USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1051 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 462 CYS SG : rot -163:sc= -0.83 USER MOD Set 1.2: A 503 THR OG1 : rot 100:sc=-0.00676 USER MOD Set 2.1: A 476 ASN : amide:sc= -4.49! C(o=-10!,f=-18!) USER MOD Set 2.2: A 480 GLN : amide:sc= -5.67! C(o=-10!,f=-10!) USER MOD Set 3.1: A 443 GLN : amide:sc= -2.33! K(o=-2.3!,f=-0.96) USER MOD Set 3.2: A 475 SER OG : rot 170:sc= 0 USER MOD Set 4.1: A 471 GLN : amide:sc= -0.361 K(o=-4,f=-4.6) USER MOD Set 4.2: A 474 MET CE :methyl 159:sc= -3.67! (180deg=-4.9!) USER MOD Single : A 386 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 9:sc= 0.973 USER MOD Single : A 389 SER OG : rot 180:sc= 0 USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD Single : A 392 GLN : amide:sc= -0.522 X(o=-0.52,f=-0.65) USER MOD Single : A 393 LYS NZ :NH3+ 162:sc= -0.0711 (180deg=-0.416) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -10.5! C(o=-11!,f=-8.6!) USER MOD Single : A 401 HIS : no HD1:sc= -13.4! C(o=-13!,f=-14!) USER MOD Single : A 407 HIS : no HD1:sc= -2.03 K(o=-2,f=-3) USER MOD Single : A 415 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 426 THR OG1 : rot 14:sc= 0.153! USER MOD Single : A 428 CYS SG : rot 150:sc= -3.71! USER MOD Single : A 432 GLN : amide:sc= -0.544 K(o=-0.54,f=-2.3) USER MOD Single : A 434 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-0.66) USER MOD Single : A 440 SER OG : rot 180:sc= 0 USER MOD Single : A 441 CYS SG : rot -1:sc= 0.0648 USER MOD Single : A 448 HIS : no HD1:sc= -8.49! C(o=-8.5!,f=-7.7!) USER MOD Single : A 449 SER OG : rot 140:sc= -2.9! USER MOD Single : A 457 THR OG1 : rot 170:sc= -0.0324 USER MOD Single : A 458 SER OG : rot -31:sc= 0.102 USER MOD Single : A 459 ASN : amide:sc=-0.000655 X(o=-0.00066,f=-0.092) USER MOD Single : A 465 SER OG : rot -110:sc= -3.83! USER MOD Single : A 467 HIS : no HD1:sc= -2.75! C(o=-2.8!,f=-2.9!) USER MOD Single : A 468 GLN : amide:sc= -0.579 K(o=-0.58,f=-0.0026) USER MOD Single : A 470 ASN : amide:sc= -0.477 X(o=-0.48,f=0) USER MOD Single : A 473 MET CE :methyl 140:sc= -2.88 (180deg=-5.28!) USER MOD Single : A 478 THR OG1 : rot -46:sc= 0.00986 USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 485 CYS SG : rot -89:sc= 0.35 USER MOD Single : A 494 SER OG : rot 84:sc= -0.807 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 498 GLN : amide:sc= -0.0118 X(o=-0.012,f=-0.016) USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot 180:sc= 0 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 47:sc= -1.97 USER MOD Single : A 516 HIS : no HD1:sc= -4.39! C(o=-4.4!,f=-3.9!) USER MOD Single : A 517 SER OG : rot 180:sc= -1.37 USER MOD Single : A 518 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.34! C(o=-3.3!,f=-4.6!) USER MOD Single : A 527 THR OG1 : rot -130:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HE2:sc= -3.64! C(o=-3.6!,f=-4.3!) USER MOD Single : A 534 GLN : amide:sc= -1.51 K(o=-1.5,f=-0.4) USER MOD Single : A 537 LYS NZ :NH3+ 160:sc= -1.75 (180deg=-2.66!) USER MOD Single : A 539 MET CE :methyl 167:sc= -7.5! (180deg=-7.93!) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 GLN : amide:sc= -1.3 X(o=-1.3,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 11.326 12.187 27.239 1.00 23.04 N ATOM 2 CA MET A 386 11.749 12.840 26.012 1.00 14.31 C ATOM 3 C MET A 386 11.936 11.822 24.885 1.00 34.53 C ATOM 4 O MET A 386 12.343 10.687 25.129 1.00 11.23 O ATOM 5 CB MET A 386 13.064 13.581 26.253 1.00 45.11 C ATOM 6 CG MET A 386 12.838 14.839 27.095 1.00 55.03 C ATOM 7 SD MET A 386 14.402 15.485 27.662 1.00 34.33 S ATOM 8 CE MET A 386 14.317 17.137 26.992 1.00 11.12 C ATOM 0 HA MET A 386 10.974 13.546 25.714 1.00 14.31 H new ATOM 0 HB2 MET A 386 13.769 12.922 26.759 1.00 45.11 H new ATOM 0 HB3 MET A 386 13.512 13.854 25.298 1.00 45.11 H new ATOM 0 HG2 MET A 386 12.317 15.593 26.505 1.00 55.03 H new ATOM 0 HG3 MET A 386 12.201 14.606 27.948 1.00 55.03 H new ATOM 0 HE1 MET A 386 15.223 17.683 27.255 1.00 11.12 H new ATOM 0 HE2 MET A 386 14.227 17.085 25.907 1.00 11.12 H new ATOM 0 HE3 MET A 386 13.450 17.653 27.404 1.00 11.12 H new ATOM 16 N GLU A 387 11.630 12.264 23.673 1.00 71.10 N ATOM 17 CA GLU A 387 11.760 11.406 22.508 1.00 14.34 C ATOM 18 C GLU A 387 12.867 11.925 21.588 1.00 15.11 C ATOM 19 O GLU A 387 12.735 12.996 20.996 1.00 2.14 O ATOM 20 CB GLU A 387 10.431 11.294 21.759 1.00 11.32 C ATOM 21 CG GLU A 387 9.612 12.579 21.899 1.00 44.12 C ATOM 22 CD GLU A 387 8.952 12.660 23.278 1.00 30.23 C ATOM 23 OE1 GLU A 387 8.601 11.622 23.860 1.00 34.44 O ATOM 24 OE2 GLU A 387 8.807 13.854 23.745 1.00 12.12 O ATOM 0 H GLU A 387 11.292 13.206 23.473 1.00 71.10 H new ATOM 0 HA GLU A 387 12.034 10.406 22.845 1.00 14.34 H new ATOM 0 HB2 GLU A 387 10.620 11.092 20.705 1.00 11.32 H new ATOM 0 HB3 GLU A 387 9.860 10.451 22.148 1.00 11.32 H new ATOM 0 HG2 GLU A 387 10.258 13.444 21.749 1.00 44.12 H new ATOM 0 HG3 GLU A 387 8.847 12.614 21.123 1.00 44.12 H new ATOM 30 N SER A 388 13.931 11.141 21.494 1.00 61.04 N ATOM 31 CA SER A 388 15.059 11.508 20.656 1.00 73.15 C ATOM 32 C SER A 388 15.072 10.650 19.390 1.00 42.10 C ATOM 33 O SER A 388 16.089 10.563 18.704 1.00 22.04 O ATOM 34 CB SER A 388 16.380 11.358 21.412 1.00 0.04 C ATOM 35 OG SER A 388 17.499 11.317 20.530 1.00 73.14 O ATOM 0 H SER A 388 14.035 10.253 21.985 1.00 61.04 H new ATOM 0 HA SER A 388 14.949 12.556 20.376 1.00 73.15 H new ATOM 0 HB2 SER A 388 16.496 12.190 22.107 1.00 0.04 H new ATOM 0 HB3 SER A 388 16.355 10.446 22.008 1.00 0.04 H new ATOM 0 HG SER A 388 17.206 11.529 19.619 1.00 73.14 H new ATOM 40 N SER A 389 13.928 10.038 19.118 1.00 12.13 N ATOM 41 CA SER A 389 13.794 9.188 17.945 1.00 44.13 C ATOM 42 C SER A 389 12.533 9.568 17.166 1.00 33.51 C ATOM 43 O SER A 389 12.044 8.787 16.352 1.00 71.41 O ATOM 44 CB SER A 389 13.750 7.710 18.339 1.00 62.24 C ATOM 45 OG SER A 389 15.004 7.254 18.840 1.00 35.12 O ATOM 0 H SER A 389 13.086 10.113 19.689 1.00 12.13 H new ATOM 0 HA SER A 389 14.666 9.341 17.309 1.00 44.13 H new ATOM 0 HB2 SER A 389 12.981 7.559 19.096 1.00 62.24 H new ATOM 0 HB3 SER A 389 13.466 7.112 17.473 1.00 62.24 H new ATOM 0 HG SER A 389 14.935 6.307 19.082 1.00 35.12 H new ATOM 50 N SER A 390 12.044 10.768 17.442 1.00 24.32 N ATOM 51 CA SER A 390 10.850 11.261 16.776 1.00 45.12 C ATOM 52 C SER A 390 11.224 11.900 15.437 1.00 11.00 C ATOM 53 O SER A 390 11.630 13.060 15.391 1.00 13.34 O ATOM 54 CB SER A 390 10.106 12.268 17.655 1.00 61.22 C ATOM 55 OG SER A 390 8.700 12.241 17.424 1.00 0.53 O ATOM 0 H SER A 390 12.453 11.414 18.118 1.00 24.32 H new ATOM 0 HA SER A 390 10.185 10.416 16.595 1.00 45.12 H new ATOM 0 HB2 SER A 390 10.305 12.050 18.704 1.00 61.22 H new ATOM 0 HB3 SER A 390 10.486 13.271 17.460 1.00 61.22 H new ATOM 0 HG SER A 390 8.260 12.896 18.005 1.00 0.53 H new ATOM 60 N GLU A 391 11.074 11.114 14.381 1.00 43.41 N ATOM 61 CA GLU A 391 11.390 11.589 13.045 1.00 61.45 C ATOM 62 C GLU A 391 10.152 12.207 12.393 1.00 32.14 C ATOM 63 O GLU A 391 9.088 12.269 13.009 1.00 31.13 O ATOM 64 CB GLU A 391 11.958 10.460 12.182 1.00 25.52 C ATOM 65 CG GLU A 391 10.836 9.616 11.575 1.00 1.13 C ATOM 66 CD GLU A 391 11.293 8.172 11.355 1.00 72.44 C ATOM 67 OE1 GLU A 391 12.098 7.909 10.449 1.00 32.24 O ATOM 68 OE2 GLU A 391 10.783 7.310 12.166 1.00 11.44 O ATOM 0 H GLU A 391 10.738 10.152 14.424 1.00 43.41 H new ATOM 0 HA GLU A 391 12.156 12.360 13.127 1.00 61.45 H new ATOM 0 HB2 GLU A 391 12.573 10.880 11.386 1.00 25.52 H new ATOM 0 HB3 GLU A 391 12.608 9.827 12.787 1.00 25.52 H new ATOM 0 HG2 GLU A 391 9.968 9.630 12.234 1.00 1.13 H new ATOM 0 HG3 GLU A 391 10.522 10.050 10.626 1.00 1.13 H new ATOM 74 N GLN A 392 10.329 12.646 11.157 1.00 71.13 N ATOM 75 CA GLN A 392 9.239 13.257 10.416 1.00 53.13 C ATOM 76 C GLN A 392 8.128 12.234 10.167 1.00 44.33 C ATOM 77 O GLN A 392 8.195 11.108 10.658 1.00 50.04 O ATOM 78 CB GLN A 392 9.737 13.855 9.099 1.00 32.42 C ATOM 79 CG GLN A 392 10.158 15.314 9.282 1.00 35.02 C ATOM 80 CD GLN A 392 9.005 16.149 9.845 1.00 64.30 C ATOM 81 OE1 GLN A 392 7.866 16.047 9.421 1.00 12.34 O ATOM 82 NE2 GLN A 392 9.365 16.978 10.821 1.00 34.02 N ATOM 0 H GLN A 392 11.212 12.591 10.649 1.00 71.13 H new ATOM 0 HA GLN A 392 8.831 14.071 11.015 1.00 53.13 H new ATOM 0 HB2 GLN A 392 10.581 13.273 8.728 1.00 32.42 H new ATOM 0 HB3 GLN A 392 8.951 13.792 8.347 1.00 32.42 H new ATOM 0 HG2 GLN A 392 11.014 15.368 9.955 1.00 35.02 H new ATOM 0 HG3 GLN A 392 10.478 15.727 8.325 1.00 35.02 H new ATOM 0 HE21 GLN A 392 10.337 17.013 11.128 1.00 34.02 H new ATOM 0 HE22 GLN A 392 8.669 17.579 11.263 1.00 34.02 H new ATOM 89 N LYS A 393 7.132 12.663 9.406 1.00 73.21 N ATOM 90 CA LYS A 393 6.008 11.798 9.087 1.00 64.21 C ATOM 91 C LYS A 393 5.799 11.779 7.572 1.00 73.41 C ATOM 92 O LYS A 393 5.595 12.824 6.956 1.00 60.44 O ATOM 93 CB LYS A 393 4.767 12.222 9.874 1.00 14.43 C ATOM 94 CG LYS A 393 3.585 11.299 9.571 1.00 54.13 C ATOM 95 CD LYS A 393 3.850 9.882 10.083 1.00 51.31 C ATOM 96 CE LYS A 393 4.129 9.886 11.586 1.00 24.21 C ATOM 97 NZ LYS A 393 3.083 10.648 12.305 1.00 42.21 N ATOM 0 H LYS A 393 7.080 13.598 9.001 1.00 73.21 H new ATOM 0 HA LYS A 393 6.217 10.773 9.393 1.00 64.21 H new ATOM 0 HB2 LYS A 393 4.985 12.202 10.942 1.00 14.43 H new ATOM 0 HB3 LYS A 393 4.505 13.249 9.621 1.00 14.43 H new ATOM 0 HG2 LYS A 393 2.682 11.694 10.036 1.00 54.13 H new ATOM 0 HG3 LYS A 393 3.405 11.273 8.496 1.00 54.13 H new ATOM 0 HD2 LYS A 393 2.989 9.248 9.871 1.00 51.31 H new ATOM 0 HD3 LYS A 393 4.700 9.453 9.553 1.00 51.31 H new ATOM 0 HE2 LYS A 393 4.162 8.862 11.958 1.00 24.21 H new ATOM 0 HE3 LYS A 393 5.107 10.327 11.779 1.00 24.21 H new ATOM 0 HZ1 LYS A 393 3.102 10.397 13.314 1.00 42.21 H new ATOM 0 HZ2 LYS A 393 3.261 11.667 12.199 1.00 42.21 H new ATOM 0 HZ3 LYS A 393 2.150 10.416 11.908 1.00 42.21 H new ATOM 106 N PHE A 394 5.857 10.579 7.014 1.00 30.34 N ATOM 107 CA PHE A 394 5.677 10.410 5.582 1.00 61.53 C ATOM 108 C PHE A 394 5.287 8.969 5.244 1.00 5.00 C ATOM 109 O PHE A 394 5.803 8.026 5.842 1.00 53.03 O ATOM 110 CB PHE A 394 7.021 10.729 4.921 1.00 50.41 C ATOM 111 CG PHE A 394 6.896 11.374 3.538 1.00 45.03 C ATOM 112 CD1 PHE A 394 5.974 12.351 3.325 1.00 33.33 C ATOM 113 CD2 PHE A 394 7.707 10.970 2.524 1.00 4.25 C ATOM 114 CE1 PHE A 394 5.860 12.950 2.042 1.00 30.13 C ATOM 115 CE2 PHE A 394 7.592 11.567 1.243 1.00 54.45 C ATOM 116 CZ PHE A 394 6.670 12.545 1.029 1.00 12.11 C ATOM 0 H PHE A 394 6.026 9.714 7.528 1.00 30.34 H new ATOM 0 HA PHE A 394 4.882 11.066 5.228 1.00 61.53 H new ATOM 0 HB2 PHE A 394 7.586 11.396 5.572 1.00 50.41 H new ATOM 0 HB3 PHE A 394 7.598 9.808 4.831 1.00 50.41 H new ATOM 0 HD1 PHE A 394 5.329 12.671 4.130 1.00 33.33 H new ATOM 0 HD2 PHE A 394 8.439 10.194 2.694 1.00 4.25 H new ATOM 0 HE1 PHE A 394 5.130 13.727 1.872 1.00 30.13 H new ATOM 0 HE2 PHE A 394 8.236 11.246 0.438 1.00 54.45 H new ATOM 0 HZ PHE A 394 6.582 13.000 0.053 1.00 12.11 H new ATOM 125 N TYR A 395 4.378 8.845 4.289 1.00 31.21 N ATOM 126 CA TYR A 395 3.912 7.535 3.865 1.00 54.44 C ATOM 127 C TYR A 395 4.617 7.091 2.582 1.00 30.04 C ATOM 128 O TYR A 395 4.724 7.862 1.629 1.00 40.14 O ATOM 129 CB TYR A 395 2.417 7.690 3.584 1.00 54.43 C ATOM 130 CG TYR A 395 1.533 7.559 4.825 1.00 14.12 C ATOM 131 CD1 TYR A 395 2.101 7.572 6.082 1.00 61.35 C ATOM 132 CD2 TYR A 395 0.166 7.426 4.689 1.00 35.52 C ATOM 133 CE1 TYR A 395 1.269 7.448 7.251 1.00 62.33 C ATOM 134 CE2 TYR A 395 -0.667 7.301 5.857 1.00 34.55 C ATOM 135 CZ TYR A 395 -0.074 7.319 7.080 1.00 62.24 C ATOM 136 OH TYR A 395 -0.859 7.201 8.184 1.00 23.10 O ATOM 0 H TYR A 395 3.951 9.630 3.796 1.00 31.21 H new ATOM 0 HA TYR A 395 4.118 6.788 4.631 1.00 54.44 H new ATOM 0 HB2 TYR A 395 2.243 8.665 3.128 1.00 54.43 H new ATOM 0 HB3 TYR A 395 2.115 6.938 2.855 1.00 54.43 H new ATOM 0 HD1 TYR A 395 3.171 7.675 6.190 1.00 61.35 H new ATOM 0 HD2 TYR A 395 -0.280 7.416 3.705 1.00 35.52 H new ATOM 0 HE1 TYR A 395 1.702 7.457 8.241 1.00 62.33 H new ATOM 0 HE2 TYR A 395 -1.738 7.195 5.763 1.00 34.55 H new ATOM 0 HH TYR A 395 -1.797 7.117 7.911 1.00 23.10 H new ATOM 145 N ASN A 396 5.080 5.850 2.597 1.00 5.11 N ATOM 146 CA ASN A 396 5.771 5.293 1.448 1.00 42.42 C ATOM 147 C ASN A 396 4.864 4.275 0.757 1.00 34.31 C ATOM 148 O ASN A 396 5.208 3.749 -0.302 1.00 13.30 O ATOM 149 CB ASN A 396 7.053 4.574 1.871 1.00 62.31 C ATOM 150 CG ASN A 396 8.195 5.570 2.084 1.00 30.21 C ATOM 151 OD1 ASN A 396 7.998 6.769 2.190 1.00 13.23 O ATOM 152 ND2 ASN A 396 9.400 5.007 2.140 1.00 71.11 N ATOM 0 H ASN A 396 4.990 5.214 3.389 1.00 5.11 H new ATOM 0 HA ASN A 396 6.023 6.114 0.776 1.00 42.42 H new ATOM 0 HB2 ASN A 396 6.875 4.017 2.791 1.00 62.31 H new ATOM 0 HB3 ASN A 396 7.336 3.848 1.108 1.00 62.31 H new ATOM 0 HD21 ASN A 396 10.228 5.587 2.279 1.00 71.11 H new ATOM 0 HD22 ASN A 396 9.496 3.996 2.044 1.00 71.11 H new ATOM 158 N PHE A 397 3.722 4.025 1.383 1.00 32.41 N ATOM 159 CA PHE A 397 2.763 3.078 0.840 1.00 75.25 C ATOM 160 C PHE A 397 1.509 3.008 1.714 1.00 75.03 C ATOM 161 O PHE A 397 1.553 3.338 2.897 1.00 1.05 O ATOM 162 CB PHE A 397 3.443 1.708 0.833 1.00 3.01 C ATOM 163 CG PHE A 397 3.702 1.134 2.228 1.00 33.01 C ATOM 164 CD1 PHE A 397 2.658 0.732 3.001 1.00 23.20 C ATOM 165 CD2 PHE A 397 4.976 1.026 2.692 1.00 4.33 C ATOM 166 CE1 PHE A 397 2.897 0.199 4.296 1.00 63.54 C ATOM 167 CE2 PHE A 397 5.214 0.492 3.987 1.00 42.13 C ATOM 168 CZ PHE A 397 4.171 0.091 4.762 1.00 70.12 C ATOM 0 H PHE A 397 3.440 4.462 2.261 1.00 32.41 H new ATOM 0 HA PHE A 397 2.460 3.386 -0.161 1.00 75.25 H new ATOM 0 HB2 PHE A 397 2.822 1.009 0.273 1.00 3.01 H new ATOM 0 HB3 PHE A 397 4.392 1.787 0.302 1.00 3.01 H new ATOM 0 HD1 PHE A 397 1.647 0.818 2.630 1.00 23.20 H new ATOM 0 HD2 PHE A 397 5.805 1.345 2.078 1.00 4.33 H new ATOM 0 HE1 PHE A 397 2.068 -0.120 4.910 1.00 63.54 H new ATOM 0 HE2 PHE A 397 6.225 0.404 4.356 1.00 42.13 H new ATOM 0 HZ PHE A 397 4.354 -0.313 5.747 1.00 70.12 H new ATOM 177 N VAL A 398 0.421 2.575 1.095 1.00 13.31 N ATOM 178 CA VAL A 398 -0.845 2.458 1.801 1.00 65.22 C ATOM 179 C VAL A 398 -1.296 0.995 1.788 1.00 41.43 C ATOM 180 O VAL A 398 -1.632 0.456 0.735 1.00 24.14 O ATOM 181 CB VAL A 398 -1.876 3.408 1.191 1.00 21.14 C ATOM 182 CG1 VAL A 398 -2.730 2.691 0.142 1.00 73.21 C ATOM 183 CG2 VAL A 398 -2.753 4.036 2.275 1.00 1.54 C ATOM 0 H VAL A 398 0.389 2.301 0.113 1.00 13.31 H new ATOM 0 HA VAL A 398 -0.730 2.754 2.844 1.00 65.22 H new ATOM 0 HB VAL A 398 -1.335 4.211 0.691 1.00 21.14 H new ATOM 0 HG11 VAL A 398 -3.455 3.389 -0.276 1.00 73.21 H new ATOM 0 HG12 VAL A 398 -2.088 2.314 -0.654 1.00 73.21 H new ATOM 0 HG13 VAL A 398 -3.256 1.858 0.608 1.00 73.21 H new ATOM 0 HG21 VAL A 398 -3.477 4.707 1.813 1.00 1.54 H new ATOM 0 HG22 VAL A 398 -3.280 3.251 2.817 1.00 1.54 H new ATOM 0 HG23 VAL A 398 -2.128 4.598 2.968 1.00 1.54 H new ATOM 193 N ILE A 399 -1.291 0.398 2.970 1.00 20.25 N ATOM 194 CA ILE A 399 -1.697 -0.991 3.108 1.00 33.21 C ATOM 195 C ILE A 399 -3.208 -1.057 3.341 1.00 71.14 C ATOM 196 O ILE A 399 -3.679 -0.815 4.451 1.00 21.05 O ATOM 197 CB ILE A 399 -0.875 -1.684 4.197 1.00 11.51 C ATOM 198 CG1 ILE A 399 0.580 -1.858 3.759 1.00 51.22 C ATOM 199 CG2 ILE A 399 -1.515 -3.014 4.603 1.00 43.44 C ATOM 200 CD1 ILE A 399 1.431 -2.427 4.897 1.00 50.43 C ATOM 0 H ILE A 399 -1.012 0.850 3.841 1.00 20.25 H new ATOM 0 HA ILE A 399 -1.493 -1.540 2.189 1.00 33.21 H new ATOM 0 HB ILE A 399 -0.870 -1.045 5.080 1.00 11.51 H new ATOM 0 HG12 ILE A 399 0.627 -2.524 2.897 1.00 51.22 H new ATOM 0 HG13 ILE A 399 0.986 -0.897 3.442 1.00 51.22 H new ATOM 0 HG21 ILE A 399 -0.912 -3.487 5.378 1.00 43.44 H new ATOM 0 HG22 ILE A 399 -2.520 -2.833 4.985 1.00 43.44 H new ATOM 0 HG23 ILE A 399 -1.570 -3.671 3.735 1.00 43.44 H new ATOM 0 HD11 ILE A 399 2.461 -2.541 4.559 1.00 50.43 H new ATOM 0 HD12 ILE A 399 1.401 -1.747 5.748 1.00 50.43 H new ATOM 0 HD13 ILE A 399 1.037 -3.399 5.195 1.00 50.43 H new ATOM 211 N LEU A 400 -3.925 -1.383 2.276 1.00 70.14 N ATOM 212 CA LEU A 400 -5.373 -1.482 2.351 1.00 3.31 C ATOM 213 C LEU A 400 -5.761 -2.903 2.767 1.00 41.02 C ATOM 214 O LEU A 400 -5.816 -3.804 1.933 1.00 35.14 O ATOM 215 CB LEU A 400 -6.010 -1.030 1.035 1.00 2.35 C ATOM 216 CG LEU A 400 -7.282 -0.189 1.160 1.00 21.44 C ATOM 217 CD1 LEU A 400 -8.017 -0.106 -0.179 1.00 1.55 C ATOM 218 CD2 LEU A 400 -8.183 -0.720 2.277 1.00 43.14 C ATOM 0 H LEU A 400 -3.531 -1.582 1.357 1.00 70.14 H new ATOM 0 HA LEU A 400 -5.763 -0.808 3.114 1.00 3.31 H new ATOM 0 HB2 LEU A 400 -5.272 -0.455 0.475 1.00 2.35 H new ATOM 0 HB3 LEU A 400 -6.240 -1.916 0.443 1.00 2.35 H new ATOM 0 HG LEU A 400 -6.995 0.826 1.434 1.00 21.44 H new ATOM 0 HD11 LEU A 400 -8.917 0.497 -0.063 1.00 1.55 H new ATOM 0 HD12 LEU A 400 -7.366 0.353 -0.923 1.00 1.55 H new ATOM 0 HD13 LEU A 400 -8.292 -1.109 -0.506 1.00 1.55 H new ATOM 0 HD21 LEU A 400 -9.080 -0.104 2.345 1.00 43.14 H new ATOM 0 HD22 LEU A 400 -8.465 -1.750 2.058 1.00 43.14 H new ATOM 0 HD23 LEU A 400 -7.646 -0.685 3.225 1.00 43.14 H new ATOM 229 N HIS A 401 -6.021 -3.057 4.056 1.00 42.31 N ATOM 230 CA HIS A 401 -6.403 -4.351 4.593 1.00 4.35 C ATOM 231 C HIS A 401 -7.688 -4.209 5.413 1.00 33.15 C ATOM 232 O HIS A 401 -8.087 -3.099 5.760 1.00 42.23 O ATOM 233 CB HIS A 401 -5.255 -4.968 5.394 1.00 13.03 C ATOM 234 CG HIS A 401 -5.108 -4.407 6.787 1.00 45.32 C ATOM 235 ND1 HIS A 401 -5.897 -4.817 7.849 1.00 74.20 N ATOM 236 CD2 HIS A 401 -4.255 -3.466 7.284 1.00 43.54 C ATOM 237 CE1 HIS A 401 -5.528 -4.144 8.930 1.00 74.50 C ATOM 238 NE2 HIS A 401 -4.511 -3.307 8.578 1.00 14.32 N ATOM 0 H HIS A 401 -5.975 -2.306 4.745 1.00 42.31 H new ATOM 0 HA HIS A 401 -6.610 -5.040 3.774 1.00 4.35 H new ATOM 0 HB2 HIS A 401 -5.410 -6.045 5.461 1.00 13.03 H new ATOM 0 HB3 HIS A 401 -4.323 -4.814 4.851 1.00 13.03 H new ATOM 0 HD2 HIS A 401 -3.499 -2.939 6.721 1.00 43.54 H new ATOM 0 HE1 HIS A 401 -5.958 -4.242 9.916 1.00 74.50 H new ATOM 0 HE2 HIS A 401 -4.026 -2.665 9.205 1.00 14.32 H new ATOM 246 N ALA A 402 -8.300 -5.349 5.697 1.00 23.25 N ATOM 247 CA ALA A 402 -9.531 -5.366 6.468 1.00 65.12 C ATOM 248 C ALA A 402 -9.276 -4.743 7.842 1.00 74.43 C ATOM 249 O ALA A 402 -8.241 -4.114 8.060 1.00 14.13 O ATOM 250 CB ALA A 402 -10.052 -6.801 6.567 1.00 3.05 C ATOM 0 H ALA A 402 -7.966 -6.268 5.407 1.00 23.25 H new ATOM 0 HA ALA A 402 -10.301 -4.773 5.974 1.00 65.12 H new ATOM 0 HB1 ALA A 402 -10.976 -6.814 7.146 1.00 3.05 H new ATOM 0 HB2 ALA A 402 -10.245 -7.188 5.566 1.00 3.05 H new ATOM 0 HB3 ALA A 402 -9.307 -7.425 7.060 1.00 3.05 H new ATOM 256 N ARG A 403 -10.235 -4.940 8.734 1.00 53.11 N ATOM 257 CA ARG A 403 -10.126 -4.406 10.081 1.00 0.41 C ATOM 258 C ARG A 403 -9.678 -5.500 11.051 1.00 64.34 C ATOM 259 O ARG A 403 -9.354 -5.217 12.203 1.00 42.31 O ATOM 260 CB ARG A 403 -11.464 -3.831 10.555 1.00 35.43 C ATOM 261 CG ARG A 403 -11.300 -3.087 11.881 1.00 45.41 C ATOM 262 CD ARG A 403 -12.302 -3.594 12.921 1.00 32.31 C ATOM 263 NE ARG A 403 -12.123 -2.863 14.195 1.00 31.12 N ATOM 264 CZ ARG A 403 -13.081 -2.739 15.137 1.00 1.35 C ATOM 265 NH1 ARG A 403 -14.298 -3.297 14.956 1.00 43.15 N ATOM 266 NH2 ARG A 403 -12.812 -2.064 16.239 1.00 24.35 N ATOM 0 H ARG A 403 -11.092 -5.462 8.550 1.00 53.11 H new ATOM 0 HA ARG A 403 -9.385 -3.607 10.062 1.00 0.41 H new ATOM 0 HB2 ARG A 403 -11.861 -3.153 9.800 1.00 35.43 H new ATOM 0 HB3 ARG A 403 -12.189 -4.636 10.673 1.00 35.43 H new ATOM 0 HG2 ARG A 403 -10.284 -3.220 12.254 1.00 45.41 H new ATOM 0 HG3 ARG A 403 -11.444 -2.018 11.723 1.00 45.41 H new ATOM 0 HD2 ARG A 403 -13.319 -3.458 12.554 1.00 32.31 H new ATOM 0 HD3 ARG A 403 -12.161 -4.663 13.083 1.00 32.31 H new ATOM 0 HE ARG A 403 -11.219 -2.425 14.372 1.00 31.12 H new ATOM 0 HH11 ARG A 403 -14.499 -3.817 14.102 1.00 43.15 H new ATOM 0 HH12 ARG A 403 -15.016 -3.198 15.674 1.00 43.15 H new ATOM 0 HH21 ARG A 403 -11.891 -1.645 16.369 1.00 24.35 H new ATOM 0 HH22 ARG A 403 -13.525 -1.961 16.961 1.00 24.35 H new ATOM 276 N ALA A 404 -9.672 -6.726 10.549 1.00 24.01 N ATOM 277 CA ALA A 404 -9.268 -7.864 11.359 1.00 52.03 C ATOM 278 C ALA A 404 -7.894 -8.353 10.892 1.00 3.44 C ATOM 279 O ALA A 404 -7.492 -9.472 11.205 1.00 63.44 O ATOM 280 CB ALA A 404 -10.335 -8.957 11.272 1.00 72.23 C ATOM 0 H ALA A 404 -9.940 -6.957 9.592 1.00 24.01 H new ATOM 0 HA ALA A 404 -9.179 -7.578 12.407 1.00 52.03 H new ATOM 0 HB1 ALA A 404 -10.032 -9.810 11.879 1.00 72.23 H new ATOM 0 HB2 ALA A 404 -11.285 -8.569 11.640 1.00 72.23 H new ATOM 0 HB3 ALA A 404 -10.449 -9.272 10.235 1.00 72.23 H new ATOM 286 N ASP A 405 -7.214 -7.490 10.153 1.00 73.14 N ATOM 287 CA ASP A 405 -5.895 -7.819 9.641 1.00 70.11 C ATOM 288 C ASP A 405 -4.916 -6.701 10.008 1.00 1.40 C ATOM 289 O ASP A 405 -4.024 -6.372 9.227 1.00 43.21 O ATOM 290 CB ASP A 405 -5.912 -7.951 8.116 1.00 5.11 C ATOM 291 CG ASP A 405 -7.299 -8.148 7.501 1.00 55.34 C ATOM 292 OD1 ASP A 405 -7.565 -7.704 6.374 1.00 15.51 O ATOM 293 OD2 ASP A 405 -8.137 -8.795 8.238 1.00 42.23 O ATOM 0 H ASP A 405 -7.552 -6.562 9.896 1.00 73.14 H new ATOM 0 HA ASP A 405 -5.590 -8.768 10.081 1.00 70.11 H new ATOM 0 HB2 ASP A 405 -5.463 -7.057 7.684 1.00 5.11 H new ATOM 0 HB3 ASP A 405 -5.282 -8.794 7.832 1.00 5.11 H new ATOM 298 N GLU A 406 -5.116 -6.150 11.196 1.00 44.01 N ATOM 299 CA GLU A 406 -4.262 -5.076 11.675 1.00 1.44 C ATOM 300 C GLU A 406 -2.864 -5.610 11.989 1.00 3.34 C ATOM 301 O GLU A 406 -1.928 -5.400 11.219 1.00 3.13 O ATOM 302 CB GLU A 406 -4.876 -4.393 12.899 1.00 13.34 C ATOM 303 CG GLU A 406 -3.841 -3.525 13.619 1.00 10.01 C ATOM 304 CD GLU A 406 -4.505 -2.654 14.686 1.00 51.41 C ATOM 305 OE1 GLU A 406 -4.684 -1.444 14.477 1.00 34.50 O ATOM 306 OE2 GLU A 406 -4.840 -3.273 15.767 1.00 15.11 O ATOM 0 H GLU A 406 -5.856 -6.427 11.841 1.00 44.01 H new ATOM 0 HA GLU A 406 -4.175 -4.328 10.887 1.00 1.44 H new ATOM 0 HB2 GLU A 406 -5.721 -3.777 12.591 1.00 13.34 H new ATOM 0 HB3 GLU A 406 -5.264 -5.147 13.584 1.00 13.34 H new ATOM 0 HG2 GLU A 406 -3.086 -4.161 14.081 1.00 10.01 H new ATOM 0 HG3 GLU A 406 -3.326 -2.892 12.896 1.00 10.01 H new ATOM 312 N HIS A 407 -2.765 -6.290 13.123 1.00 61.11 N ATOM 313 CA HIS A 407 -1.496 -6.855 13.548 1.00 44.40 C ATOM 314 C HIS A 407 -0.742 -7.396 12.332 1.00 65.51 C ATOM 315 O HIS A 407 0.483 -7.312 12.268 1.00 72.55 O ATOM 316 CB HIS A 407 -1.709 -7.914 14.632 1.00 42.34 C ATOM 317 CG HIS A 407 -2.482 -9.124 14.166 1.00 74.42 C ATOM 318 ND1 HIS A 407 -3.602 -9.032 13.358 1.00 4.43 N ATOM 319 CD2 HIS A 407 -2.285 -10.453 14.401 1.00 71.41 C ATOM 320 CE1 HIS A 407 -4.051 -10.257 13.126 1.00 53.22 C ATOM 321 NE2 HIS A 407 -3.233 -11.136 13.772 1.00 43.34 N ATOM 0 H HIS A 407 -3.543 -6.462 13.760 1.00 61.11 H new ATOM 0 HA HIS A 407 -0.880 -6.076 13.998 1.00 44.40 H new ATOM 0 HB2 HIS A 407 -0.737 -8.238 15.005 1.00 42.34 H new ATOM 0 HB3 HIS A 407 -2.237 -7.460 15.471 1.00 42.34 H new ATOM 0 HD2 HIS A 407 -1.492 -10.878 14.998 1.00 71.41 H new ATOM 0 HE1 HIS A 407 -4.914 -10.514 12.530 1.00 53.22 H new ATOM 0 HE2 HIS A 407 -3.333 -12.151 13.772 1.00 43.34 H new ATOM 328 N ILE A 408 -1.506 -7.941 11.396 1.00 3.41 N ATOM 329 CA ILE A 408 -0.926 -8.496 10.185 1.00 71.33 C ATOM 330 C ILE A 408 -0.131 -7.408 9.460 1.00 3.30 C ATOM 331 O ILE A 408 1.056 -7.582 9.183 1.00 52.53 O ATOM 332 CB ILE A 408 -2.007 -9.146 9.321 1.00 5.31 C ATOM 333 CG1 ILE A 408 -2.528 -10.431 9.969 1.00 1.33 C ATOM 334 CG2 ILE A 408 -1.502 -9.386 7.896 1.00 45.34 C ATOM 335 CD1 ILE A 408 -3.724 -10.989 9.194 1.00 41.43 C ATOM 0 H ILE A 408 -2.522 -8.010 11.452 1.00 3.41 H new ATOM 0 HA ILE A 408 -0.225 -9.294 10.430 1.00 71.33 H new ATOM 0 HB ILE A 408 -2.848 -8.456 9.251 1.00 5.31 H new ATOM 0 HG12 ILE A 408 -1.732 -11.175 10.002 1.00 1.33 H new ATOM 0 HG13 ILE A 408 -2.819 -10.231 11.000 1.00 1.33 H new ATOM 0 HG21 ILE A 408 -2.291 -9.849 7.304 1.00 45.34 H new ATOM 0 HG22 ILE A 408 -1.220 -8.435 7.445 1.00 45.34 H new ATOM 0 HG23 ILE A 408 -0.635 -10.045 7.924 1.00 45.34 H new ATOM 0 HD11 ILE A 408 -4.075 -11.902 9.675 1.00 41.43 H new ATOM 0 HD12 ILE A 408 -4.527 -10.252 9.184 1.00 41.43 H new ATOM 0 HD13 ILE A 408 -3.423 -11.211 8.170 1.00 41.43 H new ATOM 346 N ALA A 409 -0.816 -6.311 9.175 1.00 60.24 N ATOM 347 CA ALA A 409 -0.188 -5.194 8.487 1.00 4.52 C ATOM 348 C ALA A 409 0.905 -4.602 9.379 1.00 32.20 C ATOM 349 O ALA A 409 2.026 -4.375 8.926 1.00 14.23 O ATOM 350 CB ALA A 409 -1.254 -4.164 8.109 1.00 3.43 C ATOM 0 H ALA A 409 -1.799 -6.171 9.407 1.00 60.24 H new ATOM 0 HA ALA A 409 0.285 -5.528 7.563 1.00 4.52 H new ATOM 0 HB1 ALA A 409 -0.784 -3.327 7.593 1.00 3.43 H new ATOM 0 HB2 ALA A 409 -1.991 -4.627 7.453 1.00 3.43 H new ATOM 0 HB3 ALA A 409 -1.748 -3.803 9.011 1.00 3.43 H new ATOM 356 N LEU A 410 0.540 -4.367 10.631 1.00 21.34 N ATOM 357 CA LEU A 410 1.476 -3.805 11.590 1.00 24.12 C ATOM 358 C LEU A 410 2.752 -4.650 11.606 1.00 60.42 C ATOM 359 O LEU A 410 3.812 -4.170 12.005 1.00 65.53 O ATOM 360 CB LEU A 410 0.816 -3.662 12.963 1.00 33.24 C ATOM 361 CG LEU A 410 -0.468 -2.833 13.006 1.00 53.33 C ATOM 362 CD1 LEU A 410 -0.573 -2.053 14.318 1.00 42.34 C ATOM 363 CD2 LEU A 410 -0.571 -1.917 11.786 1.00 60.21 C ATOM 0 H LEU A 410 -0.391 -4.555 11.003 1.00 21.34 H new ATOM 0 HA LEU A 410 1.764 -2.796 11.294 1.00 24.12 H new ATOM 0 HB2 LEU A 410 0.594 -4.659 13.343 1.00 33.24 H new ATOM 0 HB3 LEU A 410 1.537 -3.214 13.646 1.00 33.24 H new ATOM 0 HG LEU A 410 -1.316 -3.516 12.968 1.00 53.33 H new ATOM 0 HD11 LEU A 410 -1.495 -1.472 14.323 1.00 42.34 H new ATOM 0 HD12 LEU A 410 -0.579 -2.750 15.156 1.00 42.34 H new ATOM 0 HD13 LEU A 410 0.280 -1.381 14.411 1.00 42.34 H new ATOM 0 HD21 LEU A 410 -1.493 -1.339 11.842 1.00 60.21 H new ATOM 0 HD22 LEU A 410 0.282 -1.239 11.767 1.00 60.21 H new ATOM 0 HD23 LEU A 410 -0.575 -2.520 10.878 1.00 60.21 H new ATOM 374 N ARG A 411 2.607 -5.890 11.166 1.00 24.13 N ATOM 375 CA ARG A 411 3.735 -6.807 11.127 1.00 54.35 C ATOM 376 C ARG A 411 4.559 -6.576 9.858 1.00 21.22 C ATOM 377 O ARG A 411 5.768 -6.803 9.849 1.00 52.25 O ATOM 378 CB ARG A 411 3.264 -8.262 11.163 1.00 54.23 C ATOM 379 CG ARG A 411 4.346 -9.173 11.747 1.00 41.23 C ATOM 380 CD ARG A 411 3.756 -10.519 12.174 1.00 62.42 C ATOM 381 NE ARG A 411 2.735 -10.958 11.197 1.00 25.20 N ATOM 382 CZ ARG A 411 3.017 -11.380 9.946 1.00 25.14 C ATOM 383 NH1 ARG A 411 4.293 -11.427 9.509 1.00 43.23 N ATOM 384 NH2 ARG A 411 2.025 -11.750 9.158 1.00 54.01 N ATOM 0 H ARG A 411 1.726 -6.282 10.833 1.00 24.13 H new ATOM 0 HA ARG A 411 4.350 -6.616 12.006 1.00 54.35 H new ATOM 0 HB2 ARG A 411 2.356 -8.340 11.761 1.00 54.23 H new ATOM 0 HB3 ARG A 411 3.011 -8.591 10.155 1.00 54.23 H new ATOM 0 HG2 ARG A 411 5.130 -9.334 11.007 1.00 41.23 H new ATOM 0 HG3 ARG A 411 4.812 -8.687 12.604 1.00 41.23 H new ATOM 0 HD2 ARG A 411 4.547 -11.266 12.246 1.00 62.42 H new ATOM 0 HD3 ARG A 411 3.309 -10.432 13.164 1.00 62.42 H new ATOM 0 HE ARG A 411 1.757 -10.941 11.487 1.00 25.20 H new ATOM 0 HH11 ARG A 411 5.054 -11.142 10.126 1.00 43.23 H new ATOM 0 HH12 ARG A 411 4.496 -11.747 8.562 1.00 43.23 H new ATOM 0 HH21 ARG A 411 1.064 -11.714 9.497 1.00 54.01 H new ATOM 0 HH22 ARG A 411 2.220 -12.072 8.210 1.00 54.01 H new ATOM 394 N VAL A 412 3.872 -6.130 8.816 1.00 60.41 N ATOM 395 CA VAL A 412 4.526 -5.866 7.545 1.00 41.43 C ATOM 396 C VAL A 412 5.264 -4.529 7.625 1.00 20.42 C ATOM 397 O VAL A 412 6.457 -4.457 7.327 1.00 44.03 O ATOM 398 CB VAL A 412 3.502 -5.917 6.410 1.00 14.22 C ATOM 399 CG1 VAL A 412 4.026 -5.196 5.166 1.00 20.22 C ATOM 400 CG2 VAL A 412 3.115 -7.361 6.085 1.00 73.04 C ATOM 0 H VAL A 412 2.869 -5.945 8.826 1.00 60.41 H new ATOM 0 HA VAL A 412 5.268 -6.635 7.330 1.00 41.43 H new ATOM 0 HB VAL A 412 2.604 -5.397 6.745 1.00 14.22 H new ATOM 0 HG11 VAL A 412 3.279 -5.247 4.374 1.00 20.22 H new ATOM 0 HG12 VAL A 412 4.227 -4.152 5.408 1.00 20.22 H new ATOM 0 HG13 VAL A 412 4.946 -5.674 4.829 1.00 20.22 H new ATOM 0 HG21 VAL A 412 2.386 -7.369 5.275 1.00 73.04 H new ATOM 0 HG22 VAL A 412 4.002 -7.916 5.780 1.00 73.04 H new ATOM 0 HG23 VAL A 412 2.681 -7.829 6.968 1.00 73.04 H new ATOM 410 N ARG A 413 4.528 -3.505 8.026 1.00 41.24 N ATOM 411 CA ARG A 413 5.098 -2.173 8.148 1.00 4.51 C ATOM 412 C ARG A 413 6.531 -2.258 8.677 1.00 45.33 C ATOM 413 O ARG A 413 7.446 -1.671 8.100 1.00 55.23 O ATOM 414 CB ARG A 413 4.265 -1.301 9.089 1.00 13.33 C ATOM 415 CG ARG A 413 2.770 -1.465 8.808 1.00 72.44 C ATOM 416 CD ARG A 413 2.017 -0.160 9.072 1.00 51.01 C ATOM 417 NE ARG A 413 2.558 0.504 10.279 1.00 22.54 N ATOM 418 CZ ARG A 413 1.842 1.321 11.079 1.00 11.04 C ATOM 419 NH1 ARG A 413 0.547 1.585 10.806 1.00 42.34 N ATOM 420 NH2 ARG A 413 2.427 1.859 12.133 1.00 11.12 N ATOM 0 H ARG A 413 3.540 -3.570 8.271 1.00 41.24 H new ATOM 0 HA ARG A 413 5.098 -1.719 7.157 1.00 4.51 H new ATOM 0 HB2 ARG A 413 4.476 -1.571 10.124 1.00 13.33 H new ATOM 0 HB3 ARG A 413 4.549 -0.256 8.969 1.00 13.33 H new ATOM 0 HG2 ARG A 413 2.622 -1.771 7.772 1.00 72.44 H new ATOM 0 HG3 ARG A 413 2.363 -2.258 9.436 1.00 72.44 H new ATOM 0 HD2 ARG A 413 2.109 0.502 8.211 1.00 51.01 H new ATOM 0 HD3 ARG A 413 0.955 -0.365 9.205 1.00 51.01 H new ATOM 0 HE ARG A 413 3.534 0.333 10.521 1.00 22.54 H new ATOM 0 HH11 ARG A 413 0.102 1.166 9.989 1.00 42.34 H new ATOM 0 HH12 ARG A 413 0.013 2.204 11.416 1.00 42.34 H new ATOM 0 HH21 ARG A 413 3.406 1.655 12.332 1.00 11.12 H new ATOM 0 HH22 ARG A 413 1.900 2.479 12.748 1.00 11.12 H new ATOM 430 N GLU A 414 6.683 -2.991 9.771 1.00 74.34 N ATOM 431 CA GLU A 414 7.990 -3.158 10.383 1.00 42.31 C ATOM 432 C GLU A 414 8.910 -3.959 9.461 1.00 15.15 C ATOM 433 O GLU A 414 10.018 -3.523 9.151 1.00 41.00 O ATOM 434 CB GLU A 414 7.870 -3.827 11.754 1.00 33.12 C ATOM 435 CG GLU A 414 6.900 -3.061 12.656 1.00 60.14 C ATOM 436 CD GLU A 414 6.808 -3.709 14.039 1.00 35.50 C ATOM 437 OE1 GLU A 414 7.487 -4.714 14.299 1.00 74.14 O ATOM 438 OE2 GLU A 414 5.996 -3.133 14.858 1.00 40.45 O ATOM 0 H GLU A 414 5.923 -3.475 10.249 1.00 74.34 H new ATOM 0 HA GLU A 414 8.429 -2.172 10.533 1.00 42.31 H new ATOM 0 HB2 GLU A 414 7.525 -4.854 11.632 1.00 33.12 H new ATOM 0 HB3 GLU A 414 8.851 -3.874 12.227 1.00 33.12 H new ATOM 0 HG2 GLU A 414 7.231 -2.027 12.756 1.00 60.14 H new ATOM 0 HG3 GLU A 414 5.912 -3.037 12.196 1.00 60.14 H new ATOM 444 N LYS A 415 8.418 -5.118 9.048 1.00 35.31 N ATOM 445 CA LYS A 415 9.183 -5.984 8.167 1.00 52.50 C ATOM 446 C LYS A 415 9.733 -5.162 7.001 1.00 51.23 C ATOM 447 O LYS A 415 10.788 -5.480 6.454 1.00 2.22 O ATOM 448 CB LYS A 415 8.338 -7.182 7.728 1.00 44.11 C ATOM 449 CG LYS A 415 8.614 -8.401 8.612 1.00 52.40 C ATOM 450 CD LYS A 415 9.264 -9.527 7.807 1.00 32.33 C ATOM 451 CE LYS A 415 10.477 -9.015 7.026 1.00 13.43 C ATOM 452 NZ LYS A 415 11.399 -10.128 6.714 1.00 64.13 N ATOM 0 H LYS A 415 7.499 -5.477 9.307 1.00 35.31 H new ATOM 0 HA LYS A 415 10.040 -6.402 8.695 1.00 52.50 H new ATOM 0 HB2 LYS A 415 7.280 -6.924 7.779 1.00 44.11 H new ATOM 0 HB3 LYS A 415 8.557 -7.425 6.688 1.00 44.11 H new ATOM 0 HG2 LYS A 415 9.267 -8.116 9.437 1.00 52.40 H new ATOM 0 HG3 LYS A 415 7.681 -8.755 9.051 1.00 52.40 H new ATOM 0 HD2 LYS A 415 9.572 -10.328 8.479 1.00 32.33 H new ATOM 0 HD3 LYS A 415 8.536 -9.952 7.116 1.00 32.33 H new ATOM 0 HE2 LYS A 415 10.148 -8.538 6.103 1.00 13.43 H new ATOM 0 HE3 LYS A 415 10.998 -8.256 7.609 1.00 13.43 H new ATOM 0 HZ1 LYS A 415 12.216 -9.764 6.184 1.00 64.13 H new ATOM 0 HZ2 LYS A 415 11.727 -10.565 7.599 1.00 64.13 H new ATOM 0 HZ3 LYS A 415 10.903 -10.839 6.139 1.00 64.13 H new ATOM 461 N LEU A 416 8.994 -4.118 6.654 1.00 63.24 N ATOM 462 CA LEU A 416 9.396 -3.246 5.562 1.00 4.41 C ATOM 463 C LEU A 416 10.605 -2.414 5.998 1.00 43.54 C ATOM 464 O LEU A 416 11.511 -2.168 5.204 1.00 43.35 O ATOM 465 CB LEU A 416 8.211 -2.404 5.087 1.00 55.51 C ATOM 466 CG LEU A 416 7.055 -3.176 4.444 1.00 42.13 C ATOM 467 CD1 LEU A 416 5.803 -2.302 4.340 1.00 21.01 C ATOM 468 CD2 LEU A 416 7.467 -3.750 3.088 1.00 22.02 C ATOM 0 H LEU A 416 8.120 -3.856 7.109 1.00 63.24 H new ATOM 0 HA LEU A 416 9.707 -3.834 4.699 1.00 4.41 H new ATOM 0 HB2 LEU A 416 7.821 -1.848 5.939 1.00 55.51 H new ATOM 0 HB3 LEU A 416 8.577 -1.671 4.368 1.00 55.51 H new ATOM 0 HG LEU A 416 6.807 -4.019 5.089 1.00 42.13 H new ATOM 0 HD11 LEU A 416 4.997 -2.874 3.880 1.00 21.01 H new ATOM 0 HD12 LEU A 416 5.498 -1.983 5.337 1.00 21.01 H new ATOM 0 HD13 LEU A 416 6.021 -1.426 3.729 1.00 21.01 H new ATOM 0 HD21 LEU A 416 6.628 -4.293 2.653 1.00 22.02 H new ATOM 0 HD22 LEU A 416 7.758 -2.937 2.422 1.00 22.02 H new ATOM 0 HD23 LEU A 416 8.309 -4.429 3.221 1.00 22.02 H new ATOM 479 N GLU A 417 10.578 -2.006 7.259 1.00 74.50 N ATOM 480 CA GLU A 417 11.660 -1.207 7.808 1.00 24.04 C ATOM 481 C GLU A 417 12.911 -2.068 8.001 1.00 33.35 C ATOM 482 O GLU A 417 13.982 -1.551 8.313 1.00 3.23 O ATOM 483 CB GLU A 417 11.242 -0.548 9.124 1.00 51.53 C ATOM 484 CG GLU A 417 9.883 0.142 8.984 1.00 22.25 C ATOM 485 CD GLU A 417 9.894 1.516 9.656 1.00 63.33 C ATOM 486 OE1 GLU A 417 10.937 2.187 9.681 1.00 1.13 O ATOM 487 OE2 GLU A 417 8.766 1.882 10.167 1.00 61.43 O ATOM 0 H GLU A 417 9.825 -2.214 7.915 1.00 74.50 H new ATOM 0 HA GLU A 417 11.894 -0.413 7.099 1.00 24.04 H new ATOM 0 HB2 GLU A 417 11.193 -1.300 9.912 1.00 51.53 H new ATOM 0 HB3 GLU A 417 11.995 0.181 9.425 1.00 51.53 H new ATOM 0 HG2 GLU A 417 9.634 0.251 7.929 1.00 22.25 H new ATOM 0 HG3 GLU A 417 9.108 -0.480 9.432 1.00 22.25 H new ATOM 493 N ALA A 418 12.732 -3.366 7.806 1.00 73.01 N ATOM 494 CA ALA A 418 13.832 -4.304 7.953 1.00 42.23 C ATOM 495 C ALA A 418 14.546 -4.462 6.609 1.00 55.22 C ATOM 496 O ALA A 418 15.586 -5.113 6.526 1.00 44.41 O ATOM 497 CB ALA A 418 13.302 -5.633 8.491 1.00 4.34 C ATOM 0 H ALA A 418 11.841 -3.791 7.547 1.00 73.01 H new ATOM 0 HA ALA A 418 14.561 -3.930 8.671 1.00 42.23 H new ATOM 0 HB1 ALA A 418 14.128 -6.336 8.601 1.00 4.34 H new ATOM 0 HB2 ALA A 418 12.831 -5.471 9.461 1.00 4.34 H new ATOM 0 HB3 ALA A 418 12.569 -6.041 7.795 1.00 4.34 H new ATOM 503 N LEU A 419 13.958 -3.856 5.588 1.00 40.45 N ATOM 504 CA LEU A 419 14.524 -3.921 4.252 1.00 73.00 C ATOM 505 C LEU A 419 14.871 -2.508 3.780 1.00 72.43 C ATOM 506 O LEU A 419 15.947 -2.280 3.230 1.00 22.41 O ATOM 507 CB LEU A 419 13.582 -4.671 3.307 1.00 53.31 C ATOM 508 CG LEU A 419 12.898 -5.911 3.886 1.00 53.42 C ATOM 509 CD1 LEU A 419 11.538 -6.147 3.226 1.00 61.44 C ATOM 510 CD2 LEU A 419 13.806 -7.138 3.780 1.00 41.14 C ATOM 0 H LEU A 419 13.095 -3.317 5.660 1.00 40.45 H new ATOM 0 HA LEU A 419 15.453 -4.492 4.259 1.00 73.00 H new ATOM 0 HB2 LEU A 419 12.810 -3.979 2.970 1.00 53.31 H new ATOM 0 HB3 LEU A 419 14.148 -4.971 2.425 1.00 53.31 H new ATOM 0 HG LEU A 419 12.715 -5.735 4.946 1.00 53.42 H new ATOM 0 HD11 LEU A 419 11.074 -7.034 3.656 1.00 61.44 H new ATOM 0 HD12 LEU A 419 10.896 -5.283 3.397 1.00 61.44 H new ATOM 0 HD13 LEU A 419 11.674 -6.292 2.154 1.00 61.44 H new ATOM 0 HD21 LEU A 419 13.296 -8.005 4.199 1.00 41.14 H new ATOM 0 HD22 LEU A 419 14.042 -7.326 2.733 1.00 41.14 H new ATOM 0 HD23 LEU A 419 14.728 -6.957 4.333 1.00 41.14 H new ATOM 521 N GLY A 420 13.940 -1.596 4.011 1.00 42.33 N ATOM 522 CA GLY A 420 14.134 -0.210 3.616 1.00 30.10 C ATOM 523 C GLY A 420 12.891 0.627 3.925 1.00 73.32 C ATOM 524 O GLY A 420 12.897 1.433 4.853 1.00 54.32 O ATOM 0 H GLY A 420 13.048 -1.788 4.467 1.00 42.33 H new ATOM 0 HA2 GLY A 420 14.995 0.204 4.140 1.00 30.10 H new ATOM 0 HA3 GLY A 420 14.355 -0.159 2.550 1.00 30.10 H new ATOM 528 N VAL A 421 11.855 0.406 3.128 1.00 53.14 N ATOM 529 CA VAL A 421 10.609 1.131 3.304 1.00 53.31 C ATOM 530 C VAL A 421 10.243 1.156 4.789 1.00 13.41 C ATOM 531 O VAL A 421 10.443 0.170 5.498 1.00 65.50 O ATOM 532 CB VAL A 421 9.516 0.513 2.429 1.00 45.33 C ATOM 533 CG1 VAL A 421 9.649 -1.011 2.382 1.00 11.33 C ATOM 534 CG2 VAL A 421 8.126 0.927 2.915 1.00 51.13 C ATOM 0 H VAL A 421 11.854 -0.265 2.359 1.00 53.14 H new ATOM 0 HA VAL A 421 10.720 2.166 2.980 1.00 53.31 H new ATOM 0 HB VAL A 421 9.643 0.892 1.415 1.00 45.33 H new ATOM 0 HG11 VAL A 421 8.861 -1.426 1.754 1.00 11.33 H new ATOM 0 HG12 VAL A 421 10.621 -1.279 1.968 1.00 11.33 H new ATOM 0 HG13 VAL A 421 9.560 -1.415 3.390 1.00 11.33 H new ATOM 0 HG21 VAL A 421 7.368 0.474 2.276 1.00 51.13 H new ATOM 0 HG22 VAL A 421 7.984 0.590 3.942 1.00 51.13 H new ATOM 0 HG23 VAL A 421 8.034 2.012 2.874 1.00 51.13 H new ATOM 544 N PRO A 422 9.700 2.323 5.229 1.00 52.43 N ATOM 545 CA PRO A 422 9.304 2.488 6.617 1.00 73.24 C ATOM 546 C PRO A 422 8.007 1.733 6.912 1.00 0.14 C ATOM 547 O PRO A 422 7.604 0.861 6.143 1.00 23.43 O ATOM 548 CB PRO A 422 9.176 3.990 6.813 1.00 10.45 C ATOM 549 CG PRO A 422 9.048 4.582 5.419 1.00 51.21 C ATOM 550 CD PRO A 422 9.448 3.510 4.419 1.00 75.42 C ATOM 0 HA PRO A 422 10.030 2.069 7.314 1.00 73.24 H new ATOM 0 HB2 PRO A 422 8.305 4.232 7.422 1.00 10.45 H new ATOM 0 HB3 PRO A 422 10.047 4.392 7.330 1.00 10.45 H new ATOM 0 HG2 PRO A 422 8.025 4.912 5.237 1.00 51.21 H new ATOM 0 HG3 PRO A 422 9.688 5.458 5.316 1.00 51.21 H new ATOM 0 HD2 PRO A 422 8.656 3.332 3.691 1.00 75.42 H new ATOM 0 HD3 PRO A 422 10.336 3.803 3.859 1.00 75.42 H new ATOM 555 N ASP A 423 7.389 2.095 8.026 1.00 12.13 N ATOM 556 CA ASP A 423 6.145 1.463 8.432 1.00 31.30 C ATOM 557 C ASP A 423 5.049 1.808 7.422 1.00 61.14 C ATOM 558 O ASP A 423 4.027 1.128 7.352 1.00 33.33 O ATOM 559 CB ASP A 423 5.696 1.962 9.806 1.00 14.31 C ATOM 560 CG ASP A 423 5.998 3.435 10.089 1.00 51.03 C ATOM 561 OD1 ASP A 423 5.993 3.876 11.248 1.00 54.21 O ATOM 562 OD2 ASP A 423 6.249 4.151 9.046 1.00 33.33 O ATOM 0 H ASP A 423 7.727 2.818 8.661 1.00 12.13 H new ATOM 0 HA ASP A 423 6.313 0.387 8.477 1.00 31.30 H new ATOM 0 HB2 ASP A 423 4.622 1.802 9.901 1.00 14.31 H new ATOM 0 HB3 ASP A 423 6.178 1.354 10.572 1.00 14.31 H new ATOM 567 N GLY A 424 5.299 2.866 6.664 1.00 42.02 N ATOM 568 CA GLY A 424 4.346 3.310 5.660 1.00 61.12 C ATOM 569 C GLY A 424 3.009 3.686 6.303 1.00 73.15 C ATOM 570 O GLY A 424 2.840 4.807 6.781 1.00 1.24 O ATOM 0 H GLY A 424 6.148 3.429 6.725 1.00 42.02 H new ATOM 0 HA2 GLY A 424 4.750 4.169 5.124 1.00 61.12 H new ATOM 0 HA3 GLY A 424 4.191 2.520 4.925 1.00 61.12 H new ATOM 574 N ALA A 425 2.094 2.728 6.293 1.00 12.12 N ATOM 575 CA ALA A 425 0.778 2.944 6.868 1.00 14.01 C ATOM 576 C ALA A 425 -0.181 1.869 6.355 1.00 71.22 C ATOM 577 O ALA A 425 0.228 0.959 5.633 1.00 43.23 O ATOM 578 CB ALA A 425 0.301 4.360 6.534 1.00 4.13 C ATOM 0 H ALA A 425 2.238 1.800 5.895 1.00 12.12 H new ATOM 0 HA ALA A 425 0.815 2.860 7.954 1.00 14.01 H new ATOM 0 HB1 ALA A 425 -0.687 4.522 6.965 1.00 4.13 H new ATOM 0 HB2 ALA A 425 1.001 5.087 6.946 1.00 4.13 H new ATOM 0 HB3 ALA A 425 0.249 4.481 5.452 1.00 4.13 H new ATOM 584 N THR A 426 -1.439 2.007 6.746 1.00 20.12 N ATOM 585 CA THR A 426 -2.459 1.058 6.334 1.00 2.20 C ATOM 586 C THR A 426 -3.831 1.734 6.293 1.00 42.44 C ATOM 587 O THR A 426 -4.200 2.456 7.219 1.00 53.30 O ATOM 588 CB THR A 426 -2.403 -0.140 7.285 1.00 21.40 C ATOM 589 OG1 THR A 426 -3.119 0.295 8.437 1.00 41.43 O ATOM 590 CG2 THR A 426 -0.989 -0.409 7.805 1.00 33.42 C ATOM 0 H THR A 426 -1.775 2.762 7.344 1.00 20.12 H new ATOM 0 HA THR A 426 -2.277 0.698 5.321 1.00 2.20 H new ATOM 0 HB THR A 426 -2.777 -1.027 6.773 1.00 21.40 H new ATOM 0 HG1 THR A 426 -3.615 1.113 8.224 1.00 41.43 H new ATOM 0 HG21 THR A 426 -1.005 -1.269 8.475 1.00 33.42 H new ATOM 0 HG22 THR A 426 -0.326 -0.616 6.965 1.00 33.42 H new ATOM 0 HG23 THR A 426 -0.628 0.466 8.346 1.00 33.42 H new ATOM 598 N PHE A 427 -4.550 1.478 5.210 1.00 71.11 N ATOM 599 CA PHE A 427 -5.873 2.053 5.034 1.00 21.51 C ATOM 600 C PHE A 427 -6.957 0.981 5.159 1.00 54.43 C ATOM 601 O PHE A 427 -6.678 -0.208 5.020 1.00 10.32 O ATOM 602 CB PHE A 427 -5.919 2.649 3.626 1.00 23.32 C ATOM 603 CG PHE A 427 -7.178 3.468 3.337 1.00 4.44 C ATOM 604 CD1 PHE A 427 -7.723 4.244 4.313 1.00 1.32 C ATOM 605 CD2 PHE A 427 -7.753 3.420 2.106 1.00 31.10 C ATOM 606 CE1 PHE A 427 -8.892 5.003 4.045 1.00 15.20 C ATOM 607 CE2 PHE A 427 -8.923 4.179 1.837 1.00 65.22 C ATOM 608 CZ PHE A 427 -9.468 4.955 2.813 1.00 61.24 C ATOM 0 H PHE A 427 -4.241 0.879 4.444 1.00 71.11 H new ATOM 0 HA PHE A 427 -6.056 2.807 5.800 1.00 21.51 H new ATOM 0 HB2 PHE A 427 -5.044 3.284 3.483 1.00 23.32 H new ATOM 0 HB3 PHE A 427 -5.849 1.841 2.898 1.00 23.32 H new ATOM 0 HD1 PHE A 427 -7.266 4.282 5.291 1.00 1.32 H new ATOM 0 HD2 PHE A 427 -7.320 2.804 1.332 1.00 31.10 H new ATOM 0 HE1 PHE A 427 -9.325 5.619 4.819 1.00 15.20 H new ATOM 0 HE2 PHE A 427 -9.380 4.140 0.859 1.00 65.22 H new ATOM 0 HZ PHE A 427 -10.358 5.533 2.610 1.00 61.24 H new ATOM 617 N CYS A 428 -8.172 1.442 5.418 1.00 22.22 N ATOM 618 CA CYS A 428 -9.300 0.537 5.562 1.00 51.53 C ATOM 619 C CYS A 428 -10.291 0.822 4.431 1.00 74.41 C ATOM 620 O CYS A 428 -10.463 1.971 4.026 1.00 4.13 O ATOM 621 CB CYS A 428 -9.954 0.664 6.939 1.00 34.32 C ATOM 622 SG CYS A 428 -10.629 -0.954 7.462 1.00 24.31 S ATOM 0 H CYS A 428 -8.400 2.430 5.532 1.00 22.22 H new ATOM 0 HA CYS A 428 -8.954 -0.494 5.490 1.00 51.53 H new ATOM 0 HB2 CYS A 428 -9.223 1.015 7.667 1.00 34.32 H new ATOM 0 HB3 CYS A 428 -10.751 1.406 6.905 1.00 34.32 H new ATOM 0 HG CYS A 428 -10.593 -1.041 8.759 1.00 24.31 H new ATOM 627 N GLU A 429 -10.916 -0.243 3.952 1.00 24.24 N ATOM 628 CA GLU A 429 -11.884 -0.123 2.877 1.00 15.13 C ATOM 629 C GLU A 429 -12.736 1.134 3.068 1.00 20.12 C ATOM 630 O GLU A 429 -12.385 2.206 2.578 1.00 72.35 O ATOM 631 CB GLU A 429 -12.765 -1.372 2.788 1.00 73.14 C ATOM 632 CG GLU A 429 -12.984 -1.987 4.172 1.00 51.01 C ATOM 633 CD GLU A 429 -14.408 -2.530 4.310 1.00 14.41 C ATOM 634 OE1 GLU A 429 -15.378 -1.798 4.060 1.00 71.12 O ATOM 635 OE2 GLU A 429 -14.488 -3.760 4.691 1.00 41.41 O ATOM 0 H GLU A 429 -10.770 -1.194 4.290 1.00 24.24 H new ATOM 0 HA GLU A 429 -11.342 -0.033 1.936 1.00 15.13 H new ATOM 0 HB2 GLU A 429 -13.726 -1.113 2.345 1.00 73.14 H new ATOM 0 HB3 GLU A 429 -12.298 -2.105 2.130 1.00 73.14 H new ATOM 0 HG2 GLU A 429 -12.267 -2.791 4.334 1.00 51.01 H new ATOM 0 HG3 GLU A 429 -12.801 -1.236 4.941 1.00 51.01 H new ATOM 641 N ASP A 430 -13.839 0.961 3.780 1.00 0.11 N ATOM 642 CA ASP A 430 -14.743 2.069 4.043 1.00 32.23 C ATOM 643 C ASP A 430 -15.473 1.824 5.364 1.00 24.25 C ATOM 644 O ASP A 430 -15.352 0.751 5.955 1.00 41.02 O ATOM 645 CB ASP A 430 -15.794 2.194 2.937 1.00 5.15 C ATOM 646 CG ASP A 430 -16.183 0.877 2.262 1.00 61.42 C ATOM 647 OD1 ASP A 430 -15.420 0.323 1.458 1.00 24.33 O ATOM 648 OD2 ASP A 430 -17.340 0.414 2.597 1.00 2.21 O ATOM 0 H ASP A 430 -14.128 0.070 4.184 1.00 0.11 H new ATOM 0 HA ASP A 430 -14.153 2.984 4.086 1.00 32.23 H new ATOM 0 HB2 ASP A 430 -16.691 2.647 3.359 1.00 5.15 H new ATOM 0 HB3 ASP A 430 -15.419 2.878 2.176 1.00 5.15 H new ATOM 653 N PHE A 431 -16.216 2.834 5.788 1.00 41.45 N ATOM 654 CA PHE A 431 -16.967 2.742 7.030 1.00 73.23 C ATOM 655 C PHE A 431 -16.131 2.083 8.128 1.00 1.24 C ATOM 656 O PHE A 431 -16.672 1.419 9.011 1.00 61.11 O ATOM 657 CB PHE A 431 -18.193 1.873 6.747 1.00 43.21 C ATOM 658 CG PHE A 431 -19.293 1.985 7.806 1.00 60.22 C ATOM 659 CD1 PHE A 431 -19.664 3.206 8.273 1.00 5.33 C ATOM 660 CD2 PHE A 431 -19.898 0.862 8.279 1.00 51.31 C ATOM 661 CE1 PHE A 431 -20.685 3.309 9.257 1.00 74.02 C ATOM 662 CE2 PHE A 431 -20.918 0.966 9.261 1.00 20.14 C ATOM 663 CZ PHE A 431 -21.290 2.187 9.729 1.00 65.51 C ATOM 0 H PHE A 431 -16.315 3.721 5.294 1.00 41.45 H new ATOM 0 HA PHE A 431 -17.245 3.739 7.372 1.00 73.23 H new ATOM 0 HB2 PHE A 431 -18.607 2.151 5.777 1.00 43.21 H new ATOM 0 HB3 PHE A 431 -17.879 0.832 6.673 1.00 43.21 H new ATOM 0 HD1 PHE A 431 -19.184 4.097 7.897 1.00 5.33 H new ATOM 0 HD2 PHE A 431 -19.602 -0.108 7.908 1.00 51.31 H new ATOM 0 HE1 PHE A 431 -20.980 4.279 9.630 1.00 74.02 H new ATOM 0 HE2 PHE A 431 -21.399 0.075 9.636 1.00 20.14 H new ATOM 0 HZ PHE A 431 -22.066 2.266 10.476 1.00 65.51 H new ATOM 672 N GLN A 432 -14.825 2.287 8.037 1.00 40.12 N ATOM 673 CA GLN A 432 -13.909 1.720 9.012 1.00 72.12 C ATOM 674 C GLN A 432 -13.028 2.817 9.613 1.00 3.23 C ATOM 675 O GLN A 432 -12.163 2.539 10.444 1.00 14.42 O ATOM 676 CB GLN A 432 -13.058 0.614 8.386 1.00 21.21 C ATOM 677 CG GLN A 432 -13.876 -0.663 8.188 1.00 33.53 C ATOM 678 CD GLN A 432 -13.908 -1.497 9.469 1.00 13.35 C ATOM 679 OE1 GLN A 432 -13.420 -1.099 10.514 1.00 52.42 O ATOM 680 NE2 GLN A 432 -14.510 -2.676 9.332 1.00 51.52 N ATOM 0 H GLN A 432 -14.379 2.837 7.303 1.00 40.12 H new ATOM 0 HA GLN A 432 -14.495 1.272 9.814 1.00 72.12 H new ATOM 0 HB2 GLN A 432 -12.666 0.951 7.426 1.00 21.21 H new ATOM 0 HB3 GLN A 432 -12.200 0.405 9.025 1.00 21.21 H new ATOM 0 HG2 GLN A 432 -14.893 -0.406 7.892 1.00 33.53 H new ATOM 0 HG3 GLN A 432 -13.447 -1.252 7.377 1.00 33.53 H new ATOM 0 HE21 GLN A 432 -14.898 -2.949 8.429 1.00 51.52 H new ATOM 0 HE22 GLN A 432 -14.584 -3.307 10.130 1.00 51.52 H new ATOM 687 N VAL A 433 -13.278 4.040 9.172 1.00 52.11 N ATOM 688 CA VAL A 433 -12.519 5.181 9.655 1.00 70.55 C ATOM 689 C VAL A 433 -13.434 6.086 10.481 1.00 11.34 C ATOM 690 O VAL A 433 -14.600 5.760 10.703 1.00 3.14 O ATOM 691 CB VAL A 433 -11.860 5.908 8.481 1.00 71.34 C ATOM 692 CG1 VAL A 433 -10.466 5.344 8.199 1.00 3.14 C ATOM 693 CG2 VAL A 433 -12.741 5.841 7.232 1.00 72.43 C ATOM 0 H VAL A 433 -13.997 4.267 8.484 1.00 52.11 H new ATOM 0 HA VAL A 433 -11.712 4.852 10.309 1.00 70.55 H new ATOM 0 HB VAL A 433 -11.747 6.957 8.757 1.00 71.34 H new ATOM 0 HG11 VAL A 433 -10.020 5.878 7.360 1.00 3.14 H new ATOM 0 HG12 VAL A 433 -9.839 5.466 9.082 1.00 3.14 H new ATOM 0 HG13 VAL A 433 -10.545 4.285 7.954 1.00 3.14 H new ATOM 0 HG21 VAL A 433 -12.250 6.365 6.412 1.00 72.43 H new ATOM 0 HG22 VAL A 433 -12.899 4.799 6.954 1.00 72.43 H new ATOM 0 HG23 VAL A 433 -13.702 6.311 7.439 1.00 72.43 H new ATOM 703 N HIS A 434 -12.875 7.206 10.912 1.00 4.43 N ATOM 704 CA HIS A 434 -13.628 8.160 11.708 1.00 45.32 C ATOM 705 C HIS A 434 -14.098 9.313 10.818 1.00 20.05 C ATOM 706 O HIS A 434 -15.196 9.836 11.003 1.00 34.22 O ATOM 707 CB HIS A 434 -12.805 8.636 12.907 1.00 42.34 C ATOM 708 CG HIS A 434 -11.317 8.661 12.660 1.00 65.21 C ATOM 709 ND1 HIS A 434 -10.692 9.670 11.947 1.00 62.42 N ATOM 710 CD2 HIS A 434 -10.335 7.791 13.038 1.00 50.21 C ATOM 711 CE1 HIS A 434 -9.393 9.409 11.905 1.00 32.11 C ATOM 712 NE2 HIS A 434 -9.174 8.244 12.580 1.00 1.02 N ATOM 0 H HIS A 434 -11.909 7.475 10.725 1.00 4.43 H new ATOM 0 HA HIS A 434 -14.515 7.677 12.118 1.00 45.32 H new ATOM 0 HB2 HIS A 434 -13.133 9.637 13.185 1.00 42.34 H new ATOM 0 HB3 HIS A 434 -13.011 7.985 13.757 1.00 42.34 H new ATOM 0 HD2 HIS A 434 -10.478 6.888 13.612 1.00 50.21 H new ATOM 0 HE1 HIS A 434 -8.640 10.013 11.421 1.00 32.11 H new ATOM 0 HE2 HIS A 434 -8.268 7.795 12.711 1.00 1.02 H new ATOM 719 N GLY A 435 -13.244 9.674 9.873 1.00 71.05 N ATOM 720 CA GLY A 435 -13.558 10.756 8.954 1.00 13.15 C ATOM 721 C GLY A 435 -12.384 11.035 8.014 1.00 21.21 C ATOM 722 O GLY A 435 -12.059 10.214 7.158 1.00 23.34 O ATOM 0 H GLY A 435 -12.335 9.237 9.723 1.00 71.05 H new ATOM 0 HA2 GLY A 435 -14.442 10.498 8.371 1.00 13.15 H new ATOM 0 HA3 GLY A 435 -13.800 11.657 9.517 1.00 13.15 H new ATOM 726 N ARG A 436 -11.779 12.198 8.206 1.00 71.11 N ATOM 727 CA ARG A 436 -10.646 12.597 7.386 1.00 3.43 C ATOM 728 C ARG A 436 -9.420 12.855 8.265 1.00 34.02 C ATOM 729 O ARG A 436 -8.444 13.450 7.814 1.00 73.12 O ATOM 730 CB ARG A 436 -10.965 13.860 6.584 1.00 40.53 C ATOM 731 CG ARG A 436 -12.162 13.634 5.658 1.00 23.42 C ATOM 732 CD ARG A 436 -13.475 13.974 6.366 1.00 13.42 C ATOM 733 NE ARG A 436 -13.415 15.349 6.909 1.00 42.52 N ATOM 734 CZ ARG A 436 -13.770 16.453 6.218 1.00 31.43 C ATOM 735 NH1 ARG A 436 -14.213 16.351 4.946 1.00 2.22 N ATOM 736 NH2 ARG A 436 -13.676 17.632 6.801 1.00 3.31 N ATOM 0 H ARG A 436 -12.051 12.877 8.917 1.00 71.11 H new ATOM 0 HA ARG A 436 -10.435 11.783 6.692 1.00 3.43 H new ATOM 0 HB2 ARG A 436 -11.178 14.684 7.265 1.00 40.53 H new ATOM 0 HB3 ARG A 436 -10.095 14.151 5.995 1.00 40.53 H new ATOM 0 HG2 ARG A 436 -12.056 14.250 4.765 1.00 23.42 H new ATOM 0 HG3 ARG A 436 -12.181 12.595 5.329 1.00 23.42 H new ATOM 0 HD2 ARG A 436 -14.308 13.886 5.668 1.00 13.42 H new ATOM 0 HD3 ARG A 436 -13.658 13.263 7.172 1.00 13.42 H new ATOM 0 HE ARG A 436 -13.084 15.470 7.866 1.00 42.52 H new ATOM 0 HH11 ARG A 436 -14.281 15.435 4.502 1.00 2.22 H new ATOM 0 HH12 ARG A 436 -14.480 17.190 4.430 1.00 2.22 H new ATOM 0 HH21 ARG A 436 -13.339 17.701 7.761 1.00 3.31 H new ATOM 0 HH22 ARG A 436 -13.940 18.475 6.292 1.00 3.31 H new ATOM 746 N GLY A 437 -9.512 12.394 9.503 1.00 33.52 N ATOM 747 CA GLY A 437 -8.422 12.566 10.448 1.00 71.44 C ATOM 748 C GLY A 437 -7.124 11.962 9.906 1.00 50.25 C ATOM 749 O GLY A 437 -6.033 12.400 10.267 1.00 41.51 O ATOM 0 H GLY A 437 -10.325 11.901 9.874 1.00 33.52 H new ATOM 0 HA2 GLY A 437 -8.276 13.627 10.651 1.00 71.44 H new ATOM 0 HA3 GLY A 437 -8.680 12.093 11.395 1.00 71.44 H new ATOM 753 N GLU A 438 -7.286 10.969 9.046 1.00 21.14 N ATOM 754 CA GLU A 438 -6.141 10.301 8.449 1.00 23.12 C ATOM 755 C GLU A 438 -6.097 10.567 6.943 1.00 4.23 C ATOM 756 O GLU A 438 -5.385 11.462 6.489 1.00 43.21 O ATOM 757 CB GLU A 438 -6.170 8.799 8.740 1.00 40.34 C ATOM 758 CG GLU A 438 -7.592 8.329 9.054 1.00 22.33 C ATOM 759 CD GLU A 438 -7.674 6.800 9.062 1.00 0.41 C ATOM 760 OE1 GLU A 438 -7.804 6.192 10.134 1.00 65.01 O ATOM 761 OE2 GLU A 438 -7.599 6.244 7.900 1.00 30.35 O ATOM 0 H GLU A 438 -8.193 10.610 8.747 1.00 21.14 H new ATOM 0 HA GLU A 438 -5.234 10.707 8.896 1.00 23.12 H new ATOM 0 HB2 GLU A 438 -5.783 8.251 7.881 1.00 40.34 H new ATOM 0 HB3 GLU A 438 -5.515 8.575 9.582 1.00 40.34 H new ATOM 0 HG2 GLU A 438 -7.902 8.719 10.024 1.00 22.33 H new ATOM 0 HG3 GLU A 438 -8.284 8.730 8.313 1.00 22.33 H new ATOM 767 N LEU A 439 -6.864 9.774 6.212 1.00 15.30 N ATOM 768 CA LEU A 439 -6.922 9.912 4.766 1.00 62.32 C ATOM 769 C LEU A 439 -8.383 10.018 4.325 1.00 64.43 C ATOM 770 O LEU A 439 -9.231 9.255 4.787 1.00 74.35 O ATOM 771 CB LEU A 439 -6.155 8.776 4.089 1.00 32.11 C ATOM 772 CG LEU A 439 -6.933 7.475 3.878 1.00 72.13 C ATOM 773 CD1 LEU A 439 -7.946 7.621 2.739 1.00 22.14 C ATOM 774 CD2 LEU A 439 -5.982 6.297 3.652 1.00 12.12 C ATOM 0 H LEU A 439 -7.452 9.033 6.593 1.00 15.30 H new ATOM 0 HA LEU A 439 -6.428 10.831 4.451 1.00 62.32 H new ATOM 0 HB2 LEU A 439 -5.805 9.128 3.119 1.00 32.11 H new ATOM 0 HB3 LEU A 439 -5.270 8.555 4.686 1.00 32.11 H new ATOM 0 HG LEU A 439 -7.497 7.263 4.786 1.00 72.13 H new ATOM 0 HD11 LEU A 439 -8.486 6.683 2.609 1.00 22.14 H new ATOM 0 HD12 LEU A 439 -8.652 8.416 2.980 1.00 22.14 H new ATOM 0 HD13 LEU A 439 -7.422 7.869 1.816 1.00 22.14 H new ATOM 0 HD21 LEU A 439 -6.561 5.385 3.505 1.00 12.12 H new ATOM 0 HD22 LEU A 439 -5.372 6.486 2.769 1.00 12.12 H new ATOM 0 HD23 LEU A 439 -5.335 6.180 4.521 1.00 12.12 H new ATOM 785 N SER A 440 -8.633 10.970 3.438 1.00 65.02 N ATOM 786 CA SER A 440 -9.976 11.185 2.930 1.00 50.45 C ATOM 787 C SER A 440 -10.330 10.102 1.908 1.00 61.22 C ATOM 788 O SER A 440 -11.473 9.657 1.840 1.00 12.15 O ATOM 789 CB SER A 440 -10.112 12.573 2.300 1.00 44.35 C ATOM 790 OG SER A 440 -9.882 13.613 3.248 1.00 52.14 O ATOM 0 H SER A 440 -7.927 11.601 3.058 1.00 65.02 H new ATOM 0 HA SER A 440 -10.671 11.126 3.768 1.00 50.45 H new ATOM 0 HB2 SER A 440 -9.404 12.669 1.477 1.00 44.35 H new ATOM 0 HB3 SER A 440 -11.110 12.683 1.876 1.00 44.35 H new ATOM 0 HG SER A 440 -9.976 14.484 2.808 1.00 52.14 H new ATOM 795 N CYS A 441 -9.325 9.712 1.138 1.00 22.21 N ATOM 796 CA CYS A 441 -9.514 8.690 0.122 1.00 3.25 C ATOM 797 C CYS A 441 -8.149 8.092 -0.219 1.00 62.34 C ATOM 798 O CYS A 441 -7.124 8.761 -0.085 1.00 60.51 O ATOM 799 CB CYS A 441 -10.220 9.247 -1.116 1.00 33.21 C ATOM 800 SG CYS A 441 -9.302 10.692 -1.763 1.00 65.20 S ATOM 0 H CYS A 441 -8.377 10.085 1.197 1.00 22.21 H new ATOM 0 HA CYS A 441 -10.165 7.906 0.508 1.00 3.25 H new ATOM 0 HB2 CYS A 441 -10.289 8.476 -1.883 1.00 33.21 H new ATOM 0 HB3 CYS A 441 -11.240 9.537 -0.864 1.00 33.21 H new ATOM 0 HG CYS A 441 -8.274 10.929 -1.003 1.00 65.20 H new ATOM 805 N LEU A 442 -8.176 6.842 -0.655 1.00 31.13 N ATOM 806 CA LEU A 442 -6.952 6.148 -1.017 1.00 34.22 C ATOM 807 C LEU A 442 -6.178 6.984 -2.038 1.00 54.42 C ATOM 808 O LEU A 442 -4.949 6.993 -2.034 1.00 54.00 O ATOM 809 CB LEU A 442 -7.262 4.728 -1.495 1.00 10.43 C ATOM 810 CG LEU A 442 -7.018 4.450 -2.979 1.00 44.24 C ATOM 811 CD1 LEU A 442 -6.947 2.947 -3.252 1.00 42.40 C ATOM 812 CD2 LEU A 442 -8.072 5.141 -3.847 1.00 64.32 C ATOM 0 H LEU A 442 -9.027 6.291 -0.766 1.00 31.13 H new ATOM 0 HA LEU A 442 -6.308 6.033 -0.145 1.00 34.22 H new ATOM 0 HB2 LEU A 442 -6.661 4.031 -0.912 1.00 10.43 H new ATOM 0 HB3 LEU A 442 -8.307 4.511 -1.272 1.00 10.43 H new ATOM 0 HG LEU A 442 -6.050 4.872 -3.250 1.00 44.24 H new ATOM 0 HD11 LEU A 442 -6.773 2.778 -4.315 1.00 42.40 H new ATOM 0 HD12 LEU A 442 -6.130 2.511 -2.677 1.00 42.40 H new ATOM 0 HD13 LEU A 442 -7.887 2.479 -2.960 1.00 42.40 H new ATOM 0 HD21 LEU A 442 -7.875 4.927 -4.898 1.00 64.32 H new ATOM 0 HD22 LEU A 442 -9.062 4.771 -3.581 1.00 64.32 H new ATOM 0 HD23 LEU A 442 -8.030 6.218 -3.682 1.00 64.32 H new ATOM 823 N GLN A 443 -6.932 7.668 -2.887 1.00 12.31 N ATOM 824 CA GLN A 443 -6.333 8.506 -3.912 1.00 30.31 C ATOM 825 C GLN A 443 -5.217 9.362 -3.312 1.00 23.40 C ATOM 826 O GLN A 443 -4.274 9.736 -4.008 1.00 63.24 O ATOM 827 CB GLN A 443 -7.388 9.380 -4.591 1.00 11.53 C ATOM 828 CG GLN A 443 -8.650 8.572 -4.907 1.00 30.31 C ATOM 829 CD GLN A 443 -9.451 9.225 -6.035 1.00 43.35 C ATOM 830 OE1 GLN A 443 -10.632 9.505 -5.910 1.00 44.31 O ATOM 831 NE2 GLN A 443 -8.747 9.452 -7.140 1.00 30.20 N ATOM 0 H GLN A 443 -7.952 7.659 -2.886 1.00 12.31 H new ATOM 0 HA GLN A 443 -5.899 7.859 -4.674 1.00 30.31 H new ATOM 0 HB2 GLN A 443 -7.642 10.219 -3.943 1.00 11.53 H new ATOM 0 HB3 GLN A 443 -6.981 9.799 -5.511 1.00 11.53 H new ATOM 0 HG2 GLN A 443 -8.374 7.557 -5.193 1.00 30.31 H new ATOM 0 HG3 GLN A 443 -9.270 8.495 -4.014 1.00 30.31 H new ATOM 0 HE21 GLN A 443 -7.761 9.193 -7.179 1.00 30.20 H new ATOM 0 HE22 GLN A 443 -9.193 9.885 -7.949 1.00 30.20 H new ATOM 838 N ASP A 444 -5.359 9.646 -2.026 1.00 20.02 N ATOM 839 CA ASP A 444 -4.373 10.451 -1.324 1.00 53.45 C ATOM 840 C ASP A 444 -3.086 9.642 -1.155 1.00 24.03 C ATOM 841 O ASP A 444 -1.989 10.171 -1.321 1.00 72.01 O ATOM 842 CB ASP A 444 -4.872 10.842 0.069 1.00 10.21 C ATOM 843 CG ASP A 444 -5.805 12.054 0.105 1.00 12.11 C ATOM 844 OD1 ASP A 444 -6.697 12.198 -0.745 1.00 42.42 O ATOM 845 OD2 ASP A 444 -5.587 12.882 1.069 1.00 72.20 O ATOM 0 H ASP A 444 -6.142 9.333 -1.451 1.00 20.02 H new ATOM 0 HA ASP A 444 -4.195 11.353 -1.910 1.00 53.45 H new ATOM 0 HB2 ASP A 444 -5.392 9.989 0.505 1.00 10.21 H new ATOM 0 HB3 ASP A 444 -4.010 11.047 0.703 1.00 10.21 H new ATOM 850 N ALA A 445 -3.264 8.370 -0.827 1.00 41.34 N ATOM 851 CA ALA A 445 -2.131 7.483 -0.633 1.00 61.31 C ATOM 852 C ALA A 445 -1.529 7.127 -1.994 1.00 70.22 C ATOM 853 O ALA A 445 -0.514 6.435 -2.067 1.00 52.42 O ATOM 854 CB ALA A 445 -2.579 6.245 0.147 1.00 22.31 C ATOM 0 H ALA A 445 -4.176 7.934 -0.691 1.00 41.34 H new ATOM 0 HA ALA A 445 -1.355 7.975 -0.047 1.00 61.31 H new ATOM 0 HB1 ALA A 445 -1.728 5.579 0.293 1.00 22.31 H new ATOM 0 HB2 ALA A 445 -2.972 6.549 1.117 1.00 22.31 H new ATOM 0 HB3 ALA A 445 -3.356 5.724 -0.412 1.00 22.31 H new ATOM 860 N ILE A 446 -2.180 7.614 -3.040 1.00 44.45 N ATOM 861 CA ILE A 446 -1.722 7.358 -4.394 1.00 22.31 C ATOM 862 C ILE A 446 -0.727 8.444 -4.806 1.00 34.53 C ATOM 863 O ILE A 446 0.268 8.158 -5.471 1.00 43.04 O ATOM 864 CB ILE A 446 -2.913 7.221 -5.345 1.00 74.32 C ATOM 865 CG1 ILE A 446 -3.396 5.771 -5.416 1.00 74.41 C ATOM 866 CG2 ILE A 446 -2.576 7.781 -6.728 1.00 14.53 C ATOM 867 CD1 ILE A 446 -4.667 5.656 -6.260 1.00 42.42 C ATOM 0 H ILE A 446 -3.022 8.185 -2.976 1.00 44.45 H new ATOM 0 HA ILE A 446 -1.193 6.406 -4.444 1.00 22.31 H new ATOM 0 HB ILE A 446 -3.737 7.814 -4.948 1.00 74.32 H new ATOM 0 HG12 ILE A 446 -2.614 5.144 -5.844 1.00 74.41 H new ATOM 0 HG13 ILE A 446 -3.589 5.399 -4.410 1.00 74.41 H new ATOM 0 HG21 ILE A 446 -3.439 7.672 -7.385 1.00 14.53 H new ATOM 0 HG22 ILE A 446 -2.318 8.836 -6.640 1.00 14.53 H new ATOM 0 HG23 ILE A 446 -1.730 7.235 -7.146 1.00 14.53 H new ATOM 0 HD11 ILE A 446 -4.988 4.615 -6.294 1.00 42.42 H new ATOM 0 HD12 ILE A 446 -5.455 6.265 -5.816 1.00 42.42 H new ATOM 0 HD13 ILE A 446 -4.465 6.006 -7.272 1.00 42.42 H new ATOM 878 N ASP A 447 -1.030 9.667 -4.396 1.00 25.05 N ATOM 879 CA ASP A 447 -0.173 10.797 -4.714 1.00 14.33 C ATOM 880 C ASP A 447 0.622 11.194 -3.470 1.00 2.42 C ATOM 881 O ASP A 447 1.538 12.010 -3.549 1.00 63.02 O ATOM 882 CB ASP A 447 -1.000 12.006 -5.153 1.00 53.15 C ATOM 883 CG ASP A 447 -2.235 12.292 -4.297 1.00 4.51 C ATOM 884 OD1 ASP A 447 -2.386 11.747 -3.192 1.00 13.01 O ATOM 885 OD2 ASP A 447 -3.077 13.123 -4.812 1.00 63.12 O ATOM 0 H ASP A 447 -1.857 9.900 -3.846 1.00 25.05 H new ATOM 0 HA ASP A 447 0.491 10.500 -5.525 1.00 14.33 H new ATOM 0 HB2 ASP A 447 -0.359 12.888 -5.145 1.00 53.15 H new ATOM 0 HB3 ASP A 447 -1.319 11.854 -6.184 1.00 53.15 H new ATOM 890 N HIS A 448 0.243 10.599 -2.348 1.00 21.24 N ATOM 891 CA HIS A 448 0.910 10.881 -1.089 1.00 43.02 C ATOM 892 C HIS A 448 1.615 9.619 -0.588 1.00 25.11 C ATOM 893 O HIS A 448 1.770 9.426 0.618 1.00 21.51 O ATOM 894 CB HIS A 448 -0.076 11.454 -0.068 1.00 5.21 C ATOM 895 CG HIS A 448 -1.023 12.481 -0.639 1.00 50.33 C ATOM 896 ND1 HIS A 448 -2.233 12.797 -0.046 1.00 40.22 N ATOM 897 CD2 HIS A 448 -0.924 13.262 -1.754 1.00 5.13 C ATOM 898 CE1 HIS A 448 -2.828 13.725 -0.780 1.00 50.54 C ATOM 899 NE2 HIS A 448 -2.017 14.012 -1.838 1.00 25.20 N ATOM 0 H HIS A 448 -0.518 9.923 -2.285 1.00 21.24 H new ATOM 0 HA HIS A 448 1.672 11.646 -1.240 1.00 43.02 H new ATOM 0 HB2 HIS A 448 -0.657 10.637 0.359 1.00 5.21 H new ATOM 0 HB3 HIS A 448 0.485 11.907 0.749 1.00 5.21 H new ATOM 0 HD2 HIS A 448 -0.098 13.269 -2.449 1.00 5.13 H new ATOM 0 HE1 HIS A 448 -3.788 14.176 -0.576 1.00 50.54 H new ATOM 0 HE2 HIS A 448 -2.217 14.691 -2.573 1.00 25.20 H new ATOM 906 N SER A 449 2.024 8.792 -1.538 1.00 11.15 N ATOM 907 CA SER A 449 2.710 7.554 -1.209 1.00 65.22 C ATOM 908 C SER A 449 3.459 7.027 -2.436 1.00 41.20 C ATOM 909 O SER A 449 3.145 7.400 -3.565 1.00 31.02 O ATOM 910 CB SER A 449 1.728 6.500 -0.694 1.00 13.52 C ATOM 911 OG SER A 449 2.248 5.785 0.423 1.00 42.41 O ATOM 0 H SER A 449 1.894 8.955 -2.536 1.00 11.15 H new ATOM 0 HA SER A 449 3.428 7.762 -0.415 1.00 65.22 H new ATOM 0 HB2 SER A 449 0.793 6.984 -0.411 1.00 13.52 H new ATOM 0 HB3 SER A 449 1.495 5.800 -1.496 1.00 13.52 H new ATOM 0 HG SER A 449 1.535 5.641 1.080 1.00 42.41 H new ATOM 916 N ALA A 450 4.432 6.170 -2.172 1.00 22.31 N ATOM 917 CA ALA A 450 5.229 5.589 -3.239 1.00 13.13 C ATOM 918 C ALA A 450 4.345 4.670 -4.086 1.00 1.21 C ATOM 919 O ALA A 450 3.997 5.007 -5.216 1.00 15.05 O ATOM 920 CB ALA A 450 6.429 4.854 -2.641 1.00 25.21 C ATOM 0 H ALA A 450 4.688 5.863 -1.234 1.00 22.31 H new ATOM 0 HA ALA A 450 5.619 6.368 -3.894 1.00 13.13 H new ATOM 0 HB1 ALA A 450 7.026 4.419 -3.443 1.00 25.21 H new ATOM 0 HB2 ALA A 450 7.040 5.556 -2.074 1.00 25.21 H new ATOM 0 HB3 ALA A 450 6.078 4.062 -1.979 1.00 25.21 H new ATOM 926 N PHE A 451 4.006 3.529 -3.506 1.00 25.52 N ATOM 927 CA PHE A 451 3.170 2.558 -4.192 1.00 61.01 C ATOM 928 C PHE A 451 2.066 2.037 -3.270 1.00 1.11 C ATOM 929 O PHE A 451 2.317 1.732 -2.105 1.00 51.54 O ATOM 930 CB PHE A 451 4.074 1.392 -4.594 1.00 61.20 C ATOM 931 CG PHE A 451 5.393 1.822 -5.241 1.00 52.14 C ATOM 932 CD1 PHE A 451 6.440 2.202 -4.461 1.00 63.31 C ATOM 933 CD2 PHE A 451 5.517 1.825 -6.595 1.00 64.40 C ATOM 934 CE1 PHE A 451 7.664 2.602 -5.061 1.00 61.40 C ATOM 935 CE2 PHE A 451 6.741 2.224 -7.195 1.00 23.41 C ATOM 936 CZ PHE A 451 7.789 2.604 -6.414 1.00 13.13 C ATOM 0 H PHE A 451 4.295 3.254 -2.567 1.00 25.52 H new ATOM 0 HA PHE A 451 2.696 3.022 -5.057 1.00 61.01 H new ATOM 0 HB2 PHE A 451 4.293 0.794 -3.710 1.00 61.20 H new ATOM 0 HB3 PHE A 451 3.533 0.749 -5.288 1.00 61.20 H new ATOM 0 HD1 PHE A 451 6.341 2.200 -3.386 1.00 63.31 H new ATOM 0 HD2 PHE A 451 4.685 1.524 -7.214 1.00 64.40 H new ATOM 0 HE1 PHE A 451 8.495 2.905 -4.442 1.00 61.40 H new ATOM 0 HE2 PHE A 451 6.840 2.226 -8.270 1.00 23.41 H new ATOM 0 HZ PHE A 451 8.720 2.907 -6.870 1.00 13.13 H new ATOM 945 N ILE A 452 0.867 1.949 -3.827 1.00 70.21 N ATOM 946 CA ILE A 452 -0.277 1.469 -3.069 1.00 35.20 C ATOM 947 C ILE A 452 -0.106 -0.024 -2.786 1.00 21.20 C ATOM 948 O ILE A 452 0.149 -0.808 -3.700 1.00 63.11 O ATOM 949 CB ILE A 452 -1.581 1.812 -3.793 1.00 52.13 C ATOM 950 CG1 ILE A 452 -1.667 3.311 -4.086 1.00 15.20 C ATOM 951 CG2 ILE A 452 -2.793 1.312 -3.005 1.00 3.54 C ATOM 952 CD1 ILE A 452 -1.745 4.120 -2.789 1.00 32.01 C ATOM 0 H ILE A 452 0.663 2.202 -4.794 1.00 70.21 H new ATOM 0 HA ILE A 452 -0.333 1.972 -2.104 1.00 35.20 H new ATOM 0 HB ILE A 452 -1.585 1.295 -4.753 1.00 52.13 H new ATOM 0 HG12 ILE A 452 -0.796 3.623 -4.662 1.00 15.20 H new ATOM 0 HG13 ILE A 452 -2.544 3.515 -4.700 1.00 15.20 H new ATOM 0 HG21 ILE A 452 -3.707 1.569 -3.541 1.00 3.54 H new ATOM 0 HG22 ILE A 452 -2.731 0.230 -2.890 1.00 3.54 H new ATOM 0 HG23 ILE A 452 -2.806 1.781 -2.021 1.00 3.54 H new ATOM 0 HD11 ILE A 452 -1.805 5.182 -3.026 1.00 32.01 H new ATOM 0 HD12 ILE A 452 -2.631 3.823 -2.227 1.00 32.01 H new ATOM 0 HD13 ILE A 452 -0.855 3.932 -2.189 1.00 32.01 H new ATOM 963 N ILE A 453 -0.252 -0.373 -1.517 1.00 14.02 N ATOM 964 CA ILE A 453 -0.117 -1.759 -1.102 1.00 44.20 C ATOM 965 C ILE A 453 -1.499 -2.324 -0.764 1.00 62.45 C ATOM 966 O ILE A 453 -2.199 -1.787 0.094 1.00 41.31 O ATOM 967 CB ILE A 453 0.892 -1.880 0.041 1.00 60.41 C ATOM 968 CG1 ILE A 453 2.293 -1.469 -0.418 1.00 51.32 C ATOM 969 CG2 ILE A 453 0.876 -3.288 0.640 1.00 44.11 C ATOM 970 CD1 ILE A 453 3.262 -1.408 0.763 1.00 5.11 C ATOM 0 H ILE A 453 -0.462 0.280 -0.762 1.00 14.02 H new ATOM 0 HA ILE A 453 0.284 -2.362 -1.916 1.00 44.20 H new ATOM 0 HB ILE A 453 0.596 -1.190 0.831 1.00 60.41 H new ATOM 0 HG12 ILE A 453 2.660 -2.180 -1.158 1.00 51.32 H new ATOM 0 HG13 ILE A 453 2.248 -0.496 -0.907 1.00 51.32 H new ATOM 0 HG21 ILE A 453 1.602 -3.347 1.451 1.00 44.11 H new ATOM 0 HG22 ILE A 453 -0.119 -3.507 1.028 1.00 44.11 H new ATOM 0 HG23 ILE A 453 1.133 -4.014 -0.131 1.00 44.11 H new ATOM 0 HD11 ILE A 453 4.250 -1.114 0.408 1.00 5.11 H new ATOM 0 HD12 ILE A 453 2.905 -0.678 1.489 1.00 5.11 H new ATOM 0 HD13 ILE A 453 3.323 -2.389 1.234 1.00 5.11 H new ATOM 981 N LEU A 454 -1.850 -3.397 -1.455 1.00 61.42 N ATOM 982 CA LEU A 454 -3.135 -4.040 -1.240 1.00 60.13 C ATOM 983 C LEU A 454 -2.918 -5.383 -0.539 1.00 1.12 C ATOM 984 O LEU A 454 -2.489 -6.351 -1.164 1.00 42.30 O ATOM 985 CB LEU A 454 -3.905 -4.151 -2.557 1.00 10.51 C ATOM 986 CG LEU A 454 -4.070 -2.853 -3.350 1.00 71.40 C ATOM 987 CD1 LEU A 454 -4.878 -1.824 -2.558 1.00 12.30 C ATOM 988 CD2 LEU A 454 -2.710 -2.301 -3.785 1.00 64.43 C ATOM 0 H LEU A 454 -1.266 -3.838 -2.166 1.00 61.42 H new ATOM 0 HA LEU A 454 -3.759 -3.434 -0.583 1.00 60.13 H new ATOM 0 HB2 LEU A 454 -3.398 -4.879 -3.191 1.00 10.51 H new ATOM 0 HB3 LEU A 454 -4.896 -4.551 -2.343 1.00 10.51 H new ATOM 0 HG LEU A 454 -4.634 -3.076 -4.256 1.00 71.40 H new ATOM 0 HD11 LEU A 454 -4.980 -0.911 -3.145 1.00 12.30 H new ATOM 0 HD12 LEU A 454 -5.867 -2.228 -2.340 1.00 12.30 H new ATOM 0 HD13 LEU A 454 -4.364 -1.599 -1.624 1.00 12.30 H new ATOM 0 HD21 LEU A 454 -2.855 -1.378 -4.347 1.00 64.43 H new ATOM 0 HD22 LEU A 454 -2.101 -2.098 -2.904 1.00 64.43 H new ATOM 0 HD23 LEU A 454 -2.204 -3.033 -4.414 1.00 64.43 H new ATOM 999 N LEU A 455 -3.223 -5.397 0.751 1.00 74.24 N ATOM 1000 CA LEU A 455 -3.067 -6.605 1.543 1.00 53.03 C ATOM 1001 C LEU A 455 -4.099 -7.640 1.095 1.00 10.25 C ATOM 1002 O LEU A 455 -5.132 -7.814 1.742 1.00 23.34 O ATOM 1003 CB LEU A 455 -3.132 -6.278 3.036 1.00 43.22 C ATOM 1004 CG LEU A 455 -2.298 -7.172 3.956 1.00 44.01 C ATOM 1005 CD1 LEU A 455 -0.889 -7.373 3.394 1.00 13.10 C ATOM 1006 CD2 LEU A 455 -2.271 -6.619 5.382 1.00 34.14 C ATOM 0 H LEU A 455 -3.577 -4.591 1.267 1.00 74.24 H new ATOM 0 HA LEU A 455 -2.083 -7.044 1.379 1.00 53.03 H new ATOM 0 HB2 LEU A 455 -2.810 -5.246 3.176 1.00 43.22 H new ATOM 0 HB3 LEU A 455 -4.173 -6.333 3.355 1.00 43.22 H new ATOM 0 HG LEU A 455 -2.772 -8.153 4.000 1.00 44.01 H new ATOM 0 HD11 LEU A 455 -0.317 -8.012 4.067 1.00 13.10 H new ATOM 0 HD12 LEU A 455 -0.952 -7.843 2.413 1.00 13.10 H new ATOM 0 HD13 LEU A 455 -0.393 -6.407 3.302 1.00 13.10 H new ATOM 0 HD21 LEU A 455 -1.672 -7.273 6.015 1.00 34.14 H new ATOM 0 HD22 LEU A 455 -1.835 -5.620 5.377 1.00 34.14 H new ATOM 0 HD23 LEU A 455 -3.288 -6.569 5.772 1.00 34.14 H new ATOM 1017 N LEU A 456 -3.786 -8.303 -0.008 1.00 34.45 N ATOM 1018 CA LEU A 456 -4.673 -9.317 -0.552 1.00 4.23 C ATOM 1019 C LEU A 456 -4.779 -10.478 0.440 1.00 11.55 C ATOM 1020 O LEU A 456 -3.992 -11.421 0.383 1.00 30.22 O ATOM 1021 CB LEU A 456 -4.213 -9.740 -1.948 1.00 3.45 C ATOM 1022 CG LEU A 456 -3.921 -8.606 -2.930 1.00 73.12 C ATOM 1023 CD1 LEU A 456 -3.924 -9.114 -4.373 1.00 1.34 C ATOM 1024 CD2 LEU A 456 -4.895 -7.442 -2.731 1.00 21.31 C ATOM 0 H LEU A 456 -2.929 -8.157 -0.541 1.00 34.45 H new ATOM 0 HA LEU A 456 -5.678 -8.915 -0.683 1.00 4.23 H new ATOM 0 HB2 LEU A 456 -3.312 -10.345 -1.844 1.00 3.45 H new ATOM 0 HB3 LEU A 456 -4.980 -10.382 -2.382 1.00 3.45 H new ATOM 0 HG LEU A 456 -2.920 -8.227 -2.724 1.00 73.12 H new ATOM 0 HD11 LEU A 456 -3.714 -8.286 -5.051 1.00 1.34 H new ATOM 0 HD12 LEU A 456 -3.159 -9.882 -4.490 1.00 1.34 H new ATOM 0 HD13 LEU A 456 -4.901 -9.536 -4.608 1.00 1.34 H new ATOM 0 HD21 LEU A 456 -4.665 -6.649 -3.443 1.00 21.31 H new ATOM 0 HD22 LEU A 456 -5.915 -7.790 -2.893 1.00 21.31 H new ATOM 0 HD23 LEU A 456 -4.800 -7.057 -1.716 1.00 21.31 H new ATOM 1035 N THR A 457 -5.760 -10.371 1.325 1.00 3.10 N ATOM 1036 CA THR A 457 -5.980 -11.401 2.327 1.00 75.14 C ATOM 1037 C THR A 457 -7.429 -11.887 2.282 1.00 62.10 C ATOM 1038 O THR A 457 -8.316 -11.169 1.823 1.00 75.42 O ATOM 1039 CB THR A 457 -5.570 -10.832 3.687 1.00 55.42 C ATOM 1040 OG1 THR A 457 -6.655 -9.979 4.046 1.00 52.04 O ATOM 1041 CG2 THR A 457 -4.371 -9.887 3.590 1.00 51.01 C ATOM 0 H THR A 457 -6.411 -9.587 1.369 1.00 3.10 H new ATOM 0 HA THR A 457 -5.369 -12.282 2.130 1.00 75.14 H new ATOM 0 HB THR A 457 -5.332 -11.651 4.366 1.00 55.42 H new ATOM 0 HG1 THR A 457 -6.553 -9.695 4.978 1.00 52.04 H new ATOM 0 HG21 THR A 457 -4.122 -9.512 4.583 1.00 51.01 H new ATOM 0 HG22 THR A 457 -3.516 -10.425 3.180 1.00 51.01 H new ATOM 0 HG23 THR A 457 -4.619 -9.050 2.938 1.00 51.01 H new ATOM 1049 N SER A 458 -7.626 -13.105 2.766 1.00 4.33 N ATOM 1050 CA SER A 458 -8.953 -13.697 2.788 1.00 63.43 C ATOM 1051 C SER A 458 -9.871 -12.888 3.707 1.00 30.02 C ATOM 1052 O SER A 458 -11.087 -13.078 3.700 1.00 34.23 O ATOM 1053 CB SER A 458 -8.898 -15.157 3.243 1.00 50.45 C ATOM 1054 OG SER A 458 -10.163 -15.802 3.118 1.00 65.15 O ATOM 0 H SER A 458 -6.888 -13.698 3.146 1.00 4.33 H new ATOM 0 HA SER A 458 -9.354 -13.676 1.775 1.00 63.43 H new ATOM 0 HB2 SER A 458 -8.157 -15.694 2.651 1.00 50.45 H new ATOM 0 HB3 SER A 458 -8.569 -15.201 4.281 1.00 50.45 H new ATOM 0 HG SER A 458 -10.879 -15.146 3.248 1.00 65.15 H new ATOM 1059 N ASN A 459 -9.255 -12.004 4.476 1.00 73.03 N ATOM 1060 CA ASN A 459 -10.002 -11.165 5.399 1.00 65.21 C ATOM 1061 C ASN A 459 -10.258 -9.803 4.751 1.00 71.13 C ATOM 1062 O ASN A 459 -11.093 -9.034 5.225 1.00 63.30 O ATOM 1063 CB ASN A 459 -9.216 -10.932 6.692 1.00 33.34 C ATOM 1064 CG ASN A 459 -9.271 -12.167 7.596 1.00 60.44 C ATOM 1065 OD1 ASN A 459 -8.811 -13.243 7.250 1.00 71.41 O ATOM 1066 ND2 ASN A 459 -9.856 -11.952 8.769 1.00 45.44 N ATOM 0 H ASN A 459 -8.247 -11.850 4.480 1.00 73.03 H new ATOM 0 HA ASN A 459 -10.938 -11.672 5.632 1.00 65.21 H new ATOM 0 HB2 ASN A 459 -8.179 -10.697 6.454 1.00 33.34 H new ATOM 0 HB3 ASN A 459 -9.625 -10.071 7.221 1.00 33.34 H new ATOM 0 HD21 ASN A 459 -9.941 -12.713 9.443 1.00 45.44 H new ATOM 0 HD22 ASN A 459 -10.220 -11.026 8.995 1.00 45.44 H new ATOM 1072 N PHE A 460 -9.524 -9.547 3.677 1.00 2.21 N ATOM 1073 CA PHE A 460 -9.662 -8.291 2.960 1.00 13.24 C ATOM 1074 C PHE A 460 -10.192 -8.525 1.544 1.00 40.42 C ATOM 1075 O PHE A 460 -10.312 -9.667 1.103 1.00 55.43 O ATOM 1076 CB PHE A 460 -8.266 -7.670 2.874 1.00 54.53 C ATOM 1077 CG PHE A 460 -8.231 -6.318 2.158 1.00 42.23 C ATOM 1078 CD1 PHE A 460 -8.915 -5.259 2.670 1.00 63.41 C ATOM 1079 CD2 PHE A 460 -7.515 -6.175 1.011 1.00 71.33 C ATOM 1080 CE1 PHE A 460 -8.880 -4.004 2.006 1.00 12.53 C ATOM 1081 CE2 PHE A 460 -7.482 -4.919 0.347 1.00 24.32 C ATOM 1082 CZ PHE A 460 -8.165 -3.861 0.858 1.00 5.03 C ATOM 0 H PHE A 460 -8.833 -10.188 3.287 1.00 2.21 H new ATOM 0 HA PHE A 460 -10.365 -7.640 3.480 1.00 13.24 H new ATOM 0 HB2 PHE A 460 -7.872 -7.546 3.883 1.00 54.53 H new ATOM 0 HB3 PHE A 460 -7.603 -8.362 2.355 1.00 54.53 H new ATOM 0 HD1 PHE A 460 -9.484 -5.373 3.581 1.00 63.41 H new ATOM 0 HD2 PHE A 460 -6.972 -7.015 0.605 1.00 71.33 H new ATOM 0 HE1 PHE A 460 -9.421 -3.163 2.413 1.00 12.53 H new ATOM 0 HE2 PHE A 460 -6.914 -4.805 -0.564 1.00 24.32 H new ATOM 0 HZ PHE A 460 -8.140 -2.907 0.353 1.00 5.03 H new ATOM 1091 N ASP A 461 -10.493 -7.424 0.870 1.00 11.34 N ATOM 1092 CA ASP A 461 -11.006 -7.494 -0.488 1.00 22.31 C ATOM 1093 C ASP A 461 -9.992 -6.866 -1.446 1.00 65.33 C ATOM 1094 O ASP A 461 -9.490 -5.771 -1.194 1.00 15.42 O ATOM 1095 CB ASP A 461 -12.321 -6.723 -0.620 1.00 0.24 C ATOM 1096 CG ASP A 461 -13.276 -6.863 0.567 1.00 22.23 C ATOM 1097 OD1 ASP A 461 -12.998 -6.369 1.671 1.00 24.21 O ATOM 1098 OD2 ASP A 461 -14.358 -7.521 0.322 1.00 24.40 O ATOM 0 H ASP A 461 -10.391 -6.479 1.239 1.00 11.34 H new ATOM 0 HA ASP A 461 -11.176 -8.543 -0.730 1.00 22.31 H new ATOM 0 HB2 ASP A 461 -12.092 -5.666 -0.760 1.00 0.24 H new ATOM 0 HB3 ASP A 461 -12.834 -7.061 -1.521 1.00 0.24 H new ATOM 1103 N CYS A 462 -9.719 -7.588 -2.523 1.00 25.01 N ATOM 1104 CA CYS A 462 -8.773 -7.115 -3.519 1.00 21.32 C ATOM 1105 C CYS A 462 -9.552 -6.385 -4.614 1.00 12.53 C ATOM 1106 O CYS A 462 -9.131 -5.328 -5.082 1.00 42.11 O ATOM 1107 CB CYS A 462 -7.928 -8.260 -4.086 1.00 51.45 C ATOM 1108 SG CYS A 462 -9.010 -9.489 -4.905 1.00 42.35 S ATOM 0 H CYS A 462 -10.136 -8.496 -2.727 1.00 25.01 H new ATOM 0 HA CYS A 462 -8.068 -6.425 -3.055 1.00 21.32 H new ATOM 0 HB2 CYS A 462 -7.203 -7.869 -4.799 1.00 51.45 H new ATOM 0 HB3 CYS A 462 -7.363 -8.737 -3.285 1.00 51.45 H new ATOM 0 HG CYS A 462 -8.361 -10.605 -5.057 1.00 42.35 H new ATOM 1113 N ARG A 463 -10.676 -6.977 -4.992 1.00 63.13 N ATOM 1114 CA ARG A 463 -11.518 -6.395 -6.022 1.00 14.41 C ATOM 1115 C ARG A 463 -11.793 -4.922 -5.716 1.00 63.42 C ATOM 1116 O ARG A 463 -11.881 -4.100 -6.627 1.00 11.11 O ATOM 1117 CB ARG A 463 -12.849 -7.142 -6.131 1.00 14.32 C ATOM 1118 CG ARG A 463 -12.639 -8.565 -6.658 1.00 53.45 C ATOM 1119 CD ARG A 463 -12.808 -8.616 -8.178 1.00 53.31 C ATOM 1120 NE ARG A 463 -14.237 -8.471 -8.533 1.00 4.24 N ATOM 1121 CZ ARG A 463 -15.184 -9.394 -8.254 1.00 75.05 C ATOM 1122 NH1 ARG A 463 -14.859 -10.536 -7.614 1.00 4.02 N ATOM 1123 NH2 ARG A 463 -16.431 -9.160 -8.619 1.00 1.43 N ATOM 0 H ARG A 463 -11.023 -7.854 -4.603 1.00 63.13 H new ATOM 0 HA ARG A 463 -10.987 -6.479 -6.970 1.00 14.41 H new ATOM 0 HB2 ARG A 463 -13.330 -7.180 -5.154 1.00 14.32 H new ATOM 0 HB3 ARG A 463 -13.521 -6.600 -6.796 1.00 14.32 H new ATOM 0 HG2 ARG A 463 -11.642 -8.914 -6.387 1.00 53.45 H new ATOM 0 HG3 ARG A 463 -13.352 -9.241 -6.186 1.00 53.45 H new ATOM 0 HD2 ARG A 463 -12.226 -7.820 -8.644 1.00 53.31 H new ATOM 0 HD3 ARG A 463 -12.423 -9.560 -8.564 1.00 53.31 H new ATOM 0 HE ARG A 463 -14.525 -7.622 -9.019 1.00 4.24 H new ATOM 0 HH11 ARG A 463 -13.893 -10.708 -7.337 1.00 4.02 H new ATOM 0 HH12 ARG A 463 -15.580 -11.228 -7.407 1.00 4.02 H new ATOM 0 HH21 ARG A 463 -16.667 -8.294 -9.103 1.00 1.43 H new ATOM 0 HH22 ARG A 463 -17.159 -9.845 -8.417 1.00 1.43 H new ATOM 1133 N LEU A 464 -11.920 -4.632 -4.430 1.00 50.34 N ATOM 1134 CA LEU A 464 -12.183 -3.271 -3.991 1.00 73.42 C ATOM 1135 C LEU A 464 -10.891 -2.455 -4.075 1.00 32.52 C ATOM 1136 O LEU A 464 -10.734 -1.626 -4.970 1.00 50.32 O ATOM 1137 CB LEU A 464 -12.819 -3.270 -2.600 1.00 34.13 C ATOM 1138 CG LEU A 464 -13.055 -1.895 -1.971 1.00 65.52 C ATOM 1139 CD1 LEU A 464 -11.745 -1.298 -1.453 1.00 75.51 C ATOM 1140 CD2 LEU A 464 -13.764 -0.959 -2.951 1.00 64.21 C ATOM 0 H LEU A 464 -11.846 -5.316 -3.677 1.00 50.34 H new ATOM 0 HA LEU A 464 -12.908 -2.792 -4.649 1.00 73.42 H new ATOM 0 HB2 LEU A 464 -13.775 -3.789 -2.659 1.00 34.13 H new ATOM 0 HB3 LEU A 464 -12.183 -3.849 -1.931 1.00 34.13 H new ATOM 0 HG LEU A 464 -13.714 -2.020 -1.112 1.00 65.52 H new ATOM 0 HD11 LEU A 464 -11.940 -0.321 -1.011 1.00 75.51 H new ATOM 0 HD12 LEU A 464 -11.317 -1.959 -0.699 1.00 75.51 H new ATOM 0 HD13 LEU A 464 -11.043 -1.188 -2.280 1.00 75.51 H new ATOM 0 HD21 LEU A 464 -13.920 0.011 -2.479 1.00 64.21 H new ATOM 0 HD22 LEU A 464 -13.151 -0.834 -3.843 1.00 64.21 H new ATOM 0 HD23 LEU A 464 -14.727 -1.386 -3.229 1.00 64.21 H new ATOM 1151 N SER A 465 -9.998 -2.720 -3.132 1.00 74.24 N ATOM 1152 CA SER A 465 -8.726 -2.019 -3.089 1.00 31.44 C ATOM 1153 C SER A 465 -8.202 -1.798 -4.509 1.00 13.43 C ATOM 1154 O SER A 465 -7.517 -0.812 -4.776 1.00 45.23 O ATOM 1155 CB SER A 465 -7.699 -2.795 -2.260 1.00 54.32 C ATOM 1156 OG SER A 465 -6.819 -3.558 -3.079 1.00 1.33 O ATOM 0 H SER A 465 -10.130 -3.410 -2.393 1.00 74.24 H new ATOM 0 HA SER A 465 -8.884 -1.052 -2.612 1.00 31.44 H new ATOM 0 HB2 SER A 465 -7.119 -2.097 -1.656 1.00 54.32 H new ATOM 0 HB3 SER A 465 -8.218 -3.459 -1.569 1.00 54.32 H new ATOM 0 HG SER A 465 -7.011 -4.512 -2.965 1.00 1.33 H new ATOM 1161 N LEU A 466 -8.545 -2.732 -5.385 1.00 72.42 N ATOM 1162 CA LEU A 466 -8.118 -2.651 -6.771 1.00 75.22 C ATOM 1163 C LEU A 466 -8.991 -1.635 -7.511 1.00 51.13 C ATOM 1164 O LEU A 466 -8.478 -0.701 -8.125 1.00 2.23 O ATOM 1165 CB LEU A 466 -8.113 -4.039 -7.412 1.00 1.20 C ATOM 1166 CG LEU A 466 -7.497 -4.132 -8.810 1.00 53.15 C ATOM 1167 CD1 LEU A 466 -6.865 -5.505 -9.042 1.00 24.14 C ATOM 1168 CD2 LEU A 466 -8.529 -3.785 -9.887 1.00 25.30 C ATOM 0 H LEU A 466 -9.114 -3.549 -5.161 1.00 72.42 H new ATOM 0 HA LEU A 466 -7.090 -2.293 -6.832 1.00 75.22 H new ATOM 0 HB2 LEU A 466 -7.573 -4.719 -6.753 1.00 1.20 H new ATOM 0 HB3 LEU A 466 -9.141 -4.396 -7.466 1.00 1.20 H new ATOM 0 HG LEU A 466 -6.697 -3.395 -8.881 1.00 53.15 H new ATOM 0 HD11 LEU A 466 -6.435 -5.543 -10.043 1.00 24.14 H new ATOM 0 HD12 LEU A 466 -6.081 -5.674 -8.304 1.00 24.14 H new ATOM 0 HD13 LEU A 466 -7.628 -6.278 -8.945 1.00 24.14 H new ATOM 0 HD21 LEU A 466 -8.066 -3.858 -10.871 1.00 25.30 H new ATOM 0 HD22 LEU A 466 -9.366 -4.481 -9.827 1.00 25.30 H new ATOM 0 HD23 LEU A 466 -8.890 -2.768 -9.731 1.00 25.30 H new ATOM 1179 N HIS A 467 -10.295 -1.853 -7.428 1.00 42.44 N ATOM 1180 CA HIS A 467 -11.244 -0.967 -8.081 1.00 1.34 C ATOM 1181 C HIS A 467 -10.950 0.481 -7.689 1.00 62.23 C ATOM 1182 O HIS A 467 -10.852 1.354 -8.551 1.00 33.12 O ATOM 1183 CB HIS A 467 -12.683 -1.385 -7.766 1.00 22.40 C ATOM 1184 CG HIS A 467 -13.639 -0.227 -7.611 1.00 42.24 C ATOM 1185 ND1 HIS A 467 -13.954 0.629 -8.652 1.00 62.41 N ATOM 1186 CD2 HIS A 467 -14.347 0.206 -6.528 1.00 61.11 C ATOM 1187 CE1 HIS A 467 -14.811 1.534 -8.204 1.00 2.31 C ATOM 1188 NE2 HIS A 467 -15.054 1.270 -6.888 1.00 62.43 N ATOM 0 H HIS A 467 -10.717 -2.630 -6.919 1.00 42.44 H new ATOM 0 HA HIS A 467 -11.132 -1.044 -9.163 1.00 1.34 H new ATOM 0 HB2 HIS A 467 -13.044 -2.036 -8.562 1.00 22.40 H new ATOM 0 HB3 HIS A 467 -12.687 -1.972 -6.847 1.00 22.40 H new ATOM 0 HD2 HIS A 467 -14.334 -0.241 -5.545 1.00 61.11 H new ATOM 0 HE1 HIS A 467 -15.242 2.340 -8.780 1.00 2.31 H new ATOM 0 HE2 HIS A 467 -15.677 1.803 -6.281 1.00 62.43 H new ATOM 1195 N GLN A 468 -10.816 0.693 -6.389 1.00 43.32 N ATOM 1196 CA GLN A 468 -10.534 2.023 -5.871 1.00 23.33 C ATOM 1197 C GLN A 468 -9.237 2.564 -6.479 1.00 4.05 C ATOM 1198 O GLN A 468 -9.270 3.443 -7.340 1.00 5.33 O ATOM 1199 CB GLN A 468 -10.461 2.012 -4.343 1.00 54.14 C ATOM 1200 CG GLN A 468 -11.810 1.625 -3.733 1.00 22.24 C ATOM 1201 CD GLN A 468 -11.968 2.217 -2.332 1.00 2.40 C ATOM 1202 OE1 GLN A 468 -13.045 2.612 -1.915 1.00 64.24 O ATOM 1203 NE2 GLN A 468 -10.839 2.259 -1.631 1.00 4.42 N ATOM 0 H GLN A 468 -10.897 -0.033 -5.677 1.00 43.32 H new ATOM 0 HA GLN A 468 -11.351 2.685 -6.157 1.00 23.33 H new ATOM 0 HB2 GLN A 468 -9.695 1.308 -4.017 1.00 54.14 H new ATOM 0 HB3 GLN A 468 -10.164 2.997 -3.982 1.00 54.14 H new ATOM 0 HG2 GLN A 468 -12.618 1.978 -4.374 1.00 22.24 H new ATOM 0 HG3 GLN A 468 -11.893 0.539 -3.684 1.00 22.24 H new ATOM 0 HE21 GLN A 468 -9.972 1.912 -2.040 1.00 4.42 H new ATOM 0 HE22 GLN A 468 -10.840 2.639 -0.684 1.00 4.42 H new ATOM 1210 N VAL A 469 -8.127 2.017 -6.006 1.00 51.42 N ATOM 1211 CA VAL A 469 -6.823 2.434 -6.492 1.00 71.11 C ATOM 1212 C VAL A 469 -6.892 2.653 -8.004 1.00 10.43 C ATOM 1213 O VAL A 469 -6.257 3.563 -8.534 1.00 25.44 O ATOM 1214 CB VAL A 469 -5.761 1.410 -6.084 1.00 40.34 C ATOM 1215 CG1 VAL A 469 -5.777 0.201 -7.019 1.00 62.50 C ATOM 1216 CG2 VAL A 469 -4.372 2.051 -6.037 1.00 74.43 C ATOM 0 H VAL A 469 -8.104 1.289 -5.292 1.00 51.42 H new ATOM 0 HA VAL A 469 -6.533 3.382 -6.040 1.00 71.11 H new ATOM 0 HB VAL A 469 -6.002 1.059 -5.081 1.00 40.34 H new ATOM 0 HG11 VAL A 469 -5.013 -0.511 -6.707 1.00 62.50 H new ATOM 0 HG12 VAL A 469 -6.756 -0.277 -6.979 1.00 62.50 H new ATOM 0 HG13 VAL A 469 -5.574 0.527 -8.039 1.00 62.50 H new ATOM 0 HG21 VAL A 469 -3.636 1.302 -5.745 1.00 74.43 H new ATOM 0 HG22 VAL A 469 -4.119 2.444 -7.022 1.00 74.43 H new ATOM 0 HG23 VAL A 469 -4.371 2.864 -5.311 1.00 74.43 H new ATOM 1226 N ASN A 470 -7.670 1.802 -8.658 1.00 23.15 N ATOM 1227 CA ASN A 470 -7.831 1.889 -10.099 1.00 45.23 C ATOM 1228 C ASN A 470 -8.492 3.223 -10.453 1.00 33.04 C ATOM 1229 O ASN A 470 -7.832 4.137 -10.942 1.00 62.24 O ATOM 1230 CB ASN A 470 -8.724 0.765 -10.624 1.00 24.12 C ATOM 1231 CG ASN A 470 -7.885 -0.374 -11.210 1.00 62.53 C ATOM 1232 OD1 ASN A 470 -8.130 -0.863 -12.300 1.00 55.32 O ATOM 1233 ND2 ASN A 470 -6.883 -0.764 -10.428 1.00 23.43 N ATOM 0 H ASN A 470 -8.196 1.048 -8.215 1.00 23.15 H new ATOM 0 HA ASN A 470 -6.844 1.806 -10.554 1.00 45.23 H new ATOM 0 HB2 ASN A 470 -9.348 0.383 -9.816 1.00 24.12 H new ATOM 0 HB3 ASN A 470 -9.396 1.156 -11.388 1.00 24.12 H new ATOM 0 HD21 ASN A 470 -6.263 -1.516 -10.730 1.00 23.43 H new ATOM 0 HD22 ASN A 470 -6.734 -0.311 -9.526 1.00 23.43 H new ATOM 1239 N GLN A 471 -9.790 3.290 -10.192 1.00 0.13 N ATOM 1240 CA GLN A 471 -10.549 4.496 -10.478 1.00 1.41 C ATOM 1241 C GLN A 471 -9.722 5.737 -10.134 1.00 14.14 C ATOM 1242 O GLN A 471 -9.764 6.733 -10.854 1.00 61.44 O ATOM 1243 CB GLN A 471 -11.880 4.498 -9.723 1.00 62.35 C ATOM 1244 CG GLN A 471 -12.735 3.291 -10.116 1.00 70.22 C ATOM 1245 CD GLN A 471 -13.871 3.708 -11.052 1.00 12.14 C ATOM 1246 OE1 GLN A 471 -14.601 4.654 -10.803 1.00 1.02 O ATOM 1247 NE2 GLN A 471 -13.982 2.950 -12.139 1.00 44.30 N ATOM 0 H GLN A 471 -10.335 2.529 -9.786 1.00 0.13 H new ATOM 0 HA GLN A 471 -10.774 4.517 -11.544 1.00 1.41 H new ATOM 0 HB2 GLN A 471 -11.693 4.482 -8.649 1.00 62.35 H new ATOM 0 HB3 GLN A 471 -12.423 5.418 -9.938 1.00 62.35 H new ATOM 0 HG2 GLN A 471 -12.112 2.543 -10.605 1.00 70.22 H new ATOM 0 HG3 GLN A 471 -13.148 2.826 -9.221 1.00 70.22 H new ATOM 0 HE21 GLN A 471 -13.338 2.173 -12.287 1.00 44.30 H new ATOM 0 HE22 GLN A 471 -14.711 3.146 -12.825 1.00 44.30 H new ATOM 1254 N ALA A 472 -8.991 5.636 -9.035 1.00 44.25 N ATOM 1255 CA ALA A 472 -8.157 6.738 -8.586 1.00 74.10 C ATOM 1256 C ALA A 472 -7.044 6.977 -9.610 1.00 65.24 C ATOM 1257 O ALA A 472 -6.831 8.107 -10.048 1.00 34.35 O ATOM 1258 CB ALA A 472 -7.609 6.430 -7.192 1.00 72.01 C ATOM 0 H ALA A 472 -8.958 4.807 -8.441 1.00 44.25 H new ATOM 0 HA ALA A 472 -8.741 7.655 -8.510 1.00 74.10 H new ATOM 0 HB1 ALA A 472 -6.984 7.257 -6.856 1.00 72.01 H new ATOM 0 HB2 ALA A 472 -8.438 6.296 -6.497 1.00 72.01 H new ATOM 0 HB3 ALA A 472 -7.015 5.517 -7.228 1.00 72.01 H new ATOM 1264 N MET A 473 -6.364 5.896 -9.961 1.00 11.33 N ATOM 1265 CA MET A 473 -5.278 5.974 -10.924 1.00 13.43 C ATOM 1266 C MET A 473 -5.774 6.521 -12.264 1.00 31.43 C ATOM 1267 O MET A 473 -5.216 7.480 -12.792 1.00 73.12 O ATOM 1268 CB MET A 473 -4.678 4.582 -11.130 1.00 40.41 C ATOM 1269 CG MET A 473 -3.956 4.104 -9.868 1.00 53.44 C ATOM 1270 SD MET A 473 -2.190 4.145 -10.121 1.00 35.44 S ATOM 1271 CE MET A 473 -1.713 2.682 -9.217 1.00 12.24 C ATOM 0 H MET A 473 -6.544 4.961 -9.596 1.00 11.33 H new ATOM 0 HA MET A 473 -4.518 6.652 -10.535 1.00 13.43 H new ATOM 0 HB2 MET A 473 -5.467 3.877 -11.391 1.00 40.41 H new ATOM 0 HB3 MET A 473 -3.980 4.603 -11.967 1.00 40.41 H new ATOM 0 HG2 MET A 473 -4.225 4.738 -9.023 1.00 53.44 H new ATOM 0 HG3 MET A 473 -4.272 3.091 -9.620 1.00 53.44 H new ATOM 0 HE1 MET A 473 -0.932 2.154 -9.765 1.00 12.24 H new ATOM 0 HE2 MET A 473 -1.337 2.968 -8.234 1.00 12.24 H new ATOM 0 HE3 MET A 473 -2.578 2.029 -9.099 1.00 12.24 H new ATOM 1279 N MET A 474 -6.817 5.884 -12.778 1.00 3.12 N ATOM 1280 CA MET A 474 -7.393 6.294 -14.047 1.00 22.13 C ATOM 1281 C MET A 474 -8.155 7.612 -13.903 1.00 72.15 C ATOM 1282 O MET A 474 -8.665 8.149 -14.885 1.00 73.14 O ATOM 1283 CB MET A 474 -8.346 5.205 -14.549 1.00 51.45 C ATOM 1284 CG MET A 474 -9.317 4.776 -13.450 1.00 42.54 C ATOM 1285 SD MET A 474 -10.939 4.499 -14.141 1.00 5.01 S ATOM 1286 CE MET A 474 -11.870 5.734 -13.252 1.00 12.45 C ATOM 0 H MET A 474 -7.277 5.087 -12.338 1.00 3.12 H new ATOM 0 HA MET A 474 -6.584 6.441 -14.762 1.00 22.13 H new ATOM 0 HB2 MET A 474 -8.905 5.574 -15.409 1.00 51.45 H new ATOM 0 HB3 MET A 474 -7.772 4.343 -14.888 1.00 51.45 H new ATOM 0 HG2 MET A 474 -8.957 3.866 -12.970 1.00 42.54 H new ATOM 0 HG3 MET A 474 -9.368 5.544 -12.678 1.00 42.54 H new ATOM 0 HE1 MET A 474 -12.785 5.962 -13.798 1.00 12.45 H new ATOM 0 HE2 MET A 474 -12.123 5.356 -12.261 1.00 12.45 H new ATOM 0 HE3 MET A 474 -11.271 6.639 -13.153 1.00 12.45 H new ATOM 1294 N SER A 475 -8.210 8.096 -12.670 1.00 72.44 N ATOM 1295 CA SER A 475 -8.900 9.342 -12.385 1.00 41.14 C ATOM 1296 C SER A 475 -7.930 10.519 -12.509 1.00 51.10 C ATOM 1297 O SER A 475 -8.319 11.607 -12.932 1.00 51.03 O ATOM 1298 CB SER A 475 -9.527 9.316 -10.990 1.00 51.20 C ATOM 1299 OG SER A 475 -9.643 10.624 -10.433 1.00 45.21 O ATOM 0 H SER A 475 -7.788 7.647 -11.857 1.00 72.44 H new ATOM 0 HA SER A 475 -9.702 9.463 -13.113 1.00 41.14 H new ATOM 0 HB2 SER A 475 -10.514 8.856 -11.044 1.00 51.20 H new ATOM 0 HB3 SER A 475 -8.921 8.694 -10.331 1.00 51.20 H new ATOM 0 HG SER A 475 -10.189 10.586 -9.620 1.00 45.21 H new ATOM 1304 N ASN A 476 -6.686 10.262 -12.134 1.00 3.12 N ATOM 1305 CA ASN A 476 -5.657 11.284 -12.198 1.00 53.12 C ATOM 1306 C ASN A 476 -4.483 10.771 -13.035 1.00 31.30 C ATOM 1307 O ASN A 476 -3.384 10.582 -12.518 1.00 4.53 O ATOM 1308 CB ASN A 476 -5.131 11.625 -10.803 1.00 74.21 C ATOM 1309 CG ASN A 476 -4.460 10.409 -10.159 1.00 43.12 C ATOM 1310 OD1 ASN A 476 -4.772 9.268 -10.452 1.00 10.21 O ATOM 1311 ND2 ASN A 476 -3.523 10.718 -9.268 1.00 41.14 N ATOM 0 H ASN A 476 -6.367 9.358 -11.784 1.00 3.12 H new ATOM 0 HA ASN A 476 -6.096 12.176 -12.645 1.00 53.12 H new ATOM 0 HB2 ASN A 476 -4.417 12.446 -10.870 1.00 74.21 H new ATOM 0 HB3 ASN A 476 -5.953 11.967 -10.174 1.00 74.21 H new ATOM 0 HD21 ASN A 476 -3.016 9.977 -8.783 1.00 41.14 H new ATOM 0 HD22 ASN A 476 -3.311 11.696 -9.069 1.00 41.14 H new ATOM 1317 N LEU A 477 -4.757 10.559 -14.314 1.00 71.14 N ATOM 1318 CA LEU A 477 -3.738 10.072 -15.227 1.00 22.41 C ATOM 1319 C LEU A 477 -2.729 11.188 -15.503 1.00 3.25 C ATOM 1320 O LEU A 477 -1.547 10.923 -15.717 1.00 72.04 O ATOM 1321 CB LEU A 477 -4.381 9.498 -16.490 1.00 21.14 C ATOM 1322 CG LEU A 477 -5.371 8.350 -16.277 1.00 54.42 C ATOM 1323 CD1 LEU A 477 -6.367 8.264 -17.435 1.00 32.13 C ATOM 1324 CD2 LEU A 477 -4.637 7.027 -16.052 1.00 15.13 C ATOM 0 H LEU A 477 -5.671 10.716 -14.739 1.00 71.14 H new ATOM 0 HA LEU A 477 -3.185 9.248 -14.776 1.00 22.41 H new ATOM 0 HB2 LEU A 477 -4.897 10.305 -17.010 1.00 21.14 H new ATOM 0 HB3 LEU A 477 -3.588 9.149 -17.151 1.00 21.14 H new ATOM 0 HG LEU A 477 -5.945 8.557 -15.373 1.00 54.42 H new ATOM 0 HD11 LEU A 477 -7.059 7.440 -17.259 1.00 32.13 H new ATOM 0 HD12 LEU A 477 -6.925 9.198 -17.505 1.00 32.13 H new ATOM 0 HD13 LEU A 477 -5.828 8.092 -18.367 1.00 32.13 H new ATOM 0 HD21 LEU A 477 -5.364 6.228 -15.903 1.00 15.13 H new ATOM 0 HD22 LEU A 477 -4.021 6.800 -16.922 1.00 15.13 H new ATOM 0 HD23 LEU A 477 -4.002 7.109 -15.170 1.00 15.13 H new ATOM 1335 N THR A 478 -3.233 12.413 -15.487 1.00 72.53 N ATOM 1336 CA THR A 478 -2.390 13.571 -15.733 1.00 15.43 C ATOM 1337 C THR A 478 -1.509 13.858 -14.517 1.00 55.23 C ATOM 1338 O THR A 478 -0.689 14.774 -14.542 1.00 24.34 O ATOM 1339 CB THR A 478 -3.297 14.743 -16.117 1.00 1.54 C ATOM 1340 OG1 THR A 478 -2.472 15.568 -16.934 1.00 24.23 O ATOM 1341 CG2 THR A 478 -3.644 15.631 -14.919 1.00 11.22 C ATOM 0 H THR A 478 -4.214 12.629 -15.308 1.00 72.53 H new ATOM 0 HA THR A 478 -1.701 13.390 -16.558 1.00 15.43 H new ATOM 0 HB THR A 478 -4.215 14.361 -16.563 1.00 1.54 H new ATOM 0 HG1 THR A 478 -1.598 15.682 -16.506 1.00 24.23 H new ATOM 0 HG21 THR A 478 -4.289 16.447 -15.246 1.00 11.22 H new ATOM 0 HG22 THR A 478 -4.162 15.039 -14.165 1.00 11.22 H new ATOM 0 HG23 THR A 478 -2.728 16.041 -14.492 1.00 11.22 H new ATOM 1349 N ARG A 479 -1.707 13.057 -13.480 1.00 41.43 N ATOM 1350 CA ARG A 479 -0.941 13.213 -12.256 1.00 53.44 C ATOM 1351 C ARG A 479 0.254 12.259 -12.252 1.00 21.15 C ATOM 1352 O ARG A 479 1.398 12.689 -12.385 1.00 42.53 O ATOM 1353 CB ARG A 479 -1.809 12.941 -11.025 1.00 45.01 C ATOM 1354 CG ARG A 479 -2.630 14.175 -10.648 1.00 22.43 C ATOM 1355 CD ARG A 479 -1.739 15.262 -10.044 1.00 61.13 C ATOM 1356 NE ARG A 479 -1.209 14.814 -8.737 1.00 62.53 N ATOM 1357 CZ ARG A 479 -0.046 14.144 -8.581 1.00 14.44 C ATOM 1358 NH1 ARG A 479 0.716 13.838 -9.651 1.00 72.22 N ATOM 1359 NH2 ARG A 479 0.331 13.792 -7.366 1.00 54.23 N ATOM 0 H ARG A 479 -2.388 12.297 -13.463 1.00 41.43 H new ATOM 0 HA ARG A 479 -0.586 14.243 -12.215 1.00 53.44 H new ATOM 0 HB2 ARG A 479 -2.477 12.103 -11.225 1.00 45.01 H new ATOM 0 HB3 ARG A 479 -1.176 12.651 -10.186 1.00 45.01 H new ATOM 0 HG2 ARG A 479 -3.136 14.564 -11.532 1.00 22.43 H new ATOM 0 HG3 ARG A 479 -3.405 13.896 -9.934 1.00 22.43 H new ATOM 0 HD2 ARG A 479 -0.916 15.487 -10.722 1.00 61.13 H new ATOM 0 HD3 ARG A 479 -2.309 16.183 -9.918 1.00 61.13 H new ATOM 0 HE ARG A 479 -1.756 15.024 -7.902 1.00 62.53 H new ATOM 0 HH11 ARG A 479 0.416 14.113 -10.586 1.00 72.22 H new ATOM 0 HH12 ARG A 479 1.593 13.332 -9.525 1.00 72.22 H new ATOM 0 HH21 ARG A 479 -0.253 14.026 -6.563 1.00 54.23 H new ATOM 0 HH22 ARG A 479 1.206 13.286 -7.230 1.00 54.23 H new ATOM 1369 N GLN A 480 -0.054 10.979 -12.098 1.00 21.22 N ATOM 1370 CA GLN A 480 0.980 9.958 -12.076 1.00 71.21 C ATOM 1371 C GLN A 480 0.768 8.961 -13.217 1.00 41.24 C ATOM 1372 O GLN A 480 1.731 8.460 -13.796 1.00 5.43 O ATOM 1373 CB GLN A 480 1.017 9.244 -10.724 1.00 23.14 C ATOM 1374 CG GLN A 480 -0.390 9.112 -10.136 1.00 63.54 C ATOM 1375 CD GLN A 480 -1.220 8.096 -10.920 1.00 11.03 C ATOM 1376 OE1 GLN A 480 -0.862 6.937 -11.058 1.00 12.41 O ATOM 1377 NE2 GLN A 480 -2.345 8.592 -11.428 1.00 44.11 N ATOM 0 H GLN A 480 -1.005 10.626 -11.987 1.00 21.22 H new ATOM 0 HA GLN A 480 1.945 10.444 -12.220 1.00 71.21 H new ATOM 0 HB2 GLN A 480 1.460 8.255 -10.843 1.00 23.14 H new ATOM 0 HB3 GLN A 480 1.653 9.797 -10.033 1.00 23.14 H new ATOM 0 HG2 GLN A 480 -0.324 8.805 -9.092 1.00 63.54 H new ATOM 0 HG3 GLN A 480 -0.887 10.082 -10.152 1.00 63.54 H new ATOM 0 HE21 GLN A 480 -2.585 9.571 -11.275 1.00 44.11 H new ATOM 0 HE22 GLN A 480 -2.967 7.993 -11.970 1.00 44.11 H new ATOM 1384 N GLY A 481 -0.499 8.704 -13.507 1.00 12.43 N ATOM 1385 CA GLY A 481 -0.850 7.776 -14.567 1.00 35.25 C ATOM 1386 C GLY A 481 0.055 6.542 -14.541 1.00 53.13 C ATOM 1387 O GLY A 481 0.377 5.981 -15.588 1.00 45.31 O ATOM 0 H GLY A 481 -1.295 9.123 -13.026 1.00 12.43 H new ATOM 0 HA2 GLY A 481 -1.890 7.470 -14.457 1.00 35.25 H new ATOM 0 HA3 GLY A 481 -0.764 8.273 -15.533 1.00 35.25 H new ATOM 1391 N SER A 482 0.442 6.158 -13.334 1.00 41.22 N ATOM 1392 CA SER A 482 1.305 5.003 -13.156 1.00 34.52 C ATOM 1393 C SER A 482 0.522 3.860 -12.507 1.00 51.31 C ATOM 1394 O SER A 482 0.331 3.845 -11.293 1.00 52.03 O ATOM 1395 CB SER A 482 2.530 5.355 -12.309 1.00 35.35 C ATOM 1396 OG SER A 482 3.613 5.824 -13.108 1.00 62.22 O ATOM 0 H SER A 482 0.174 6.627 -12.469 1.00 41.22 H new ATOM 0 HA SER A 482 1.655 4.684 -14.138 1.00 34.52 H new ATOM 0 HB2 SER A 482 2.260 6.119 -11.580 1.00 35.35 H new ATOM 0 HB3 SER A 482 2.847 4.476 -11.747 1.00 35.35 H new ATOM 0 HG SER A 482 4.375 6.040 -12.531 1.00 62.22 H new ATOM 1401 N PRO A 483 0.080 2.906 -13.369 1.00 13.34 N ATOM 1402 CA PRO A 483 -0.680 1.762 -12.893 1.00 21.34 C ATOM 1403 C PRO A 483 0.233 0.753 -12.191 1.00 10.12 C ATOM 1404 O PRO A 483 -0.229 -0.288 -11.726 1.00 32.42 O ATOM 1405 CB PRO A 483 -1.352 1.192 -14.131 1.00 20.13 C ATOM 1406 CG PRO A 483 -0.583 1.750 -15.317 1.00 34.52 C ATOM 1407 CD PRO A 483 0.286 2.891 -14.814 1.00 23.15 C ATOM 0 HA PRO A 483 -1.423 2.033 -12.143 1.00 21.34 H new ATOM 0 HB2 PRO A 483 -1.323 0.102 -14.124 1.00 20.13 H new ATOM 0 HB3 PRO A 483 -2.402 1.483 -14.174 1.00 20.13 H new ATOM 0 HG2 PRO A 483 0.032 0.974 -15.772 1.00 34.52 H new ATOM 0 HG3 PRO A 483 -1.270 2.104 -16.085 1.00 34.52 H new ATOM 0 HD2 PRO A 483 1.335 2.729 -15.063 1.00 23.15 H new ATOM 0 HD3 PRO A 483 -0.006 3.839 -15.265 1.00 23.15 H new ATOM 1412 N ASP A 484 1.511 1.099 -12.135 1.00 33.05 N ATOM 1413 CA ASP A 484 2.492 0.236 -11.498 1.00 11.11 C ATOM 1414 C ASP A 484 2.683 0.676 -10.044 1.00 71.33 C ATOM 1415 O ASP A 484 3.633 0.259 -9.386 1.00 24.31 O ATOM 1416 CB ASP A 484 3.847 0.328 -12.202 1.00 63.13 C ATOM 1417 CG ASP A 484 3.867 -0.203 -13.637 1.00 23.31 C ATOM 1418 OD1 ASP A 484 4.671 0.239 -14.470 1.00 65.55 O ATOM 1419 OD2 ASP A 484 2.998 -1.122 -13.889 1.00 3.05 O ATOM 0 H ASP A 484 1.890 1.964 -12.520 1.00 33.05 H new ATOM 0 HA ASP A 484 2.126 -0.789 -11.554 1.00 11.11 H new ATOM 0 HB2 ASP A 484 4.164 1.371 -12.212 1.00 63.13 H new ATOM 0 HB3 ASP A 484 4.582 -0.224 -11.616 1.00 63.13 H new ATOM 1424 N CYS A 485 1.765 1.516 -9.588 1.00 23.35 N ATOM 1425 CA CYS A 485 1.820 2.016 -8.226 1.00 62.02 C ATOM 1426 C CYS A 485 0.957 1.111 -7.345 1.00 24.42 C ATOM 1427 O CYS A 485 0.289 1.585 -6.427 1.00 15.03 O ATOM 1428 CB CYS A 485 1.381 3.479 -8.144 1.00 42.42 C ATOM 1429 SG CYS A 485 2.827 4.582 -8.348 1.00 24.43 S ATOM 0 H CYS A 485 0.979 1.862 -10.138 1.00 23.35 H new ATOM 0 HA CYS A 485 2.850 1.992 -7.869 1.00 62.02 H new ATOM 0 HB2 CYS A 485 0.642 3.689 -8.917 1.00 42.42 H new ATOM 0 HB3 CYS A 485 0.901 3.670 -7.184 1.00 42.42 H new ATOM 0 HG CYS A 485 3.361 4.817 -7.186 1.00 24.43 H new ATOM 1434 N VAL A 486 1.000 -0.176 -7.653 1.00 24.32 N ATOM 1435 CA VAL A 486 0.232 -1.154 -6.902 1.00 11.41 C ATOM 1436 C VAL A 486 1.149 -2.302 -6.478 1.00 63.11 C ATOM 1437 O VAL A 486 2.024 -2.714 -7.236 1.00 23.55 O ATOM 1438 CB VAL A 486 -0.970 -1.620 -7.726 1.00 62.40 C ATOM 1439 CG1 VAL A 486 -1.576 -2.897 -7.138 1.00 23.21 C ATOM 1440 CG2 VAL A 486 -2.022 -0.514 -7.837 1.00 2.23 C ATOM 0 H VAL A 486 1.556 -0.565 -8.414 1.00 24.32 H new ATOM 0 HA VAL A 486 -0.169 -0.707 -5.992 1.00 11.41 H new ATOM 0 HB VAL A 486 -0.618 -1.848 -8.732 1.00 62.40 H new ATOM 0 HG11 VAL A 486 -2.429 -3.207 -7.742 1.00 23.21 H new ATOM 0 HG12 VAL A 486 -0.826 -3.688 -7.136 1.00 23.21 H new ATOM 0 HG13 VAL A 486 -1.905 -2.707 -6.117 1.00 23.21 H new ATOM 0 HG21 VAL A 486 -2.865 -0.872 -8.428 1.00 2.23 H new ATOM 0 HG22 VAL A 486 -2.368 -0.239 -6.840 1.00 2.23 H new ATOM 0 HG23 VAL A 486 -1.583 0.358 -8.322 1.00 2.23 H new ATOM 1450 N ILE A 487 0.917 -2.786 -5.266 1.00 32.14 N ATOM 1451 CA ILE A 487 1.711 -3.879 -4.732 1.00 33.44 C ATOM 1452 C ILE A 487 0.812 -4.804 -3.909 1.00 52.42 C ATOM 1453 O ILE A 487 0.542 -4.533 -2.740 1.00 73.00 O ATOM 1454 CB ILE A 487 2.913 -3.339 -3.955 1.00 53.24 C ATOM 1455 CG1 ILE A 487 3.564 -2.169 -4.697 1.00 70.01 C ATOM 1456 CG2 ILE A 487 3.916 -4.453 -3.652 1.00 5.21 C ATOM 1457 CD1 ILE A 487 4.289 -2.651 -5.954 1.00 64.02 C ATOM 0 H ILE A 487 0.190 -2.441 -4.639 1.00 32.14 H new ATOM 0 HA ILE A 487 2.127 -4.477 -5.542 1.00 33.44 H new ATOM 0 HB ILE A 487 2.557 -2.957 -2.998 1.00 53.24 H new ATOM 0 HG12 ILE A 487 2.803 -1.438 -4.970 1.00 70.01 H new ATOM 0 HG13 ILE A 487 4.269 -1.663 -4.038 1.00 70.01 H new ATOM 0 HG21 ILE A 487 4.761 -4.042 -3.099 1.00 5.21 H new ATOM 0 HG22 ILE A 487 3.432 -5.225 -3.054 1.00 5.21 H new ATOM 0 HG23 ILE A 487 4.271 -4.887 -4.587 1.00 5.21 H new ATOM 0 HD11 ILE A 487 4.742 -1.800 -6.462 1.00 64.02 H new ATOM 0 HD12 ILE A 487 5.066 -3.363 -5.675 1.00 64.02 H new ATOM 0 HD13 ILE A 487 3.576 -3.135 -6.622 1.00 64.02 H new ATOM 1468 N PRO A 488 0.361 -5.903 -4.568 1.00 22.24 N ATOM 1469 CA PRO A 488 -0.503 -6.869 -3.909 1.00 74.32 C ATOM 1470 C PRO A 488 0.291 -7.738 -2.932 1.00 61.51 C ATOM 1471 O PRO A 488 0.913 -8.723 -3.332 1.00 54.34 O ATOM 1472 CB PRO A 488 -1.132 -7.670 -5.039 1.00 71.44 C ATOM 1473 CG PRO A 488 -0.251 -7.436 -6.256 1.00 71.12 C ATOM 1474 CD PRO A 488 0.661 -6.258 -5.953 1.00 52.22 C ATOM 0 HA PRO A 488 -1.271 -6.397 -3.297 1.00 74.32 H new ATOM 0 HB2 PRO A 488 -1.178 -8.730 -4.788 1.00 71.44 H new ATOM 0 HB3 PRO A 488 -2.154 -7.342 -5.228 1.00 71.44 H new ATOM 0 HG2 PRO A 488 0.337 -8.326 -6.478 1.00 71.12 H new ATOM 0 HG3 PRO A 488 -0.862 -7.230 -7.135 1.00 71.12 H new ATOM 0 HD2 PRO A 488 1.710 -6.528 -6.074 1.00 52.22 H new ATOM 0 HD3 PRO A 488 0.467 -5.423 -6.627 1.00 52.22 H new ATOM 1479 N PHE A 489 0.246 -7.342 -1.667 1.00 32.44 N ATOM 1480 CA PHE A 489 0.953 -8.074 -0.630 1.00 55.24 C ATOM 1481 C PHE A 489 0.189 -9.336 -0.231 1.00 4.42 C ATOM 1482 O PHE A 489 -0.987 -9.488 -0.564 1.00 63.42 O ATOM 1483 CB PHE A 489 1.049 -7.145 0.583 1.00 10.15 C ATOM 1484 CG PHE A 489 2.256 -7.420 1.483 1.00 44.31 C ATOM 1485 CD1 PHE A 489 3.461 -6.861 1.194 1.00 34.32 C ATOM 1486 CD2 PHE A 489 2.122 -8.226 2.571 1.00 54.03 C ATOM 1487 CE1 PHE A 489 4.581 -7.116 2.030 1.00 15.45 C ATOM 1488 CE2 PHE A 489 3.241 -8.482 3.406 1.00 74.41 C ATOM 1489 CZ PHE A 489 4.448 -7.921 3.118 1.00 31.03 C ATOM 0 H PHE A 489 -0.268 -6.525 -1.338 1.00 32.44 H new ATOM 0 HA PHE A 489 1.936 -8.377 -0.991 1.00 55.24 H new ATOM 0 HB2 PHE A 489 1.096 -6.113 0.235 1.00 10.15 H new ATOM 0 HB3 PHE A 489 0.138 -7.241 1.174 1.00 10.15 H new ATOM 0 HD1 PHE A 489 3.567 -6.223 0.329 1.00 34.32 H new ATOM 0 HD2 PHE A 489 1.165 -8.671 2.799 1.00 54.03 H new ATOM 0 HE1 PHE A 489 5.538 -6.671 1.802 1.00 15.45 H new ATOM 0 HE2 PHE A 489 3.135 -9.122 4.270 1.00 74.41 H new ATOM 0 HZ PHE A 489 5.299 -8.115 3.753 1.00 31.03 H new ATOM 1498 N LEU A 490 0.885 -10.212 0.478 1.00 24.33 N ATOM 1499 CA LEU A 490 0.287 -11.458 0.927 1.00 3.21 C ATOM 1500 C LEU A 490 0.932 -11.882 2.248 1.00 42.25 C ATOM 1501 O LEU A 490 2.052 -12.391 2.262 1.00 41.42 O ATOM 1502 CB LEU A 490 0.377 -12.521 -0.169 1.00 71.13 C ATOM 1503 CG LEU A 490 -0.432 -13.798 0.066 1.00 64.45 C ATOM 1504 CD1 LEU A 490 0.446 -14.902 0.661 1.00 51.22 C ATOM 1505 CD2 LEU A 490 -1.663 -13.516 0.930 1.00 63.42 C ATOM 0 H LEU A 490 1.859 -10.084 0.753 1.00 24.33 H new ATOM 0 HA LEU A 490 -0.777 -11.321 1.120 1.00 3.21 H new ATOM 0 HB2 LEU A 490 0.049 -12.075 -1.108 1.00 71.13 H new ATOM 0 HB3 LEU A 490 1.424 -12.796 -0.295 1.00 71.13 H new ATOM 0 HG LEU A 490 -0.791 -14.157 -0.898 1.00 64.45 H new ATOM 0 HD11 LEU A 490 -0.154 -15.799 0.818 1.00 51.22 H new ATOM 0 HD12 LEU A 490 1.262 -15.127 -0.025 1.00 51.22 H new ATOM 0 HD13 LEU A 490 0.855 -14.567 1.614 1.00 51.22 H new ATOM 0 HD21 LEU A 490 -2.220 -14.440 1.082 1.00 63.42 H new ATOM 0 HD22 LEU A 490 -1.347 -13.120 1.895 1.00 63.42 H new ATOM 0 HD23 LEU A 490 -2.300 -12.786 0.429 1.00 63.42 H new ATOM 1516 N PRO A 491 0.178 -11.651 3.356 1.00 63.22 N ATOM 1517 CA PRO A 491 0.663 -12.003 4.680 1.00 51.34 C ATOM 1518 C PRO A 491 0.593 -13.514 4.906 1.00 14.05 C ATOM 1519 O PRO A 491 0.007 -14.239 4.102 1.00 51.14 O ATOM 1520 CB PRO A 491 -0.212 -11.217 5.643 1.00 74.41 C ATOM 1521 CG PRO A 491 -1.447 -10.819 4.852 1.00 13.13 C ATOM 1522 CD PRO A 491 -1.153 -11.050 3.378 1.00 33.41 C ATOM 0 HA PRO A 491 1.714 -11.751 4.823 1.00 51.34 H new ATOM 0 HB2 PRO A 491 -0.481 -11.822 6.509 1.00 74.41 H new ATOM 0 HB3 PRO A 491 0.312 -10.338 6.018 1.00 74.41 H new ATOM 0 HG2 PRO A 491 -2.308 -11.409 5.166 1.00 13.13 H new ATOM 0 HG3 PRO A 491 -1.695 -9.773 5.032 1.00 13.13 H new ATOM 0 HD2 PRO A 491 -1.893 -11.710 2.925 1.00 33.41 H new ATOM 0 HD3 PRO A 491 -1.175 -10.115 2.818 1.00 33.41 H new ATOM 1527 N LEU A 492 1.199 -13.945 6.002 1.00 72.51 N ATOM 1528 CA LEU A 492 1.213 -15.357 6.343 1.00 33.22 C ATOM 1529 C LEU A 492 -0.155 -15.756 6.901 1.00 40.14 C ATOM 1530 O LEU A 492 -0.541 -16.921 6.833 1.00 33.04 O ATOM 1531 CB LEU A 492 2.376 -15.669 7.287 1.00 1.12 C ATOM 1532 CG LEU A 492 3.777 -15.377 6.745 1.00 61.21 C ATOM 1533 CD1 LEU A 492 3.946 -13.888 6.437 1.00 40.11 C ATOM 1534 CD2 LEU A 492 4.854 -15.890 7.702 1.00 64.23 C ATOM 0 H LEU A 492 1.684 -13.341 6.666 1.00 72.51 H new ATOM 0 HA LEU A 492 1.384 -15.962 5.453 1.00 33.22 H new ATOM 0 HB2 LEU A 492 2.237 -15.097 8.205 1.00 1.12 H new ATOM 0 HB3 LEU A 492 2.325 -16.724 7.558 1.00 1.12 H new ATOM 0 HG LEU A 492 3.899 -15.916 5.806 1.00 61.21 H new ATOM 0 HD11 LEU A 492 4.950 -13.707 6.053 1.00 40.11 H new ATOM 0 HD12 LEU A 492 3.212 -13.585 5.690 1.00 40.11 H new ATOM 0 HD13 LEU A 492 3.796 -13.309 7.348 1.00 40.11 H new ATOM 0 HD21 LEU A 492 5.840 -15.669 7.292 1.00 64.23 H new ATOM 0 HD22 LEU A 492 4.745 -15.399 8.669 1.00 64.23 H new ATOM 0 HD23 LEU A 492 4.746 -16.967 7.827 1.00 64.23 H new ATOM 1545 N GLU A 493 -0.849 -14.767 7.440 1.00 40.54 N ATOM 1546 CA GLU A 493 -2.167 -14.998 8.009 1.00 21.02 C ATOM 1547 C GLU A 493 -3.144 -15.444 6.920 1.00 32.10 C ATOM 1548 O GLU A 493 -4.020 -16.272 7.167 1.00 44.10 O ATOM 1549 CB GLU A 493 -2.682 -13.751 8.728 1.00 64.14 C ATOM 1550 CG GLU A 493 -2.181 -13.706 10.174 1.00 21.32 C ATOM 1551 CD GLU A 493 -2.565 -14.982 10.926 1.00 50.15 C ATOM 1552 OE1 GLU A 493 -1.693 -15.648 11.503 1.00 62.24 O ATOM 1553 OE2 GLU A 493 -3.821 -15.273 10.900 1.00 13.20 O ATOM 0 H GLU A 493 -0.524 -13.802 7.496 1.00 40.54 H new ATOM 0 HA GLU A 493 -2.086 -15.795 8.748 1.00 21.02 H new ATOM 0 HB2 GLU A 493 -2.352 -12.858 8.197 1.00 64.14 H new ATOM 0 HB3 GLU A 493 -3.772 -13.744 8.716 1.00 64.14 H new ATOM 0 HG2 GLU A 493 -1.098 -13.586 10.184 1.00 21.32 H new ATOM 0 HG3 GLU A 493 -2.603 -12.839 10.682 1.00 21.32 H new ATOM 1559 N SER A 494 -2.963 -14.877 5.736 1.00 24.30 N ATOM 1560 CA SER A 494 -3.817 -15.207 4.609 1.00 62.34 C ATOM 1561 C SER A 494 -2.974 -15.752 3.455 1.00 24.35 C ATOM 1562 O SER A 494 -1.746 -15.777 3.536 1.00 12.15 O ATOM 1563 CB SER A 494 -4.617 -13.986 4.150 1.00 13.21 C ATOM 1564 OG SER A 494 -5.716 -13.711 5.015 1.00 23.45 O ATOM 0 H SER A 494 -2.236 -14.190 5.533 1.00 24.30 H new ATOM 0 HA SER A 494 -4.523 -15.973 4.928 1.00 62.34 H new ATOM 0 HB2 SER A 494 -3.961 -13.117 4.110 1.00 13.21 H new ATOM 0 HB3 SER A 494 -4.985 -14.154 3.138 1.00 13.21 H new ATOM 0 HG SER A 494 -5.406 -13.181 5.779 1.00 23.45 H new ATOM 1569 N SER A 495 -3.665 -16.177 2.408 1.00 12.43 N ATOM 1570 CA SER A 495 -2.996 -16.721 1.239 1.00 24.02 C ATOM 1571 C SER A 495 -3.747 -16.317 -0.031 1.00 61.04 C ATOM 1572 O SER A 495 -4.885 -15.855 0.039 1.00 75.23 O ATOM 1573 CB SER A 495 -2.885 -18.245 1.328 1.00 10.10 C ATOM 1574 OG SER A 495 -1.612 -18.660 1.815 1.00 4.24 O ATOM 0 H SER A 495 -4.683 -16.156 2.345 1.00 12.43 H new ATOM 0 HA SER A 495 -1.987 -16.311 1.201 1.00 24.02 H new ATOM 0 HB2 SER A 495 -3.667 -18.628 1.984 1.00 10.10 H new ATOM 0 HB3 SER A 495 -3.055 -18.679 0.343 1.00 10.10 H new ATOM 0 HG SER A 495 -1.582 -19.639 1.859 1.00 4.24 H new ATOM 1579 N PRO A 496 -3.064 -16.511 -1.190 1.00 4.11 N ATOM 1580 CA PRO A 496 -3.654 -16.173 -2.473 1.00 60.14 C ATOM 1581 C PRO A 496 -4.708 -17.203 -2.882 1.00 73.01 C ATOM 1582 O PRO A 496 -5.709 -16.859 -3.509 1.00 73.12 O ATOM 1583 CB PRO A 496 -2.483 -16.104 -3.439 1.00 52.11 C ATOM 1584 CG PRO A 496 -1.346 -16.859 -2.770 1.00 52.54 C ATOM 1585 CD PRO A 496 -1.713 -17.057 -1.309 1.00 11.45 C ATOM 0 HA PRO A 496 -4.191 -15.225 -2.451 1.00 60.14 H new ATOM 0 HB2 PRO A 496 -2.740 -16.555 -4.398 1.00 52.11 H new ATOM 0 HB3 PRO A 496 -2.201 -15.070 -3.638 1.00 52.11 H new ATOM 0 HG2 PRO A 496 -1.188 -17.821 -3.257 1.00 52.54 H new ATOM 0 HG3 PRO A 496 -0.414 -16.301 -2.857 1.00 52.54 H new ATOM 0 HD2 PRO A 496 -1.686 -18.111 -1.033 1.00 11.45 H new ATOM 0 HD3 PRO A 496 -1.016 -16.537 -0.651 1.00 11.45 H new ATOM 1590 N ALA A 497 -4.447 -18.447 -2.510 1.00 34.42 N ATOM 1591 CA ALA A 497 -5.360 -19.531 -2.830 1.00 11.53 C ATOM 1592 C ALA A 497 -6.715 -19.263 -2.170 1.00 42.24 C ATOM 1593 O ALA A 497 -7.749 -19.709 -2.664 1.00 40.11 O ATOM 1594 CB ALA A 497 -4.750 -20.861 -2.386 1.00 24.12 C ATOM 0 H ALA A 497 -3.616 -18.729 -1.990 1.00 34.42 H new ATOM 0 HA ALA A 497 -5.522 -19.590 -3.906 1.00 11.53 H new ATOM 0 HB1 ALA A 497 -5.435 -21.674 -2.626 1.00 24.12 H new ATOM 0 HB2 ALA A 497 -3.804 -21.019 -2.904 1.00 24.12 H new ATOM 0 HB3 ALA A 497 -4.575 -20.840 -1.310 1.00 24.12 H new ATOM 1600 N GLN A 498 -6.664 -18.535 -1.064 1.00 61.22 N ATOM 1601 CA GLN A 498 -7.873 -18.201 -0.332 1.00 55.32 C ATOM 1602 C GLN A 498 -8.694 -17.165 -1.105 1.00 20.21 C ATOM 1603 O GLN A 498 -9.833 -16.875 -0.743 1.00 51.21 O ATOM 1604 CB GLN A 498 -7.543 -17.698 1.074 1.00 42.31 C ATOM 1605 CG GLN A 498 -6.301 -18.400 1.629 1.00 31.22 C ATOM 1606 CD GLN A 498 -6.380 -18.532 3.152 1.00 52.12 C ATOM 1607 OE1 GLN A 498 -6.414 -17.557 3.883 1.00 2.31 O ATOM 1608 NE2 GLN A 498 -6.406 -19.789 3.584 1.00 54.42 N ATOM 0 H GLN A 498 -5.804 -18.167 -0.657 1.00 61.22 H new ATOM 0 HA GLN A 498 -8.471 -19.106 -0.228 1.00 55.32 H new ATOM 0 HB2 GLN A 498 -7.376 -16.621 1.049 1.00 42.31 H new ATOM 0 HB3 GLN A 498 -8.391 -17.874 1.736 1.00 42.31 H new ATOM 0 HG2 GLN A 498 -6.206 -19.388 1.179 1.00 31.22 H new ATOM 0 HG3 GLN A 498 -5.408 -17.838 1.355 1.00 31.22 H new ATOM 0 HE21 GLN A 498 -6.375 -20.559 2.916 1.00 54.42 H new ATOM 0 HE22 GLN A 498 -6.457 -19.984 4.584 1.00 54.42 H new ATOM 1615 N LEU A 499 -8.082 -16.637 -2.155 1.00 70.11 N ATOM 1616 CA LEU A 499 -8.742 -15.641 -2.981 1.00 62.53 C ATOM 1617 C LEU A 499 -9.422 -16.333 -4.164 1.00 4.34 C ATOM 1618 O LEU A 499 -9.096 -17.474 -4.490 1.00 3.15 O ATOM 1619 CB LEU A 499 -7.753 -14.548 -3.395 1.00 1.44 C ATOM 1620 CG LEU A 499 -6.759 -14.101 -2.321 1.00 23.02 C ATOM 1621 CD1 LEU A 499 -5.909 -12.929 -2.814 1.00 51.42 C ATOM 1622 CD2 LEU A 499 -7.479 -13.777 -1.011 1.00 4.01 C ATOM 0 H LEU A 499 -7.137 -16.880 -2.452 1.00 70.11 H new ATOM 0 HA LEU A 499 -9.524 -15.135 -2.415 1.00 62.53 H new ATOM 0 HB2 LEU A 499 -7.190 -14.903 -4.258 1.00 1.44 H new ATOM 0 HB3 LEU A 499 -8.321 -13.677 -3.722 1.00 1.44 H new ATOM 0 HG LEU A 499 -6.078 -14.928 -2.119 1.00 23.02 H new ATOM 0 HD11 LEU A 499 -5.211 -12.631 -2.031 1.00 51.42 H new ATOM 0 HD12 LEU A 499 -5.352 -13.231 -3.701 1.00 51.42 H new ATOM 0 HD13 LEU A 499 -6.557 -12.088 -3.061 1.00 51.42 H new ATOM 0 HD21 LEU A 499 -6.751 -13.462 -0.264 1.00 4.01 H new ATOM 0 HD22 LEU A 499 -8.197 -12.974 -1.179 1.00 4.01 H new ATOM 0 HD23 LEU A 499 -8.003 -14.664 -0.655 1.00 4.01 H new ATOM 1633 N SER A 500 -10.354 -15.617 -4.772 1.00 51.21 N ATOM 1634 CA SER A 500 -11.084 -16.149 -5.911 1.00 3.53 C ATOM 1635 C SER A 500 -10.121 -16.425 -7.068 1.00 3.31 C ATOM 1636 O SER A 500 -9.002 -15.915 -7.083 1.00 44.15 O ATOM 1637 CB SER A 500 -12.186 -15.186 -6.358 1.00 13.54 C ATOM 1638 OG SER A 500 -13.134 -14.942 -5.320 1.00 14.50 O ATOM 0 H SER A 500 -10.622 -14.672 -4.498 1.00 51.21 H new ATOM 0 HA SER A 500 -11.556 -17.084 -5.608 1.00 3.53 H new ATOM 0 HB2 SER A 500 -11.739 -14.242 -6.670 1.00 13.54 H new ATOM 0 HB3 SER A 500 -12.698 -15.599 -7.227 1.00 13.54 H new ATOM 0 HG SER A 500 -13.820 -14.322 -5.643 1.00 14.50 H new ATOM 1643 N SER A 501 -10.589 -17.232 -8.006 1.00 53.32 N ATOM 1644 CA SER A 501 -9.784 -17.582 -9.164 1.00 20.11 C ATOM 1645 C SER A 501 -9.570 -16.350 -10.045 1.00 13.32 C ATOM 1646 O SER A 501 -8.775 -16.383 -10.982 1.00 31.53 O ATOM 1647 CB SER A 501 -10.438 -18.705 -9.971 1.00 13.24 C ATOM 1648 OG SER A 501 -10.455 -19.938 -9.256 1.00 71.41 O ATOM 0 H SER A 501 -11.517 -17.655 -7.989 1.00 53.32 H new ATOM 0 HA SER A 501 -8.817 -17.941 -8.812 1.00 20.11 H new ATOM 0 HB2 SER A 501 -11.459 -18.420 -10.227 1.00 13.24 H new ATOM 0 HB3 SER A 501 -9.900 -18.838 -10.909 1.00 13.24 H new ATOM 0 HG SER A 501 -10.882 -20.629 -9.805 1.00 71.41 H new ATOM 1653 N ASP A 502 -10.295 -15.291 -9.713 1.00 23.22 N ATOM 1654 CA ASP A 502 -10.195 -14.050 -10.462 1.00 30.14 C ATOM 1655 C ASP A 502 -9.005 -13.241 -9.943 1.00 40.55 C ATOM 1656 O ASP A 502 -8.345 -12.540 -10.708 1.00 11.42 O ATOM 1657 CB ASP A 502 -11.457 -13.201 -10.292 1.00 63.40 C ATOM 1658 CG ASP A 502 -12.770 -13.986 -10.295 1.00 63.13 C ATOM 1659 OD1 ASP A 502 -12.886 -15.041 -9.654 1.00 25.24 O ATOM 1660 OD2 ASP A 502 -13.714 -13.465 -11.002 1.00 32.31 O ATOM 0 H ASP A 502 -10.954 -15.267 -8.935 1.00 23.22 H new ATOM 0 HA ASP A 502 -10.069 -14.300 -11.515 1.00 30.14 H new ATOM 0 HB2 ASP A 502 -11.383 -12.650 -9.354 1.00 63.40 H new ATOM 0 HB3 ASP A 502 -11.491 -12.463 -11.093 1.00 63.40 H new ATOM 1665 N THR A 503 -8.768 -13.364 -8.645 1.00 11.11 N ATOM 1666 CA THR A 503 -7.670 -12.652 -8.014 1.00 1.11 C ATOM 1667 C THR A 503 -6.401 -12.772 -8.861 1.00 4.32 C ATOM 1668 O THR A 503 -5.573 -11.862 -8.877 1.00 31.41 O ATOM 1669 CB THR A 503 -7.507 -13.197 -6.593 1.00 32.41 C ATOM 1670 OG1 THR A 503 -8.573 -12.594 -5.866 1.00 14.03 O ATOM 1671 CG2 THR A 503 -6.245 -12.673 -5.907 1.00 54.30 C ATOM 0 H THR A 503 -9.318 -13.946 -8.013 1.00 11.11 H new ATOM 0 HA THR A 503 -7.878 -11.584 -7.945 1.00 1.11 H new ATOM 0 HB THR A 503 -7.478 -14.286 -6.623 1.00 32.41 H new ATOM 0 HG1 THR A 503 -9.310 -13.234 -5.775 1.00 14.03 H new ATOM 0 HG21 THR A 503 -6.177 -13.090 -4.902 1.00 54.30 H new ATOM 0 HG22 THR A 503 -5.368 -12.969 -6.483 1.00 54.30 H new ATOM 0 HG23 THR A 503 -6.289 -11.586 -5.846 1.00 54.30 H new ATOM 1679 N ALA A 504 -6.288 -13.902 -9.542 1.00 21.41 N ATOM 1680 CA ALA A 504 -5.133 -14.154 -10.388 1.00 50.31 C ATOM 1681 C ALA A 504 -5.123 -13.146 -11.541 1.00 23.34 C ATOM 1682 O ALA A 504 -4.073 -12.611 -11.892 1.00 12.01 O ATOM 1683 CB ALA A 504 -5.165 -15.602 -10.880 1.00 71.34 C ATOM 0 H ALA A 504 -6.977 -14.654 -9.526 1.00 21.41 H new ATOM 0 HA ALA A 504 -4.209 -14.022 -9.825 1.00 50.31 H new ATOM 0 HB1 ALA A 504 -4.299 -15.790 -11.514 1.00 71.34 H new ATOM 0 HB2 ALA A 504 -5.142 -16.277 -10.025 1.00 71.34 H new ATOM 0 HB3 ALA A 504 -6.077 -15.772 -11.452 1.00 71.34 H new ATOM 1689 N SER A 505 -6.304 -12.921 -12.097 1.00 52.13 N ATOM 1690 CA SER A 505 -6.443 -11.987 -13.203 1.00 45.42 C ATOM 1691 C SER A 505 -6.499 -10.554 -12.673 1.00 55.15 C ATOM 1692 O SER A 505 -6.333 -9.600 -13.433 1.00 3.12 O ATOM 1693 CB SER A 505 -7.693 -12.297 -14.029 1.00 42.13 C ATOM 1694 OG SER A 505 -7.959 -11.283 -14.995 1.00 0.30 O ATOM 0 H SER A 505 -7.173 -13.368 -11.804 1.00 52.13 H new ATOM 0 HA SER A 505 -5.574 -12.093 -13.853 1.00 45.42 H new ATOM 0 HB2 SER A 505 -7.566 -13.255 -14.534 1.00 42.13 H new ATOM 0 HB3 SER A 505 -8.551 -12.399 -13.364 1.00 42.13 H new ATOM 0 HG SER A 505 -8.763 -11.518 -15.503 1.00 0.30 H new ATOM 1699 N LEU A 506 -6.734 -10.445 -11.373 1.00 54.53 N ATOM 1700 CA LEU A 506 -6.813 -9.142 -10.734 1.00 2.45 C ATOM 1701 C LEU A 506 -5.400 -8.588 -10.539 1.00 5.40 C ATOM 1702 O LEU A 506 -5.179 -7.384 -10.668 1.00 10.25 O ATOM 1703 CB LEU A 506 -7.624 -9.231 -9.439 1.00 11.14 C ATOM 1704 CG LEU A 506 -9.089 -9.647 -9.591 1.00 51.10 C ATOM 1705 CD1 LEU A 506 -9.703 -9.999 -8.235 1.00 63.14 C ATOM 1706 CD2 LEU A 506 -9.892 -8.569 -10.322 1.00 41.34 C ATOM 0 H LEU A 506 -6.872 -11.237 -10.745 1.00 54.53 H new ATOM 0 HA LEU A 506 -7.347 -8.436 -11.370 1.00 2.45 H new ATOM 0 HB2 LEU A 506 -7.133 -9.941 -8.774 1.00 11.14 H new ATOM 0 HB3 LEU A 506 -7.592 -8.259 -8.947 1.00 11.14 H new ATOM 0 HG LEU A 506 -9.126 -10.547 -10.204 1.00 51.10 H new ATOM 0 HD11 LEU A 506 -10.744 -10.291 -8.372 1.00 63.14 H new ATOM 0 HD12 LEU A 506 -9.150 -10.825 -7.789 1.00 63.14 H new ATOM 0 HD13 LEU A 506 -9.653 -9.132 -7.577 1.00 63.14 H new ATOM 0 HD21 LEU A 506 -10.929 -8.890 -10.417 1.00 41.34 H new ATOM 0 HD22 LEU A 506 -9.850 -7.638 -9.757 1.00 41.34 H new ATOM 0 HD23 LEU A 506 -9.469 -8.410 -11.314 1.00 41.34 H new ATOM 1717 N LEU A 507 -4.481 -9.491 -10.229 1.00 54.20 N ATOM 1718 CA LEU A 507 -3.098 -9.108 -10.014 1.00 71.22 C ATOM 1719 C LEU A 507 -2.236 -9.665 -11.149 1.00 11.41 C ATOM 1720 O LEU A 507 -1.015 -9.740 -11.028 1.00 71.24 O ATOM 1721 CB LEU A 507 -2.632 -9.536 -8.621 1.00 52.30 C ATOM 1722 CG LEU A 507 -2.385 -11.033 -8.428 1.00 23.30 C ATOM 1723 CD1 LEU A 507 -0.913 -11.380 -8.657 1.00 11.15 C ATOM 1724 CD2 LEU A 507 -2.875 -11.496 -7.055 1.00 1.40 C ATOM 0 H LEU A 507 -4.669 -10.488 -10.122 1.00 54.20 H new ATOM 0 HA LEU A 507 -2.996 -8.023 -10.039 1.00 71.22 H new ATOM 0 HB2 LEU A 507 -1.710 -9.003 -8.388 1.00 52.30 H new ATOM 0 HB3 LEU A 507 -3.379 -9.214 -7.895 1.00 52.30 H new ATOM 0 HG LEU A 507 -2.964 -11.574 -9.177 1.00 23.30 H new ATOM 0 HD11 LEU A 507 -0.765 -12.450 -8.513 1.00 11.15 H new ATOM 0 HD12 LEU A 507 -0.629 -11.107 -9.673 1.00 11.15 H new ATOM 0 HD13 LEU A 507 -0.295 -10.830 -7.948 1.00 11.15 H new ATOM 0 HD21 LEU A 507 -2.688 -12.564 -6.943 1.00 1.40 H new ATOM 0 HD22 LEU A 507 -2.343 -10.951 -6.276 1.00 1.40 H new ATOM 0 HD23 LEU A 507 -3.944 -11.304 -6.966 1.00 1.40 H new ATOM 1735 N SER A 508 -2.908 -10.044 -12.227 1.00 33.42 N ATOM 1736 CA SER A 508 -2.218 -10.595 -13.382 1.00 14.43 C ATOM 1737 C SER A 508 -1.299 -9.537 -13.996 1.00 44.41 C ATOM 1738 O SER A 508 -1.768 -8.604 -14.647 1.00 32.12 O ATOM 1739 CB SER A 508 -3.215 -11.102 -14.427 1.00 24.33 C ATOM 1740 OG SER A 508 -4.317 -10.214 -14.590 1.00 44.33 O ATOM 0 H SER A 508 -3.921 -9.981 -12.325 1.00 33.42 H new ATOM 0 HA SER A 508 -1.617 -11.441 -13.050 1.00 14.43 H new ATOM 0 HB2 SER A 508 -2.706 -11.227 -15.383 1.00 24.33 H new ATOM 0 HB3 SER A 508 -3.582 -12.085 -14.131 1.00 24.33 H new ATOM 0 HG SER A 508 -3.987 -9.296 -14.680 1.00 44.33 H new ATOM 1745 N GLY A 509 -0.007 -9.717 -13.765 1.00 73.41 N ATOM 1746 CA GLY A 509 0.983 -8.790 -14.288 1.00 22.00 C ATOM 1747 C GLY A 509 1.651 -8.006 -13.156 1.00 55.42 C ATOM 1748 O GLY A 509 2.734 -7.453 -13.336 1.00 41.11 O ATOM 0 H GLY A 509 0.377 -10.491 -13.223 1.00 73.41 H new ATOM 0 HA2 GLY A 509 1.739 -9.338 -14.851 1.00 22.00 H new ATOM 0 HA3 GLY A 509 0.507 -8.098 -14.983 1.00 22.00 H new ATOM 1752 N LEU A 510 0.976 -7.986 -12.016 1.00 43.22 N ATOM 1753 CA LEU A 510 1.491 -7.279 -10.855 1.00 0.32 C ATOM 1754 C LEU A 510 2.670 -8.060 -10.271 1.00 53.22 C ATOM 1755 O LEU A 510 3.090 -9.071 -10.832 1.00 61.34 O ATOM 1756 CB LEU A 510 0.370 -7.015 -9.848 1.00 33.31 C ATOM 1757 CG LEU A 510 -0.856 -6.275 -10.389 1.00 62.04 C ATOM 1758 CD1 LEU A 510 -1.647 -5.623 -9.253 1.00 71.14 C ATOM 1759 CD2 LEU A 510 -0.454 -5.262 -11.464 1.00 13.24 C ATOM 0 H LEU A 510 0.078 -8.447 -11.871 1.00 43.22 H new ATOM 0 HA LEU A 510 1.868 -6.297 -11.142 1.00 0.32 H new ATOM 0 HB2 LEU A 510 0.042 -7.971 -9.440 1.00 33.31 H new ATOM 0 HB3 LEU A 510 0.781 -6.439 -9.019 1.00 33.31 H new ATOM 0 HG LEU A 510 -1.514 -7.003 -10.863 1.00 62.04 H new ATOM 0 HD11 LEU A 510 -2.513 -5.104 -9.664 1.00 71.14 H new ATOM 0 HD12 LEU A 510 -1.982 -6.391 -8.555 1.00 71.14 H new ATOM 0 HD13 LEU A 510 -1.011 -4.909 -8.729 1.00 71.14 H new ATOM 0 HD21 LEU A 510 -1.343 -4.750 -11.832 1.00 13.24 H new ATOM 0 HD22 LEU A 510 0.235 -4.533 -11.037 1.00 13.24 H new ATOM 0 HD23 LEU A 510 0.033 -5.781 -12.289 1.00 13.24 H new ATOM 1770 N VAL A 511 3.172 -7.560 -9.150 1.00 4.44 N ATOM 1771 CA VAL A 511 4.295 -8.197 -8.484 1.00 30.01 C ATOM 1772 C VAL A 511 3.845 -8.712 -7.115 1.00 41.23 C ATOM 1773 O VAL A 511 3.848 -7.966 -6.136 1.00 3.10 O ATOM 1774 CB VAL A 511 5.474 -7.226 -8.399 1.00 54.54 C ATOM 1775 CG1 VAL A 511 6.538 -7.739 -7.428 1.00 75.25 C ATOM 1776 CG2 VAL A 511 6.071 -6.967 -9.783 1.00 23.54 C ATOM 0 H VAL A 511 2.821 -6.722 -8.687 1.00 4.44 H new ATOM 0 HA VAL A 511 4.641 -9.057 -9.058 1.00 30.01 H new ATOM 0 HB VAL A 511 5.100 -6.277 -8.013 1.00 54.54 H new ATOM 0 HG11 VAL A 511 7.365 -7.030 -7.386 1.00 75.25 H new ATOM 0 HG12 VAL A 511 6.102 -7.847 -6.435 1.00 75.25 H new ATOM 0 HG13 VAL A 511 6.906 -8.706 -7.770 1.00 75.25 H new ATOM 0 HG21 VAL A 511 6.907 -6.274 -9.695 1.00 23.54 H new ATOM 0 HG22 VAL A 511 6.422 -7.907 -10.209 1.00 23.54 H new ATOM 0 HG23 VAL A 511 5.309 -6.536 -10.433 1.00 23.54 H new ATOM 1786 N ARG A 512 3.468 -9.981 -7.089 1.00 31.34 N ATOM 1787 CA ARG A 512 3.016 -10.604 -5.857 1.00 64.34 C ATOM 1788 C ARG A 512 4.063 -10.423 -4.756 1.00 62.13 C ATOM 1789 O ARG A 512 5.209 -10.841 -4.911 1.00 65.55 O ATOM 1790 CB ARG A 512 2.750 -12.097 -6.059 1.00 70.13 C ATOM 1791 CG ARG A 512 2.298 -12.755 -4.753 1.00 74.33 C ATOM 1792 CD ARG A 512 0.779 -12.665 -4.594 1.00 62.23 C ATOM 1793 NE ARG A 512 0.123 -13.729 -5.386 1.00 13.31 N ATOM 1794 CZ ARG A 512 -1.216 -13.875 -5.496 1.00 72.53 C ATOM 1795 NH1 ARG A 512 -2.051 -13.024 -4.864 1.00 55.32 N ATOM 1796 NH2 ARG A 512 -1.693 -14.861 -6.233 1.00 41.23 N ATOM 0 H ARG A 512 3.466 -10.596 -7.903 1.00 31.34 H new ATOM 0 HA ARG A 512 2.086 -10.119 -5.562 1.00 64.34 H new ATOM 0 HB2 ARG A 512 1.985 -12.234 -6.823 1.00 70.13 H new ATOM 0 HB3 ARG A 512 3.654 -12.585 -6.423 1.00 70.13 H new ATOM 0 HG2 ARG A 512 2.608 -13.800 -4.741 1.00 74.33 H new ATOM 0 HG3 ARG A 512 2.786 -12.269 -3.908 1.00 74.33 H new ATOM 0 HD2 ARG A 512 0.509 -12.764 -3.543 1.00 62.23 H new ATOM 0 HD3 ARG A 512 0.428 -11.687 -4.923 1.00 62.23 H new ATOM 0 HE ARG A 512 0.719 -14.394 -5.880 1.00 13.31 H new ATOM 0 HH11 ARG A 512 -1.673 -12.264 -4.298 1.00 55.32 H new ATOM 0 HH12 ARG A 512 -3.060 -13.141 -4.952 1.00 55.32 H new ATOM 0 HH21 ARG A 512 -1.054 -15.498 -6.708 1.00 41.23 H new ATOM 0 HH22 ARG A 512 -2.701 -14.986 -6.327 1.00 41.23 H new ATOM 1806 N LEU A 513 3.631 -9.800 -3.669 1.00 13.43 N ATOM 1807 CA LEU A 513 4.517 -9.560 -2.544 1.00 65.15 C ATOM 1808 C LEU A 513 4.101 -10.452 -1.373 1.00 45.42 C ATOM 1809 O LEU A 513 2.935 -10.466 -0.982 1.00 41.21 O ATOM 1810 CB LEU A 513 4.552 -8.069 -2.199 1.00 4.35 C ATOM 1811 CG LEU A 513 5.910 -7.512 -1.766 1.00 71.25 C ATOM 1812 CD1 LEU A 513 7.019 -7.976 -2.712 1.00 61.24 C ATOM 1813 CD2 LEU A 513 5.863 -5.988 -1.641 1.00 30.24 C ATOM 0 H LEU A 513 2.679 -9.455 -3.544 1.00 13.43 H new ATOM 0 HA LEU A 513 5.541 -9.829 -2.802 1.00 65.15 H new ATOM 0 HB2 LEU A 513 4.212 -7.507 -3.069 1.00 4.35 H new ATOM 0 HB3 LEU A 513 3.834 -7.884 -1.400 1.00 4.35 H new ATOM 0 HG LEU A 513 6.143 -7.909 -0.778 1.00 71.25 H new ATOM 0 HD11 LEU A 513 7.974 -7.566 -2.382 1.00 61.24 H new ATOM 0 HD12 LEU A 513 7.070 -9.065 -2.707 1.00 61.24 H new ATOM 0 HD13 LEU A 513 6.805 -7.628 -3.722 1.00 61.24 H new ATOM 0 HD21 LEU A 513 6.841 -5.618 -1.332 1.00 30.24 H new ATOM 0 HD22 LEU A 513 5.598 -5.552 -2.604 1.00 30.24 H new ATOM 0 HD23 LEU A 513 5.117 -5.707 -0.898 1.00 30.24 H new ATOM 1824 N ASP A 514 5.079 -11.175 -0.845 1.00 50.44 N ATOM 1825 CA ASP A 514 4.828 -12.068 0.273 1.00 42.45 C ATOM 1826 C ASP A 514 5.672 -11.626 1.472 1.00 13.13 C ATOM 1827 O ASP A 514 6.574 -10.803 1.331 1.00 54.20 O ATOM 1828 CB ASP A 514 5.216 -13.507 -0.073 1.00 43.34 C ATOM 1829 CG ASP A 514 5.018 -13.894 -1.541 1.00 64.31 C ATOM 1830 OD1 ASP A 514 5.976 -13.929 -2.326 1.00 71.13 O ATOM 1831 OD2 ASP A 514 3.802 -14.171 -1.871 1.00 75.54 O ATOM 0 H ASP A 514 6.045 -11.160 -1.171 1.00 50.44 H new ATOM 0 HA ASP A 514 3.764 -12.028 0.505 1.00 42.45 H new ATOM 0 HB2 ASP A 514 6.263 -13.658 0.189 1.00 43.34 H new ATOM 0 HB3 ASP A 514 4.631 -14.185 0.548 1.00 43.34 H new ATOM 1836 N GLU A 515 5.348 -12.194 2.624 1.00 32.04 N ATOM 1837 CA GLU A 515 6.063 -11.869 3.846 1.00 71.51 C ATOM 1838 C GLU A 515 6.741 -13.119 4.412 1.00 20.51 C ATOM 1839 O GLU A 515 7.306 -13.082 5.504 1.00 63.41 O ATOM 1840 CB GLU A 515 5.129 -11.237 4.878 1.00 52.10 C ATOM 1841 CG GLU A 515 5.857 -10.996 6.202 1.00 52.55 C ATOM 1842 CD GLU A 515 5.181 -9.881 7.003 1.00 61.24 C ATOM 1843 OE1 GLU A 515 4.013 -10.019 7.395 1.00 13.04 O ATOM 1844 OE2 GLU A 515 5.915 -8.842 7.217 1.00 55.11 O ATOM 0 H GLU A 515 4.599 -12.878 2.737 1.00 32.04 H new ATOM 0 HA GLU A 515 6.834 -11.136 3.608 1.00 71.51 H new ATOM 0 HB2 GLU A 515 4.743 -10.293 4.494 1.00 52.10 H new ATOM 0 HB3 GLU A 515 4.271 -11.888 5.044 1.00 52.10 H new ATOM 0 HG2 GLU A 515 5.868 -11.915 6.788 1.00 52.55 H new ATOM 0 HG3 GLU A 515 6.896 -10.730 6.007 1.00 52.55 H new ATOM 1850 N HIS A 516 6.660 -14.197 3.644 1.00 60.13 N ATOM 1851 CA HIS A 516 7.259 -15.454 4.055 1.00 11.04 C ATOM 1852 C HIS A 516 8.284 -15.902 3.012 1.00 70.24 C ATOM 1853 O HIS A 516 8.896 -16.960 3.149 1.00 32.32 O ATOM 1854 CB HIS A 516 6.181 -16.509 4.317 1.00 62.41 C ATOM 1855 CG HIS A 516 5.041 -16.480 3.326 1.00 64.32 C ATOM 1856 ND1 HIS A 516 3.769 -16.931 3.634 1.00 61.15 N ATOM 1857 CD2 HIS A 516 4.995 -16.048 2.033 1.00 22.13 C ATOM 1858 CE1 HIS A 516 3.001 -16.774 2.566 1.00 1.10 C ATOM 1859 NE2 HIS A 516 3.762 -16.228 1.574 1.00 63.44 N ATOM 0 H HIS A 516 6.188 -14.224 2.740 1.00 60.13 H new ATOM 0 HA HIS A 516 7.789 -15.316 4.997 1.00 11.04 H new ATOM 0 HB2 HIS A 516 6.641 -17.497 4.297 1.00 62.41 H new ATOM 0 HB3 HIS A 516 5.781 -16.364 5.320 1.00 62.41 H new ATOM 0 HD2 HIS A 516 5.821 -15.630 1.477 1.00 22.13 H new ATOM 0 HE1 HIS A 516 1.955 -17.033 2.493 1.00 1.10 H new ATOM 0 HE2 HIS A 516 3.438 -15.996 0.635 1.00 63.44 H new ATOM 1866 N SER A 517 8.441 -15.071 1.990 1.00 11.44 N ATOM 1867 CA SER A 517 9.381 -15.367 0.923 1.00 13.23 C ATOM 1868 C SER A 517 10.740 -14.736 1.233 1.00 72.13 C ATOM 1869 O SER A 517 10.809 -13.590 1.674 1.00 11.03 O ATOM 1870 CB SER A 517 8.859 -14.869 -0.426 1.00 11.15 C ATOM 1871 OG SER A 517 9.301 -15.687 -1.506 1.00 23.30 O ATOM 0 H SER A 517 7.933 -14.194 1.880 1.00 11.44 H new ATOM 0 HA SER A 517 9.496 -16.449 0.859 1.00 13.23 H new ATOM 0 HB2 SER A 517 7.769 -14.850 -0.408 1.00 11.15 H new ATOM 0 HB3 SER A 517 9.193 -13.844 -0.588 1.00 11.15 H new ATOM 0 HG SER A 517 8.945 -15.336 -2.349 1.00 23.30 H new ATOM 1876 N GLN A 518 11.786 -15.511 0.988 1.00 41.11 N ATOM 1877 CA GLN A 518 13.140 -15.041 1.235 1.00 11.42 C ATOM 1878 C GLN A 518 13.595 -14.117 0.105 1.00 50.41 C ATOM 1879 O GLN A 518 14.729 -13.640 0.107 1.00 62.30 O ATOM 1880 CB GLN A 518 14.105 -16.216 1.406 1.00 62.32 C ATOM 1881 CG GLN A 518 14.175 -17.057 0.131 1.00 32.34 C ATOM 1882 CD GLN A 518 15.506 -17.808 0.042 1.00 71.11 C ATOM 1883 OE1 GLN A 518 15.930 -18.481 0.966 1.00 32.34 O ATOM 1884 NE2 GLN A 518 16.137 -17.654 -1.118 1.00 34.05 N ATOM 0 H GLN A 518 11.724 -16.461 0.621 1.00 41.11 H new ATOM 0 HA GLN A 518 13.143 -14.473 2.165 1.00 11.42 H new ATOM 0 HB2 GLN A 518 15.098 -15.842 1.654 1.00 62.32 H new ATOM 0 HB3 GLN A 518 13.781 -16.839 2.240 1.00 62.32 H new ATOM 0 HG2 GLN A 518 13.350 -17.769 0.115 1.00 32.34 H new ATOM 0 HG3 GLN A 518 14.058 -16.413 -0.741 1.00 32.34 H new ATOM 0 HE21 GLN A 518 15.725 -17.076 -1.850 1.00 34.05 H new ATOM 0 HE22 GLN A 518 17.033 -18.114 -1.276 1.00 34.05 H new ATOM 1891 N ILE A 519 12.688 -13.890 -0.834 1.00 24.13 N ATOM 1892 CA ILE A 519 12.983 -13.032 -1.968 1.00 72.14 C ATOM 1893 C ILE A 519 12.200 -11.724 -1.830 1.00 62.11 C ATOM 1894 O ILE A 519 12.623 -10.686 -2.335 1.00 22.23 O ATOM 1895 CB ILE A 519 12.719 -13.770 -3.283 1.00 44.11 C ATOM 1896 CG1 ILE A 519 12.057 -12.847 -4.307 1.00 1.53 C ATOM 1897 CG2 ILE A 519 11.901 -15.041 -3.043 1.00 75.24 C ATOM 1898 CD1 ILE A 519 13.037 -11.779 -4.796 1.00 53.22 C ATOM 0 H ILE A 519 11.748 -14.286 -0.832 1.00 24.13 H new ATOM 0 HA ILE A 519 14.041 -12.772 -1.982 1.00 72.14 H new ATOM 0 HB ILE A 519 13.678 -14.078 -3.701 1.00 44.11 H new ATOM 0 HG12 ILE A 519 11.700 -13.434 -5.154 1.00 1.53 H new ATOM 0 HG13 ILE A 519 11.185 -12.369 -3.861 1.00 1.53 H new ATOM 0 HG21 ILE A 519 11.727 -15.547 -3.993 1.00 75.24 H new ATOM 0 HG22 ILE A 519 12.448 -15.705 -2.373 1.00 75.24 H new ATOM 0 HG23 ILE A 519 10.944 -14.778 -2.592 1.00 75.24 H new ATOM 0 HD11 ILE A 519 12.541 -11.136 -5.523 1.00 53.22 H new ATOM 0 HD12 ILE A 519 13.373 -11.179 -3.950 1.00 53.22 H new ATOM 0 HD13 ILE A 519 13.896 -12.260 -5.263 1.00 53.22 H new ATOM 1909 N PHE A 520 11.071 -11.818 -1.142 1.00 54.52 N ATOM 1910 CA PHE A 520 10.225 -10.655 -0.930 1.00 22.43 C ATOM 1911 C PHE A 520 11.066 -9.411 -0.645 1.00 53.04 C ATOM 1912 O PHE A 520 10.708 -8.306 -1.056 1.00 31.24 O ATOM 1913 CB PHE A 520 9.349 -10.955 0.288 1.00 24.25 C ATOM 1914 CG PHE A 520 8.914 -9.710 1.062 1.00 3.22 C ATOM 1915 CD1 PHE A 520 8.314 -8.678 0.411 1.00 35.44 C ATOM 1916 CD2 PHE A 520 9.126 -9.634 2.404 1.00 22.43 C ATOM 1917 CE1 PHE A 520 7.909 -7.523 1.129 1.00 11.44 C ATOM 1918 CE2 PHE A 520 8.723 -8.478 3.123 1.00 15.33 C ATOM 1919 CZ PHE A 520 8.122 -7.447 2.470 1.00 72.24 C ATOM 0 H PHE A 520 10.723 -12.681 -0.724 1.00 54.52 H new ATOM 0 HA PHE A 520 9.629 -10.461 -1.822 1.00 22.43 H new ATOM 0 HB2 PHE A 520 8.461 -11.495 -0.040 1.00 24.25 H new ATOM 0 HB3 PHE A 520 9.894 -11.617 0.961 1.00 24.25 H new ATOM 0 HD1 PHE A 520 8.145 -8.737 -0.654 1.00 35.44 H new ATOM 0 HD2 PHE A 520 9.601 -10.454 2.923 1.00 22.43 H new ATOM 0 HE1 PHE A 520 7.432 -6.705 0.611 1.00 11.44 H new ATOM 0 HE2 PHE A 520 8.893 -8.417 4.188 1.00 15.33 H new ATOM 0 HZ PHE A 520 7.814 -6.568 3.017 1.00 72.24 H new ATOM 1928 N ALA A 521 12.170 -9.627 0.056 1.00 11.42 N ATOM 1929 CA ALA A 521 13.063 -8.535 0.400 1.00 64.42 C ATOM 1930 C ALA A 521 13.507 -7.823 -0.879 1.00 20.40 C ATOM 1931 O ALA A 521 13.475 -6.595 -0.953 1.00 22.11 O ATOM 1932 CB ALA A 521 14.247 -9.080 1.204 1.00 54.14 C ATOM 0 H ALA A 521 12.466 -10.543 0.395 1.00 11.42 H new ATOM 0 HA ALA A 521 12.552 -7.803 1.025 1.00 64.42 H new ATOM 0 HB1 ALA A 521 14.918 -8.261 1.463 1.00 54.14 H new ATOM 0 HB2 ALA A 521 13.881 -9.552 2.116 1.00 54.14 H new ATOM 0 HB3 ALA A 521 14.785 -9.815 0.606 1.00 54.14 H new ATOM 1938 N ARG A 522 13.911 -8.622 -1.855 1.00 64.32 N ATOM 1939 CA ARG A 522 14.361 -8.084 -3.127 1.00 21.34 C ATOM 1940 C ARG A 522 13.170 -7.568 -3.936 1.00 14.25 C ATOM 1941 O ARG A 522 13.336 -6.759 -4.847 1.00 60.34 O ATOM 1942 CB ARG A 522 15.102 -9.143 -3.943 1.00 33.45 C ATOM 1943 CG ARG A 522 16.454 -9.478 -3.310 1.00 71.13 C ATOM 1944 CD ARG A 522 16.283 -10.429 -2.122 1.00 62.00 C ATOM 1945 NE ARG A 522 17.603 -10.939 -1.689 1.00 4.51 N ATOM 1946 CZ ARG A 522 18.204 -12.027 -2.217 1.00 72.23 C ATOM 1947 NH1 ARG A 522 17.608 -12.727 -3.204 1.00 33.25 N ATOM 1948 NH2 ARG A 522 19.384 -12.394 -1.754 1.00 4.21 N ATOM 0 H ARG A 522 13.936 -9.640 -1.790 1.00 64.32 H new ATOM 0 HA ARG A 522 15.045 -7.262 -2.915 1.00 21.34 H new ATOM 0 HB2 ARG A 522 14.495 -10.046 -4.010 1.00 33.45 H new ATOM 0 HB3 ARG A 522 15.252 -8.783 -4.961 1.00 33.45 H new ATOM 0 HG2 ARG A 522 17.105 -9.935 -4.055 1.00 71.13 H new ATOM 0 HG3 ARG A 522 16.942 -8.561 -2.979 1.00 71.13 H new ATOM 0 HD2 ARG A 522 15.796 -9.910 -1.297 1.00 62.00 H new ATOM 0 HD3 ARG A 522 15.636 -11.261 -2.401 1.00 62.00 H new ATOM 0 HE ARG A 522 18.089 -10.438 -0.946 1.00 4.51 H new ATOM 0 HH11 ARG A 522 16.696 -12.436 -3.557 1.00 33.25 H new ATOM 0 HH12 ARG A 522 18.069 -13.548 -3.597 1.00 33.25 H new ATOM 0 HH21 ARG A 522 19.828 -11.858 -1.008 1.00 4.21 H new ATOM 0 HH22 ARG A 522 19.852 -13.213 -2.142 1.00 4.21 H new ATOM 1958 N LYS A 523 11.993 -8.060 -3.575 1.00 63.24 N ATOM 1959 CA LYS A 523 10.774 -7.658 -4.256 1.00 71.43 C ATOM 1960 C LYS A 523 10.400 -6.237 -3.829 1.00 43.55 C ATOM 1961 O LYS A 523 10.062 -5.402 -4.666 1.00 73.12 O ATOM 1962 CB LYS A 523 9.664 -8.684 -4.016 1.00 74.30 C ATOM 1963 CG LYS A 523 10.140 -10.097 -4.362 1.00 72.45 C ATOM 1964 CD LYS A 523 10.724 -10.147 -5.776 1.00 1.34 C ATOM 1965 CE LYS A 523 9.727 -9.601 -6.801 1.00 3.20 C ATOM 1966 NZ LYS A 523 10.007 -10.157 -8.143 1.00 12.24 N ATOM 0 H LYS A 523 11.858 -8.733 -2.820 1.00 63.24 H new ATOM 0 HA LYS A 523 10.930 -7.636 -5.335 1.00 71.43 H new ATOM 0 HB2 LYS A 523 9.349 -8.647 -2.973 1.00 74.30 H new ATOM 0 HB3 LYS A 523 8.793 -8.431 -4.621 1.00 74.30 H new ATOM 0 HG2 LYS A 523 10.893 -10.418 -3.642 1.00 72.45 H new ATOM 0 HG3 LYS A 523 9.306 -10.795 -4.284 1.00 72.45 H new ATOM 0 HD2 LYS A 523 11.645 -9.565 -5.814 1.00 1.34 H new ATOM 0 HD3 LYS A 523 10.985 -11.174 -6.029 1.00 1.34 H new ATOM 0 HE2 LYS A 523 8.711 -9.856 -6.500 1.00 3.20 H new ATOM 0 HE3 LYS A 523 9.787 -8.513 -6.832 1.00 3.20 H new ATOM 0 HZ1 LYS A 523 9.322 -9.776 -8.826 1.00 12.24 H new ATOM 0 HZ2 LYS A 523 10.970 -9.893 -8.434 1.00 12.24 H new ATOM 0 HZ3 LYS A 523 9.927 -11.193 -8.113 1.00 12.24 H new ATOM 1975 N VAL A 524 10.474 -6.007 -2.526 1.00 63.00 N ATOM 1976 CA VAL A 524 10.148 -4.701 -1.978 1.00 44.44 C ATOM 1977 C VAL A 524 11.291 -3.727 -2.274 1.00 11.42 C ATOM 1978 O VAL A 524 11.052 -2.567 -2.605 1.00 20.51 O ATOM 1979 CB VAL A 524 9.839 -4.823 -0.484 1.00 62.03 C ATOM 1980 CG1 VAL A 524 11.122 -4.768 0.347 1.00 5.34 C ATOM 1981 CG2 VAL A 524 8.850 -3.743 -0.038 1.00 33.40 C ATOM 0 H VAL A 524 10.755 -6.702 -1.834 1.00 63.00 H new ATOM 0 HA VAL A 524 9.251 -4.302 -2.451 1.00 44.44 H new ATOM 0 HB VAL A 524 9.372 -5.794 -0.317 1.00 62.03 H new ATOM 0 HG11 VAL A 524 10.874 -4.857 1.405 1.00 5.34 H new ATOM 0 HG12 VAL A 524 11.778 -5.589 0.058 1.00 5.34 H new ATOM 0 HG13 VAL A 524 11.629 -3.819 0.171 1.00 5.34 H new ATOM 0 HG21 VAL A 524 8.648 -3.853 1.027 1.00 33.40 H new ATOM 0 HG22 VAL A 524 9.277 -2.758 -0.227 1.00 33.40 H new ATOM 0 HG23 VAL A 524 7.920 -3.848 -0.597 1.00 33.40 H new ATOM 1991 N ALA A 525 12.507 -4.236 -2.145 1.00 1.20 N ATOM 1992 CA ALA A 525 13.687 -3.427 -2.395 1.00 43.44 C ATOM 1993 C ALA A 525 13.829 -3.189 -3.899 1.00 22.14 C ATOM 1994 O ALA A 525 14.713 -2.454 -4.335 1.00 70.15 O ATOM 1995 CB ALA A 525 14.915 -4.115 -1.795 1.00 30.51 C ATOM 0 H ALA A 525 12.701 -5.199 -1.870 1.00 1.20 H new ATOM 0 HA ALA A 525 13.592 -2.453 -1.915 1.00 43.44 H new ATOM 0 HB1 ALA A 525 15.800 -3.508 -1.983 1.00 30.51 H new ATOM 0 HB2 ALA A 525 14.777 -4.233 -0.720 1.00 30.51 H new ATOM 0 HB3 ALA A 525 15.043 -5.095 -2.254 1.00 30.51 H new ATOM 2001 N ASN A 526 12.943 -3.826 -4.653 1.00 44.44 N ATOM 2002 CA ASN A 526 12.957 -3.693 -6.099 1.00 63.35 C ATOM 2003 C ASN A 526 11.969 -2.602 -6.517 1.00 21.43 C ATOM 2004 O ASN A 526 12.256 -1.812 -7.415 1.00 14.42 O ATOM 2005 CB ASN A 526 12.535 -4.998 -6.776 1.00 14.24 C ATOM 2006 CG ASN A 526 13.755 -5.800 -7.231 1.00 10.12 C ATOM 2007 OD1 ASN A 526 14.835 -5.273 -7.435 1.00 30.42 O ATOM 2008 ND2 ASN A 526 13.523 -7.102 -7.378 1.00 75.23 N ATOM 0 H ASN A 526 12.211 -4.436 -4.288 1.00 44.44 H new ATOM 0 HA ASN A 526 13.972 -3.440 -6.404 1.00 63.35 H new ATOM 0 HB2 ASN A 526 11.941 -5.595 -6.084 1.00 14.24 H new ATOM 0 HB3 ASN A 526 11.900 -4.778 -7.634 1.00 14.24 H new ATOM 0 HD21 ASN A 526 14.274 -7.723 -7.678 1.00 75.23 H new ATOM 0 HD22 ASN A 526 12.594 -7.479 -7.190 1.00 75.23 H new ATOM 2014 N THR A 527 10.828 -2.593 -5.845 1.00 71.25 N ATOM 2015 CA THR A 527 9.796 -1.613 -6.135 1.00 65.14 C ATOM 2016 C THR A 527 9.934 -0.404 -5.207 1.00 1.33 C ATOM 2017 O THR A 527 10.023 0.731 -5.669 1.00 63.35 O ATOM 2018 CB THR A 527 8.439 -2.309 -6.030 1.00 2.53 C ATOM 2019 OG1 THR A 527 7.498 -1.289 -6.358 1.00 75.22 O ATOM 2020 CG2 THR A 527 8.086 -2.690 -4.591 1.00 44.40 C ATOM 0 H THR A 527 10.595 -3.249 -5.100 1.00 71.25 H new ATOM 0 HA THR A 527 9.897 -1.220 -7.147 1.00 65.14 H new ATOM 0 HB THR A 527 8.442 -3.203 -6.653 1.00 2.53 H new ATOM 0 HG1 THR A 527 6.796 -1.260 -5.675 1.00 75.22 H new ATOM 0 HG21 THR A 527 7.113 -3.181 -4.573 1.00 44.40 H new ATOM 0 HG22 THR A 527 8.843 -3.369 -4.198 1.00 44.40 H new ATOM 0 HG23 THR A 527 8.051 -1.791 -3.975 1.00 44.40 H new ATOM 2028 N PHE A 528 9.944 -0.690 -3.912 1.00 54.10 N ATOM 2029 CA PHE A 528 10.068 0.358 -2.915 1.00 40.20 C ATOM 2030 C PHE A 528 11.536 0.703 -2.662 1.00 22.40 C ATOM 2031 O PHE A 528 11.999 0.670 -1.522 1.00 41.32 O ATOM 2032 CB PHE A 528 9.452 -0.180 -1.621 1.00 30.51 C ATOM 2033 CG PHE A 528 7.926 -0.275 -1.652 1.00 42.34 C ATOM 2034 CD1 PHE A 528 7.173 0.855 -1.583 1.00 24.24 C ATOM 2035 CD2 PHE A 528 7.322 -1.491 -1.746 1.00 43.33 C ATOM 2036 CE1 PHE A 528 5.755 0.767 -1.610 1.00 63.53 C ATOM 2037 CE2 PHE A 528 5.905 -1.579 -1.774 1.00 3.10 C ATOM 2038 CZ PHE A 528 5.151 -0.448 -1.705 1.00 65.42 C ATOM 0 H PHE A 528 9.868 -1.633 -3.532 1.00 54.10 H new ATOM 0 HA PHE A 528 9.565 1.261 -3.260 1.00 40.20 H new ATOM 0 HB2 PHE A 528 9.863 -1.169 -1.418 1.00 30.51 H new ATOM 0 HB3 PHE A 528 9.749 0.465 -0.794 1.00 30.51 H new ATOM 0 HD1 PHE A 528 7.653 1.820 -1.508 1.00 24.24 H new ATOM 0 HD2 PHE A 528 7.920 -2.389 -1.799 1.00 43.33 H new ATOM 0 HE1 PHE A 528 5.157 1.665 -1.555 1.00 63.53 H new ATOM 0 HE2 PHE A 528 5.425 -2.544 -1.850 1.00 3.10 H new ATOM 0 HZ PHE A 528 4.073 -0.515 -1.726 1.00 65.42 H new ATOM 2047 N LYS A 529 12.231 1.028 -3.744 1.00 4.43 N ATOM 2048 CA LYS A 529 13.637 1.378 -3.653 1.00 62.21 C ATOM 2049 C LYS A 529 13.780 2.707 -2.910 1.00 4.40 C ATOM 2050 O LYS A 529 12.859 3.521 -2.903 1.00 12.41 O ATOM 2051 CB LYS A 529 14.280 1.379 -5.042 1.00 32.11 C ATOM 2052 CG LYS A 529 14.622 -0.044 -5.488 1.00 31.14 C ATOM 2053 CD LYS A 529 14.957 -0.085 -6.981 1.00 50.30 C ATOM 2054 CE LYS A 529 15.661 -1.392 -7.349 1.00 1.12 C ATOM 2055 NZ LYS A 529 16.601 -1.176 -8.473 1.00 41.44 N ATOM 0 H LYS A 529 11.845 1.056 -4.688 1.00 4.43 H new ATOM 0 HA LYS A 529 14.179 0.629 -3.076 1.00 62.21 H new ATOM 0 HB2 LYS A 529 13.600 1.836 -5.761 1.00 32.11 H new ATOM 0 HB3 LYS A 529 15.185 1.987 -5.028 1.00 32.11 H new ATOM 0 HG2 LYS A 529 15.469 -0.416 -4.911 1.00 31.14 H new ATOM 0 HG3 LYS A 529 13.781 -0.706 -5.282 1.00 31.14 H new ATOM 0 HD2 LYS A 529 14.043 0.017 -7.565 1.00 50.30 H new ATOM 0 HD3 LYS A 529 15.595 0.761 -7.238 1.00 50.30 H new ATOM 0 HE2 LYS A 529 16.201 -1.777 -6.484 1.00 1.12 H new ATOM 0 HE3 LYS A 529 14.922 -2.145 -7.624 1.00 1.12 H new ATOM 0 HZ1 LYS A 529 17.071 -2.073 -8.710 1.00 41.44 H new ATOM 0 HZ2 LYS A 529 16.077 -0.830 -9.302 1.00 41.44 H new ATOM 0 HZ3 LYS A 529 17.316 -0.473 -8.197 1.00 41.44 H new ATOM 2064 N PRO A 530 14.973 2.890 -2.283 1.00 71.42 N ATOM 2065 CA PRO A 530 15.249 4.106 -1.537 1.00 51.55 C ATOM 2066 C PRO A 530 15.525 5.277 -2.482 1.00 53.23 C ATOM 2067 O PRO A 530 15.139 6.411 -2.200 1.00 63.34 O ATOM 2068 CB PRO A 530 16.436 3.765 -0.653 1.00 4.52 C ATOM 2069 CG PRO A 530 17.072 2.528 -1.266 1.00 63.31 C ATOM 2070 CD PRO A 530 16.089 1.948 -2.269 1.00 24.31 C ATOM 0 HA PRO A 530 14.401 4.431 -0.934 1.00 51.55 H new ATOM 0 HB2 PRO A 530 17.146 4.591 -0.617 1.00 4.52 H new ATOM 0 HB3 PRO A 530 16.117 3.573 0.372 1.00 4.52 H new ATOM 0 HG2 PRO A 530 18.011 2.785 -1.756 1.00 63.31 H new ATOM 0 HG3 PRO A 530 17.306 1.796 -0.493 1.00 63.31 H new ATOM 0 HD2 PRO A 530 16.540 1.854 -3.257 1.00 24.31 H new ATOM 0 HD3 PRO A 530 15.762 0.951 -1.972 1.00 24.31 H new ATOM 2075 N HIS A 531 16.191 4.964 -3.584 1.00 0.32 N ATOM 2076 CA HIS A 531 16.523 5.976 -4.573 1.00 62.44 C ATOM 2077 C HIS A 531 15.250 6.432 -5.288 1.00 14.11 C ATOM 2078 O HIS A 531 15.262 7.427 -6.010 1.00 14.33 O ATOM 2079 CB HIS A 531 17.595 5.465 -5.536 1.00 33.45 C ATOM 2080 CG HIS A 531 17.042 4.756 -6.750 1.00 51.20 C ATOM 2081 ND1 HIS A 531 17.113 3.385 -6.915 1.00 34.24 N ATOM 2082 CD2 HIS A 531 16.408 5.245 -7.855 1.00 22.02 C ATOM 2083 CE1 HIS A 531 16.545 3.072 -8.071 1.00 3.10 C ATOM 2084 NE2 HIS A 531 16.109 4.227 -8.652 1.00 2.11 N ATOM 0 H HIS A 531 16.510 4.023 -3.814 1.00 0.32 H new ATOM 0 HA HIS A 531 16.951 6.847 -4.077 1.00 62.44 H new ATOM 0 HB2 HIS A 531 18.204 6.307 -5.866 1.00 33.45 H new ATOM 0 HB3 HIS A 531 18.256 4.784 -5.000 1.00 33.45 H new ATOM 0 HD1 HIS A 531 17.532 2.726 -6.258 1.00 34.24 H new ATOM 0 HD2 HIS A 531 16.187 6.284 -8.048 1.00 22.02 H new ATOM 0 HE1 HIS A 531 16.445 2.078 -8.481 1.00 3.10 H new ATOM 2091 N ARG A 532 14.182 5.680 -5.064 1.00 70.43 N ATOM 2092 CA ARG A 532 12.904 5.993 -5.679 1.00 53.31 C ATOM 2093 C ARG A 532 12.046 6.826 -4.725 1.00 24.35 C ATOM 2094 O ARG A 532 11.413 7.797 -5.139 1.00 73.21 O ATOM 2095 CB ARG A 532 12.146 4.718 -6.055 1.00 43.23 C ATOM 2096 CG ARG A 532 12.990 3.828 -6.969 1.00 32.21 C ATOM 2097 CD ARG A 532 13.181 4.478 -8.343 1.00 1.34 C ATOM 2098 NE ARG A 532 11.875 4.609 -9.025 1.00 33.41 N ATOM 2099 CZ ARG A 532 11.686 5.296 -10.171 1.00 40.42 C ATOM 2100 NH1 ARG A 532 12.720 5.922 -10.774 1.00 2.02 N ATOM 2101 NH2 ARG A 532 10.474 5.351 -10.695 1.00 25.44 N ATOM 0 H ARG A 532 14.176 4.855 -4.465 1.00 70.43 H new ATOM 0 HA ARG A 532 13.104 6.564 -6.586 1.00 53.31 H new ATOM 0 HB2 ARG A 532 11.880 4.169 -5.152 1.00 43.23 H new ATOM 0 HB3 ARG A 532 11.214 4.979 -6.556 1.00 43.23 H new ATOM 0 HG2 ARG A 532 13.962 3.647 -6.510 1.00 32.21 H new ATOM 0 HG3 ARG A 532 12.507 2.858 -7.085 1.00 32.21 H new ATOM 0 HD2 ARG A 532 13.642 5.459 -8.230 1.00 1.34 H new ATOM 0 HD3 ARG A 532 13.858 3.876 -8.949 1.00 1.34 H new ATOM 0 HE ARG A 532 11.067 4.152 -8.603 1.00 33.41 H new ATOM 0 HH11 ARG A 532 13.653 5.878 -10.363 1.00 2.02 H new ATOM 0 HH12 ARG A 532 12.568 6.439 -11.640 1.00 2.02 H new ATOM 0 HH21 ARG A 532 9.697 4.878 -10.234 1.00 25.44 H new ATOM 0 HH22 ARG A 532 10.316 5.866 -11.561 1.00 25.44 H new ATOM 2111 N LEU A 533 12.050 6.415 -3.465 1.00 73.34 N ATOM 2112 CA LEU A 533 11.279 7.112 -2.448 1.00 63.41 C ATOM 2113 C LEU A 533 11.649 8.597 -2.462 1.00 24.52 C ATOM 2114 O LEU A 533 10.845 9.443 -2.075 1.00 32.32 O ATOM 2115 CB LEU A 533 11.466 6.444 -1.085 1.00 64.14 C ATOM 2116 CG LEU A 533 10.470 5.336 -0.738 1.00 13.24 C ATOM 2117 CD1 LEU A 533 9.043 5.882 -0.671 1.00 74.45 C ATOM 2118 CD2 LEU A 533 10.590 4.165 -1.716 1.00 13.24 C ATOM 0 H LEU A 533 12.574 5.609 -3.125 1.00 73.34 H new ATOM 0 HA LEU A 533 10.213 7.047 -2.666 1.00 63.41 H new ATOM 0 HB2 LEU A 533 12.472 6.027 -1.042 1.00 64.14 H new ATOM 0 HB3 LEU A 533 11.406 7.213 -0.315 1.00 64.14 H new ATOM 0 HG LEU A 533 10.715 4.955 0.253 1.00 13.24 H new ATOM 0 HD11 LEU A 533 8.355 5.074 -0.423 1.00 74.45 H new ATOM 0 HD12 LEU A 533 8.985 6.656 0.095 1.00 74.45 H new ATOM 0 HD13 LEU A 533 8.770 6.306 -1.637 1.00 74.45 H new ATOM 0 HD21 LEU A 533 9.871 3.391 -1.447 1.00 13.24 H new ATOM 0 HD22 LEU A 533 10.386 4.514 -2.728 1.00 13.24 H new ATOM 0 HD23 LEU A 533 11.599 3.755 -1.670 1.00 13.24 H new ATOM 2129 N GLN A 534 12.865 8.866 -2.913 1.00 63.43 N ATOM 2130 CA GLN A 534 13.351 10.234 -2.983 1.00 41.22 C ATOM 2131 C GLN A 534 13.228 10.769 -4.410 1.00 10.10 C ATOM 2132 O GLN A 534 12.739 11.879 -4.621 1.00 2.02 O ATOM 2133 CB GLN A 534 14.794 10.329 -2.484 1.00 54.25 C ATOM 2134 CG GLN A 534 14.962 9.604 -1.148 1.00 32.40 C ATOM 2135 CD GLN A 534 16.406 9.130 -0.959 1.00 5.32 C ATOM 2136 OE1 GLN A 534 17.055 9.418 0.032 1.00 44.31 O ATOM 2137 NE2 GLN A 534 16.868 8.390 -1.962 1.00 62.12 N ATOM 0 H GLN A 534 13.528 8.161 -3.234 1.00 63.43 H new ATOM 0 HA GLN A 534 12.734 10.852 -2.330 1.00 41.22 H new ATOM 0 HB2 GLN A 534 15.467 9.896 -3.224 1.00 54.25 H new ATOM 0 HB3 GLN A 534 15.075 11.376 -2.371 1.00 54.25 H new ATOM 0 HG2 GLN A 534 14.684 10.270 -0.331 1.00 32.40 H new ATOM 0 HG3 GLN A 534 14.287 8.750 -1.106 1.00 32.40 H new ATOM 0 HE21 GLN A 534 16.270 8.186 -2.763 1.00 62.12 H new ATOM 0 HE22 GLN A 534 17.820 8.026 -1.931 1.00 62.12 H new ATOM 2144 N ALA A 535 13.678 9.956 -5.354 1.00 74.33 N ATOM 2145 CA ALA A 535 13.623 10.334 -6.756 1.00 64.22 C ATOM 2146 C ALA A 535 12.163 10.501 -7.179 1.00 1.13 C ATOM 2147 O ALA A 535 11.879 11.054 -8.241 1.00 31.51 O ATOM 2148 CB ALA A 535 14.358 9.287 -7.596 1.00 64.03 C ATOM 0 H ALA A 535 14.082 9.037 -5.176 1.00 74.33 H new ATOM 0 HA ALA A 535 14.123 11.290 -6.915 1.00 64.22 H new ATOM 0 HB1 ALA A 535 14.317 9.570 -8.648 1.00 64.03 H new ATOM 0 HB2 ALA A 535 15.398 9.229 -7.276 1.00 64.03 H new ATOM 0 HB3 ALA A 535 13.883 8.315 -7.463 1.00 64.03 H new ATOM 2154 N ARG A 536 11.274 10.012 -6.326 1.00 14.15 N ATOM 2155 CA ARG A 536 9.850 10.100 -6.598 1.00 13.45 C ATOM 2156 C ARG A 536 9.445 11.554 -6.847 1.00 11.43 C ATOM 2157 O ARG A 536 8.521 11.824 -7.613 1.00 11.42 O ATOM 2158 CB ARG A 536 9.032 9.542 -5.433 1.00 54.42 C ATOM 2159 CG ARG A 536 7.532 9.594 -5.740 1.00 70.25 C ATOM 2160 CD ARG A 536 7.083 8.339 -6.490 1.00 41.41 C ATOM 2161 NE ARG A 536 5.673 8.030 -6.159 1.00 74.45 N ATOM 2162 CZ ARG A 536 4.626 8.805 -6.514 1.00 32.14 C ATOM 2163 NH1 ARG A 536 4.820 9.941 -7.215 1.00 50.35 N ATOM 2164 NH2 ARG A 536 3.408 8.432 -6.165 1.00 13.31 N ATOM 0 H ARG A 536 11.513 9.554 -5.447 1.00 14.15 H new ATOM 0 HA ARG A 536 9.645 9.506 -7.488 1.00 13.45 H new ATOM 0 HB2 ARG A 536 9.331 8.513 -5.235 1.00 54.42 H new ATOM 0 HB3 ARG A 536 9.242 10.115 -4.530 1.00 54.42 H new ATOM 0 HG2 ARG A 536 6.970 9.687 -4.811 1.00 70.25 H new ATOM 0 HG3 ARG A 536 7.310 10.478 -6.337 1.00 70.25 H new ATOM 0 HD2 ARG A 536 7.189 8.490 -7.564 1.00 41.41 H new ATOM 0 HD3 ARG A 536 7.721 7.497 -6.222 1.00 41.41 H new ATOM 0 HE ARG A 536 5.481 7.179 -5.630 1.00 74.45 H new ATOM 0 HH11 ARG A 536 5.764 10.221 -7.481 1.00 50.35 H new ATOM 0 HH12 ARG A 536 4.023 10.520 -7.479 1.00 50.35 H new ATOM 0 HH21 ARG A 536 3.270 7.571 -5.636 1.00 13.31 H new ATOM 0 HH22 ARG A 536 2.605 9.005 -6.425 1.00 13.31 H new ATOM 2174 N LYS A 537 10.157 12.454 -6.185 1.00 0.44 N ATOM 2175 CA LYS A 537 9.885 13.874 -6.324 1.00 41.32 C ATOM 2176 C LYS A 537 10.858 14.480 -7.336 1.00 45.24 C ATOM 2177 O LYS A 537 10.631 15.577 -7.843 1.00 62.34 O ATOM 2178 CB LYS A 537 9.910 14.562 -4.957 1.00 53.30 C ATOM 2179 CG LYS A 537 9.019 13.824 -3.956 1.00 44.55 C ATOM 2180 CD LYS A 537 9.834 12.833 -3.123 1.00 13.14 C ATOM 2181 CE LYS A 537 11.010 13.529 -2.437 1.00 74.14 C ATOM 2182 NZ LYS A 537 10.678 14.942 -2.146 1.00 45.11 N ATOM 0 H LYS A 537 10.923 12.227 -5.550 1.00 0.44 H new ATOM 0 HA LYS A 537 8.880 14.032 -6.715 1.00 41.32 H new ATOM 0 HB2 LYS A 537 10.933 14.597 -4.582 1.00 53.30 H new ATOM 0 HB3 LYS A 537 9.572 15.593 -5.059 1.00 53.30 H new ATOM 0 HG2 LYS A 537 8.532 14.544 -3.298 1.00 44.55 H new ATOM 0 HG3 LYS A 537 8.229 13.294 -4.489 1.00 44.55 H new ATOM 0 HD2 LYS A 537 9.193 12.370 -2.373 1.00 13.14 H new ATOM 0 HD3 LYS A 537 10.204 12.033 -3.764 1.00 13.14 H new ATOM 0 HE2 LYS A 537 11.258 13.009 -1.511 1.00 74.14 H new ATOM 0 HE3 LYS A 537 11.892 13.481 -3.076 1.00 74.14 H new ATOM 0 HZ1 LYS A 537 11.313 15.302 -1.405 1.00 45.11 H new ATOM 0 HZ2 LYS A 537 10.795 15.511 -3.009 1.00 45.11 H new ATOM 0 HZ3 LYS A 537 9.693 15.007 -1.820 1.00 45.11 H new ATOM 2191 N ALA A 538 11.925 13.738 -7.599 1.00 60.42 N ATOM 2192 CA ALA A 538 12.936 14.189 -8.541 1.00 44.21 C ATOM 2193 C ALA A 538 12.302 14.349 -9.924 1.00 10.00 C ATOM 2194 O ALA A 538 12.853 15.030 -10.789 1.00 43.41 O ATOM 2195 CB ALA A 538 14.105 13.202 -8.546 1.00 2.25 C ATOM 0 H ALA A 538 12.111 12.828 -7.176 1.00 60.42 H new ATOM 0 HA ALA A 538 13.331 15.161 -8.245 1.00 44.21 H new ATOM 0 HB1 ALA A 538 14.863 13.540 -9.252 1.00 2.25 H new ATOM 0 HB2 ALA A 538 14.538 13.146 -7.547 1.00 2.25 H new ATOM 0 HB3 ALA A 538 13.747 12.216 -8.842 1.00 2.25 H new ATOM 2201 N MET A 539 11.152 13.711 -10.091 1.00 63.51 N ATOM 2202 CA MET A 539 10.439 13.774 -11.355 1.00 14.50 C ATOM 2203 C MET A 539 9.309 14.805 -11.295 1.00 70.12 C ATOM 2204 O MET A 539 9.015 15.467 -12.289 1.00 51.31 O ATOM 2205 CB MET A 539 9.858 12.398 -11.682 1.00 11.15 C ATOM 2206 CG MET A 539 9.165 11.790 -10.460 1.00 13.32 C ATOM 2207 SD MET A 539 8.078 10.469 -10.968 1.00 23.14 S ATOM 2208 CE MET A 539 7.349 10.045 -9.396 1.00 30.33 C ATOM 0 H MET A 539 10.697 13.148 -9.372 1.00 63.51 H new ATOM 0 HA MET A 539 11.141 14.076 -12.133 1.00 14.50 H new ATOM 0 HB2 MET A 539 9.145 12.486 -12.502 1.00 11.15 H new ATOM 0 HB3 MET A 539 10.654 11.735 -12.021 1.00 11.15 H new ATOM 0 HG2 MET A 539 9.910 11.410 -9.761 1.00 13.32 H new ATOM 0 HG3 MET A 539 8.597 12.558 -9.935 1.00 13.32 H new ATOM 0 HE1 MET A 539 6.484 9.401 -9.558 1.00 30.33 H new ATOM 0 HE2 MET A 539 8.083 9.520 -8.784 1.00 30.33 H new ATOM 0 HE3 MET A 539 7.034 10.954 -8.884 1.00 30.33 H new ATOM 2216 N TRP A 540 8.706 14.907 -10.119 1.00 34.24 N ATOM 2217 CA TRP A 540 7.616 15.845 -9.917 1.00 1.14 C ATOM 2218 C TRP A 540 8.083 17.223 -10.388 1.00 41.33 C ATOM 2219 O TRP A 540 7.269 18.068 -10.755 1.00 61.20 O ATOM 2220 CB TRP A 540 7.148 15.837 -8.460 1.00 64.45 C ATOM 2221 CG TRP A 540 5.879 15.019 -8.218 1.00 73.15 C ATOM 2222 CD1 TRP A 540 4.943 15.207 -7.277 1.00 32.21 C ATOM 2223 CD2 TRP A 540 5.439 13.869 -8.972 1.00 55.34 C ATOM 2224 NE1 TRP A 540 3.937 14.266 -7.369 1.00 65.12 N ATOM 2225 CE2 TRP A 540 4.248 13.426 -8.432 1.00 73.23 C ATOM 2226 CE3 TRP A 540 6.028 13.224 -10.074 1.00 74.04 C ATOM 2227 CZ2 TRP A 540 3.546 12.323 -8.927 1.00 74.42 C ATOM 2228 CZ3 TRP A 540 5.314 12.123 -10.557 1.00 13.45 C ATOM 2229 CH2 TRP A 540 4.114 11.664 -10.025 1.00 43.02 C ATOM 0 H TRP A 540 8.952 14.355 -9.297 1.00 34.24 H new ATOM 0 HA TRP A 540 6.744 15.555 -10.504 1.00 1.14 H new ATOM 0 HB2 TRP A 540 7.948 15.441 -7.835 1.00 64.45 H new ATOM 0 HB3 TRP A 540 6.972 16.864 -8.140 1.00 64.45 H new ATOM 0 HD1 TRP A 540 4.972 15.996 -6.540 1.00 32.21 H new ATOM 0 HE1 TRP A 540 3.116 14.199 -6.767 1.00 65.12 H new ATOM 0 HE3 TRP A 540 6.958 13.553 -10.513 1.00 74.04 H new ATOM 0 HZ2 TRP A 540 2.616 11.996 -8.486 1.00 74.42 H new ATOM 0 HZ3 TRP A 540 5.724 11.591 -11.403 1.00 13.45 H new ATOM 0 HH2 TRP A 540 3.623 10.804 -10.456 1.00 43.02 H new ATOM 2239 N ARG A 541 9.395 17.408 -10.361 1.00 52.04 N ATOM 2240 CA ARG A 541 9.982 18.670 -10.779 1.00 72.34 C ATOM 2241 C ARG A 541 9.680 18.932 -12.257 1.00 44.41 C ATOM 2242 O ARG A 541 9.400 20.065 -12.645 1.00 61.23 O ATOM 2243 CB ARG A 541 11.497 18.669 -10.569 1.00 60.23 C ATOM 2244 CG ARG A 541 12.206 17.894 -11.683 1.00 11.31 C ATOM 2245 CD ARG A 541 13.699 17.748 -11.384 1.00 35.21 C ATOM 2246 NE ARG A 541 14.401 19.015 -11.687 1.00 21.54 N ATOM 2247 CZ ARG A 541 15.713 19.095 -12.002 1.00 41.32 C ATOM 2248 NH1 ARG A 541 16.474 17.983 -12.059 1.00 53.13 N ATOM 2249 NH2 ARG A 541 16.237 20.280 -12.253 1.00 71.33 N ATOM 0 H ARG A 541 10.068 16.705 -10.056 1.00 52.04 H new ATOM 0 HA ARG A 541 9.542 19.459 -10.168 1.00 72.34 H new ATOM 0 HB2 ARG A 541 11.865 19.695 -10.544 1.00 60.23 H new ATOM 0 HB3 ARG A 541 11.733 18.222 -9.603 1.00 60.23 H new ATOM 0 HG2 ARG A 541 11.754 16.908 -11.789 1.00 11.31 H new ATOM 0 HG3 ARG A 541 12.070 18.410 -12.633 1.00 11.31 H new ATOM 0 HD2 ARG A 541 13.845 17.483 -10.337 1.00 35.21 H new ATOM 0 HD3 ARG A 541 14.120 16.938 -11.979 1.00 35.21 H new ATOM 0 HE ARG A 541 13.862 19.880 -11.656 1.00 21.54 H new ATOM 0 HH11 ARG A 541 16.060 17.071 -11.864 1.00 53.13 H new ATOM 0 HH12 ARG A 541 17.463 18.054 -12.298 1.00 53.13 H new ATOM 0 HH21 ARG A 541 15.654 21.116 -12.208 1.00 71.33 H new ATOM 0 HH22 ARG A 541 17.225 20.360 -12.492 1.00 71.33 H new ATOM 2259 N LYS A 542 9.744 17.865 -13.039 1.00 42.34 N ATOM 2260 CA LYS A 542 9.481 17.965 -14.464 1.00 31.21 C ATOM 2261 C LYS A 542 8.127 18.646 -14.682 1.00 63.21 C ATOM 2262 O LYS A 542 8.004 19.533 -15.525 1.00 43.12 O ATOM 2263 CB LYS A 542 9.591 16.590 -15.127 1.00 55.03 C ATOM 2264 CG LYS A 542 10.997 16.011 -14.958 1.00 55.44 C ATOM 2265 CD LYS A 542 12.065 17.050 -15.311 1.00 12.33 C ATOM 2266 CE LYS A 542 11.791 17.671 -16.683 1.00 45.33 C ATOM 2267 NZ LYS A 542 12.083 16.699 -17.760 1.00 62.33 N ATOM 0 H LYS A 542 9.974 16.926 -12.713 1.00 42.34 H new ATOM 0 HA LYS A 542 10.234 18.588 -14.947 1.00 31.21 H new ATOM 0 HB2 LYS A 542 8.859 15.911 -14.689 1.00 55.03 H new ATOM 0 HB3 LYS A 542 9.353 16.674 -16.187 1.00 55.03 H new ATOM 0 HG2 LYS A 542 11.135 15.677 -13.930 1.00 55.44 H new ATOM 0 HG3 LYS A 542 11.112 15.135 -15.596 1.00 55.44 H new ATOM 0 HD2 LYS A 542 12.083 17.831 -14.551 1.00 12.33 H new ATOM 0 HD3 LYS A 542 13.049 16.581 -15.310 1.00 12.33 H new ATOM 0 HE2 LYS A 542 10.750 17.988 -16.744 1.00 45.33 H new ATOM 0 HE3 LYS A 542 12.404 18.563 -16.814 1.00 45.33 H new ATOM 0 HZ1 LYS A 542 11.892 17.137 -18.684 1.00 62.33 H new ATOM 0 HZ2 LYS A 542 13.083 16.417 -17.711 1.00 62.33 H new ATOM 0 HZ3 LYS A 542 11.480 15.860 -17.643 1.00 62.33 H new ATOM 2276 N GLU A 543 7.148 18.206 -13.906 1.00 2.13 N ATOM 2277 CA GLU A 543 5.810 18.762 -14.002 1.00 30.15 C ATOM 2278 C GLU A 543 5.872 20.290 -14.056 1.00 30.24 C ATOM 2279 O GLU A 543 4.979 20.931 -14.608 1.00 63.13 O ATOM 2280 CB GLU A 543 4.933 18.290 -12.840 1.00 23.42 C ATOM 2281 CG GLU A 543 4.645 16.791 -12.945 1.00 21.50 C ATOM 2282 CD GLU A 543 3.840 16.474 -14.208 1.00 52.54 C ATOM 2283 OE1 GLU A 543 2.921 17.227 -14.561 1.00 61.21 O ATOM 2284 OE2 GLU A 543 4.201 15.404 -14.830 1.00 34.13 O ATOM 0 H GLU A 543 7.255 17.470 -13.208 1.00 2.13 H new ATOM 0 HA GLU A 543 5.356 18.403 -14.925 1.00 30.15 H new ATOM 0 HB2 GLU A 543 5.431 18.503 -11.894 1.00 23.42 H new ATOM 0 HB3 GLU A 543 3.995 18.845 -12.839 1.00 23.42 H new ATOM 0 HG2 GLU A 543 5.584 16.237 -12.959 1.00 21.50 H new ATOM 0 HG3 GLU A 543 4.093 16.461 -12.065 1.00 21.50 H new ATOM 2290 N GLN A 544 6.934 20.827 -13.477 1.00 30.22 N ATOM 2291 CA GLN A 544 7.126 22.268 -13.452 1.00 54.31 C ATOM 2292 C GLN A 544 7.740 22.745 -14.769 1.00 54.31 C ATOM 2293 O GLN A 544 7.378 23.804 -15.280 1.00 3.42 O ATOM 2294 CB GLN A 544 7.989 22.685 -12.260 1.00 71.13 C ATOM 2295 CG GLN A 544 7.403 22.161 -10.947 1.00 52.43 C ATOM 2296 CD GLN A 544 8.506 21.907 -9.917 1.00 34.14 C ATOM 2297 OE1 GLN A 544 9.573 22.496 -9.954 1.00 72.24 O ATOM 2298 NE2 GLN A 544 8.189 20.997 -9.000 1.00 10.31 N ATOM 0 H GLN A 544 7.672 20.291 -13.021 1.00 30.22 H new ATOM 0 HA GLN A 544 6.152 22.743 -13.336 1.00 54.31 H new ATOM 0 HB2 GLN A 544 9.002 22.303 -12.388 1.00 71.13 H new ATOM 0 HB3 GLN A 544 8.061 23.772 -12.222 1.00 71.13 H new ATOM 0 HG2 GLN A 544 6.689 22.882 -10.550 1.00 52.43 H new ATOM 0 HG3 GLN A 544 6.854 21.238 -11.132 1.00 52.43 H new ATOM 0 HE21 GLN A 544 7.277 20.541 -9.028 1.00 10.31 H new ATOM 0 HE22 GLN A 544 8.858 20.755 -8.269 1.00 10.31 H new ATOM 2305 N ASP A 545 8.660 21.940 -15.281 1.00 74.24 N ATOM 2306 CA ASP A 545 9.328 22.267 -16.529 1.00 74.10 C ATOM 2307 C ASP A 545 8.307 22.259 -17.668 1.00 14.24 C ATOM 2308 O ASP A 545 8.571 22.781 -18.749 1.00 62.51 O ATOM 2309 CB ASP A 545 10.413 21.240 -16.860 1.00 4.24 C ATOM 2310 CG ASP A 545 11.441 21.694 -17.896 1.00 72.52 C ATOM 2311 OD1 ASP A 545 11.298 21.426 -19.098 1.00 64.14 O ATOM 2312 OD2 ASP A 545 12.438 22.361 -17.419 1.00 32.24 O ATOM 0 H ASP A 545 8.958 21.063 -14.854 1.00 74.24 H new ATOM 0 HA ASP A 545 9.784 23.251 -16.418 1.00 74.10 H new ATOM 0 HB2 ASP A 545 10.937 20.979 -15.941 1.00 4.24 H new ATOM 0 HB3 ASP A 545 9.933 20.331 -17.222 1.00 4.24 H new TER 2317 ASP A 545