ATOM 1121 CB GLU A 493 -18.429 -1.892 4.226 1.00 0.00 C ATOM 1122 CG GLU A 493 -19.477 -2.777 4.880 1.00 0.00 C ATOM 1123 CD GLU A 493 -19.996 -2.201 6.183 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -19.167 -1.768 7.011 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -21.229 -2.185 6.376 1.00 0.00 O ATOM 0 H GLU A 493 -17.240 0.196 2.831 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.865 -1.173 2.798 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.777 -2.511 3.610 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.806 -1.447 5.002 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -20.310 -2.917 4.191 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -19.050 -3.762 5.067 1.00 0.00 H new ATOM 1132 N ASP A 494 -18.652 0.833 5.137 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.004 1.919 6.044 1.00 0.00 C ATOM 1134 C ASP A 494 -17.940 3.013 6.020 1.00 0.00 C ATOM 1135 O ASP A 494 -16.984 2.980 6.793 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.174 1.388 7.468 1.00 0.00 C ATOM 1137 CG ASP A 494 -17.901 0.768 8.011 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -17.315 -0.087 7.315 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -17.492 1.137 9.132 1.00 0.00 O ATOM 0 H ASP A 494 -17.701 0.482 5.248 1.00 0.00 H new ATOM 0 HA ASP A 494 -19.949 2.347 5.709 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -19.485 2.203 8.122 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -19.971 0.645 7.483 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.115 3.982 5.126 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.162 5.071 5.017 1.00 0.00 C ATOM 1146 C GLY A 495 -15.737 4.581 4.852 1.00 0.00 C ATOM 1147 O GLY A 495 -14.787 5.347 5.012 1.00 0.00 O ATOM 0 H GLY A 495 -18.899 4.032 4.476 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -17.428 5.698 4.166 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -17.227 5.697 5.907 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.587 3.300 4.533 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.268 2.707 4.347 1.00 0.00 C ATOM 1153 C LYS A 496 -14.255 1.781 3.134 1.00 0.00 C ATOM 1154 O LYS A 496 -15.257 1.136 2.821 1.00 0.00 O ATOM 1155 CB LYS A 496 -13.854 1.931 5.599 1.00 0.00 C ATOM 1156 CG LYS A 496 -13.798 2.786 6.853 1.00 0.00 C ATOM 1157 CD LYS A 496 -13.684 1.932 8.105 1.00 0.00 C ATOM 1158 CE LYS A 496 -14.123 2.698 9.344 1.00 0.00 C ATOM 1159 NZ LYS A 496 -14.347 1.794 10.505 1.00 0.00 N ATOM 0 H LYS A 496 -16.363 2.652 4.398 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.555 3.513 4.175 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.556 1.113 5.758 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -12.875 1.482 5.431 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.946 3.464 6.795 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.694 3.404 6.913 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.296 1.037 7.993 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.653 1.600 8.228 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -13.365 3.438 9.601 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -15.041 3.244 9.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -14.645 2.354 11.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -15.088 1.104 10.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -13.465 1.291 10.729 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.114 1.718 2.457 1.00 0.00 N ATOM 1174 CA LEU A 497 -12.969 0.869 1.279 1.00 0.00 C ATOM 1175 C LEU A 497 -12.309 -0.457 1.642 1.00 0.00 C ATOM 1176 O LEU A 497 -11.811 -0.631 2.755 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.146 1.585 0.208 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.677 2.944 -0.251 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.600 3.714 -0.998 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.911 2.766 -1.124 1.00 0.00 C ATOM 0 H LEU A 497 -12.276 2.244 2.703 1.00 0.00 H new ATOM 0 HA LEU A 497 -13.964 0.663 0.885 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.134 1.723 0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -12.074 0.933 -0.662 1.00 0.00 H new ATOM 0 HG LEU A 497 -12.959 3.519 0.631 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -11.997 4.678 -1.317 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.744 3.873 -0.341 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.286 3.144 -1.872 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.276 3.743 -1.442 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.654 2.172 -2.001 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.688 2.256 -0.555 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.307 -1.389 0.696 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.708 -2.701 0.915 1.00 0.00 C ATOM 1194 C TYR A 498 -11.370 -3.374 -0.411 1.00 0.00 C ATOM 1195 O TYR A 498 -12.142 -3.309 -1.369 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.655 -3.588 1.724 1.00 0.00 C ATOM 1197 CG TYR A 498 -12.915 -3.079 3.124 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -12.012 -3.320 4.151 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.064 -2.355 3.419 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.246 -2.857 5.432 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.306 -1.887 4.696 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.394 -2.141 5.699 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.630 -1.677 6.973 1.00 0.00 O ATOM 0 H TYR A 498 -12.714 -1.261 -0.231 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.784 -2.561 1.476 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.604 -3.670 1.194 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.236 -4.592 1.784 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.111 -3.879 3.945 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.780 -2.155 2.636 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.534 -3.055 6.219 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.204 -1.326 4.908 1.00 0.00 H new ATOM 0 HH TYR A 498 -14.481 -1.191 6.992 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.211 -4.022 -0.460 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.769 -4.710 -1.668 1.00 0.00 C ATOM 1215 C LEU A 499 -9.359 -6.146 -1.358 1.00 0.00 C ATOM 1216 O LEU A 499 -8.869 -6.440 -0.267 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.598 -3.959 -2.306 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.156 -4.453 -3.684 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.250 -4.214 -4.713 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.864 -3.768 -4.106 1.00 0.00 C ATOM 0 H LEU A 499 -9.560 -4.085 0.323 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.603 -4.734 -2.369 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.869 -2.907 -2.389 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.744 -4.016 -1.631 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.972 -5.526 -3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -8.917 -4.572 -5.687 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.151 -4.751 -4.417 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.467 -3.147 -4.773 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.564 -4.131 -5.089 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -7.021 -2.690 -4.150 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.080 -3.991 -3.382 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.560 -7.034 -2.324 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.210 -8.440 -2.155 1.00 0.00 C ATOM 1234 C CYS A 500 -7.822 -8.726 -2.719 1.00 0.00 C ATOM 1235 O CYS A 500 -7.506 -8.342 -3.845 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.246 -9.332 -2.841 1.00 0.00 C ATOM 1237 SG CYS A 500 -11.914 -9.186 -2.158 1.00 0.00 S ATOM 0 H CYS A 500 -9.963 -6.806 -3.233 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.202 -8.661 -1.088 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.277 -9.085 -3.902 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -9.923 -10.370 -2.765 1.00 0.00 H new ATOM 0 HG CYS A 500 -12.718 -9.976 -2.805 1.00 0.00 H new ATOM 1243 N VAL A 501 -6.995 -9.403 -1.927 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.640 -9.740 -2.346 1.00 0.00 C ATOM 1245 C VAL A 501 -5.357 -11.225 -2.147 1.00 0.00 C ATOM 1246 O VAL A 501 -5.312 -11.712 -1.018 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.592 -8.920 -1.571 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.855 -7.430 -1.731 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.588 -9.314 -0.102 1.00 0.00 C ATOM 0 H VAL A 501 -7.240 -9.728 -0.992 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.567 -9.498 -3.406 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.607 -9.137 -1.985 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.105 -6.866 -1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.803 -7.163 -2.786 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.846 -7.192 -1.345 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -3.842 -8.725 0.431 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.572 -9.127 0.328 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.347 -10.373 -0.010 1.00 0.00 H new ATOM 1259 N SER A 502 -5.166 -11.938 -3.252 1.00 0.00 N ATOM 1260 CA SER A 502 -4.889 -13.369 -3.199 1.00 0.00 C ATOM 1261 C SER A 502 -3.396 -13.628 -3.028 1.00 0.00 C ATOM 1262 O SER A 502 -2.564 -12.958 -3.640 1.00 0.00 O ATOM 1263 CB SER A 502 -5.395 -14.055 -4.470 1.00 0.00 C ATOM 1264 OG SER A 502 -4.745 -13.542 -5.620 1.00 0.00 O ATOM 0 H SER A 502 -5.198 -11.549 -4.194 1.00 0.00 H new ATOM 0 HA SER A 502 -5.412 -13.783 -2.337 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.223 -15.129 -4.400 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.471 -13.910 -4.562 1.00 0.00 H new ATOM 0 HG SER A 502 -5.085 -13.998 -6.418 1.00 0.00 H new ATOM 1270 N SER A 503 -3.063 -14.606 -2.191 1.00 0.00 N ATOM 1271 CA SER A 503 -1.670 -14.952 -1.936 1.00 0.00 C ATOM 1272 C SER A 503 -1.442 -16.451 -2.109 1.00 0.00 C ATOM 1273 O SER A 503 -2.362 -17.262 -1.996 1.00 0.00 O ATOM 1274 CB SER A 503 -1.266 -14.523 -0.523 1.00 0.00 C ATOM 1275 OG SER A 503 -0.998 -13.133 -0.470 1.00 0.00 O ATOM 0 H SER A 503 -3.739 -15.172 -1.678 1.00 0.00 H new ATOM 0 HA SER A 503 -1.051 -14.422 -2.660 1.00 0.00 H new ATOM 0 HB2 SER A 503 -2.064 -14.770 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.383 -15.079 -0.209 1.00 0.00 H new ATOM 0 HG SER A 503 -0.050 -12.975 -0.660 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.186 -16.829 -2.390 1.00 0.00 N ATOM 1282 CA PRO A 504 0.194 -18.231 -2.584 1.00 0.00 C ATOM 1283 C PRO A 504 -0.393 -19.145 -1.513 1.00 0.00 C ATOM 1284 O PRO A 504 -0.828 -20.260 -1.803 1.00 0.00 O ATOM 1285 CB PRO A 504 1.721 -18.202 -2.485 1.00 0.00 C ATOM 1286 CG PRO A 504 2.103 -16.830 -2.923 1.00 0.00 C ATOM 1287 CD PRO A 504 0.960 -15.917 -2.539 1.00 0.00 C ATOM 0 HA PRO A 504 -0.178 -18.627 -3.529 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.056 -18.400 -1.467 1.00 0.00 H new ATOM 0 HB3 PRO A 504 2.174 -18.961 -3.123 1.00 0.00 H new ATOM 0 HG2 PRO A 504 3.029 -16.514 -2.442 1.00 0.00 H new ATOM 0 HG3 PRO A 504 2.276 -16.801 -3.999 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.169 -15.383 -1.612 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.775 -15.164 -3.305 1.00 0.00 H new ATOM 1295 N THR A 505 -0.401 -18.665 -0.273 1.00 0.00 N ATOM 1296 CA THR A 505 -0.933 -19.438 0.842 1.00 0.00 C ATOM 1297 C THR A 505 -2.333 -18.967 1.220 1.00 0.00 C ATOM 1298 O THR A 505 -3.295 -19.733 1.155 1.00 0.00 O ATOM 1299 CB THR A 505 -0.020 -19.343 2.078 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.221 -17.969 2.404 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.304 -20.050 1.829 1.00 0.00 C ATOM 0 H THR A 505 -0.045 -17.744 -0.016 1.00 0.00 H new ATOM 0 HA THR A 505 -0.979 -20.476 0.513 1.00 0.00 H new ATOM 0 HB THR A 505 -0.523 -19.832 2.912 1.00 0.00 H new ATOM 0 HG1 THR A 505 1.156 -17.856 2.673 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.932 -19.969 2.716 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.119 -21.102 1.610 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.811 -19.586 0.983 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.439 -17.702 1.614 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.723 -17.129 2.001 1.00 0.00 C ATOM 1311 C ILE A 506 -4.579 -16.822 0.777 1.00 0.00 C ATOM 1312 O ILE A 506 -4.060 -16.521 -0.299 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.538 -15.839 2.821 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.668 -16.109 4.050 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.890 -15.277 3.235 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.417 -16.768 5.187 1.00 0.00 C ATOM 0 H ILE A 506 -1.653 -17.055 1.674 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.228 -17.873 2.617 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.034 -15.100 2.199 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.831 -16.744 3.760 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.246 -15.167 4.401 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.743 -14.365 3.814 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.478 -15.051 2.345 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.419 -16.011 3.843 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.738 -16.929 6.025 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.238 -16.124 5.504 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.816 -17.726 4.853 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.894 -16.898 0.947 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.825 -16.626 -0.141 1.00 0.00 C ATOM 1330 C LYS A 507 -7.218 -15.152 -0.165 1.00 0.00 C ATOM 1331 O LYS A 507 -6.890 -14.398 0.751 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.076 -17.496 0.000 1.00 0.00 C ATOM 1333 CG LYS A 507 -7.940 -18.865 -0.645 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.119 -18.792 -2.152 1.00 0.00 C ATOM 1335 CE LYS A 507 -8.312 -20.173 -2.758 1.00 0.00 C ATOM 1336 NZ LYS A 507 -7.019 -20.894 -2.920 1.00 0.00 N ATOM 0 H LYS A 507 -6.340 -17.146 1.830 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.327 -16.867 -1.080 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.303 -17.623 1.059 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -8.923 -16.975 -0.447 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -6.959 -19.281 -0.414 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.682 -19.543 -0.222 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -8.980 -18.167 -2.387 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.247 -18.315 -2.600 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -8.977 -20.758 -2.123 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -8.799 -20.079 -3.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -7.194 -21.831 -3.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -6.393 -20.348 -3.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -6.566 -21.007 -1.991 1.00 0.00 H new ATOM 1350 N ASP A 508 -7.923 -14.750 -1.217 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.363 -13.367 -1.359 1.00 0.00 C ATOM 1352 C ASP A 508 -8.701 -12.763 0.000 1.00 0.00 C ATOM 1353 O ASP A 508 -9.737 -13.073 0.590 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.579 -13.288 -2.283 1.00 0.00 C ATOM 1355 CG ASP A 508 -9.219 -13.534 -3.735 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -8.548 -14.550 -4.017 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -9.610 -12.712 -4.590 1.00 0.00 O ATOM 0 H ASP A 508 -8.202 -15.362 -1.984 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.546 -12.795 -1.798 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.321 -14.021 -1.966 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -10.041 -12.305 -2.188 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.821 -11.898 0.494 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.025 -11.249 1.783 1.00 0.00 C ATOM 1364 C LYS A 509 -8.440 -9.793 1.600 1.00 0.00 C ATOM 1365 O LYS A 509 -7.833 -9.041 0.836 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.748 -11.325 2.624 1.00 0.00 C ATOM 1367 CG LYS A 509 -6.966 -11.003 4.092 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.481 -12.210 4.858 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.109 -12.136 6.331 1.00 0.00 C ATOM 1370 NZ LYS A 509 -5.704 -12.566 6.571 1.00 0.00 N ATOM 0 H LYS A 509 -6.959 -11.630 0.020 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.827 -11.774 2.303 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.326 -12.327 2.539 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.012 -10.633 2.215 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.029 -10.663 4.534 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.678 -10.182 4.184 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.565 -12.270 4.758 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -7.070 -13.121 4.423 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -7.242 -11.115 6.688 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -7.785 -12.766 6.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -5.490 -12.501 7.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -5.583 -13.549 6.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -5.057 -11.949 6.041 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.496 -9.383 2.317 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.014 -8.013 2.252 1.00 0.00 C ATOM 1386 C PRO A 510 -9.170 -7.035 3.064 1.00 0.00 C ATOM 1387 O PRO A 510 -9.377 -6.872 4.266 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.417 -8.134 2.851 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.331 -9.293 3.784 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.267 -10.225 3.248 1.00 0.00 C ATOM 0 HA PRO A 510 -10.003 -7.621 1.235 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.703 -7.223 3.377 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.165 -8.304 2.077 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.077 -8.958 4.790 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.291 -9.804 3.851 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.638 -10.616 4.048 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.707 -11.083 2.740 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.219 -6.387 2.399 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.346 -5.424 3.059 1.00 0.00 C ATOM 1400 C VAL A 511 -7.986 -4.041 3.103 1.00 0.00 C ATOM 1401 O VAL A 511 -8.720 -3.658 2.193 1.00 0.00 O ATOM 1402 CB VAL A 511 -5.983 -5.324 2.349 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.205 -6.623 2.500 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.172 -4.975 0.880 1.00 0.00 C ATOM 0 H VAL A 511 -8.034 -6.512 1.404 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.192 -5.782 4.077 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.407 -4.526 2.818 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.245 -6.533 1.992 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.038 -6.826 3.558 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.774 -7.441 2.059 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.199 -4.908 0.394 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.767 -5.749 0.396 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.686 -4.017 0.797 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.702 -3.298 4.167 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.251 -1.957 4.330 1.00 0.00 C ATOM 1416 C GLN A 512 -7.439 -0.936 3.539 1.00 0.00 C ATOM 1417 O GLN A 512 -6.337 -0.561 3.940 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.277 -1.569 5.809 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.056 -0.294 6.091 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.019 0.102 7.554 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -8.370 -0.554 8.370 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -9.715 1.180 7.894 1.00 0.00 N ATOM 0 H GLN A 512 -7.095 -3.601 4.929 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.271 -1.961 3.945 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -8.714 -2.386 6.383 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.253 -1.444 6.161 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -8.647 0.517 5.489 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.092 -0.430 5.782 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -10.239 1.694 7.185 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -9.726 1.495 8.864 1.00 0.00 H new ATOM 1431 N ILE A 513 -7.991 -0.492 2.415 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.317 0.485 1.568 1.00 0.00 C ATOM 1433 C ILE A 513 -7.810 1.898 1.861 1.00 0.00 C ATOM 1434 O ILE A 513 -8.943 2.252 1.535 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.531 0.178 0.074 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.120 -1.262 -0.237 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.745 1.157 -0.785 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.699 -1.586 0.169 1.00 0.00 C ATOM 0 H ILE A 513 -8.902 -0.793 2.070 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.253 0.419 1.795 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.590 0.291 -0.157 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.800 -1.944 0.274 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.234 -1.441 -1.306 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.906 0.928 -1.838 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.082 2.173 -0.579 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.683 1.073 -0.554 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.477 -2.623 -0.081 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.010 -0.929 -0.362 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.585 -1.440 1.243 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.950 2.703 2.477 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.297 4.078 2.814 1.00 0.00 C ATOM 1452 C ARG A 514 -6.245 5.049 2.287 1.00 0.00 C ATOM 1453 O ARG A 514 -5.239 5.327 2.939 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.437 4.235 4.329 1.00 0.00 C ATOM 1455 CG ARG A 514 -7.464 5.683 4.792 1.00 0.00 C ATOM 1456 CD ARG A 514 -8.225 5.836 6.099 1.00 0.00 C ATOM 1457 NE ARG A 514 -9.663 5.968 5.884 1.00 0.00 N ATOM 1458 CZ ARG A 514 -10.555 5.994 6.869 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -10.157 5.899 8.130 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -11.847 6.117 6.592 1.00 0.00 N ATOM 0 H ARG A 514 -6.008 2.426 2.753 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.251 4.311 2.342 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -8.353 3.742 4.654 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.608 3.722 4.817 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -6.444 6.044 4.919 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -7.928 6.303 4.025 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.032 4.972 6.734 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -7.856 6.712 6.632 1.00 0.00 H new ATOM 0 HE ARG A 514 -10.002 6.044 4.925 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -9.164 5.806 8.346 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -10.843 5.919 8.884 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -12.156 6.192 5.623 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -12.531 6.137 7.348 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.480 5.577 1.076 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.565 6.525 0.434 1.00 0.00 C ATOM 1476 C PRO A 515 -5.081 7.605 1.396 1.00 0.00 C ATOM 1477 O PRO A 515 -5.766 8.604 1.618 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.415 7.142 -0.679 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.414 6.090 -1.019 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.659 5.291 0.242 1.00 0.00 C ATOM 0 HA PRO A 515 -4.659 6.037 0.075 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -6.902 8.057 -0.344 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -5.806 7.404 -1.544 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.340 6.539 -1.378 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.042 5.447 -1.817 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.581 5.596 0.736 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -7.749 4.226 0.029 1.00 0.00 H new ATOM 1488 N TRP A 516 -3.897 7.399 1.962 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.322 8.357 2.900 1.00 0.00 C ATOM 1490 C TRP A 516 -3.134 9.719 2.241 1.00 0.00 C ATOM 1491 O TRP A 516 -2.084 10.000 1.664 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.982 7.843 3.428 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.460 8.631 4.592 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.622 9.708 4.542 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.741 8.401 5.977 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.365 10.162 5.814 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -1.040 9.378 6.711 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.518 7.468 6.668 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -1.093 9.444 8.101 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -2.570 7.535 8.047 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.862 8.517 8.752 1.00 0.00 C ATOM 0 H TRP A 516 -3.317 6.578 1.788 1.00 0.00 H new ATOM 0 HA TRP A 516 -4.014 8.471 3.734 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.093 6.800 3.725 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.248 7.869 2.622 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.220 10.139 3.637 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.232 10.954 6.051 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.068 6.708 6.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 -0.547 10.200 8.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -3.167 6.818 8.591 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.924 8.543 9.830 1.00 0.00 H new ATOM 1512 N ASN A 517 -4.158 10.561 2.330 1.00 0.00 N ATOM 1513 CA ASN A 517 -4.105 11.895 1.741 1.00 0.00 C ATOM 1514 C ASN A 517 -3.245 12.829 2.587 1.00 0.00 C ATOM 1515 O ASN A 517 -3.727 13.439 3.543 1.00 0.00 O ATOM 1516 CB ASN A 517 -5.516 12.469 1.599 1.00 0.00 C ATOM 1517 CG ASN A 517 -6.424 12.060 2.743 1.00 0.00 C ATOM 1518 OD1 ASN A 517 -6.879 10.918 2.811 1.00 0.00 O ATOM 1519 ND2 ASN A 517 -6.693 12.994 3.648 1.00 0.00 N ATOM 0 H ASN A 517 -5.035 10.344 2.804 1.00 0.00 H new ATOM 0 HA ASN A 517 -3.654 11.811 0.752 1.00 0.00 H new ATOM 0 HB2 ASN A 517 -5.460 13.557 1.554 1.00 0.00 H new ATOM 0 HB3 ASN A 517 -5.949 12.133 0.657 1.00 0.00 H new ATOM 0 HD21 ASN A 517 -7.299 12.778 4.440 1.00 0.00 H new ATOM 0 HD22 ASN A 517 -6.294 13.928 3.552 1.00 0.00 H new ATOM 1526 N LEU A 518 -1.971 12.938 2.229 1.00 0.00 N ATOM 1527 CA LEU A 518 -1.043 13.798 2.955 1.00 0.00 C ATOM 1528 C LEU A 518 -0.722 15.054 2.150 1.00 0.00 C ATOM 1529 O LEU A 518 -0.030 14.992 1.134 1.00 0.00 O ATOM 1530 CB LEU A 518 0.246 13.039 3.272 1.00 0.00 C ATOM 1531 CG LEU A 518 1.394 13.874 3.841 1.00 0.00 C ATOM 1532 CD1 LEU A 518 1.122 14.236 5.293 1.00 0.00 C ATOM 1533 CD2 LEU A 518 2.713 13.124 3.715 1.00 0.00 C ATOM 0 H LEU A 518 -1.557 12.442 1.440 1.00 0.00 H new ATOM 0 HA LEU A 518 -1.519 14.098 3.888 1.00 0.00 H new ATOM 0 HB2 LEU A 518 0.012 12.247 3.983 1.00 0.00 H new ATOM 0 HB3 LEU A 518 0.593 12.555 2.359 1.00 0.00 H new ATOM 0 HG LEU A 518 1.467 14.797 3.265 1.00 0.00 H new ATOM 0 HD11 LEU A 518 1.949 14.830 5.681 1.00 0.00 H new ATOM 0 HD12 LEU A 518 0.200 14.813 5.357 1.00 0.00 H new ATOM 0 HD13 LEU A 518 1.022 13.325 5.883 1.00 0.00 H new ATOM 0 HD21 LEU A 518 3.519 13.733 4.125 1.00 0.00 H new ATOM 0 HD22 LEU A 518 2.652 12.185 4.266 1.00 0.00 H new ATOM 0 HD23 LEU A 518 2.914 12.916 2.664 1.00 0.00 H new ATOM 1545 N SER A 519 -1.229 16.192 2.612 1.00 0.00 N ATOM 1546 CA SER A 519 -0.998 17.463 1.934 1.00 0.00 C ATOM 1547 C SER A 519 -1.458 18.632 2.800 1.00 0.00 C ATOM 1548 O SER A 519 -2.641 18.753 3.121 1.00 0.00 O ATOM 1549 CB SER A 519 -1.729 17.489 0.591 1.00 0.00 C ATOM 1550 OG SER A 519 -1.080 18.352 -0.327 1.00 0.00 O ATOM 0 H SER A 519 -1.802 16.261 3.453 1.00 0.00 H new ATOM 0 HA SER A 519 0.073 17.564 1.758 1.00 0.00 H new ATOM 0 HB2 SER A 519 -1.773 16.481 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 519 -2.757 17.818 0.740 1.00 0.00 H new ATOM 0 HG SER A 519 -1.566 18.349 -1.178 1.00 0.00 H new ATOM 1556 N ASP A 520 -0.516 19.490 3.173 1.00 0.00 N ATOM 1557 CA ASP A 520 -0.823 20.651 4.001 1.00 0.00 C ATOM 1558 C ASP A 520 -1.055 21.887 3.138 1.00 0.00 C ATOM 1559 O ASP A 520 -2.117 22.508 3.198 1.00 0.00 O ATOM 1560 CB ASP A 520 0.311 20.912 4.993 1.00 0.00 C ATOM 1561 CG ASP A 520 0.333 22.346 5.484 1.00 0.00 C ATOM 1562 OD1 ASP A 520 -0.715 22.824 5.967 1.00 0.00 O ATOM 1563 OD2 ASP A 520 1.398 22.990 5.386 1.00 0.00 O ATOM 0 H ASP A 520 0.467 19.404 2.915 1.00 0.00 H new ATOM 0 HA ASP A 520 -1.737 20.439 4.555 1.00 0.00 H new ATOM 0 HB2 ASP A 520 0.206 20.241 5.845 1.00 0.00 H new ATOM 0 HB3 ASP A 520 1.265 20.679 4.520 1.00 0.00 H new ATOM 1568 N SER A 521 -0.055 22.240 2.337 1.00 0.00 N ATOM 1569 CA SER A 521 -0.148 23.405 1.465 1.00 0.00 C ATOM 1570 C SER A 521 -1.565 23.566 0.923 1.00 0.00 C ATOM 1571 O SER A 521 -2.086 22.681 0.244 1.00 0.00 O ATOM 1572 CB SER A 521 0.843 23.282 0.306 1.00 0.00 C ATOM 1573 OG SER A 521 2.181 23.360 0.768 1.00 0.00 O ATOM 0 H SER A 521 0.829 21.736 2.274 1.00 0.00 H new ATOM 0 HA SER A 521 0.100 24.289 2.053 1.00 0.00 H new ATOM 0 HB2 SER A 521 0.688 22.335 -0.210 1.00 0.00 H new ATOM 0 HB3 SER A 521 0.659 24.074 -0.420 1.00 0.00 H new ATOM 0 HG SER A 521 2.795 23.277 0.008 1.00 0.00 H new ATOM 1579 N ASP A 522 -2.182 24.702 1.228 1.00 0.00 N ATOM 1580 CA ASP A 522 -3.539 24.981 0.771 1.00 0.00 C ATOM 1581 C ASP A 522 -3.609 26.336 0.074 1.00 0.00 C ATOM 1582 O ASP A 522 -4.681 26.931 -0.043 1.00 0.00 O ATOM 1583 CB ASP A 522 -4.513 24.949 1.950 1.00 0.00 C ATOM 1584 CG ASP A 522 -5.906 24.514 1.538 1.00 0.00 C ATOM 1585 OD1 ASP A 522 -6.677 25.370 1.056 1.00 0.00 O ATOM 1586 OD2 ASP A 522 -6.225 23.317 1.698 1.00 0.00 O ATOM 0 H ASP A 522 -1.765 25.444 1.789 1.00 0.00 H new ATOM 0 HA ASP A 522 -3.822 24.209 0.055 1.00 0.00 H new ATOM 0 HB2 ASP A 522 -4.134 24.269 2.713 1.00 0.00 H new ATOM 0 HB3 ASP A 522 -4.564 25.939 2.403 1.00 0.00 H new ATOM 1591 N PHE A 523 -2.460 26.819 -0.388 1.00 0.00 N ATOM 1592 CA PHE A 523 -2.391 28.104 -1.072 1.00 0.00 C ATOM 1593 C PHE A 523 -1.224 28.135 -2.054 1.00 0.00 C ATOM 1594 O PHE A 523 -0.200 27.487 -1.840 1.00 0.00 O ATOM 1595 CB PHE A 523 -2.248 29.240 -0.056 1.00 0.00 C ATOM 1596 CG PHE A 523 -1.733 30.518 -0.654 1.00 0.00 C ATOM 1597 CD1 PHE A 523 -0.371 30.751 -0.756 1.00 0.00 C ATOM 1598 CD2 PHE A 523 -2.611 31.486 -1.114 1.00 0.00 C ATOM 1599 CE1 PHE A 523 0.106 31.926 -1.307 1.00 0.00 C ATOM 1600 CE2 PHE A 523 -2.140 32.663 -1.666 1.00 0.00 C ATOM 1601 CZ PHE A 523 -0.779 32.883 -1.761 1.00 0.00 C ATOM 0 H PHE A 523 -1.564 26.339 -0.301 1.00 0.00 H new ATOM 0 HA PHE A 523 -3.317 28.240 -1.631 1.00 0.00 H new ATOM 0 HB2 PHE A 523 -3.218 29.429 0.405 1.00 0.00 H new ATOM 0 HB3 PHE A 523 -1.573 28.923 0.739 1.00 0.00 H new ATOM 0 HD1 PHE A 523 0.326 30.006 -0.401 1.00 0.00 H new ATOM 0 HD2 PHE A 523 -3.676 31.319 -1.041 1.00 0.00 H new ATOM 0 HE1 PHE A 523 1.170 32.095 -1.382 1.00 0.00 H new ATOM 0 HE2 PHE A 523 -2.835 33.409 -2.022 1.00 0.00 H new ATOM 0 HZ PHE A 523 -0.408 33.802 -2.190 1.00 0.00 H new ATOM 1611 N VAL A 524 -1.386 28.894 -3.134 1.00 0.00 N ATOM 1612 CA VAL A 524 -0.347 29.011 -4.149 1.00 0.00 C ATOM 1613 C VAL A 524 -0.046 30.473 -4.463 1.00 0.00 C ATOM 1614 O VAL A 524 -0.946 31.312 -4.480 1.00 0.00 O ATOM 1615 CB VAL A 524 -0.750 28.291 -5.450 1.00 0.00 C ATOM 1616 CG1 VAL A 524 0.334 28.449 -6.506 1.00 0.00 C ATOM 1617 CG2 VAL A 524 -1.033 26.821 -5.179 1.00 0.00 C ATOM 0 H VAL A 524 -2.228 29.437 -3.328 1.00 0.00 H new ATOM 0 HA VAL A 524 0.547 28.538 -3.742 1.00 0.00 H new ATOM 0 HB VAL A 524 -1.663 28.749 -5.831 1.00 0.00 H new ATOM 0 HG11 VAL A 524 0.032 27.934 -7.418 1.00 0.00 H new ATOM 0 HG12 VAL A 524 0.482 29.508 -6.719 1.00 0.00 H new ATOM 0 HG13 VAL A 524 1.266 28.019 -6.138 1.00 0.00 H new ATOM 0 HG21 VAL A 524 -1.316 26.328 -6.109 1.00 0.00 H new ATOM 0 HG22 VAL A 524 -0.139 26.347 -4.774 1.00 0.00 H new ATOM 0 HG23 VAL A 524 -1.847 26.734 -4.459 1.00 0.00 H new ATOM 1627 N MET A 525 1.225 30.770 -4.710 1.00 0.00 N ATOM 1628 CA MET A 525 1.644 32.131 -5.025 1.00 0.00 C ATOM 1629 C MET A 525 2.138 32.228 -6.465 1.00 0.00 C ATOM 1630 O MET A 525 2.501 31.223 -7.076 1.00 0.00 O ATOM 1631 CB MET A 525 2.745 32.583 -4.064 1.00 0.00 C ATOM 1632 CG MET A 525 2.756 34.083 -3.815 1.00 0.00 C ATOM 1633 SD MET A 525 4.168 34.612 -2.825 1.00 0.00 S ATOM 1634 CE MET A 525 4.186 36.369 -3.174 1.00 0.00 C ATOM 0 H MET A 525 1.983 30.087 -4.698 1.00 0.00 H new ATOM 0 HA MET A 525 0.781 32.786 -4.911 1.00 0.00 H new ATOM 0 HB2 MET A 525 2.620 32.066 -3.113 1.00 0.00 H new ATOM 0 HB3 MET A 525 3.713 32.282 -4.466 1.00 0.00 H new ATOM 0 HG2 MET A 525 2.771 34.606 -4.771 1.00 0.00 H new ATOM 0 HG3 MET A 525 1.834 34.370 -3.309 1.00 0.00 H new ATOM 0 HE1 MET A 525 5.007 36.839 -2.632 1.00 0.00 H new ATOM 0 HE2 MET A 525 4.321 36.526 -4.244 1.00 0.00 H new ATOM 0 HE3 MET A 525 3.242 36.812 -2.858 1.00 0.00 H new ATOM 1644 N ASP A 526 2.148 33.444 -7.001 1.00 0.00 N ATOM 1645 CA ASP A 526 2.598 33.672 -8.369 1.00 0.00 C ATOM 1646 C ASP A 526 1.710 32.932 -9.364 1.00 0.00 C ATOM 1647 O ASP A 526 2.201 32.316 -10.310 1.00 0.00 O ATOM 1648 CB ASP A 526 4.052 33.224 -8.532 1.00 0.00 C ATOM 1649 CG ASP A 526 4.947 33.751 -7.428 1.00 0.00 C ATOM 1650 OD1 ASP A 526 4.862 33.233 -6.295 1.00 0.00 O ATOM 1651 OD2 ASP A 526 5.735 34.683 -7.698 1.00 0.00 O ATOM 0 H ASP A 526 1.850 34.286 -6.509 1.00 0.00 H new ATOM 0 HA ASP A 526 2.530 34.740 -8.574 1.00 0.00 H new ATOM 0 HB2 ASP A 526 4.095 32.135 -8.542 1.00 0.00 H new ATOM 0 HB3 ASP A 526 4.429 33.566 -9.496 1.00 0.00 H new ATOM 1656 N SER A 527 0.401 32.996 -9.143 1.00 0.00 N ATOM 1657 CA SER A 527 -0.556 32.328 -10.017 1.00 0.00 C ATOM 1658 C SER A 527 -0.865 33.186 -11.240 1.00 0.00 C ATOM 1659 O SER A 527 -0.867 32.698 -12.370 1.00 0.00 O ATOM 1660 CB SER A 527 -1.846 32.021 -9.255 1.00 0.00 C ATOM 1661 OG SER A 527 -1.589 31.212 -8.121 1.00 0.00 O ATOM 0 H SER A 527 -0.021 33.504 -8.366 1.00 0.00 H new ATOM 0 HA SER A 527 -0.111 31.392 -10.355 1.00 0.00 H new ATOM 0 HB2 SER A 527 -2.317 32.953 -8.942 1.00 0.00 H new ATOM 0 HB3 SER A 527 -2.550 31.514 -9.915 1.00 0.00 H new ATOM 0 HG SER A 527 -2.430 31.032 -7.651 1.00 0.00 H new ATOM 1667 N GLY A 528 -1.126 34.468 -11.005 1.00 0.00 N ATOM 1668 CA GLY A 528 -1.434 35.375 -12.096 1.00 0.00 C ATOM 1669 C GLY A 528 -0.479 36.550 -12.160 1.00 0.00 C ATOM 1670 O GLY A 528 -0.658 37.560 -11.478 1.00 0.00 O ATOM 0 H GLY A 528 -1.130 34.895 -10.079 1.00 0.00 H new ATOM 0 HA2 GLY A 528 -1.398 34.830 -13.039 1.00 0.00 H new ATOM 0 HA3 GLY A 528 -2.453 35.745 -11.980 1.00 0.00 H new ATOM 1674 N PRO A 529 0.564 36.426 -12.994 1.00 0.00 N ATOM 1675 CA PRO A 529 1.572 37.476 -13.163 1.00 0.00 C ATOM 1676 C PRO A 529 0.948 38.859 -13.317 1.00 0.00 C ATOM 1677 O PRO A 529 0.544 39.250 -14.412 1.00 0.00 O ATOM 1678 CB PRO A 529 2.296 37.070 -14.449 1.00 0.00 C ATOM 1679 CG PRO A 529 2.148 35.589 -14.515 1.00 0.00 C ATOM 1680 CD PRO A 529 0.839 35.250 -13.836 1.00 0.00 C ATOM 0 HA PRO A 529 2.227 37.555 -12.296 1.00 0.00 H new ATOM 0 HB2 PRO A 529 1.854 37.551 -15.321 1.00 0.00 H new ATOM 0 HB3 PRO A 529 3.346 37.362 -14.422 1.00 0.00 H new ATOM 0 HG2 PRO A 529 2.147 35.246 -15.550 1.00 0.00 H new ATOM 0 HG3 PRO A 529 2.982 35.095 -14.016 1.00 0.00 H new ATOM 0 HD2 PRO A 529 0.043 35.083 -14.562 1.00 0.00 H new ATOM 0 HD3 PRO A 529 0.922 34.342 -13.239 1.00 0.00 H new ATOM 1688 N SER A 530 0.873 39.596 -12.213 1.00 0.00 N ATOM 1689 CA SER A 530 0.295 40.935 -12.225 1.00 0.00 C ATOM 1690 C SER A 530 -1.049 40.939 -12.947 1.00 0.00 C ATOM 1691 O SER A 530 -1.345 41.846 -13.726 1.00 0.00 O ATOM 1692 CB SER A 530 1.252 41.920 -12.899 1.00 0.00 C ATOM 1693 OG SER A 530 0.811 43.256 -12.728 1.00 0.00 O ATOM 0 H SER A 530 1.205 39.288 -11.299 1.00 0.00 H new ATOM 0 HA SER A 530 0.134 41.245 -11.192 1.00 0.00 H new ATOM 0 HB2 SER A 530 2.251 41.807 -12.479 1.00 0.00 H new ATOM 0 HB3 SER A 530 1.326 41.691 -13.962 1.00 0.00 H new ATOM 0 HG SER A 530 -0.099 43.347 -13.079 1.00 0.00 H new ATOM 1699 N SER A 531 -1.859 39.919 -12.683 1.00 0.00 N ATOM 1700 CA SER A 531 -3.171 39.802 -13.310 1.00 0.00 C ATOM 1701 C SER A 531 -4.283 40.024 -12.289 1.00 0.00 C ATOM 1702 O SER A 531 -4.149 39.663 -11.121 1.00 0.00 O ATOM 1703 CB SER A 531 -3.328 38.426 -13.961 1.00 0.00 C ATOM 1704 OG SER A 531 -4.563 38.325 -14.648 1.00 0.00 O ATOM 0 H SER A 531 -1.630 39.162 -12.039 1.00 0.00 H new ATOM 0 HA SER A 531 -3.249 40.571 -14.079 1.00 0.00 H new ATOM 0 HB2 SER A 531 -2.506 38.253 -14.656 1.00 0.00 H new ATOM 0 HB3 SER A 531 -3.268 37.650 -13.198 1.00 0.00 H new ATOM 0 HG SER A 531 -4.638 37.437 -15.057 1.00 0.00 H new ATOM 1710 N GLY A 532 -5.381 40.622 -12.740 1.00 0.00 N ATOM 1711 CA GLY A 532 -6.501 40.882 -11.855 1.00 0.00 C ATOM 1712 C GLY A 532 -7.062 42.280 -12.026 1.00 0.00 C ATOM 1713 O GLY A 532 -6.419 43.146 -12.618 1.00 0.00 O ATOM 0 H GLY A 532 -5.515 40.931 -13.703 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -7.288 40.152 -12.046 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -6.183 40.745 -10.821 1.00 0.00 H new TER 1717 GLY A 532