USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=31 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 476 ASN : amide:sc= -9.58! C(o=-18!,f=-24!) USER MOD Set 1.2: A 480 GLN : amide:sc= -8.06! C(o=-18!,f=-25!) USER MOD Set 2.1: A 473 MET CE :methyl -163:sc= -13! (180deg=-12.1!) USER MOD Set 2.2: A 482 SER OG : rot 44:sc= 0.437 USER MOD Set 2.3: A 485 CYS SG : rot -97:sc= -7.27! USER MOD Set 3.1: A 471 GLN : amide:sc= -0.0236 K(o=-0.054,f=-1.9) USER MOD Set 3.2: A 474 MET CE :methyl -163:sc= -0.0302 (180deg=0) USER MOD Set 4.1: A 458 SER OG : rot 134:sc= -1.33 USER MOD Set 4.2: A 494 SER OG : rot 77:sc= -1.05 USER MOD Set 4.3: A 498 GLN : amide:sc= -0.243 K(o=-2.6,f=-9.9!) USER MOD Single : A 386 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 15:sc= 0.896 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 X(o=0,f=0) USER MOD Single : A 393 LYS NZ :NH3+ -152:sc= -2.46! (180deg=-3.43!) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -6.92! C(o=-6.9!,f=-8.7!) USER MOD Single : A 401 HIS : no HD1:sc= -8.95! C(o=-8.9!,f=-10!) USER MOD Single : A 407 HIS : no HD1:sc= -2.17! X(o=-2.2!,f=-2) USER MOD Single : A 415 LYS NZ :NH3+ 170:sc= 0.455 (180deg=0.273) USER MOD Single : A 426 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 CYS SG : rot 66:sc= -1.79 USER MOD Single : A 432 GLN : amide:sc= -2.55 X(o=-2.6,f=-3!) USER MOD Single : A 434 HIS : no HD1:sc= -3.84! C(o=-3.8!,f=-4.4!) USER MOD Single : A 440 SER OG : rot 160:sc= -0.0787 USER MOD Single : A 441 CYS SG : rot 180:sc= 0 USER MOD Single : A 443 GLN : amide:sc= -2.64 K(o=-2.6,f=-0.31) USER MOD Single : A 448 HIS : no HD1:sc= -0.608 K(o=-0.61,f=-0.088) USER MOD Single : A 449 SER OG : rot 160:sc= -2.94! USER MOD Single : A 457 THR OG1 : rot 171:sc= 0.027 USER MOD Single : A 459 ASN : amide:sc= -0.0147 K(o=-0.015,f=-0.65) USER MOD Single : A 462 CYS SG : rot 120:sc= -3.21! USER MOD Single : A 465 SER OG : rot -130:sc= -4.49! USER MOD Single : A 467 HIS : no HD1:sc= -0.0645 K(o=-0.065,f=-0.59) USER MOD Single : A 468 GLN : amide:sc= -1.46 K(o=-1.5,f=-0.46) USER MOD Single : A 470 ASN : amide:sc= -1.83 K(o=-1.8,f=-0.29) USER MOD Single : A 475 SER OG : rot -28:sc= 0.0505 USER MOD Single : A 478 THR OG1 : rot -30:sc= 0.551 USER MOD Single : A 495 SER OG : rot 180:sc= 0 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 503 THR OG1 : rot -170:sc= 0 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot -59:sc= 0.481 USER MOD Single : A 516 HIS : no HD1:sc= -4.78! C(o=-4.8!,f=-8.4!) USER MOD Single : A 517 SER OG : rot 160:sc= -1.56! 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= -2.14 K(o=-2.1,f=-3.8!) USER MOD Single : A 527 THR OG1 : rot 180:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -4.79! C(o=-4.8!,f=-8!) USER MOD Single : A 534 GLN : amide:sc= -1.72 K(o=-1.7,f=-0.58) USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 539 MET CE :methyl -171:sc= -4.72! (180deg=-5.4!) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 GLN : amide:sc= -0.166 K(o=-0.17,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 13.422 26.804 10.914 1.00 31.44 N ATOM 2 CA MET A 386 13.436 25.591 10.113 1.00 12.25 C ATOM 3 C MET A 386 14.811 24.923 10.153 1.00 62.24 C ATOM 4 O MET A 386 15.771 25.437 9.580 1.00 11.31 O ATOM 5 CB MET A 386 13.073 25.928 8.666 1.00 54.44 C ATOM 6 CG MET A 386 13.353 24.744 7.740 1.00 3.12 C ATOM 7 SD MET A 386 12.423 24.918 6.226 1.00 61.23 S ATOM 8 CE MET A 386 13.440 26.112 5.373 1.00 24.23 C ATOM 0 HA MET A 386 12.704 24.897 10.527 1.00 12.25 H new ATOM 0 HB2 MET A 386 12.019 26.200 8.606 1.00 54.44 H new ATOM 0 HB3 MET A 386 13.645 26.795 8.336 1.00 54.44 H new ATOM 0 HG2 MET A 386 14.419 24.690 7.517 1.00 3.12 H new ATOM 0 HG3 MET A 386 13.084 23.812 8.237 1.00 3.12 H new ATOM 0 HE1 MET A 386 13.001 26.336 4.401 1.00 24.23 H new ATOM 0 HE2 MET A 386 13.500 27.026 5.963 1.00 24.23 H new ATOM 0 HE3 MET A 386 14.441 25.704 5.233 1.00 24.23 H new ATOM 16 N GLU A 387 14.864 23.788 10.834 1.00 62.41 N ATOM 17 CA GLU A 387 16.107 23.045 10.955 1.00 63.52 C ATOM 18 C GLU A 387 16.275 22.092 9.770 1.00 54.33 C ATOM 19 O GLU A 387 15.319 21.829 9.041 1.00 42.05 O ATOM 20 CB GLU A 387 16.164 22.284 12.281 1.00 21.30 C ATOM 21 CG GLU A 387 15.385 23.024 13.372 1.00 33.43 C ATOM 22 CD GLU A 387 15.964 22.724 14.756 1.00 50.25 C ATOM 23 OE1 GLU A 387 16.193 23.654 15.546 1.00 14.31 O ATOM 24 OE2 GLU A 387 16.176 21.477 15.002 1.00 10.04 O ATOM 0 H GLU A 387 14.066 23.365 11.308 1.00 62.41 H new ATOM 0 HA GLU A 387 16.933 23.756 10.945 1.00 63.52 H new ATOM 0 HB2 GLU A 387 15.751 21.284 12.149 1.00 21.30 H new ATOM 0 HB3 GLU A 387 17.202 22.162 12.590 1.00 21.30 H new ATOM 0 HG2 GLU A 387 15.419 24.097 13.184 1.00 33.43 H new ATOM 0 HG3 GLU A 387 14.337 22.728 13.340 1.00 33.43 H new ATOM 30 N SER A 388 17.496 21.603 9.612 1.00 12.20 N ATOM 31 CA SER A 388 17.801 20.687 8.527 1.00 1.51 C ATOM 32 C SER A 388 17.627 19.241 8.998 1.00 50.33 C ATOM 33 O SER A 388 18.089 18.311 8.342 1.00 61.24 O ATOM 34 CB SER A 388 19.221 20.906 8.003 1.00 64.24 C ATOM 35 OG SER A 388 19.700 19.781 7.272 1.00 14.53 O ATOM 0 H SER A 388 18.286 21.824 10.218 1.00 12.20 H new ATOM 0 HA SER A 388 17.107 20.883 7.710 1.00 1.51 H new ATOM 0 HB2 SER A 388 19.239 21.788 7.363 1.00 64.24 H new ATOM 0 HB3 SER A 388 19.890 21.106 8.840 1.00 64.24 H new ATOM 0 HG SER A 388 18.949 19.191 7.050 1.00 14.53 H new ATOM 40 N SER A 389 16.958 19.100 10.133 1.00 1.43 N ATOM 41 CA SER A 389 16.717 17.784 10.700 1.00 3.34 C ATOM 42 C SER A 389 15.236 17.630 11.054 1.00 3.52 C ATOM 43 O SER A 389 14.868 16.755 11.837 1.00 72.34 O ATOM 44 CB SER A 389 17.584 17.550 11.937 1.00 22.43 C ATOM 45 OG SER A 389 18.924 17.210 11.592 1.00 25.32 O ATOM 0 H SER A 389 16.576 19.875 10.675 1.00 1.43 H new ATOM 0 HA SER A 389 16.986 17.036 9.954 1.00 3.34 H new ATOM 0 HB2 SER A 389 17.585 18.448 12.554 1.00 22.43 H new ATOM 0 HB3 SER A 389 17.150 16.751 12.538 1.00 22.43 H new ATOM 0 HG SER A 389 19.447 17.070 12.409 1.00 25.32 H new ATOM 50 N SER A 390 14.425 18.493 10.461 1.00 53.44 N ATOM 51 CA SER A 390 12.993 18.465 10.703 1.00 1.31 C ATOM 52 C SER A 390 12.327 17.443 9.782 1.00 34.21 C ATOM 53 O SER A 390 12.216 17.666 8.577 1.00 11.30 O ATOM 54 CB SER A 390 12.371 19.848 10.499 1.00 52.44 C ATOM 55 OG SER A 390 10.948 19.809 10.559 1.00 23.25 O ATOM 0 H SER A 390 14.733 19.217 9.812 1.00 53.44 H new ATOM 0 HA SER A 390 12.828 18.173 11.740 1.00 1.31 H new ATOM 0 HB2 SER A 390 12.747 20.530 11.261 1.00 52.44 H new ATOM 0 HB3 SER A 390 12.682 20.246 9.533 1.00 52.44 H new ATOM 0 HG SER A 390 10.590 20.712 10.426 1.00 23.25 H new ATOM 60 N GLU A 391 11.900 16.342 10.382 1.00 21.01 N ATOM 61 CA GLU A 391 11.246 15.283 9.629 1.00 51.03 C ATOM 62 C GLU A 391 9.772 15.625 9.403 1.00 73.34 C ATOM 63 O GLU A 391 9.297 16.665 9.855 1.00 40.22 O ATOM 64 CB GLU A 391 11.393 13.936 10.339 1.00 73.21 C ATOM 65 CG GLU A 391 10.374 13.798 11.471 1.00 22.03 C ATOM 66 CD GLU A 391 10.897 12.872 12.570 1.00 4.20 C ATOM 67 OE1 GLU A 391 11.536 13.339 13.524 1.00 50.42 O ATOM 68 OE2 GLU A 391 10.617 11.622 12.409 1.00 70.21 O ATOM 0 H GLU A 391 11.994 16.159 11.381 1.00 21.01 H new ATOM 0 HA GLU A 391 11.733 15.200 8.657 1.00 51.03 H new ATOM 0 HB2 GLU A 391 11.257 13.126 9.622 1.00 73.21 H new ATOM 0 HB3 GLU A 391 12.402 13.841 10.740 1.00 73.21 H new ATOM 0 HG2 GLU A 391 10.157 14.780 11.891 1.00 22.03 H new ATOM 0 HG3 GLU A 391 9.437 13.406 11.076 1.00 22.03 H new ATOM 74 N GLN A 392 9.093 14.732 8.700 1.00 2.01 N ATOM 75 CA GLN A 392 7.683 14.925 8.407 1.00 12.30 C ATOM 76 C GLN A 392 6.982 13.574 8.252 1.00 42.34 C ATOM 77 O GLN A 392 7.607 12.586 7.871 1.00 51.12 O ATOM 78 CB GLN A 392 7.496 15.787 7.156 1.00 31.11 C ATOM 79 CG GLN A 392 6.071 15.663 6.612 1.00 64.20 C ATOM 80 CD GLN A 392 5.802 16.715 5.534 1.00 23.35 C ATOM 81 OE1 GLN A 392 5.904 16.462 4.344 1.00 4.54 O ATOM 82 NE2 GLN A 392 5.457 17.906 6.014 1.00 43.50 N ATOM 0 H GLN A 392 9.493 13.872 8.324 1.00 2.01 H new ATOM 0 HA GLN A 392 7.227 15.454 9.244 1.00 12.30 H new ATOM 0 HB2 GLN A 392 7.709 16.829 7.393 1.00 31.11 H new ATOM 0 HB3 GLN A 392 8.209 15.482 6.390 1.00 31.11 H new ATOM 0 HG2 GLN A 392 5.922 14.666 6.197 1.00 64.20 H new ATOM 0 HG3 GLN A 392 5.356 15.780 7.426 1.00 64.20 H new ATOM 0 HE21 GLN A 392 5.390 18.050 7.022 1.00 43.50 H new ATOM 0 HE22 GLN A 392 5.259 18.676 5.375 1.00 43.50 H new ATOM 89 N LYS A 393 5.692 13.574 8.554 1.00 5.10 N ATOM 90 CA LYS A 393 4.900 12.361 8.454 1.00 34.04 C ATOM 91 C LYS A 393 4.412 12.193 7.013 1.00 30.22 C ATOM 92 O LYS A 393 3.748 13.075 6.472 1.00 71.25 O ATOM 93 CB LYS A 393 3.772 12.370 9.487 1.00 22.01 C ATOM 94 CG LYS A 393 2.929 11.096 9.391 1.00 64.40 C ATOM 95 CD LYS A 393 3.770 9.859 9.718 1.00 31.12 C ATOM 96 CE LYS A 393 4.352 9.948 11.130 1.00 75.53 C ATOM 97 NZ LYS A 393 5.661 10.640 11.106 1.00 44.23 N ATOM 0 H LYS A 393 5.176 14.396 8.868 1.00 5.10 H new ATOM 0 HA LYS A 393 5.509 11.488 8.689 1.00 34.04 H new ATOM 0 HB2 LYS A 393 4.192 12.457 10.489 1.00 22.01 H new ATOM 0 HB3 LYS A 393 3.138 13.243 9.330 1.00 22.01 H new ATOM 0 HG2 LYS A 393 2.086 11.160 10.079 1.00 64.40 H new ATOM 0 HG3 LYS A 393 2.515 11.004 8.387 1.00 64.40 H new ATOM 0 HD2 LYS A 393 3.155 8.963 9.630 1.00 31.12 H new ATOM 0 HD3 LYS A 393 4.578 9.763 8.993 1.00 31.12 H new ATOM 0 HE2 LYS A 393 3.662 10.484 11.782 1.00 75.53 H new ATOM 0 HE3 LYS A 393 4.470 8.947 11.545 1.00 75.53 H new ATOM 0 HZ1 LYS A 393 6.247 10.302 11.896 1.00 44.23 H new ATOM 0 HZ2 LYS A 393 6.143 10.440 10.207 1.00 44.23 H new ATOM 0 HZ3 LYS A 393 5.513 11.665 11.199 1.00 44.23 H new ATOM 106 N PHE A 394 4.761 11.056 6.432 1.00 4.14 N ATOM 107 CA PHE A 394 4.368 10.760 5.066 1.00 33.51 C ATOM 108 C PHE A 394 4.202 9.254 4.854 1.00 23.34 C ATOM 109 O PHE A 394 4.593 8.458 5.707 1.00 30.00 O ATOM 110 CB PHE A 394 5.490 11.269 4.158 1.00 61.12 C ATOM 111 CG PHE A 394 6.884 10.783 4.559 1.00 13.21 C ATOM 112 CD1 PHE A 394 7.233 9.484 4.365 1.00 35.44 C ATOM 113 CD2 PHE A 394 7.774 11.652 5.112 1.00 32.32 C ATOM 114 CE1 PHE A 394 8.527 9.033 4.737 1.00 31.34 C ATOM 115 CE2 PHE A 394 9.068 11.200 5.484 1.00 22.22 C ATOM 116 CZ PHE A 394 9.417 9.900 5.289 1.00 0.24 C ATOM 0 H PHE A 394 5.313 10.327 6.884 1.00 4.14 H new ATOM 0 HA PHE A 394 3.414 11.237 4.843 1.00 33.51 H new ATOM 0 HB2 PHE A 394 5.287 10.953 3.135 1.00 61.12 H new ATOM 0 HB3 PHE A 394 5.481 12.359 4.163 1.00 61.12 H new ATOM 0 HD1 PHE A 394 6.526 8.795 3.928 1.00 35.44 H new ATOM 0 HD2 PHE A 394 7.496 12.684 5.268 1.00 32.32 H new ATOM 0 HE1 PHE A 394 8.804 8.001 4.581 1.00 31.34 H new ATOM 0 HE2 PHE A 394 9.775 11.889 5.922 1.00 22.22 H new ATOM 0 HZ PHE A 394 10.401 9.556 5.573 1.00 0.24 H new ATOM 125 N TYR A 395 3.620 8.909 3.715 1.00 61.50 N ATOM 126 CA TYR A 395 3.398 7.512 3.382 1.00 30.15 C ATOM 127 C TYR A 395 4.036 7.161 2.037 1.00 35.43 C ATOM 128 O TYR A 395 4.106 8.000 1.141 1.00 74.34 O ATOM 129 CB TYR A 395 1.882 7.340 3.273 1.00 44.55 C ATOM 130 CG TYR A 395 1.113 7.800 4.515 1.00 23.52 C ATOM 131 CD1 TYR A 395 1.703 7.717 5.760 1.00 23.32 C ATOM 132 CD2 TYR A 395 -0.168 8.295 4.390 1.00 25.44 C ATOM 133 CE1 TYR A 395 0.981 8.148 6.929 1.00 11.34 C ATOM 134 CE2 TYR A 395 -0.891 8.725 5.559 1.00 41.23 C ATOM 135 CZ TYR A 395 -0.281 8.630 6.771 1.00 14.41 C ATOM 136 OH TYR A 395 -0.963 9.039 7.874 1.00 1.44 O ATOM 0 H TYR A 395 3.295 9.572 3.011 1.00 61.50 H new ATOM 0 HA TYR A 395 3.839 6.863 4.138 1.00 30.15 H new ATOM 0 HB2 TYR A 395 1.524 7.899 2.409 1.00 44.55 H new ATOM 0 HB3 TYR A 395 1.658 6.289 3.088 1.00 44.55 H new ATOM 0 HD1 TYR A 395 2.706 7.329 5.857 1.00 23.32 H new ATOM 0 HD2 TYR A 395 -0.629 8.360 3.416 1.00 25.44 H new ATOM 0 HE1 TYR A 395 1.431 8.090 7.909 1.00 11.34 H new ATOM 0 HE2 TYR A 395 -1.895 9.114 5.475 1.00 41.23 H new ATOM 0 HH TYR A 395 -1.850 9.360 7.610 1.00 1.44 H new ATOM 145 N ASN A 396 4.485 5.918 1.937 1.00 75.24 N ATOM 146 CA ASN A 396 5.115 5.446 0.715 1.00 25.20 C ATOM 147 C ASN A 396 4.230 4.377 0.070 1.00 72.24 C ATOM 148 O ASN A 396 4.439 4.006 -1.083 1.00 52.52 O ATOM 149 CB ASN A 396 6.479 4.816 1.008 1.00 10.10 C ATOM 150 CG ASN A 396 7.559 5.890 1.154 1.00 42.42 C ATOM 151 OD1 ASN A 396 8.245 6.252 0.212 1.00 2.13 O ATOM 152 ND2 ASN A 396 7.671 6.379 2.386 1.00 13.51 N ATOM 0 H ASN A 396 4.425 5.224 2.682 1.00 75.24 H new ATOM 0 HA ASN A 396 5.246 6.300 0.051 1.00 25.20 H new ATOM 0 HB2 ASN A 396 6.422 4.226 1.923 1.00 10.10 H new ATOM 0 HB3 ASN A 396 6.748 4.132 0.203 1.00 10.10 H new ATOM 0 HD21 ASN A 396 8.363 7.101 2.587 1.00 13.51 H new ATOM 0 HD22 ASN A 396 7.065 6.032 3.130 1.00 13.51 H new ATOM 158 N PHE A 397 3.258 3.913 0.844 1.00 60.30 N ATOM 159 CA PHE A 397 2.341 2.894 0.363 1.00 54.33 C ATOM 160 C PHE A 397 1.203 2.667 1.359 1.00 3.15 C ATOM 161 O PHE A 397 1.446 2.438 2.543 1.00 61.42 O ATOM 162 CB PHE A 397 3.143 1.601 0.219 1.00 34.42 C ATOM 163 CG PHE A 397 3.824 1.144 1.511 1.00 34.53 C ATOM 164 CD1 PHE A 397 4.937 1.786 1.957 1.00 51.35 C ATOM 165 CD2 PHE A 397 3.317 0.095 2.211 1.00 5.03 C ATOM 166 CE1 PHE A 397 5.568 1.362 3.156 1.00 42.11 C ATOM 167 CE2 PHE A 397 3.949 -0.330 3.410 1.00 74.24 C ATOM 168 CZ PHE A 397 5.060 0.313 3.857 1.00 60.42 C ATOM 0 H PHE A 397 3.086 4.224 1.800 1.00 60.30 H new ATOM 0 HA PHE A 397 1.902 3.207 -0.584 1.00 54.33 H new ATOM 0 HB2 PHE A 397 2.478 0.810 -0.129 1.00 34.42 H new ATOM 0 HB3 PHE A 397 3.902 1.740 -0.550 1.00 34.42 H new ATOM 0 HD1 PHE A 397 5.341 2.618 1.399 1.00 51.35 H new ATOM 0 HD2 PHE A 397 2.434 -0.415 1.856 1.00 5.03 H new ATOM 0 HE1 PHE A 397 6.451 1.872 3.511 1.00 42.11 H new ATOM 0 HE2 PHE A 397 3.547 -1.164 3.966 1.00 74.24 H new ATOM 0 HZ PHE A 397 5.540 -0.009 4.769 1.00 60.42 H new ATOM 177 N VAL A 398 -0.016 2.737 0.844 1.00 70.50 N ATOM 178 CA VAL A 398 -1.191 2.541 1.675 1.00 15.51 C ATOM 179 C VAL A 398 -1.553 1.054 1.697 1.00 61.42 C ATOM 180 O VAL A 398 -2.050 0.517 0.709 1.00 35.32 O ATOM 181 CB VAL A 398 -2.337 3.427 1.177 1.00 25.30 C ATOM 182 CG1 VAL A 398 -3.048 2.785 -0.017 1.00 65.32 C ATOM 183 CG2 VAL A 398 -3.324 3.729 2.305 1.00 52.03 C ATOM 0 H VAL A 398 -0.215 2.927 -0.138 1.00 70.50 H new ATOM 0 HA VAL A 398 -0.987 2.841 2.703 1.00 15.51 H new ATOM 0 HB VAL A 398 -1.910 4.372 0.843 1.00 25.30 H new ATOM 0 HG11 VAL A 398 -3.857 3.435 -0.351 1.00 65.32 H new ATOM 0 HG12 VAL A 398 -2.337 2.644 -0.831 1.00 65.32 H new ATOM 0 HG13 VAL A 398 -3.457 1.819 0.279 1.00 65.32 H new ATOM 0 HG21 VAL A 398 -4.128 4.360 1.926 1.00 52.03 H new ATOM 0 HG22 VAL A 398 -3.742 2.796 2.682 1.00 52.03 H new ATOM 0 HG23 VAL A 398 -2.806 4.247 3.112 1.00 52.03 H new ATOM 193 N ILE A 399 -1.288 0.432 2.836 1.00 24.43 N ATOM 194 CA ILE A 399 -1.578 -0.982 3.001 1.00 45.10 C ATOM 195 C ILE A 399 -3.089 -1.174 3.159 1.00 33.33 C ATOM 196 O ILE A 399 -3.628 -1.002 4.250 1.00 43.32 O ATOM 197 CB ILE A 399 -0.761 -1.567 4.155 1.00 62.45 C ATOM 198 CG1 ILE A 399 0.739 -1.383 3.914 1.00 54.03 C ATOM 199 CG2 ILE A 399 -1.127 -3.032 4.400 1.00 30.51 C ATOM 200 CD1 ILE A 399 1.550 -1.839 5.126 1.00 25.03 C ATOM 0 H ILE A 399 -0.876 0.881 3.654 1.00 24.43 H new ATOM 0 HA ILE A 399 -1.276 -1.538 2.113 1.00 45.10 H new ATOM 0 HB ILE A 399 -1.011 -1.017 5.063 1.00 62.45 H new ATOM 0 HG12 ILE A 399 1.042 -1.952 3.035 1.00 54.03 H new ATOM 0 HG13 ILE A 399 0.951 -0.335 3.704 1.00 54.03 H new ATOM 0 HG21 ILE A 399 -0.532 -3.423 5.225 1.00 30.51 H new ATOM 0 HG22 ILE A 399 -2.186 -3.106 4.649 1.00 30.51 H new ATOM 0 HG23 ILE A 399 -0.925 -3.613 3.500 1.00 30.51 H new ATOM 0 HD11 ILE A 399 2.612 -1.697 4.927 1.00 25.03 H new ATOM 0 HD12 ILE A 399 1.262 -1.252 5.998 1.00 25.03 H new ATOM 0 HD13 ILE A 399 1.355 -2.894 5.318 1.00 25.03 H new ATOM 211 N LEU A 400 -3.727 -1.526 2.052 1.00 21.42 N ATOM 212 CA LEU A 400 -5.162 -1.742 2.053 1.00 51.01 C ATOM 213 C LEU A 400 -5.464 -3.141 2.594 1.00 72.31 C ATOM 214 O LEU A 400 -5.279 -4.135 1.892 1.00 75.42 O ATOM 215 CB LEU A 400 -5.746 -1.482 0.662 1.00 64.33 C ATOM 216 CG LEU A 400 -6.331 -0.088 0.431 1.00 11.10 C ATOM 217 CD1 LEU A 400 -6.223 0.315 -1.041 1.00 52.22 C ATOM 218 CD2 LEU A 400 -7.771 -0.007 0.943 1.00 44.10 C ATOM 0 H LEU A 400 -3.275 -1.667 1.148 1.00 21.42 H new ATOM 0 HA LEU A 400 -5.652 -1.030 2.717 1.00 51.01 H new ATOM 0 HB2 LEU A 400 -4.963 -1.653 -0.077 1.00 64.33 H new ATOM 0 HB3 LEU A 400 -6.528 -2.218 0.474 1.00 64.33 H new ATOM 0 HG LEU A 400 -5.744 0.629 1.005 1.00 11.10 H new ATOM 0 HD11 LEU A 400 -6.646 1.310 -1.178 1.00 52.22 H new ATOM 0 HD12 LEU A 400 -5.175 0.322 -1.340 1.00 52.22 H new ATOM 0 HD13 LEU A 400 -6.771 -0.400 -1.655 1.00 52.22 H new ATOM 0 HD21 LEU A 400 -8.164 0.994 0.767 1.00 44.10 H new ATOM 0 HD22 LEU A 400 -8.386 -0.736 0.416 1.00 44.10 H new ATOM 0 HD23 LEU A 400 -7.790 -0.221 2.012 1.00 44.10 H new ATOM 229 N HIS A 401 -5.921 -3.176 3.837 1.00 14.41 N ATOM 230 CA HIS A 401 -6.249 -4.438 4.479 1.00 52.15 C ATOM 231 C HIS A 401 -7.571 -4.299 5.234 1.00 41.41 C ATOM 232 O HIS A 401 -8.114 -3.201 5.350 1.00 10.33 O ATOM 233 CB HIS A 401 -5.100 -4.904 5.375 1.00 11.13 C ATOM 234 CG HIS A 401 -5.018 -4.180 6.697 1.00 42.01 C ATOM 235 ND1 HIS A 401 -5.810 -4.512 7.783 1.00 62.43 N ATOM 236 CD2 HIS A 401 -4.232 -3.140 7.096 1.00 32.32 C ATOM 237 CE1 HIS A 401 -5.504 -3.700 8.785 1.00 31.12 C ATOM 238 NE2 HIS A 401 -4.527 -2.850 8.357 1.00 4.45 N ATOM 0 H HIS A 401 -6.072 -2.351 4.417 1.00 14.41 H new ATOM 0 HA HIS A 401 -6.382 -5.213 3.724 1.00 52.15 H new ATOM 0 HB2 HIS A 401 -5.211 -5.972 5.564 1.00 11.13 H new ATOM 0 HB3 HIS A 401 -4.159 -4.770 4.841 1.00 11.13 H new ATOM 0 HD2 HIS A 401 -3.494 -2.637 6.489 1.00 32.32 H new ATOM 0 HE1 HIS A 401 -5.950 -3.710 9.768 1.00 31.12 H new ATOM 0 HE2 HIS A 401 -4.095 -2.113 8.914 1.00 4.45 H new ATOM 246 N ALA A 402 -8.054 -5.429 5.731 1.00 30.23 N ATOM 247 CA ALA A 402 -9.303 -5.450 6.472 1.00 40.24 C ATOM 248 C ALA A 402 -9.124 -4.686 7.786 1.00 72.53 C ATOM 249 O ALA A 402 -8.189 -3.900 7.928 1.00 54.14 O ATOM 250 CB ALA A 402 -9.742 -6.899 6.696 1.00 34.11 C ATOM 0 H ALA A 402 -7.601 -6.338 5.634 1.00 30.23 H new ATOM 0 HA ALA A 402 -10.092 -4.955 5.906 1.00 40.24 H new ATOM 0 HB1 ALA A 402 -10.679 -6.913 7.252 1.00 34.11 H new ATOM 0 HB2 ALA A 402 -9.884 -7.389 5.733 1.00 34.11 H new ATOM 0 HB3 ALA A 402 -8.976 -7.428 7.263 1.00 34.11 H new ATOM 256 N ARG A 403 -10.033 -4.946 8.713 1.00 32.04 N ATOM 257 CA ARG A 403 -9.987 -4.293 10.011 1.00 72.43 C ATOM 258 C ARG A 403 -9.365 -5.224 11.053 1.00 32.25 C ATOM 259 O ARG A 403 -8.778 -4.765 12.031 1.00 62.23 O ATOM 260 CB ARG A 403 -11.387 -3.887 10.473 1.00 53.24 C ATOM 261 CG ARG A 403 -11.359 -3.352 11.905 1.00 65.33 C ATOM 262 CD ARG A 403 -11.892 -4.394 12.891 1.00 13.34 C ATOM 263 NE ARG A 403 -11.260 -4.210 14.215 1.00 4.21 N ATOM 264 CZ ARG A 403 -11.762 -4.701 15.369 1.00 34.24 C ATOM 265 NH1 ARG A 403 -12.910 -5.411 15.368 1.00 22.44 N ATOM 266 NH2 ARG A 403 -11.114 -4.476 16.497 1.00 32.15 N ATOM 0 H ARG A 403 -10.806 -5.600 8.592 1.00 32.04 H new ATOM 0 HA ARG A 403 -9.375 -3.397 9.909 1.00 72.43 H new ATOM 0 HB2 ARG A 403 -11.788 -3.125 9.804 1.00 53.24 H new ATOM 0 HB3 ARG A 403 -12.056 -4.746 10.415 1.00 53.24 H new ATOM 0 HG2 ARG A 403 -10.339 -3.079 12.175 1.00 65.33 H new ATOM 0 HG3 ARG A 403 -11.959 -2.445 11.970 1.00 65.33 H new ATOM 0 HD2 ARG A 403 -12.974 -4.302 12.980 1.00 13.34 H new ATOM 0 HD3 ARG A 403 -11.687 -5.397 12.518 1.00 13.34 H new ATOM 0 HE ARG A 403 -10.390 -3.679 14.260 1.00 4.21 H new ATOM 0 HH11 ARG A 403 -13.404 -5.580 14.492 1.00 22.44 H new ATOM 0 HH12 ARG A 403 -13.283 -5.779 16.243 1.00 22.44 H new ATOM 0 HH21 ARG A 403 -10.247 -3.938 16.489 1.00 32.15 H new ATOM 0 HH22 ARG A 403 -11.480 -4.840 17.377 1.00 32.15 H new ATOM 276 N ALA A 404 -9.514 -6.518 10.807 1.00 34.43 N ATOM 277 CA ALA A 404 -8.973 -7.519 11.711 1.00 12.52 C ATOM 278 C ALA A 404 -7.603 -7.971 11.204 1.00 35.23 C ATOM 279 O ALA A 404 -7.097 -9.014 11.618 1.00 32.01 O ATOM 280 CB ALA A 404 -9.962 -8.680 11.836 1.00 31.42 C ATOM 0 H ALA A 404 -10.002 -6.896 9.995 1.00 34.43 H new ATOM 0 HA ALA A 404 -8.833 -7.101 12.708 1.00 12.52 H new ATOM 0 HB1 ALA A 404 -9.557 -9.431 12.514 1.00 31.42 H new ATOM 0 HB2 ALA A 404 -10.909 -8.310 12.228 1.00 31.42 H new ATOM 0 HB3 ALA A 404 -10.125 -9.126 10.855 1.00 31.42 H new ATOM 286 N ASP A 405 -7.040 -7.167 10.314 1.00 43.22 N ATOM 287 CA ASP A 405 -5.738 -7.472 9.746 1.00 62.05 C ATOM 288 C ASP A 405 -4.774 -6.321 10.047 1.00 51.22 C ATOM 289 O ASP A 405 -3.828 -6.087 9.296 1.00 51.41 O ATOM 290 CB ASP A 405 -5.823 -7.632 8.228 1.00 24.22 C ATOM 291 CG ASP A 405 -5.804 -9.078 7.729 1.00 62.32 C ATOM 292 OD1 ASP A 405 -6.433 -9.967 8.322 1.00 20.32 O ATOM 293 OD2 ASP A 405 -5.093 -9.279 6.670 1.00 11.42 O ATOM 0 H ASP A 405 -7.462 -6.304 9.972 1.00 43.22 H new ATOM 0 HA ASP A 405 -5.387 -8.405 10.187 1.00 62.05 H new ATOM 0 HB2 ASP A 405 -6.738 -7.155 7.878 1.00 24.22 H new ATOM 0 HB3 ASP A 405 -4.990 -7.096 7.774 1.00 24.22 H new ATOM 298 N GLU A 406 -5.048 -5.634 11.147 1.00 63.24 N ATOM 299 CA GLU A 406 -4.216 -4.514 11.556 1.00 11.45 C ATOM 300 C GLU A 406 -2.814 -5.002 11.926 1.00 30.12 C ATOM 301 O GLU A 406 -1.868 -4.821 11.159 1.00 24.01 O ATOM 302 CB GLU A 406 -4.856 -3.752 12.717 1.00 40.24 C ATOM 303 CG GLU A 406 -3.906 -2.681 13.260 1.00 14.21 C ATOM 304 CD GLU A 406 -4.642 -1.721 14.197 1.00 0.40 C ATOM 305 OE1 GLU A 406 -4.770 -2.004 15.398 1.00 33.30 O ATOM 306 OE2 GLU A 406 -5.087 -0.647 13.638 1.00 72.44 O ATOM 0 H GLU A 406 -5.834 -5.831 11.767 1.00 63.24 H new ATOM 0 HA GLU A 406 -4.129 -3.825 10.716 1.00 11.45 H new ATOM 0 HB2 GLU A 406 -5.783 -3.286 12.384 1.00 40.24 H new ATOM 0 HB3 GLU A 406 -5.118 -4.449 13.513 1.00 40.24 H new ATOM 0 HG2 GLU A 406 -3.083 -3.156 13.794 1.00 14.21 H new ATOM 0 HG3 GLU A 406 -3.469 -2.123 12.432 1.00 14.21 H new ATOM 312 N HIS A 407 -2.724 -5.609 13.100 1.00 74.44 N ATOM 313 CA HIS A 407 -1.452 -6.123 13.580 1.00 1.33 C ATOM 314 C HIS A 407 -0.665 -6.718 12.412 1.00 31.24 C ATOM 315 O HIS A 407 0.559 -6.607 12.362 1.00 62.42 O ATOM 316 CB HIS A 407 -1.666 -7.121 14.720 1.00 62.10 C ATOM 317 CG HIS A 407 -2.290 -8.425 14.286 1.00 21.42 C ATOM 318 ND1 HIS A 407 -3.466 -8.489 13.559 1.00 41.12 N ATOM 319 CD2 HIS A 407 -1.889 -9.714 14.482 1.00 1.23 C ATOM 320 CE1 HIS A 407 -3.751 -9.763 13.334 1.00 1.32 C ATOM 321 NE2 HIS A 407 -2.773 -10.521 13.908 1.00 33.21 N ATOM 0 H HIS A 407 -3.510 -5.757 13.733 1.00 74.44 H new ATOM 0 HA HIS A 407 -0.859 -5.308 13.994 1.00 1.33 H new ATOM 0 HB2 HIS A 407 -0.706 -7.329 15.192 1.00 62.10 H new ATOM 0 HB3 HIS A 407 -2.300 -6.661 15.478 1.00 62.10 H new ATOM 0 HD2 HIS A 407 -1.002 -10.025 15.014 1.00 1.23 H new ATOM 0 HE1 HIS A 407 -4.607 -10.136 12.791 1.00 1.32 H new ATOM 0 HE2 HIS A 407 -2.728 -11.540 13.898 1.00 33.21 H new ATOM 328 N ILE A 408 -1.399 -7.338 11.498 1.00 4.25 N ATOM 329 CA ILE A 408 -0.785 -7.952 10.335 1.00 75.42 C ATOM 330 C ILE A 408 -0.005 -6.889 9.555 1.00 21.34 C ATOM 331 O ILE A 408 1.206 -7.009 9.378 1.00 14.23 O ATOM 332 CB ILE A 408 -1.836 -8.681 9.495 1.00 73.40 C ATOM 333 CG1 ILE A 408 -2.304 -9.960 10.192 1.00 63.20 C ATOM 334 CG2 ILE A 408 -1.316 -8.955 8.083 1.00 52.30 C ATOM 335 CD1 ILE A 408 -3.352 -10.692 9.352 1.00 53.43 C ATOM 0 H ILE A 408 -2.414 -7.427 11.541 1.00 4.25 H new ATOM 0 HA ILE A 408 -0.069 -8.715 10.641 1.00 75.42 H new ATOM 0 HB ILE A 408 -2.706 -8.031 9.397 1.00 73.40 H new ATOM 0 HG12 ILE A 408 -1.451 -10.616 10.367 1.00 63.20 H new ATOM 0 HG13 ILE A 408 -2.723 -9.714 11.168 1.00 63.20 H new ATOM 0 HG21 ILE A 408 -2.082 -9.474 7.507 1.00 52.30 H new ATOM 0 HG22 ILE A 408 -1.073 -8.011 7.595 1.00 52.30 H new ATOM 0 HG23 ILE A 408 -0.422 -9.576 8.139 1.00 52.30 H new ATOM 0 HD11 ILE A 408 -3.667 -11.597 9.871 1.00 53.43 H new ATOM 0 HD12 ILE A 408 -4.214 -10.043 9.199 1.00 53.43 H new ATOM 0 HD13 ILE A 408 -2.923 -10.958 8.386 1.00 53.43 H new ATOM 346 N ALA A 409 -0.732 -5.874 9.112 1.00 24.41 N ATOM 347 CA ALA A 409 -0.124 -4.792 8.358 1.00 61.22 C ATOM 348 C ALA A 409 0.938 -4.106 9.222 1.00 34.33 C ATOM 349 O ALA A 409 2.080 -3.942 8.794 1.00 40.23 O ATOM 350 CB ALA A 409 -1.210 -3.821 7.890 1.00 4.12 C ATOM 0 H ALA A 409 -1.737 -5.778 9.261 1.00 24.41 H new ATOM 0 HA ALA A 409 0.374 -5.178 7.468 1.00 61.22 H new ATOM 0 HB1 ALA A 409 -0.753 -3.009 7.324 1.00 4.12 H new ATOM 0 HB2 ALA A 409 -1.922 -4.349 7.256 1.00 4.12 H new ATOM 0 HB3 ALA A 409 -1.730 -3.412 8.756 1.00 4.12 H new ATOM 356 N LEU A 410 0.523 -3.728 10.421 1.00 42.13 N ATOM 357 CA LEU A 410 1.424 -3.063 11.348 1.00 4.44 C ATOM 358 C LEU A 410 2.718 -3.873 11.464 1.00 51.24 C ATOM 359 O LEU A 410 3.778 -3.317 11.746 1.00 25.40 O ATOM 360 CB LEU A 410 0.728 -2.821 12.690 1.00 71.42 C ATOM 361 CG LEU A 410 -0.568 -2.010 12.636 1.00 62.52 C ATOM 362 CD1 LEU A 410 -0.716 -1.132 13.880 1.00 63.31 C ATOM 363 CD2 LEU A 410 -0.650 -1.194 11.345 1.00 55.24 C ATOM 0 H LEU A 410 -0.424 -3.869 10.773 1.00 42.13 H new ATOM 0 HA LEU A 410 1.697 -2.076 10.973 1.00 4.44 H new ATOM 0 HB2 LEU A 410 0.510 -3.788 13.143 1.00 71.42 H new ATOM 0 HB3 LEU A 410 1.426 -2.309 13.352 1.00 71.42 H new ATOM 0 HG LEU A 410 -1.407 -2.705 12.631 1.00 62.52 H new ATOM 0 HD11 LEU A 410 -1.645 -0.566 13.817 1.00 63.31 H new ATOM 0 HD12 LEU A 410 -0.734 -1.762 14.770 1.00 63.31 H new ATOM 0 HD13 LEU A 410 0.126 -0.442 13.941 1.00 63.31 H new ATOM 0 HD21 LEU A 410 -1.581 -0.627 11.332 1.00 55.24 H new ATOM 0 HD22 LEU A 410 0.195 -0.507 11.295 1.00 55.24 H new ATOM 0 HD23 LEU A 410 -0.622 -1.866 10.487 1.00 55.24 H new ATOM 374 N ARG A 411 2.586 -5.172 11.240 1.00 73.42 N ATOM 375 CA ARG A 411 3.732 -6.063 11.315 1.00 11.20 C ATOM 376 C ARG A 411 4.575 -5.951 10.043 1.00 24.33 C ATOM 377 O ARG A 411 5.793 -6.123 10.084 1.00 42.30 O ATOM 378 CB ARG A 411 3.288 -7.516 11.499 1.00 31.32 C ATOM 379 CG ARG A 411 4.473 -8.408 11.873 1.00 30.52 C ATOM 380 CD ARG A 411 4.470 -9.699 11.051 1.00 54.53 C ATOM 381 NE ARG A 411 3.478 -10.647 11.605 1.00 21.12 N ATOM 382 CZ ARG A 411 3.586 -11.233 12.816 1.00 25.00 C ATOM 383 NH1 ARG A 411 4.644 -10.970 13.614 1.00 14.42 N ATOM 384 NH2 ARG A 411 2.641 -12.066 13.212 1.00 54.51 N ATOM 0 H ARG A 411 1.704 -5.629 11.007 1.00 73.42 H new ATOM 0 HA ARG A 411 4.329 -5.765 12.177 1.00 11.20 H new ATOM 0 HB2 ARG A 411 2.527 -7.572 12.277 1.00 31.32 H new ATOM 0 HB3 ARG A 411 2.831 -7.880 10.579 1.00 31.32 H new ATOM 0 HG2 ARG A 411 5.405 -7.869 11.706 1.00 30.52 H new ATOM 0 HG3 ARG A 411 4.430 -8.649 12.935 1.00 30.52 H new ATOM 0 HD2 ARG A 411 4.232 -9.477 10.011 1.00 54.53 H new ATOM 0 HD3 ARG A 411 5.462 -10.150 11.062 1.00 54.53 H new ATOM 0 HE ARG A 411 2.662 -10.872 11.036 1.00 21.12 H new ATOM 0 HH11 ARG A 411 5.369 -10.324 13.303 1.00 14.42 H new ATOM 0 HH12 ARG A 411 4.717 -11.417 14.528 1.00 14.42 H new ATOM 0 HH21 ARG A 411 1.844 -12.259 12.605 1.00 54.51 H new ATOM 0 HH22 ARG A 411 2.708 -12.517 14.124 1.00 54.51 H new ATOM 394 N VAL A 412 3.895 -5.667 8.943 1.00 15.11 N ATOM 395 CA VAL A 412 4.566 -5.531 7.661 1.00 53.41 C ATOM 396 C VAL A 412 5.283 -4.180 7.606 1.00 45.32 C ATOM 397 O VAL A 412 6.487 -4.122 7.361 1.00 61.33 O ATOM 398 CB VAL A 412 3.563 -5.722 6.522 1.00 43.44 C ATOM 399 CG1 VAL A 412 4.032 -5.009 5.252 1.00 64.21 C ATOM 400 CG2 VAL A 412 3.311 -7.207 6.255 1.00 44.34 C ATOM 0 H VAL A 412 2.885 -5.527 8.912 1.00 15.11 H new ATOM 0 HA VAL A 412 5.323 -6.306 7.543 1.00 53.41 H new ATOM 0 HB VAL A 412 2.619 -5.272 6.830 1.00 43.44 H new ATOM 0 HG11 VAL A 412 3.301 -5.161 4.458 1.00 64.21 H new ATOM 0 HG12 VAL A 412 4.135 -3.942 5.451 1.00 64.21 H new ATOM 0 HG13 VAL A 412 4.995 -5.415 4.941 1.00 64.21 H new ATOM 0 HG21 VAL A 412 2.594 -7.314 5.441 1.00 44.34 H new ATOM 0 HG22 VAL A 412 4.248 -7.691 5.980 1.00 44.34 H new ATOM 0 HG23 VAL A 412 2.911 -7.676 7.154 1.00 44.34 H new ATOM 410 N ARG A 413 4.513 -3.127 7.839 1.00 15.24 N ATOM 411 CA ARG A 413 5.059 -1.781 7.819 1.00 44.32 C ATOM 412 C ARG A 413 6.492 -1.782 8.355 1.00 61.13 C ATOM 413 O ARG A 413 7.394 -1.229 7.728 1.00 42.14 O ATOM 414 CB ARG A 413 4.208 -0.830 8.661 1.00 52.23 C ATOM 415 CG ARG A 413 2.716 -1.031 8.379 1.00 71.45 C ATOM 416 CD ARG A 413 1.947 0.282 8.533 1.00 11.44 C ATOM 417 NE ARG A 413 2.478 1.047 9.683 1.00 52.43 N ATOM 418 CZ ARG A 413 1.893 2.154 10.191 1.00 21.04 C ATOM 419 NH1 ARG A 413 0.752 2.634 9.653 1.00 11.12 N ATOM 420 NH2 ARG A 413 2.454 2.759 11.222 1.00 22.14 N ATOM 0 H ARG A 413 3.515 -3.179 8.043 1.00 15.24 H new ATOM 0 HA ARG A 413 5.054 -1.436 6.785 1.00 44.32 H new ATOM 0 HB2 ARG A 413 4.407 -0.999 9.719 1.00 52.23 H new ATOM 0 HB3 ARG A 413 4.487 0.201 8.444 1.00 52.23 H new ATOM 0 HG2 ARG A 413 2.582 -1.419 7.369 1.00 71.45 H new ATOM 0 HG3 ARG A 413 2.310 -1.777 9.063 1.00 71.45 H new ATOM 0 HD2 ARG A 413 2.034 0.873 7.621 1.00 11.44 H new ATOM 0 HD3 ARG A 413 0.887 0.077 8.680 1.00 11.44 H new ATOM 0 HE ARG A 413 3.339 0.718 10.119 1.00 52.43 H new ATOM 0 HH11 ARG A 413 0.325 2.160 8.857 1.00 11.12 H new ATOM 0 HH12 ARG A 413 0.317 3.470 10.043 1.00 11.12 H new ATOM 0 HH21 ARG A 413 3.316 2.390 11.623 1.00 22.14 H new ATOM 0 HH22 ARG A 413 2.025 3.596 11.617 1.00 22.14 H new ATOM 430 N GLU A 414 6.658 -2.410 9.509 1.00 44.41 N ATOM 431 CA GLU A 414 7.966 -2.491 10.138 1.00 10.31 C ATOM 432 C GLU A 414 8.898 -3.378 9.310 1.00 54.12 C ATOM 433 O GLU A 414 9.956 -2.931 8.868 1.00 24.11 O ATOM 434 CB GLU A 414 7.854 -3.003 11.575 1.00 55.42 C ATOM 435 CG GLU A 414 7.326 -1.910 12.506 1.00 65.13 C ATOM 436 CD GLU A 414 8.338 -0.772 12.644 1.00 53.24 C ATOM 437 OE1 GLU A 414 9.554 -1.015 12.618 1.00 34.14 O ATOM 438 OE2 GLU A 414 7.822 0.403 12.783 1.00 70.11 O ATOM 0 H GLU A 414 5.908 -2.868 10.026 1.00 44.41 H new ATOM 0 HA GLU A 414 8.391 -1.488 10.178 1.00 10.31 H new ATOM 0 HB2 GLU A 414 7.189 -3.866 11.607 1.00 55.42 H new ATOM 0 HB3 GLU A 414 8.831 -3.341 11.922 1.00 55.42 H new ATOM 0 HG2 GLU A 414 6.385 -1.520 12.118 1.00 65.13 H new ATOM 0 HG3 GLU A 414 7.114 -2.334 13.487 1.00 65.13 H new ATOM 444 N LYS A 415 8.471 -4.618 9.124 1.00 22.22 N ATOM 445 CA LYS A 415 9.254 -5.573 8.358 1.00 63.34 C ATOM 446 C LYS A 415 9.868 -4.866 7.148 1.00 54.43 C ATOM 447 O LYS A 415 11.086 -4.872 6.973 1.00 71.43 O ATOM 448 CB LYS A 415 8.406 -6.792 7.993 1.00 21.44 C ATOM 449 CG LYS A 415 9.158 -8.091 8.286 1.00 25.23 C ATOM 450 CD LYS A 415 10.511 -8.114 7.572 1.00 73.20 C ATOM 451 CE LYS A 415 10.331 -8.247 6.059 1.00 55.43 C ATOM 452 NZ LYS A 415 10.524 -9.650 5.632 1.00 4.40 N ATOM 0 H LYS A 415 7.592 -4.984 9.491 1.00 22.22 H new ATOM 0 HA LYS A 415 10.079 -5.957 8.957 1.00 63.34 H new ATOM 0 HB2 LYS A 415 7.473 -6.773 8.557 1.00 21.44 H new ATOM 0 HB3 LYS A 415 8.141 -6.752 6.937 1.00 21.44 H new ATOM 0 HG2 LYS A 415 9.308 -8.194 9.361 1.00 25.23 H new ATOM 0 HG3 LYS A 415 8.559 -8.943 7.965 1.00 25.23 H new ATOM 0 HD2 LYS A 415 11.061 -7.200 7.797 1.00 73.20 H new ATOM 0 HD3 LYS A 415 11.109 -8.946 7.945 1.00 73.20 H new ATOM 0 HE2 LYS A 415 9.334 -7.909 5.775 1.00 55.43 H new ATOM 0 HE3 LYS A 415 11.045 -7.603 5.545 1.00 55.43 H new ATOM 0 HZ1 LYS A 415 10.234 -9.754 4.639 1.00 4.40 H new ATOM 0 HZ2 LYS A 415 11.527 -9.907 5.729 1.00 4.40 H new ATOM 0 HZ3 LYS A 415 9.947 -10.277 6.228 1.00 4.40 H new ATOM 461 N LEU A 416 8.997 -4.275 6.343 1.00 3.34 N ATOM 462 CA LEU A 416 9.438 -3.566 5.155 1.00 74.21 C ATOM 463 C LEU A 416 10.726 -2.801 5.471 1.00 33.20 C ATOM 464 O LEU A 416 11.742 -2.987 4.802 1.00 65.33 O ATOM 465 CB LEU A 416 8.315 -2.681 4.610 1.00 62.21 C ATOM 466 CG LEU A 416 7.087 -3.415 4.070 1.00 54.33 C ATOM 467 CD1 LEU A 416 5.890 -2.468 3.956 1.00 0.52 C ATOM 468 CD2 LEU A 416 7.400 -4.104 2.740 1.00 45.22 C ATOM 0 H LEU A 416 7.988 -4.273 6.491 1.00 3.34 H new ATOM 0 HA LEU A 416 9.672 -4.270 4.357 1.00 74.21 H new ATOM 0 HB2 LEU A 416 7.992 -2.008 5.404 1.00 62.21 H new ATOM 0 HB3 LEU A 416 8.723 -2.060 3.812 1.00 62.21 H new ATOM 0 HG LEU A 416 6.816 -4.196 4.781 1.00 54.33 H new ATOM 0 HD11 LEU A 416 5.029 -3.014 3.570 1.00 0.52 H new ATOM 0 HD12 LEU A 416 5.651 -2.063 4.940 1.00 0.52 H new ATOM 0 HD13 LEU A 416 6.136 -1.651 3.277 1.00 0.52 H new ATOM 0 HD21 LEU A 416 6.510 -4.618 2.378 1.00 45.22 H new ATOM 0 HD22 LEU A 416 7.711 -3.358 2.008 1.00 45.22 H new ATOM 0 HD23 LEU A 416 8.203 -4.827 2.885 1.00 45.22 H new ATOM 479 N GLU A 417 10.640 -1.957 6.489 1.00 42.40 N ATOM 480 CA GLU A 417 11.785 -1.165 6.901 1.00 53.03 C ATOM 481 C GLU A 417 13.074 -1.976 6.758 1.00 54.11 C ATOM 482 O GLU A 417 14.050 -1.502 6.176 1.00 44.51 O ATOM 483 CB GLU A 417 11.613 -0.658 8.335 1.00 13.14 C ATOM 484 CG GLU A 417 10.237 -0.018 8.529 1.00 22.23 C ATOM 485 CD GLU A 417 10.233 0.916 9.741 1.00 45.12 C ATOM 486 OE1 GLU A 417 9.997 2.123 9.592 1.00 51.35 O ATOM 487 OE2 GLU A 417 10.487 0.345 10.870 1.00 45.22 O ATOM 0 H GLU A 417 9.795 -1.805 7.040 1.00 42.40 H new ATOM 0 HA GLU A 417 11.853 -0.295 6.247 1.00 53.03 H new ATOM 0 HB2 GLU A 417 11.735 -1.485 9.034 1.00 13.14 H new ATOM 0 HB3 GLU A 417 12.392 0.070 8.563 1.00 13.14 H new ATOM 0 HG2 GLU A 417 9.962 0.540 7.634 1.00 22.23 H new ATOM 0 HG3 GLU A 417 9.486 -0.796 8.662 1.00 22.23 H new ATOM 493 N ALA A 418 13.036 -3.187 7.295 1.00 50.31 N ATOM 494 CA ALA A 418 14.188 -4.068 7.233 1.00 3.14 C ATOM 495 C ALA A 418 14.731 -4.094 5.803 1.00 55.55 C ATOM 496 O ALA A 418 15.933 -3.943 5.588 1.00 1.32 O ATOM 497 CB ALA A 418 13.792 -5.462 7.731 1.00 75.12 C ATOM 0 H ALA A 418 12.225 -3.578 7.775 1.00 50.31 H new ATOM 0 HA ALA A 418 14.985 -3.703 7.881 1.00 3.14 H new ATOM 0 HB1 ALA A 418 14.657 -6.124 7.685 1.00 75.12 H new ATOM 0 HB2 ALA A 418 13.441 -5.394 8.761 1.00 75.12 H new ATOM 0 HB3 ALA A 418 12.996 -5.860 7.102 1.00 75.12 H new ATOM 503 N LEU A 419 13.819 -4.284 4.861 1.00 1.11 N ATOM 504 CA LEU A 419 14.190 -4.330 3.458 1.00 31.11 C ATOM 505 C LEU A 419 14.572 -2.924 2.989 1.00 4.13 C ATOM 506 O LEU A 419 15.588 -2.743 2.319 1.00 22.33 O ATOM 507 CB LEU A 419 13.077 -4.973 2.628 1.00 24.10 C ATOM 508 CG LEU A 419 12.459 -6.248 3.208 1.00 52.11 C ATOM 509 CD1 LEU A 419 11.006 -6.407 2.760 1.00 31.34 C ATOM 510 CD2 LEU A 419 13.304 -7.474 2.860 1.00 61.41 C ATOM 0 H LEU A 419 12.823 -4.408 5.043 1.00 1.11 H new ATOM 0 HA LEU A 419 15.066 -4.963 3.318 1.00 31.11 H new ATOM 0 HB2 LEU A 419 12.283 -4.239 2.490 1.00 24.10 H new ATOM 0 HB3 LEU A 419 13.475 -5.203 1.639 1.00 24.10 H new ATOM 0 HG LEU A 419 12.452 -6.160 4.294 1.00 52.11 H new ATOM 0 HD11 LEU A 419 10.592 -7.321 3.186 1.00 31.34 H new ATOM 0 HD12 LEU A 419 10.424 -5.551 3.101 1.00 31.34 H new ATOM 0 HD13 LEU A 419 10.965 -6.463 1.672 1.00 31.34 H new ATOM 0 HD21 LEU A 419 12.843 -8.366 3.284 1.00 61.41 H new ATOM 0 HD22 LEU A 419 13.366 -7.578 1.777 1.00 61.41 H new ATOM 0 HD23 LEU A 419 14.306 -7.354 3.271 1.00 61.41 H new ATOM 521 N GLY A 420 13.736 -1.964 3.360 1.00 21.43 N ATOM 522 CA GLY A 420 13.974 -0.581 2.986 1.00 40.21 C ATOM 523 C GLY A 420 12.734 0.277 3.241 1.00 3.14 C ATOM 524 O GLY A 420 12.709 1.077 4.175 1.00 61.33 O ATOM 0 H GLY A 420 12.894 -2.117 3.915 1.00 21.43 H new ATOM 0 HA2 GLY A 420 14.816 -0.187 3.554 1.00 40.21 H new ATOM 0 HA3 GLY A 420 14.247 -0.527 1.932 1.00 40.21 H new ATOM 528 N VAL A 421 11.732 0.080 2.397 1.00 74.42 N ATOM 529 CA VAL A 421 10.491 0.825 2.520 1.00 50.43 C ATOM 530 C VAL A 421 10.135 0.972 4.001 1.00 54.34 C ATOM 531 O VAL A 421 10.255 0.020 4.770 1.00 71.02 O ATOM 532 CB VAL A 421 9.389 0.145 1.705 1.00 71.23 C ATOM 533 CG1 VAL A 421 9.568 -1.375 1.702 1.00 61.14 C ATOM 534 CG2 VAL A 421 8.003 0.535 2.224 1.00 30.54 C ATOM 0 H VAL A 421 11.755 -0.586 1.624 1.00 74.42 H new ATOM 0 HA VAL A 421 10.606 1.829 2.111 1.00 50.43 H new ATOM 0 HB VAL A 421 9.470 0.493 0.675 1.00 71.23 H new ATOM 0 HG11 VAL A 421 8.772 -1.834 1.116 1.00 61.14 H new ATOM 0 HG12 VAL A 421 10.533 -1.627 1.263 1.00 61.14 H new ATOM 0 HG13 VAL A 421 9.527 -1.748 2.725 1.00 61.14 H new ATOM 0 HG21 VAL A 421 7.238 0.038 1.627 1.00 30.54 H new ATOM 0 HG22 VAL A 421 7.906 0.230 3.266 1.00 30.54 H new ATOM 0 HG23 VAL A 421 7.877 1.615 2.149 1.00 30.54 H new ATOM 544 N PRO A 422 9.693 2.207 4.365 1.00 23.32 N ATOM 545 CA PRO A 422 9.319 2.491 5.740 1.00 51.53 C ATOM 546 C PRO A 422 7.964 1.867 6.079 1.00 13.23 C ATOM 547 O PRO A 422 7.436 1.065 5.311 1.00 0.03 O ATOM 548 CB PRO A 422 9.317 4.008 5.842 1.00 14.24 C ATOM 549 CG PRO A 422 9.234 4.521 4.412 1.00 22.03 C ATOM 550 CD PRO A 422 9.538 3.359 3.481 1.00 25.43 C ATOM 0 HA PRO A 422 10.011 2.058 6.462 1.00 51.53 H new ATOM 0 HB2 PRO A 422 8.471 4.359 6.433 1.00 14.24 H new ATOM 0 HB3 PRO A 422 10.220 4.368 6.334 1.00 14.24 H new ATOM 0 HG2 PRO A 422 8.242 4.924 4.208 1.00 22.03 H new ATOM 0 HG3 PRO A 422 9.946 5.332 4.255 1.00 22.03 H new ATOM 0 HD2 PRO A 422 8.731 3.203 2.765 1.00 25.43 H new ATOM 0 HD3 PRO A 422 10.445 3.540 2.904 1.00 25.43 H new ATOM 555 N ASP A 423 7.439 2.260 7.232 1.00 34.05 N ATOM 556 CA ASP A 423 6.156 1.750 7.682 1.00 11.11 C ATOM 557 C ASP A 423 5.110 1.973 6.587 1.00 54.42 C ATOM 558 O ASP A 423 4.342 1.068 6.262 1.00 35.13 O ATOM 559 CB ASP A 423 5.684 2.480 8.941 1.00 11.14 C ATOM 560 CG ASP A 423 6.793 2.844 9.930 1.00 21.33 C ATOM 561 OD1 ASP A 423 6.963 2.190 10.970 1.00 54.41 O ATOM 562 OD2 ASP A 423 7.511 3.861 9.592 1.00 65.33 O ATOM 0 H ASP A 423 7.880 2.926 7.867 1.00 34.05 H new ATOM 0 HA ASP A 423 6.274 0.689 7.902 1.00 11.11 H new ATOM 0 HB2 ASP A 423 5.170 3.393 8.642 1.00 11.14 H new ATOM 0 HB3 ASP A 423 4.952 1.855 9.453 1.00 11.14 H new ATOM 567 N GLY A 424 5.113 3.184 6.048 1.00 51.11 N ATOM 568 CA GLY A 424 4.174 3.537 4.998 1.00 54.03 C ATOM 569 C GLY A 424 2.828 3.966 5.586 1.00 54.30 C ATOM 570 O GLY A 424 2.640 5.130 5.936 1.00 33.32 O ATOM 0 H GLY A 424 5.751 3.932 6.319 1.00 51.11 H new ATOM 0 HA2 GLY A 424 4.585 4.346 4.394 1.00 54.03 H new ATOM 0 HA3 GLY A 424 4.029 2.685 4.333 1.00 54.03 H new ATOM 574 N ALA A 425 1.924 3.001 5.675 1.00 3.52 N ATOM 575 CA ALA A 425 0.601 3.262 6.215 1.00 53.21 C ATOM 576 C ALA A 425 -0.351 2.143 5.790 1.00 32.35 C ATOM 577 O ALA A 425 0.062 1.192 5.127 1.00 50.14 O ATOM 578 CB ALA A 425 0.124 4.640 5.751 1.00 13.15 C ATOM 0 H ALA A 425 2.082 2.037 5.382 1.00 3.52 H new ATOM 0 HA ALA A 425 0.628 3.274 7.305 1.00 53.21 H new ATOM 0 HB1 ALA A 425 -0.869 4.837 6.156 1.00 13.15 H new ATOM 0 HB2 ALA A 425 0.818 5.403 6.104 1.00 13.15 H new ATOM 0 HB3 ALA A 425 0.083 4.663 4.662 1.00 13.15 H new ATOM 584 N THR A 426 -1.605 2.290 6.189 1.00 43.23 N ATOM 585 CA THR A 426 -2.618 1.302 5.857 1.00 53.33 C ATOM 586 C THR A 426 -3.975 1.978 5.657 1.00 11.33 C ATOM 587 O THR A 426 -4.144 3.151 5.985 1.00 42.14 O ATOM 588 CB THR A 426 -2.622 0.242 6.959 1.00 3.21 C ATOM 589 OG1 THR A 426 -3.379 0.837 8.011 1.00 54.34 O ATOM 590 CG2 THR A 426 -1.237 0.028 7.574 1.00 51.43 C ATOM 0 H THR A 426 -1.944 3.079 6.740 1.00 43.23 H new ATOM 0 HA THR A 426 -2.395 0.807 4.912 1.00 53.33 H new ATOM 0 HB THR A 426 -2.988 -0.701 6.552 1.00 3.21 H new ATOM 0 HG1 THR A 426 -3.433 0.216 8.767 1.00 54.34 H new ATOM 0 HG21 THR A 426 -1.298 -0.735 8.350 1.00 51.43 H new ATOM 0 HG22 THR A 426 -0.541 -0.297 6.800 1.00 51.43 H new ATOM 0 HG23 THR A 426 -0.884 0.963 8.010 1.00 51.43 H new ATOM 598 N PHE A 427 -4.911 1.208 5.119 1.00 32.41 N ATOM 599 CA PHE A 427 -6.248 1.717 4.872 1.00 32.32 C ATOM 600 C PHE A 427 -7.275 0.582 4.865 1.00 73.31 C ATOM 601 O PHE A 427 -7.003 -0.501 4.347 1.00 11.31 O ATOM 602 CB PHE A 427 -6.227 2.377 3.492 1.00 15.03 C ATOM 603 CG PHE A 427 -7.516 3.124 3.138 1.00 23.45 C ATOM 604 CD1 PHE A 427 -8.149 3.871 4.081 1.00 71.20 C ATOM 605 CD2 PHE A 427 -8.029 3.036 1.881 1.00 43.34 C ATOM 606 CE1 PHE A 427 -9.346 4.562 3.754 1.00 65.43 C ATOM 607 CE2 PHE A 427 -9.224 3.728 1.554 1.00 11.33 C ATOM 608 CZ PHE A 427 -9.857 4.476 2.496 1.00 44.42 C ATOM 0 H PHE A 427 -4.768 0.235 4.848 1.00 32.41 H new ATOM 0 HA PHE A 427 -6.529 2.420 5.656 1.00 32.32 H new ATOM 0 HB2 PHE A 427 -5.391 3.075 3.447 1.00 15.03 H new ATOM 0 HB3 PHE A 427 -6.044 1.612 2.738 1.00 15.03 H new ATOM 0 HD1 PHE A 427 -7.742 3.939 5.079 1.00 71.20 H new ATOM 0 HD2 PHE A 427 -7.527 2.440 1.133 1.00 43.34 H new ATOM 0 HE1 PHE A 427 -9.850 5.155 4.503 1.00 65.43 H new ATOM 0 HE2 PHE A 427 -9.631 3.660 0.556 1.00 11.33 H new ATOM 0 HZ PHE A 427 -10.766 5.002 2.246 1.00 44.42 H new ATOM 617 N CYS A 428 -8.431 0.868 5.444 1.00 65.45 N ATOM 618 CA CYS A 428 -9.497 -0.114 5.513 1.00 1.24 C ATOM 619 C CYS A 428 -10.603 0.309 4.543 1.00 63.01 C ATOM 620 O CYS A 428 -10.679 1.474 4.154 1.00 14.02 O ATOM 621 CB CYS A 428 -10.024 -0.283 6.939 1.00 63.54 C ATOM 622 SG CYS A 428 -10.660 1.316 7.563 1.00 33.00 S ATOM 0 H CYS A 428 -8.652 1.768 5.870 1.00 65.45 H new ATOM 0 HA CYS A 428 -9.112 -1.091 5.222 1.00 1.24 H new ATOM 0 HB2 CYS A 428 -10.817 -1.031 6.957 1.00 63.54 H new ATOM 0 HB3 CYS A 428 -9.228 -0.646 7.589 1.00 63.54 H new ATOM 0 HG CYS A 428 -11.706 1.665 6.875 1.00 33.00 H new ATOM 627 N GLU A 429 -11.432 -0.660 4.180 1.00 61.14 N ATOM 628 CA GLU A 429 -12.530 -0.401 3.265 1.00 32.40 C ATOM 629 C GLU A 429 -13.257 0.886 3.657 1.00 14.22 C ATOM 630 O GLU A 429 -13.016 1.437 4.729 1.00 42.05 O ATOM 631 CB GLU A 429 -13.497 -1.585 3.220 1.00 11.35 C ATOM 632 CG GLU A 429 -13.047 -2.622 2.188 1.00 30.51 C ATOM 633 CD GLU A 429 -13.698 -3.980 2.456 1.00 20.31 C ATOM 634 OE1 GLU A 429 -13.412 -4.613 3.484 1.00 42.51 O ATOM 635 OE2 GLU A 429 -14.529 -4.375 1.552 1.00 41.12 O ATOM 0 H GLU A 429 -11.365 -1.625 4.503 1.00 61.14 H new ATOM 0 HA GLU A 429 -12.119 -0.271 2.264 1.00 32.40 H new ATOM 0 HB2 GLU A 429 -13.556 -2.049 4.205 1.00 11.35 H new ATOM 0 HB3 GLU A 429 -14.498 -1.232 2.973 1.00 11.35 H new ATOM 0 HG2 GLU A 429 -13.308 -2.281 1.186 1.00 30.51 H new ATOM 0 HG3 GLU A 429 -11.962 -2.723 2.217 1.00 30.51 H new ATOM 641 N ASP A 430 -14.134 1.328 2.767 1.00 73.43 N ATOM 642 CA ASP A 430 -14.898 2.540 3.007 1.00 34.11 C ATOM 643 C ASP A 430 -16.367 2.176 3.229 1.00 20.01 C ATOM 644 O ASP A 430 -17.248 3.021 3.080 1.00 52.52 O ATOM 645 CB ASP A 430 -14.821 3.486 1.806 1.00 51.41 C ATOM 646 CG ASP A 430 -13.659 4.480 1.839 1.00 63.24 C ATOM 647 OD1 ASP A 430 -13.160 4.845 2.914 1.00 42.42 O ATOM 648 OD2 ASP A 430 -13.257 4.888 0.682 1.00 45.30 O ATOM 0 H ASP A 430 -14.332 0.868 1.878 1.00 73.43 H new ATOM 0 HA ASP A 430 -14.480 3.035 3.883 1.00 34.11 H new ATOM 0 HB2 ASP A 430 -14.743 2.889 0.897 1.00 51.41 H new ATOM 0 HB3 ASP A 430 -15.755 4.044 1.742 1.00 51.41 H new ATOM 653 N PHE A 431 -16.584 0.918 3.581 1.00 5.50 N ATOM 654 CA PHE A 431 -17.931 0.432 3.825 1.00 1.34 C ATOM 655 C PHE A 431 -18.059 -0.147 5.237 1.00 32.22 C ATOM 656 O PHE A 431 -18.993 -0.894 5.523 1.00 71.50 O ATOM 657 CB PHE A 431 -18.199 -0.678 2.807 1.00 71.43 C ATOM 658 CG PHE A 431 -19.632 -1.211 2.828 1.00 22.32 C ATOM 659 CD1 PHE A 431 -20.609 -0.566 2.136 1.00 10.43 C ATOM 660 CD2 PHE A 431 -19.930 -2.331 3.540 1.00 2.42 C ATOM 661 CE1 PHE A 431 -21.939 -1.061 2.155 1.00 4.20 C ATOM 662 CE2 PHE A 431 -21.261 -2.827 3.561 1.00 53.21 C ATOM 663 CZ PHE A 431 -22.238 -2.181 2.867 1.00 25.11 C ATOM 0 H PHE A 431 -15.850 0.220 3.703 1.00 5.50 H new ATOM 0 HA PHE A 431 -18.643 1.252 3.731 1.00 1.34 H new ATOM 0 HB2 PHE A 431 -17.977 -0.302 1.808 1.00 71.43 H new ATOM 0 HB3 PHE A 431 -17.513 -1.503 2.996 1.00 71.43 H new ATOM 0 HD1 PHE A 431 -20.373 0.324 1.571 1.00 10.43 H new ATOM 0 HD2 PHE A 431 -19.154 -2.843 4.090 1.00 2.42 H new ATOM 0 HE1 PHE A 431 -22.714 -0.548 1.604 1.00 4.20 H new ATOM 0 HE2 PHE A 431 -21.498 -3.716 4.127 1.00 53.21 H new ATOM 0 HZ PHE A 431 -23.250 -2.558 2.882 1.00 25.11 H new ATOM 672 N GLN A 432 -17.105 0.220 6.080 1.00 21.12 N ATOM 673 CA GLN A 432 -17.098 -0.254 7.453 1.00 62.11 C ATOM 674 C GLN A 432 -16.978 0.926 8.421 1.00 73.42 C ATOM 675 O GLN A 432 -17.675 0.978 9.432 1.00 13.54 O ATOM 676 CB GLN A 432 -15.973 -1.266 7.680 1.00 73.11 C ATOM 677 CG GLN A 432 -14.829 -1.044 6.688 1.00 2.11 C ATOM 678 CD GLN A 432 -13.765 -2.135 6.823 1.00 3.24 C ATOM 679 OE1 GLN A 432 -12.764 -1.982 7.502 1.00 50.23 O ATOM 680 NE2 GLN A 432 -14.039 -3.245 6.143 1.00 12.14 N ATOM 0 H GLN A 432 -16.332 0.840 5.839 1.00 21.12 H new ATOM 0 HA GLN A 432 -18.043 -0.763 7.645 1.00 62.11 H new ATOM 0 HB2 GLN A 432 -15.598 -1.176 8.699 1.00 73.11 H new ATOM 0 HB3 GLN A 432 -16.362 -2.278 7.572 1.00 73.11 H new ATOM 0 HG2 GLN A 432 -15.221 -1.038 5.671 1.00 2.11 H new ATOM 0 HG3 GLN A 432 -14.377 -0.067 6.861 1.00 2.11 H new ATOM 0 HE21 GLN A 432 -14.896 -3.308 5.593 1.00 12.14 H new ATOM 0 HE22 GLN A 432 -13.392 -4.033 6.171 1.00 12.14 H new ATOM 687 N VAL A 433 -16.084 1.843 8.076 1.00 62.11 N ATOM 688 CA VAL A 433 -15.864 3.017 8.901 1.00 63.34 C ATOM 689 C VAL A 433 -17.018 4.001 8.702 1.00 62.43 C ATOM 690 O VAL A 433 -17.794 3.869 7.756 1.00 43.44 O ATOM 691 CB VAL A 433 -14.496 3.629 8.586 1.00 14.32 C ATOM 692 CG1 VAL A 433 -13.389 2.577 8.685 1.00 11.21 C ATOM 693 CG2 VAL A 433 -14.498 4.294 7.209 1.00 75.14 C ATOM 0 H VAL A 433 -15.505 1.795 7.237 1.00 62.11 H new ATOM 0 HA VAL A 433 -15.849 2.744 9.956 1.00 63.34 H new ATOM 0 HB VAL A 433 -14.294 4.399 9.330 1.00 14.32 H new ATOM 0 HG11 VAL A 433 -12.428 3.038 8.457 1.00 11.21 H new ATOM 0 HG12 VAL A 433 -13.365 2.168 9.695 1.00 11.21 H new ATOM 0 HG13 VAL A 433 -13.585 1.775 7.974 1.00 11.21 H new ATOM 0 HG21 VAL A 433 -13.515 4.721 7.010 1.00 75.14 H new ATOM 0 HG22 VAL A 433 -14.733 3.551 6.447 1.00 75.14 H new ATOM 0 HG23 VAL A 433 -15.248 5.085 7.188 1.00 75.14 H new ATOM 703 N HIS A 434 -17.095 4.966 9.606 1.00 42.12 N ATOM 704 CA HIS A 434 -18.142 5.971 9.542 1.00 44.54 C ATOM 705 C HIS A 434 -17.957 6.824 8.286 1.00 50.44 C ATOM 706 O HIS A 434 -18.905 7.045 7.534 1.00 34.22 O ATOM 707 CB HIS A 434 -18.177 6.804 10.826 1.00 32.10 C ATOM 708 CG HIS A 434 -16.812 7.185 11.346 1.00 73.53 C ATOM 709 ND1 HIS A 434 -16.142 8.323 10.931 1.00 34.04 N ATOM 710 CD2 HIS A 434 -16.000 6.571 12.253 1.00 52.20 C ATOM 711 CE1 HIS A 434 -14.979 8.378 11.564 1.00 61.34 C ATOM 712 NE2 HIS A 434 -14.893 7.293 12.382 1.00 22.31 N ATOM 0 H HIS A 434 -16.449 5.073 10.388 1.00 42.12 H new ATOM 0 HA HIS A 434 -19.114 5.484 9.469 1.00 44.54 H new ATOM 0 HB2 HIS A 434 -18.751 7.712 10.643 1.00 32.10 H new ATOM 0 HB3 HIS A 434 -18.705 6.243 11.597 1.00 32.10 H new ATOM 0 HD2 HIS A 434 -16.220 5.653 12.778 1.00 52.20 H new ATOM 0 HE1 HIS A 434 -14.231 9.148 11.451 1.00 61.34 H new ATOM 0 HE2 HIS A 434 -14.107 7.071 12.993 1.00 22.31 H new ATOM 719 N GLY A 435 -16.727 7.284 8.099 1.00 53.21 N ATOM 720 CA GLY A 435 -16.405 8.109 6.946 1.00 41.01 C ATOM 721 C GLY A 435 -16.897 9.544 7.146 1.00 71.25 C ATOM 722 O GLY A 435 -17.751 10.021 6.399 1.00 20.11 O ATOM 0 H GLY A 435 -15.943 7.101 8.726 1.00 53.21 H new ATOM 0 HA2 GLY A 435 -15.327 8.109 6.784 1.00 41.01 H new ATOM 0 HA3 GLY A 435 -16.862 7.685 6.052 1.00 41.01 H new ATOM 726 N ARG A 436 -16.337 10.193 8.156 1.00 25.32 N ATOM 727 CA ARG A 436 -16.707 11.564 8.462 1.00 23.21 C ATOM 728 C ARG A 436 -15.504 12.492 8.281 1.00 11.51 C ATOM 729 O ARG A 436 -15.286 13.396 9.088 1.00 34.33 O ATOM 730 CB ARG A 436 -17.227 11.687 9.896 1.00 22.45 C ATOM 731 CG ARG A 436 -18.561 10.956 10.061 1.00 5.00 C ATOM 732 CD ARG A 436 -19.634 11.565 9.157 1.00 72.25 C ATOM 733 NE ARG A 436 -19.648 10.871 7.852 1.00 14.34 N ATOM 734 CZ ARG A 436 -20.113 9.617 7.666 1.00 11.52 C ATOM 735 NH1 ARG A 436 -20.604 8.908 8.703 1.00 3.43 N ATOM 736 NH2 ARG A 436 -20.079 9.093 6.453 1.00 63.15 N ATOM 0 H ARG A 436 -15.629 9.794 8.773 1.00 25.32 H new ATOM 0 HA ARG A 436 -17.501 11.855 7.774 1.00 23.21 H new ATOM 0 HB2 ARG A 436 -16.494 11.274 10.589 1.00 22.45 H new ATOM 0 HB3 ARG A 436 -17.351 12.739 10.153 1.00 22.45 H new ATOM 0 HG2 ARG A 436 -18.434 9.900 9.821 1.00 5.00 H new ATOM 0 HG3 ARG A 436 -18.883 11.009 11.101 1.00 5.00 H new ATOM 0 HD2 ARG A 436 -20.611 11.483 9.632 1.00 72.25 H new ATOM 0 HD3 ARG A 436 -19.439 12.627 9.011 1.00 72.25 H new ATOM 0 HE ARG A 436 -19.283 11.371 7.041 1.00 14.34 H new ATOM 0 HH11 ARG A 436 -20.626 9.318 9.636 1.00 3.43 H new ATOM 0 HH12 ARG A 436 -20.953 7.961 8.554 1.00 3.43 H new ATOM 0 HH21 ARG A 436 -19.705 9.635 5.674 1.00 63.15 H new ATOM 0 HH22 ARG A 436 -20.426 8.147 6.296 1.00 63.15 H new ATOM 746 N GLY A 437 -14.756 12.238 7.217 1.00 64.21 N ATOM 747 CA GLY A 437 -13.581 13.040 6.921 1.00 30.44 C ATOM 748 C GLY A 437 -12.367 12.549 7.713 1.00 2.12 C ATOM 749 O GLY A 437 -11.828 13.278 8.544 1.00 1.41 O ATOM 0 H GLY A 437 -14.941 11.489 6.550 1.00 64.21 H new ATOM 0 HA2 GLY A 437 -13.365 12.995 5.853 1.00 30.44 H new ATOM 0 HA3 GLY A 437 -13.779 14.084 7.163 1.00 30.44 H new ATOM 753 N GLU A 438 -11.974 11.316 7.428 1.00 71.21 N ATOM 754 CA GLU A 438 -10.835 10.718 8.105 1.00 51.35 C ATOM 755 C GLU A 438 -9.557 10.950 7.296 1.00 31.54 C ATOM 756 O GLU A 438 -8.520 11.304 7.854 1.00 61.14 O ATOM 757 CB GLU A 438 -11.064 9.227 8.354 1.00 52.52 C ATOM 758 CG GLU A 438 -12.198 9.006 9.357 1.00 71.33 C ATOM 759 CD GLU A 438 -12.051 7.656 10.062 1.00 1.22 C ATOM 760 OE1 GLU A 438 -11.467 6.721 9.496 1.00 71.42 O ATOM 761 OE2 GLU A 438 -12.568 7.599 11.243 1.00 13.51 O ATOM 0 H GLU A 438 -12.424 10.715 6.738 1.00 71.21 H new ATOM 0 HA GLU A 438 -10.720 11.199 9.076 1.00 51.35 H new ATOM 0 HB2 GLU A 438 -11.304 8.730 7.414 1.00 52.52 H new ATOM 0 HB3 GLU A 438 -10.147 8.773 8.730 1.00 52.52 H new ATOM 0 HG2 GLU A 438 -12.197 9.808 10.095 1.00 71.33 H new ATOM 0 HG3 GLU A 438 -13.158 9.049 8.842 1.00 71.33 H new ATOM 767 N LEU A 439 -9.673 10.739 5.992 1.00 1.12 N ATOM 768 CA LEU A 439 -8.541 10.919 5.102 1.00 53.13 C ATOM 769 C LEU A 439 -8.982 11.728 3.879 1.00 1.23 C ATOM 770 O LEU A 439 -10.164 11.752 3.541 1.00 43.51 O ATOM 771 CB LEU A 439 -7.913 9.569 4.750 1.00 4.45 C ATOM 772 CG LEU A 439 -8.649 8.742 3.694 1.00 0.44 C ATOM 773 CD1 LEU A 439 -8.308 9.226 2.284 1.00 20.31 C ATOM 774 CD2 LEU A 439 -8.367 7.249 3.872 1.00 33.34 C ATOM 0 H LEU A 439 -10.535 10.445 5.532 1.00 1.12 H new ATOM 0 HA LEU A 439 -7.756 11.490 5.598 1.00 53.13 H new ATOM 0 HB2 LEU A 439 -6.895 9.744 4.401 1.00 4.45 H new ATOM 0 HB3 LEU A 439 -7.840 8.976 5.662 1.00 4.45 H new ATOM 0 HG LEU A 439 -9.721 8.885 3.833 1.00 0.44 H new ATOM 0 HD11 LEU A 439 -8.844 8.622 1.552 1.00 20.31 H new ATOM 0 HD12 LEU A 439 -8.601 10.270 2.177 1.00 20.31 H new ATOM 0 HD13 LEU A 439 -7.235 9.132 2.116 1.00 20.31 H new ATOM 0 HD21 LEU A 439 -8.902 6.684 3.109 1.00 33.34 H new ATOM 0 HD22 LEU A 439 -7.297 7.067 3.775 1.00 33.34 H new ATOM 0 HD23 LEU A 439 -8.701 6.931 4.860 1.00 33.34 H new ATOM 785 N SER A 440 -8.009 12.369 3.250 1.00 64.11 N ATOM 786 CA SER A 440 -8.282 13.175 2.074 1.00 73.45 C ATOM 787 C SER A 440 -9.136 12.383 1.082 1.00 44.11 C ATOM 788 O SER A 440 -10.301 12.711 0.862 1.00 11.04 O ATOM 789 CB SER A 440 -6.984 13.634 1.407 1.00 55.04 C ATOM 790 OG SER A 440 -7.204 14.108 0.081 1.00 71.13 O ATOM 0 H SER A 440 -7.029 12.346 3.533 1.00 64.11 H new ATOM 0 HA SER A 440 -8.831 14.062 2.389 1.00 73.45 H new ATOM 0 HB2 SER A 440 -6.530 14.425 2.004 1.00 55.04 H new ATOM 0 HB3 SER A 440 -6.276 12.806 1.383 1.00 55.04 H new ATOM 0 HG SER A 440 -6.452 14.674 -0.193 1.00 71.13 H new ATOM 795 N CYS A 441 -8.524 11.357 0.511 1.00 4.32 N ATOM 796 CA CYS A 441 -9.214 10.514 -0.451 1.00 51.54 C ATOM 797 C CYS A 441 -8.473 9.179 -0.539 1.00 52.51 C ATOM 798 O CYS A 441 -7.252 9.132 -0.398 1.00 3.31 O ATOM 799 CB CYS A 441 -9.329 11.194 -1.816 1.00 14.40 C ATOM 800 SG CYS A 441 -10.879 10.681 -2.643 1.00 60.12 S ATOM 0 H CYS A 441 -7.557 11.090 0.696 1.00 4.32 H new ATOM 0 HA CYS A 441 -10.237 10.338 -0.118 1.00 51.54 H new ATOM 0 HB2 CYS A 441 -9.313 12.277 -1.694 1.00 14.40 H new ATOM 0 HB3 CYS A 441 -8.472 10.931 -2.436 1.00 14.40 H new ATOM 0 HG CYS A 441 -10.968 11.266 -3.800 1.00 60.12 H new ATOM 805 N LEU A 442 -9.243 8.126 -0.772 1.00 62.41 N ATOM 806 CA LEU A 442 -8.676 6.793 -0.881 1.00 22.32 C ATOM 807 C LEU A 442 -7.662 6.767 -2.027 1.00 23.54 C ATOM 808 O LEU A 442 -6.621 6.119 -1.925 1.00 51.21 O ATOM 809 CB LEU A 442 -9.783 5.747 -1.016 1.00 52.14 C ATOM 810 CG LEU A 442 -9.392 4.440 -1.708 1.00 42.13 C ATOM 811 CD1 LEU A 442 -9.502 4.569 -3.228 1.00 70.05 C ATOM 812 CD2 LEU A 442 -7.998 3.986 -1.271 1.00 65.14 C ATOM 0 H LEU A 442 -10.255 8.169 -0.888 1.00 62.41 H new ATOM 0 HA LEU A 442 -8.136 6.534 0.030 1.00 22.32 H new ATOM 0 HB2 LEU A 442 -10.154 5.510 -0.019 1.00 52.14 H new ATOM 0 HB3 LEU A 442 -10.611 6.193 -1.567 1.00 52.14 H new ATOM 0 HG LEU A 442 -10.095 3.666 -1.400 1.00 42.13 H new ATOM 0 HD11 LEU A 442 -9.218 3.626 -3.695 1.00 70.05 H new ATOM 0 HD12 LEU A 442 -10.529 4.814 -3.499 1.00 70.05 H new ATOM 0 HD13 LEU A 442 -8.837 5.360 -3.575 1.00 70.05 H new ATOM 0 HD21 LEU A 442 -7.743 3.055 -1.777 1.00 65.14 H new ATOM 0 HD22 LEU A 442 -7.268 4.752 -1.532 1.00 65.14 H new ATOM 0 HD23 LEU A 442 -7.988 3.827 -0.193 1.00 65.14 H new ATOM 823 N GLN A 443 -8.001 7.480 -3.090 1.00 31.40 N ATOM 824 CA GLN A 443 -7.133 7.546 -4.254 1.00 14.13 C ATOM 825 C GLN A 443 -6.018 8.568 -4.026 1.00 75.22 C ATOM 826 O GLN A 443 -5.116 8.702 -4.853 1.00 74.20 O ATOM 827 CB GLN A 443 -7.933 7.880 -5.515 1.00 35.25 C ATOM 828 CG GLN A 443 -9.215 7.048 -5.587 1.00 55.23 C ATOM 829 CD GLN A 443 -10.101 7.505 -6.748 1.00 21.32 C ATOM 830 OE1 GLN A 443 -10.783 8.513 -6.683 1.00 13.32 O ATOM 831 NE2 GLN A 443 -10.050 6.708 -7.813 1.00 24.04 N ATOM 0 H GLN A 443 -8.864 8.017 -3.170 1.00 31.40 H new ATOM 0 HA GLN A 443 -6.678 6.567 -4.401 1.00 14.13 H new ATOM 0 HB2 GLN A 443 -8.183 8.941 -5.521 1.00 35.25 H new ATOM 0 HB3 GLN A 443 -7.323 7.691 -6.398 1.00 35.25 H new ATOM 0 HG2 GLN A 443 -8.963 5.995 -5.710 1.00 55.23 H new ATOM 0 HG3 GLN A 443 -9.764 7.137 -4.649 1.00 55.23 H new ATOM 0 HE21 GLN A 443 -9.457 5.878 -7.801 1.00 24.04 H new ATOM 0 HE22 GLN A 443 -10.604 6.927 -8.641 1.00 24.04 H new ATOM 838 N ASP A 444 -6.115 9.264 -2.903 1.00 0.50 N ATOM 839 CA ASP A 444 -5.126 10.269 -2.556 1.00 60.31 C ATOM 840 C ASP A 444 -3.854 9.578 -2.062 1.00 51.23 C ATOM 841 O ASP A 444 -2.813 10.216 -1.915 1.00 73.24 O ATOM 842 CB ASP A 444 -5.635 11.180 -1.439 1.00 63.53 C ATOM 843 CG ASP A 444 -5.097 12.613 -1.476 1.00 12.32 C ATOM 844 OD1 ASP A 444 -5.523 13.433 -2.302 1.00 52.43 O ATOM 845 OD2 ASP A 444 -4.190 12.877 -0.599 1.00 73.24 O ATOM 0 H ASP A 444 -6.865 9.151 -2.221 1.00 0.50 H new ATOM 0 HA ASP A 444 -4.927 10.867 -3.445 1.00 60.31 H new ATOM 0 HB2 ASP A 444 -6.723 11.215 -1.487 1.00 63.53 H new ATOM 0 HB3 ASP A 444 -5.373 10.734 -0.479 1.00 63.53 H new ATOM 850 N ALA A 445 -3.980 8.282 -1.818 1.00 42.23 N ATOM 851 CA ALA A 445 -2.854 7.497 -1.341 1.00 32.01 C ATOM 852 C ALA A 445 -2.003 7.059 -2.535 1.00 2.31 C ATOM 853 O ALA A 445 -0.841 6.690 -2.370 1.00 1.23 O ATOM 854 CB ALA A 445 -3.369 6.309 -0.525 1.00 20.52 C ATOM 0 H ALA A 445 -4.845 7.756 -1.942 1.00 42.23 H new ATOM 0 HA ALA A 445 -2.220 8.093 -0.684 1.00 32.01 H new ATOM 0 HB1 ALA A 445 -2.525 5.720 -0.167 1.00 20.52 H new ATOM 0 HB2 ALA A 445 -3.944 6.674 0.326 1.00 20.52 H new ATOM 0 HB3 ALA A 445 -4.006 5.686 -1.152 1.00 20.52 H new ATOM 860 N ILE A 446 -2.614 7.115 -3.709 1.00 23.42 N ATOM 861 CA ILE A 446 -1.925 6.730 -4.930 1.00 11.34 C ATOM 862 C ILE A 446 -0.962 7.845 -5.341 1.00 32.02 C ATOM 863 O ILE A 446 0.059 7.584 -5.976 1.00 43.12 O ATOM 864 CB ILE A 446 -2.935 6.354 -6.017 1.00 52.11 C ATOM 865 CG1 ILE A 446 -2.422 5.186 -6.861 1.00 31.10 C ATOM 866 CG2 ILE A 446 -3.291 7.570 -6.876 1.00 65.42 C ATOM 867 CD1 ILE A 446 -3.577 4.297 -7.326 1.00 13.32 C ATOM 0 H ILE A 446 -3.578 7.421 -3.841 1.00 23.42 H new ATOM 0 HA ILE A 446 -1.323 5.837 -4.764 1.00 11.34 H new ATOM 0 HB ILE A 446 -3.853 6.021 -5.532 1.00 52.11 H new ATOM 0 HG12 ILE A 446 -1.881 5.568 -7.727 1.00 31.10 H new ATOM 0 HG13 ILE A 446 -1.715 4.595 -6.279 1.00 31.10 H new ATOM 0 HG21 ILE A 446 -4.010 7.277 -7.641 1.00 65.42 H new ATOM 0 HG22 ILE A 446 -3.727 8.345 -6.246 1.00 65.42 H new ATOM 0 HG23 ILE A 446 -2.390 7.955 -7.353 1.00 65.42 H new ATOM 0 HD11 ILE A 446 -3.185 3.474 -7.924 1.00 13.32 H new ATOM 0 HD12 ILE A 446 -4.101 3.897 -6.458 1.00 13.32 H new ATOM 0 HD13 ILE A 446 -4.269 4.885 -7.928 1.00 13.32 H new ATOM 878 N ASP A 447 -1.322 9.063 -4.965 1.00 0.04 N ATOM 879 CA ASP A 447 -0.503 10.218 -5.288 1.00 63.33 C ATOM 880 C ASP A 447 0.255 10.666 -4.036 1.00 1.30 C ATOM 881 O ASP A 447 1.366 11.188 -4.132 1.00 13.21 O ATOM 882 CB ASP A 447 -1.364 11.389 -5.762 1.00 71.04 C ATOM 883 CG ASP A 447 -1.992 12.225 -4.645 1.00 41.44 C ATOM 884 OD1 ASP A 447 -1.306 13.006 -3.969 1.00 74.02 O ATOM 885 OD2 ASP A 447 -3.259 12.048 -4.477 1.00 3.14 O ATOM 0 H ASP A 447 -2.170 9.275 -4.440 1.00 0.04 H new ATOM 0 HA ASP A 447 0.185 9.931 -6.083 1.00 63.33 H new ATOM 0 HB2 ASP A 447 -0.752 12.042 -6.383 1.00 71.04 H new ATOM 0 HB3 ASP A 447 -2.161 11.001 -6.396 1.00 71.04 H new ATOM 890 N HIS A 448 -0.375 10.445 -2.892 1.00 71.32 N ATOM 891 CA HIS A 448 0.227 10.819 -1.622 1.00 74.10 C ATOM 892 C HIS A 448 1.033 9.642 -1.070 1.00 41.53 C ATOM 893 O HIS A 448 1.298 9.575 0.129 1.00 61.20 O ATOM 894 CB HIS A 448 -0.837 11.320 -0.645 1.00 71.13 C ATOM 895 CG HIS A 448 -0.287 12.158 0.486 1.00 34.42 C ATOM 896 ND1 HIS A 448 -0.320 13.540 0.479 1.00 55.33 N ATOM 897 CD2 HIS A 448 0.310 11.793 1.657 1.00 30.22 C ATOM 898 CE1 HIS A 448 0.234 13.977 1.601 1.00 75.15 C ATOM 899 NE2 HIS A 448 0.624 12.893 2.328 1.00 61.43 N ATOM 0 H HIS A 448 -1.296 10.012 -2.817 1.00 71.32 H new ATOM 0 HA HIS A 448 0.918 11.648 -1.772 1.00 74.10 H new ATOM 0 HB2 HIS A 448 -1.572 11.908 -1.195 1.00 71.13 H new ATOM 0 HB3 HIS A 448 -1.363 10.462 -0.226 1.00 71.13 H new ATOM 0 HD2 HIS A 448 0.495 10.780 1.982 1.00 30.22 H new ATOM 0 HE1 HIS A 448 0.355 15.011 1.888 1.00 75.15 H new ATOM 0 HE2 HIS A 448 1.082 12.923 3.239 1.00 61.43 H new ATOM 906 N SER A 449 1.401 8.744 -1.971 1.00 24.34 N ATOM 907 CA SER A 449 2.172 7.572 -1.588 1.00 14.13 C ATOM 908 C SER A 449 2.843 6.962 -2.821 1.00 13.33 C ATOM 909 O SER A 449 2.290 7.010 -3.919 1.00 33.42 O ATOM 910 CB SER A 449 1.287 6.533 -0.897 1.00 64.24 C ATOM 911 OG SER A 449 1.942 5.934 0.220 1.00 42.52 O ATOM 0 H SER A 449 1.180 8.803 -2.965 1.00 24.34 H new ATOM 0 HA SER A 449 2.940 7.884 -0.880 1.00 14.13 H new ATOM 0 HB2 SER A 449 0.363 7.006 -0.565 1.00 64.24 H new ATOM 0 HB3 SER A 449 1.009 5.759 -1.613 1.00 64.24 H new ATOM 0 HG SER A 449 1.274 5.534 0.815 1.00 42.52 H new ATOM 916 N ALA A 450 4.022 6.402 -2.597 1.00 73.24 N ATOM 917 CA ALA A 450 4.774 5.783 -3.676 1.00 1.41 C ATOM 918 C ALA A 450 3.864 4.818 -4.437 1.00 0.01 C ATOM 919 O ALA A 450 3.313 5.170 -5.479 1.00 1.52 O ATOM 920 CB ALA A 450 6.011 5.090 -3.103 1.00 54.25 C ATOM 0 H ALA A 450 4.476 6.364 -1.684 1.00 73.24 H new ATOM 0 HA ALA A 450 5.121 6.536 -4.384 1.00 1.41 H new ATOM 0 HB1 ALA A 450 6.575 4.626 -3.912 1.00 54.25 H new ATOM 0 HB2 ALA A 450 6.638 5.824 -2.598 1.00 54.25 H new ATOM 0 HB3 ALA A 450 5.702 4.325 -2.390 1.00 54.25 H new ATOM 926 N PHE A 451 3.734 3.619 -3.887 1.00 31.41 N ATOM 927 CA PHE A 451 2.900 2.601 -4.500 1.00 32.55 C ATOM 928 C PHE A 451 1.893 2.038 -3.496 1.00 73.21 C ATOM 929 O PHE A 451 2.233 1.797 -2.340 1.00 24.11 O ATOM 930 CB PHE A 451 3.832 1.474 -4.956 1.00 11.31 C ATOM 931 CG PHE A 451 4.928 1.927 -5.923 1.00 0.20 C ATOM 932 CD1 PHE A 451 4.611 2.697 -6.998 1.00 23.33 C ATOM 933 CD2 PHE A 451 6.220 1.558 -5.707 1.00 12.51 C ATOM 934 CE1 PHE A 451 5.628 3.117 -7.895 1.00 22.34 C ATOM 935 CE2 PHE A 451 7.236 1.978 -6.604 1.00 33.52 C ATOM 936 CZ PHE A 451 6.921 2.749 -7.679 1.00 11.04 C ATOM 0 H PHE A 451 4.193 3.331 -3.023 1.00 31.41 H new ATOM 0 HA PHE A 451 2.341 3.030 -5.332 1.00 32.55 H new ATOM 0 HB2 PHE A 451 4.298 1.025 -4.079 1.00 11.31 H new ATOM 0 HB3 PHE A 451 3.238 0.696 -5.435 1.00 11.31 H new ATOM 0 HD1 PHE A 451 3.585 2.989 -7.169 1.00 23.33 H new ATOM 0 HD2 PHE A 451 6.472 0.946 -4.854 1.00 12.51 H new ATOM 0 HE1 PHE A 451 5.376 3.728 -8.749 1.00 22.34 H new ATOM 0 HE2 PHE A 451 8.261 1.685 -6.433 1.00 33.52 H new ATOM 0 HZ PHE A 451 7.695 3.069 -8.360 1.00 11.04 H new ATOM 945 N ILE A 452 0.673 1.844 -3.975 1.00 12.31 N ATOM 946 CA ILE A 452 -0.387 1.314 -3.133 1.00 31.54 C ATOM 947 C ILE A 452 -0.161 -0.185 -2.920 1.00 70.12 C ATOM 948 O ILE A 452 0.061 -0.925 -3.877 1.00 41.34 O ATOM 949 CB ILE A 452 -1.758 1.651 -3.723 1.00 22.11 C ATOM 950 CG1 ILE A 452 -1.827 3.119 -4.147 1.00 44.05 C ATOM 951 CG2 ILE A 452 -2.878 1.283 -2.749 1.00 2.35 C ATOM 952 CD1 ILE A 452 -1.641 4.046 -2.942 1.00 13.00 C ATOM 0 H ILE A 452 0.395 2.044 -4.936 1.00 12.31 H new ATOM 0 HA ILE A 452 -0.364 1.784 -2.150 1.00 31.54 H new ATOM 0 HB ILE A 452 -1.901 1.050 -4.621 1.00 22.11 H new ATOM 0 HG12 ILE A 452 -1.056 3.323 -4.890 1.00 44.05 H new ATOM 0 HG13 ILE A 452 -2.788 3.320 -4.620 1.00 44.05 H new ATOM 0 HG21 ILE A 452 -3.842 1.532 -3.192 1.00 2.35 H new ATOM 0 HG22 ILE A 452 -2.841 0.214 -2.539 1.00 2.35 H new ATOM 0 HG23 ILE A 452 -2.750 1.840 -1.821 1.00 2.35 H new ATOM 0 HD11 ILE A 452 -1.694 5.084 -3.270 1.00 13.00 H new ATOM 0 HD12 ILE A 452 -2.427 3.855 -2.212 1.00 13.00 H new ATOM 0 HD13 ILE A 452 -0.669 3.859 -2.486 1.00 13.00 H new ATOM 963 N ILE A 453 -0.225 -0.586 -1.658 1.00 33.11 N ATOM 964 CA ILE A 453 -0.030 -1.982 -1.307 1.00 20.42 C ATOM 965 C ILE A 453 -1.373 -2.594 -0.902 1.00 41.34 C ATOM 966 O ILE A 453 -1.923 -2.255 0.145 1.00 21.32 O ATOM 967 CB ILE A 453 1.055 -2.118 -0.237 1.00 40.23 C ATOM 968 CG1 ILE A 453 2.441 -2.233 -0.873 1.00 73.05 C ATOM 969 CG2 ILE A 453 0.756 -3.290 0.701 1.00 64.23 C ATOM 970 CD1 ILE A 453 3.536 -1.841 0.122 1.00 71.21 C ATOM 0 H ILE A 453 -0.409 0.031 -0.867 1.00 33.11 H new ATOM 0 HA ILE A 453 0.331 -2.545 -2.168 1.00 20.42 H new ATOM 0 HB ILE A 453 1.053 -1.212 0.369 1.00 40.23 H new ATOM 0 HG12 ILE A 453 2.604 -3.255 -1.215 1.00 73.05 H new ATOM 0 HG13 ILE A 453 2.496 -1.590 -1.752 1.00 73.05 H new ATOM 0 HG21 ILE A 453 1.542 -3.365 1.452 1.00 64.23 H new ATOM 0 HG22 ILE A 453 -0.202 -3.126 1.194 1.00 64.23 H new ATOM 0 HG23 ILE A 453 0.715 -4.215 0.126 1.00 64.23 H new ATOM 0 HD11 ILE A 453 4.511 -1.932 -0.356 1.00 71.21 H new ATOM 0 HD12 ILE A 453 3.384 -0.811 0.443 1.00 71.21 H new ATOM 0 HD13 ILE A 453 3.494 -2.501 0.988 1.00 71.21 H new ATOM 981 N LEU A 454 -1.862 -3.483 -1.754 1.00 45.52 N ATOM 982 CA LEU A 454 -3.130 -4.145 -1.497 1.00 12.13 C ATOM 983 C LEU A 454 -2.880 -5.423 -0.694 1.00 33.34 C ATOM 984 O LEU A 454 -2.463 -6.438 -1.249 1.00 34.14 O ATOM 985 CB LEU A 454 -3.885 -4.379 -2.807 1.00 4.41 C ATOM 986 CG LEU A 454 -4.249 -3.126 -3.606 1.00 3.24 C ATOM 987 CD1 LEU A 454 -5.145 -2.195 -2.786 1.00 62.11 C ATOM 988 CD2 LEU A 454 -2.992 -2.414 -4.111 1.00 12.20 C ATOM 0 H LEU A 454 -1.404 -3.760 -2.622 1.00 45.52 H new ATOM 0 HA LEU A 454 -3.777 -3.510 -0.891 1.00 12.13 H new ATOM 0 HB2 LEU A 454 -3.280 -5.027 -3.441 1.00 4.41 H new ATOM 0 HB3 LEU A 454 -4.803 -4.921 -2.582 1.00 4.41 H new ATOM 0 HG LEU A 454 -4.820 -3.433 -4.483 1.00 3.24 H new ATOM 0 HD11 LEU A 454 -5.389 -1.312 -3.376 1.00 62.11 H new ATOM 0 HD12 LEU A 454 -6.063 -2.717 -2.517 1.00 62.11 H new ATOM 0 HD13 LEU A 454 -4.621 -1.892 -1.879 1.00 62.11 H new ATOM 0 HD21 LEU A 454 -3.278 -1.527 -4.676 1.00 12.20 H new ATOM 0 HD22 LEU A 454 -2.374 -2.120 -3.262 1.00 12.20 H new ATOM 0 HD23 LEU A 454 -2.427 -3.087 -4.755 1.00 12.20 H new ATOM 999 N LEU A 455 -3.146 -5.331 0.600 1.00 23.33 N ATOM 1000 CA LEU A 455 -2.955 -6.467 1.486 1.00 4.23 C ATOM 1001 C LEU A 455 -3.968 -7.559 1.132 1.00 60.44 C ATOM 1002 O LEU A 455 -5.002 -7.686 1.784 1.00 44.44 O ATOM 1003 CB LEU A 455 -3.016 -6.023 2.949 1.00 34.31 C ATOM 1004 CG LEU A 455 -2.270 -6.908 3.950 1.00 52.50 C ATOM 1005 CD1 LEU A 455 -0.892 -7.300 3.414 1.00 21.12 C ATOM 1006 CD2 LEU A 455 -2.181 -6.230 5.319 1.00 63.10 C ATOM 0 H LEU A 455 -3.492 -4.487 1.057 1.00 23.33 H new ATOM 0 HA LEU A 455 -1.962 -6.895 1.349 1.00 4.23 H new ATOM 0 HB2 LEU A 455 -2.614 -5.012 3.018 1.00 34.31 H new ATOM 0 HB3 LEU A 455 -4.063 -5.972 3.249 1.00 34.31 H new ATOM 0 HG LEU A 455 -2.838 -7.829 4.082 1.00 52.50 H new ATOM 0 HD11 LEU A 455 -0.383 -7.929 4.144 1.00 21.12 H new ATOM 0 HD12 LEU A 455 -1.008 -7.850 2.480 1.00 21.12 H new ATOM 0 HD13 LEU A 455 -0.302 -6.401 3.235 1.00 21.12 H new ATOM 0 HD21 LEU A 455 -1.646 -6.879 6.012 1.00 63.10 H new ATOM 0 HD22 LEU A 455 -1.648 -5.284 5.223 1.00 63.10 H new ATOM 0 HD23 LEU A 455 -3.186 -6.043 5.698 1.00 63.10 H new ATOM 1017 N LEU A 456 -3.631 -8.320 0.101 1.00 5.34 N ATOM 1018 CA LEU A 456 -4.497 -9.398 -0.346 1.00 12.14 C ATOM 1019 C LEU A 456 -4.604 -10.453 0.756 1.00 43.50 C ATOM 1020 O LEU A 456 -3.788 -11.371 0.824 1.00 31.01 O ATOM 1021 CB LEU A 456 -4.011 -9.956 -1.685 1.00 50.21 C ATOM 1022 CG LEU A 456 -3.779 -8.928 -2.796 1.00 24.40 C ATOM 1023 CD1 LEU A 456 -3.771 -9.599 -4.170 1.00 54.54 C ATOM 1024 CD2 LEU A 456 -4.804 -7.795 -2.716 1.00 2.53 C ATOM 0 H LEU A 456 -2.771 -8.212 -0.437 1.00 5.34 H new ATOM 0 HA LEU A 456 -5.505 -9.024 -0.529 1.00 12.14 H new ATOM 0 HB2 LEU A 456 -3.079 -10.494 -1.515 1.00 50.21 H new ATOM 0 HB3 LEU A 456 -4.740 -10.685 -2.038 1.00 50.21 H new ATOM 0 HG LEU A 456 -2.795 -8.482 -2.650 1.00 24.40 H new ATOM 0 HD11 LEU A 456 -3.604 -8.847 -4.941 1.00 54.54 H new ATOM 0 HD12 LEU A 456 -2.973 -10.341 -4.208 1.00 54.54 H new ATOM 0 HD13 LEU A 456 -4.730 -10.088 -4.342 1.00 54.54 H new ATOM 0 HD21 LEU A 456 -4.617 -7.078 -3.516 1.00 2.53 H new ATOM 0 HD22 LEU A 456 -5.808 -8.205 -2.823 1.00 2.53 H new ATOM 0 HD23 LEU A 456 -4.718 -7.294 -1.752 1.00 2.53 H new ATOM 1035 N THR A 457 -5.617 -10.286 1.595 1.00 21.14 N ATOM 1036 CA THR A 457 -5.841 -11.213 2.691 1.00 44.40 C ATOM 1037 C THR A 457 -7.284 -11.719 2.676 1.00 12.31 C ATOM 1038 O THR A 457 -8.178 -11.042 2.168 1.00 35.31 O ATOM 1039 CB THR A 457 -5.459 -10.505 3.993 1.00 21.23 C ATOM 1040 OG1 THR A 457 -6.342 -9.389 4.053 1.00 3.45 O ATOM 1041 CG2 THR A 457 -4.065 -9.876 3.931 1.00 3.44 C ATOM 0 H THR A 457 -6.291 -9.523 1.537 1.00 21.14 H new ATOM 0 HA THR A 457 -5.218 -12.102 2.591 1.00 44.40 H new ATOM 0 HB THR A 457 -5.499 -11.216 4.818 1.00 21.23 H new ATOM 0 HG1 THR A 457 -6.268 -8.960 4.931 1.00 3.45 H new ATOM 0 HG21 THR A 457 -3.844 -9.387 4.880 1.00 3.44 H new ATOM 0 HG22 THR A 457 -3.324 -10.652 3.742 1.00 3.44 H new ATOM 0 HG23 THR A 457 -4.033 -9.140 3.127 1.00 3.44 H new ATOM 1049 N SER A 458 -7.469 -12.903 3.239 1.00 30.34 N ATOM 1050 CA SER A 458 -8.789 -13.509 3.295 1.00 60.34 C ATOM 1051 C SER A 458 -9.732 -12.629 4.120 1.00 3.12 C ATOM 1052 O SER A 458 -10.949 -12.805 4.074 1.00 65.23 O ATOM 1053 CB SER A 458 -8.724 -14.918 3.887 1.00 34.50 C ATOM 1054 OG SER A 458 -7.536 -15.604 3.502 1.00 54.33 O ATOM 0 H SER A 458 -6.726 -13.460 3.661 1.00 30.34 H new ATOM 0 HA SER A 458 -9.173 -13.590 2.278 1.00 60.34 H new ATOM 0 HB2 SER A 458 -8.771 -14.857 4.974 1.00 34.50 H new ATOM 0 HB3 SER A 458 -9.594 -15.489 3.562 1.00 34.50 H new ATOM 0 HG SER A 458 -7.140 -16.037 4.287 1.00 54.33 H new ATOM 1059 N ASN A 459 -9.134 -11.703 4.855 1.00 75.02 N ATOM 1060 CA ASN A 459 -9.904 -10.796 5.689 1.00 14.54 C ATOM 1061 C ASN A 459 -10.213 -9.522 4.899 1.00 65.11 C ATOM 1062 O ASN A 459 -11.078 -8.740 5.289 1.00 52.11 O ATOM 1063 CB ASN A 459 -9.122 -10.399 6.941 1.00 30.44 C ATOM 1064 CG ASN A 459 -9.285 -11.446 8.044 1.00 4.12 C ATOM 1065 OD1 ASN A 459 -9.619 -12.595 7.803 1.00 54.33 O ATOM 1066 ND2 ASN A 459 -9.031 -10.988 9.267 1.00 13.45 N ATOM 0 H ASN A 459 -8.125 -11.561 4.890 1.00 75.02 H new ATOM 0 HA ASN A 459 -10.820 -11.307 5.985 1.00 14.54 H new ATOM 0 HB2 ASN A 459 -8.066 -10.287 6.694 1.00 30.44 H new ATOM 0 HB3 ASN A 459 -9.470 -9.430 7.300 1.00 30.44 H new ATOM 0 HD21 ASN A 459 -9.112 -11.610 10.071 1.00 13.45 H new ATOM 0 HD22 ASN A 459 -8.756 -10.015 9.400 1.00 13.45 H new ATOM 1072 N PHE A 460 -9.486 -9.353 3.804 1.00 5.41 N ATOM 1073 CA PHE A 460 -9.670 -8.188 2.957 1.00 52.43 C ATOM 1074 C PHE A 460 -10.237 -8.585 1.592 1.00 65.45 C ATOM 1075 O PHE A 460 -10.379 -9.771 1.297 1.00 33.21 O ATOM 1076 CB PHE A 460 -8.292 -7.554 2.760 1.00 20.35 C ATOM 1077 CG PHE A 460 -8.321 -6.218 2.014 1.00 31.55 C ATOM 1078 CD1 PHE A 460 -9.135 -5.218 2.442 1.00 42.44 C ATOM 1079 CD2 PHE A 460 -7.531 -6.032 0.921 1.00 4.32 C ATOM 1080 CE1 PHE A 460 -9.162 -3.978 1.751 1.00 70.30 C ATOM 1081 CE2 PHE A 460 -7.558 -4.793 0.230 1.00 61.44 C ATOM 1082 CZ PHE A 460 -8.372 -3.792 0.658 1.00 44.53 C ATOM 0 H PHE A 460 -8.769 -10.004 3.484 1.00 5.41 H new ATOM 0 HA PHE A 460 -10.372 -7.497 3.424 1.00 52.43 H new ATOM 0 HB2 PHE A 460 -7.830 -7.403 3.736 1.00 20.35 H new ATOM 0 HB3 PHE A 460 -7.658 -8.251 2.211 1.00 20.35 H new ATOM 0 HD1 PHE A 460 -9.762 -5.366 3.309 1.00 42.44 H new ATOM 0 HD2 PHE A 460 -6.884 -6.827 0.580 1.00 4.32 H new ATOM 0 HE1 PHE A 460 -9.809 -3.183 2.092 1.00 70.30 H new ATOM 0 HE2 PHE A 460 -6.931 -4.645 -0.637 1.00 61.44 H new ATOM 0 HZ PHE A 460 -8.392 -2.849 0.131 1.00 44.53 H new ATOM 1091 N ASP A 461 -10.544 -7.572 0.796 1.00 21.20 N ATOM 1092 CA ASP A 461 -11.090 -7.800 -0.531 1.00 2.21 C ATOM 1093 C ASP A 461 -10.169 -7.164 -1.573 1.00 74.02 C ATOM 1094 O ASP A 461 -9.675 -6.055 -1.377 1.00 63.44 O ATOM 1095 CB ASP A 461 -12.475 -7.166 -0.672 1.00 15.45 C ATOM 1096 CG ASP A 461 -13.639 -8.039 -0.198 1.00 32.51 C ATOM 1097 OD1 ASP A 461 -14.056 -8.979 -0.892 1.00 63.03 O ATOM 1098 OD2 ASP A 461 -14.127 -7.719 0.952 1.00 50.44 O ATOM 0 H ASP A 461 -10.425 -6.590 1.045 1.00 21.20 H new ATOM 0 HA ASP A 461 -11.169 -8.876 -0.683 1.00 2.21 H new ATOM 0 HB2 ASP A 461 -12.489 -6.232 -0.110 1.00 15.45 H new ATOM 0 HB3 ASP A 461 -12.636 -6.910 -1.719 1.00 15.45 H new ATOM 1103 N CYS A 462 -9.967 -7.894 -2.662 1.00 45.33 N ATOM 1104 CA CYS A 462 -9.114 -7.415 -3.736 1.00 62.11 C ATOM 1105 C CYS A 462 -9.995 -6.718 -4.773 1.00 51.14 C ATOM 1106 O CYS A 462 -9.691 -5.607 -5.206 1.00 51.32 O ATOM 1107 CB CYS A 462 -8.292 -8.548 -4.353 1.00 54.34 C ATOM 1108 SG CYS A 462 -7.734 -9.700 -3.046 1.00 31.24 S ATOM 0 H CYS A 462 -10.380 -8.813 -2.823 1.00 45.33 H new ATOM 0 HA CYS A 462 -8.389 -6.704 -3.340 1.00 62.11 H new ATOM 0 HB2 CYS A 462 -8.891 -9.083 -5.090 1.00 54.34 H new ATOM 0 HB3 CYS A 462 -7.430 -8.138 -4.880 1.00 54.34 H new ATOM 0 HG CYS A 462 -8.206 -10.888 -3.284 1.00 31.24 H new ATOM 1113 N ARG A 463 -11.071 -7.398 -5.143 1.00 42.00 N ATOM 1114 CA ARG A 463 -11.998 -6.858 -6.122 1.00 75.24 C ATOM 1115 C ARG A 463 -12.337 -5.405 -5.787 1.00 51.24 C ATOM 1116 O ARG A 463 -12.718 -4.633 -6.666 1.00 43.42 O ATOM 1117 CB ARG A 463 -13.288 -7.678 -6.169 1.00 10.44 C ATOM 1118 CG ARG A 463 -12.985 -9.177 -6.186 1.00 34.00 C ATOM 1119 CD ARG A 463 -14.145 -9.964 -6.803 1.00 42.12 C ATOM 1120 NE ARG A 463 -14.175 -11.336 -6.250 1.00 32.23 N ATOM 1121 CZ ARG A 463 -14.740 -11.665 -5.070 1.00 11.24 C ATOM 1122 NH1 ARG A 463 -15.331 -10.723 -4.306 1.00 55.43 N ATOM 1123 NH2 ARG A 463 -14.709 -12.925 -4.674 1.00 24.10 N ATOM 0 H ARG A 463 -11.321 -8.319 -4.782 1.00 42.00 H new ATOM 0 HA ARG A 463 -11.515 -6.906 -7.098 1.00 75.24 H new ATOM 0 HB2 ARG A 463 -13.907 -7.438 -5.304 1.00 10.44 H new ATOM 0 HB3 ARG A 463 -13.862 -7.409 -7.056 1.00 10.44 H new ATOM 0 HG2 ARG A 463 -12.073 -9.361 -6.754 1.00 34.00 H new ATOM 0 HG3 ARG A 463 -12.803 -9.527 -5.170 1.00 34.00 H new ATOM 0 HD2 ARG A 463 -15.089 -9.459 -6.597 1.00 42.12 H new ATOM 0 HD3 ARG A 463 -14.034 -10.002 -7.887 1.00 42.12 H new ATOM 0 HE ARG A 463 -13.741 -12.080 -6.796 1.00 32.23 H new ATOM 0 HH11 ARG A 463 -15.353 -9.753 -4.619 1.00 55.43 H new ATOM 0 HH12 ARG A 463 -15.756 -10.981 -3.415 1.00 55.43 H new ATOM 0 HH21 ARG A 463 -14.262 -13.632 -5.258 1.00 24.10 H new ATOM 0 HH22 ARG A 463 -15.132 -13.191 -3.784 1.00 24.10 H new ATOM 1133 N LEU A 464 -12.186 -5.074 -4.512 1.00 73.31 N ATOM 1134 CA LEU A 464 -12.472 -3.726 -4.050 1.00 3.31 C ATOM 1135 C LEU A 464 -11.212 -2.868 -4.184 1.00 3.24 C ATOM 1136 O LEU A 464 -11.149 -1.978 -5.031 1.00 31.42 O ATOM 1137 CB LEU A 464 -13.047 -3.756 -2.633 1.00 12.50 C ATOM 1138 CG LEU A 464 -13.497 -2.409 -2.063 1.00 33.10 C ATOM 1139 CD1 LEU A 464 -12.365 -1.742 -1.280 1.00 64.20 C ATOM 1140 CD2 LEU A 464 -14.044 -1.501 -3.166 1.00 22.44 C ATOM 0 H LEU A 464 -11.869 -5.716 -3.785 1.00 73.31 H new ATOM 0 HA LEU A 464 -13.240 -3.265 -4.671 1.00 3.31 H new ATOM 0 HB2 LEU A 464 -13.899 -4.436 -2.622 1.00 12.50 H new ATOM 0 HB3 LEU A 464 -12.295 -4.177 -1.966 1.00 12.50 H new ATOM 0 HG LEU A 464 -14.312 -2.589 -1.362 1.00 33.10 H new ATOM 0 HD11 LEU A 464 -12.710 -0.786 -0.885 1.00 64.20 H new ATOM 0 HD12 LEU A 464 -12.063 -2.388 -0.455 1.00 64.20 H new ATOM 0 HD13 LEU A 464 -11.514 -1.576 -1.941 1.00 64.20 H new ATOM 0 HD21 LEU A 464 -14.357 -0.551 -2.733 1.00 22.44 H new ATOM 0 HD22 LEU A 464 -13.267 -1.323 -3.910 1.00 22.44 H new ATOM 0 HD23 LEU A 464 -14.899 -1.981 -3.642 1.00 22.44 H new ATOM 1151 N SER A 465 -10.240 -3.164 -3.332 1.00 34.33 N ATOM 1152 CA SER A 465 -8.986 -2.431 -3.345 1.00 22.34 C ATOM 1153 C SER A 465 -8.453 -2.330 -4.776 1.00 22.41 C ATOM 1154 O SER A 465 -8.251 -1.231 -5.289 1.00 21.22 O ATOM 1155 CB SER A 465 -7.949 -3.100 -2.439 1.00 60.13 C ATOM 1156 OG SER A 465 -7.047 -3.922 -3.174 1.00 40.14 O ATOM 0 H SER A 465 -10.296 -3.901 -2.629 1.00 34.33 H new ATOM 0 HA SER A 465 -9.172 -1.428 -2.962 1.00 22.34 H new ATOM 0 HB2 SER A 465 -7.387 -2.334 -1.904 1.00 60.13 H new ATOM 0 HB3 SER A 465 -8.459 -3.703 -1.688 1.00 60.13 H new ATOM 0 HG SER A 465 -6.990 -4.804 -2.751 1.00 40.14 H new ATOM 1161 N LEU A 466 -8.240 -3.490 -5.378 1.00 42.11 N ATOM 1162 CA LEU A 466 -7.735 -3.545 -6.738 1.00 32.41 C ATOM 1163 C LEU A 466 -8.596 -2.654 -7.635 1.00 11.42 C ATOM 1164 O LEU A 466 -8.151 -2.216 -8.694 1.00 72.24 O ATOM 1165 CB LEU A 466 -7.645 -4.996 -7.218 1.00 41.11 C ATOM 1166 CG LEU A 466 -6.885 -5.223 -8.527 1.00 24.03 C ATOM 1167 CD1 LEU A 466 -7.806 -5.048 -9.734 1.00 13.51 C ATOM 1168 CD2 LEU A 466 -5.652 -4.320 -8.609 1.00 33.22 C ATOM 0 H LEU A 466 -8.408 -4.400 -4.948 1.00 42.11 H new ATOM 0 HA LEU A 466 -6.718 -3.154 -6.782 1.00 32.41 H new ATOM 0 HB2 LEU A 466 -7.168 -5.588 -6.437 1.00 41.11 H new ATOM 0 HB3 LEU A 466 -8.657 -5.382 -7.337 1.00 41.11 H new ATOM 0 HG LEU A 466 -6.530 -6.254 -8.541 1.00 24.03 H new ATOM 0 HD11 LEU A 466 -7.240 -5.215 -10.651 1.00 13.51 H new ATOM 0 HD12 LEU A 466 -8.623 -5.767 -9.676 1.00 13.51 H new ATOM 0 HD13 LEU A 466 -8.213 -4.037 -9.738 1.00 13.51 H new ATOM 0 HD21 LEU A 466 -5.130 -4.501 -9.549 1.00 33.22 H new ATOM 0 HD22 LEU A 466 -5.962 -3.276 -8.562 1.00 33.22 H new ATOM 0 HD23 LEU A 466 -4.985 -4.539 -7.775 1.00 33.22 H new ATOM 1179 N HIS A 467 -9.818 -2.413 -7.178 1.00 63.22 N ATOM 1180 CA HIS A 467 -10.745 -1.583 -7.926 1.00 50.44 C ATOM 1181 C HIS A 467 -10.636 -0.132 -7.447 1.00 32.55 C ATOM 1182 O HIS A 467 -10.928 0.796 -8.199 1.00 52.02 O ATOM 1183 CB HIS A 467 -12.170 -2.133 -7.824 1.00 42.21 C ATOM 1184 CG HIS A 467 -13.240 -1.137 -8.203 1.00 32.54 C ATOM 1185 ND1 HIS A 467 -13.228 -0.441 -9.399 1.00 32.43 N ATOM 1186 CD2 HIS A 467 -14.357 -0.732 -7.533 1.00 2.24 C ATOM 1187 CE1 HIS A 467 -14.292 0.348 -9.435 1.00 1.45 C ATOM 1188 NE2 HIS A 467 -14.991 0.165 -8.278 1.00 52.10 N ATOM 0 H HIS A 467 -10.186 -2.779 -6.300 1.00 63.22 H new ATOM 0 HA HIS A 467 -10.483 -1.602 -8.984 1.00 50.44 H new ATOM 0 HB2 HIS A 467 -12.258 -3.008 -8.468 1.00 42.21 H new ATOM 0 HB3 HIS A 467 -12.347 -2.470 -6.802 1.00 42.21 H new ATOM 0 HD2 HIS A 467 -14.672 -1.082 -6.561 1.00 2.24 H new ATOM 0 HE1 HIS A 467 -14.559 1.018 -10.239 1.00 1.45 H new ATOM 0 HE2 HIS A 467 -15.858 0.639 -8.027 1.00 52.10 H new ATOM 1195 N GLN A 468 -10.211 0.015 -6.201 1.00 61.23 N ATOM 1196 CA GLN A 468 -10.058 1.336 -5.615 1.00 52.11 C ATOM 1197 C GLN A 468 -8.686 1.916 -5.965 1.00 41.43 C ATOM 1198 O GLN A 468 -8.430 3.096 -5.729 1.00 75.32 O ATOM 1199 CB GLN A 468 -10.264 1.290 -4.100 1.00 3.33 C ATOM 1200 CG GLN A 468 -11.678 0.823 -3.751 1.00 13.42 C ATOM 1201 CD GLN A 468 -12.218 1.570 -2.529 1.00 23.54 C ATOM 1202 OE1 GLN A 468 -13.352 2.014 -2.492 1.00 42.33 O ATOM 1203 NE2 GLN A 468 -11.342 1.681 -1.535 1.00 64.44 N ATOM 0 H GLN A 468 -9.968 -0.758 -5.581 1.00 61.23 H new ATOM 0 HA GLN A 468 -10.824 1.989 -6.033 1.00 52.11 H new ATOM 0 HB2 GLN A 468 -9.534 0.617 -3.651 1.00 3.33 H new ATOM 0 HB3 GLN A 468 -10.089 2.279 -3.676 1.00 3.33 H new ATOM 0 HG2 GLN A 468 -12.339 0.986 -4.602 1.00 13.42 H new ATOM 0 HG3 GLN A 468 -11.672 -0.249 -3.553 1.00 13.42 H new ATOM 0 HE21 GLN A 468 -10.407 1.285 -1.633 1.00 64.44 H new ATOM 0 HE22 GLN A 468 -11.605 2.162 -0.675 1.00 64.44 H new ATOM 1210 N VAL A 469 -7.842 1.061 -6.521 1.00 50.11 N ATOM 1211 CA VAL A 469 -6.504 1.475 -6.906 1.00 34.24 C ATOM 1212 C VAL A 469 -6.475 1.766 -8.409 1.00 44.51 C ATOM 1213 O VAL A 469 -6.053 2.842 -8.828 1.00 12.34 O ATOM 1214 CB VAL A 469 -5.487 0.413 -6.484 1.00 33.31 C ATOM 1215 CG1 VAL A 469 -5.650 -0.863 -7.313 1.00 65.11 C ATOM 1216 CG2 VAL A 469 -4.058 0.953 -6.584 1.00 24.33 C ATOM 0 H VAL A 469 -8.058 0.083 -6.714 1.00 50.11 H new ATOM 0 HA VAL A 469 -6.227 2.395 -6.392 1.00 34.24 H new ATOM 0 HB VAL A 469 -5.679 0.161 -5.441 1.00 33.31 H new ATOM 0 HG11 VAL A 469 -4.915 -1.601 -6.993 1.00 65.11 H new ATOM 0 HG12 VAL A 469 -6.653 -1.264 -7.170 1.00 65.11 H new ATOM 0 HG13 VAL A 469 -5.498 -0.634 -8.368 1.00 65.11 H new ATOM 0 HG21 VAL A 469 -3.354 0.179 -6.279 1.00 24.33 H new ATOM 0 HG22 VAL A 469 -3.851 1.246 -7.613 1.00 24.33 H new ATOM 0 HG23 VAL A 469 -3.950 1.819 -5.931 1.00 24.33 H new ATOM 1226 N ASN A 470 -6.933 0.787 -9.177 1.00 3.33 N ATOM 1227 CA ASN A 470 -6.966 0.924 -10.622 1.00 14.32 C ATOM 1228 C ASN A 470 -7.599 2.268 -10.989 1.00 1.24 C ATOM 1229 O ASN A 470 -7.105 2.971 -11.869 1.00 44.43 O ATOM 1230 CB ASN A 470 -7.805 -0.184 -11.263 1.00 64.24 C ATOM 1231 CG ASN A 470 -6.933 -1.382 -11.640 1.00 4.12 C ATOM 1232 OD1 ASN A 470 -6.830 -1.769 -12.793 1.00 21.34 O ATOM 1233 ND2 ASN A 470 -6.313 -1.948 -10.609 1.00 43.03 N ATOM 0 H ASN A 470 -7.284 -0.104 -8.825 1.00 3.33 H new ATOM 0 HA ASN A 470 -5.942 0.859 -10.989 1.00 14.32 H new ATOM 0 HB2 ASN A 470 -8.585 -0.501 -10.571 1.00 64.24 H new ATOM 0 HB3 ASN A 470 -8.304 0.201 -12.152 1.00 64.24 H new ATOM 0 HD21 ASN A 470 -5.708 -2.756 -10.758 1.00 43.03 H new ATOM 0 HD22 ASN A 470 -6.442 -1.575 -9.669 1.00 43.03 H new ATOM 1239 N GLN A 471 -8.683 2.584 -10.295 1.00 24.14 N ATOM 1240 CA GLN A 471 -9.389 3.830 -10.537 1.00 64.43 C ATOM 1241 C GLN A 471 -8.552 5.017 -10.054 1.00 11.15 C ATOM 1242 O GLN A 471 -8.506 6.056 -10.709 1.00 73.11 O ATOM 1243 CB GLN A 471 -10.764 3.820 -9.866 1.00 61.22 C ATOM 1244 CG GLN A 471 -11.542 2.555 -10.229 1.00 54.22 C ATOM 1245 CD GLN A 471 -12.374 2.769 -11.496 1.00 2.54 C ATOM 1246 OE1 GLN A 471 -13.278 3.586 -11.547 1.00 43.34 O ATOM 1247 NE2 GLN A 471 -12.018 1.991 -12.515 1.00 1.43 N ATOM 0 H GLN A 471 -9.089 1.998 -9.565 1.00 24.14 H new ATOM 0 HA GLN A 471 -9.546 3.934 -11.611 1.00 64.43 H new ATOM 0 HB2 GLN A 471 -10.645 3.880 -8.784 1.00 61.22 H new ATOM 0 HB3 GLN A 471 -11.329 4.700 -10.174 1.00 61.22 H new ATOM 0 HG2 GLN A 471 -10.849 1.728 -10.380 1.00 54.22 H new ATOM 0 HG3 GLN A 471 -12.196 2.276 -9.403 1.00 54.22 H new ATOM 0 HE21 GLN A 471 -11.251 1.327 -12.406 1.00 1.43 H new ATOM 0 HE22 GLN A 471 -12.512 2.059 -13.405 1.00 1.43 H new ATOM 1254 N ALA A 472 -7.910 4.821 -8.911 1.00 4.40 N ATOM 1255 CA ALA A 472 -7.078 5.861 -8.332 1.00 72.33 C ATOM 1256 C ALA A 472 -6.039 6.309 -9.364 1.00 43.22 C ATOM 1257 O ALA A 472 -5.477 7.397 -9.251 1.00 71.42 O ATOM 1258 CB ALA A 472 -6.435 5.343 -7.044 1.00 75.14 C ATOM 0 H ALA A 472 -7.950 3.957 -8.371 1.00 4.40 H new ATOM 0 HA ALA A 472 -7.679 6.732 -8.068 1.00 72.33 H new ATOM 0 HB1 ALA A 472 -5.811 6.124 -6.610 1.00 75.14 H new ATOM 0 HB2 ALA A 472 -7.214 5.065 -6.335 1.00 75.14 H new ATOM 0 HB3 ALA A 472 -5.821 4.471 -7.269 1.00 75.14 H new ATOM 1264 N MET A 473 -5.817 5.447 -10.345 1.00 3.14 N ATOM 1265 CA MET A 473 -4.855 5.740 -11.394 1.00 13.42 C ATOM 1266 C MET A 473 -5.515 6.505 -12.543 1.00 41.20 C ATOM 1267 O MET A 473 -5.200 7.671 -12.780 1.00 23.43 O ATOM 1268 CB MET A 473 -4.264 4.432 -11.925 1.00 53.51 C ATOM 1269 CG MET A 473 -3.542 3.667 -10.814 1.00 35.43 C ATOM 1270 SD MET A 473 -3.566 1.916 -11.164 1.00 60.31 S ATOM 1271 CE MET A 473 -1.936 1.465 -10.592 1.00 32.55 C ATOM 0 H MET A 473 -6.286 4.546 -10.436 1.00 3.14 H new ATOM 0 HA MET A 473 -4.065 6.362 -10.974 1.00 13.42 H new ATOM 0 HB2 MET A 473 -5.058 3.812 -12.342 1.00 53.51 H new ATOM 0 HB3 MET A 473 -3.568 4.646 -12.736 1.00 53.51 H new ATOM 0 HG2 MET A 473 -2.513 4.016 -10.731 1.00 35.43 H new ATOM 0 HG3 MET A 473 -4.023 3.861 -9.855 1.00 35.43 H new ATOM 0 HE1 MET A 473 -1.663 0.492 -11.000 1.00 32.55 H new ATOM 0 HE2 MET A 473 -1.215 2.212 -10.923 1.00 32.55 H new ATOM 0 HE3 MET A 473 -1.933 1.415 -9.503 1.00 32.55 H new ATOM 1279 N MET A 474 -6.420 5.820 -13.227 1.00 21.52 N ATOM 1280 CA MET A 474 -7.125 6.419 -14.346 1.00 40.51 C ATOM 1281 C MET A 474 -7.948 7.628 -13.889 1.00 13.04 C ATOM 1282 O MET A 474 -8.429 8.402 -14.715 1.00 42.44 O ATOM 1283 CB MET A 474 -8.053 5.382 -14.982 1.00 63.33 C ATOM 1284 CG MET A 474 -8.938 4.716 -13.924 1.00 72.15 C ATOM 1285 SD MET A 474 -10.473 4.183 -14.662 1.00 31.53 S ATOM 1286 CE MET A 474 -11.627 5.174 -13.728 1.00 4.30 C ATOM 0 H MET A 474 -6.681 4.854 -13.027 1.00 21.52 H new ATOM 0 HA MET A 474 -6.389 6.756 -15.076 1.00 40.51 H new ATOM 0 HB2 MET A 474 -8.678 5.862 -15.735 1.00 63.33 H new ATOM 0 HB3 MET A 474 -7.461 4.624 -15.495 1.00 63.33 H new ATOM 0 HG2 MET A 474 -8.419 3.863 -13.488 1.00 72.15 H new ATOM 0 HG3 MET A 474 -9.138 5.416 -13.113 1.00 72.15 H new ATOM 0 HE1 MET A 474 -12.631 4.763 -13.836 1.00 4.30 H new ATOM 0 HE2 MET A 474 -11.344 5.167 -12.675 1.00 4.30 H new ATOM 0 HE3 MET A 474 -11.612 6.198 -14.101 1.00 4.30 H new ATOM 1294 N SER A 475 -8.083 7.750 -12.578 1.00 41.33 N ATOM 1295 CA SER A 475 -8.839 8.850 -12.002 1.00 24.13 C ATOM 1296 C SER A 475 -7.892 9.986 -11.610 1.00 1.34 C ATOM 1297 O SER A 475 -8.334 11.102 -11.346 1.00 42.24 O ATOM 1298 CB SER A 475 -9.645 8.388 -10.787 1.00 3.12 C ATOM 1299 OG SER A 475 -10.542 9.394 -10.327 1.00 62.13 O ATOM 0 H SER A 475 -7.682 7.105 -11.897 1.00 41.33 H new ATOM 0 HA SER A 475 -9.541 9.213 -12.753 1.00 24.13 H new ATOM 0 HB2 SER A 475 -10.208 7.491 -11.045 1.00 3.12 H new ATOM 0 HB3 SER A 475 -8.963 8.115 -9.982 1.00 3.12 H new ATOM 0 HG SER A 475 -10.182 10.279 -10.547 1.00 62.13 H new ATOM 1304 N ASN A 476 -6.608 9.662 -11.588 1.00 64.54 N ATOM 1305 CA ASN A 476 -5.596 10.641 -11.231 1.00 31.30 C ATOM 1306 C ASN A 476 -4.300 10.325 -11.983 1.00 3.53 C ATOM 1307 O ASN A 476 -3.430 9.628 -11.462 1.00 14.41 O ATOM 1308 CB ASN A 476 -5.293 10.604 -9.733 1.00 24.02 C ATOM 1309 CG ASN A 476 -4.273 11.678 -9.351 1.00 2.30 C ATOM 1310 OD1 ASN A 476 -4.176 12.725 -9.969 1.00 24.40 O ATOM 1311 ND2 ASN A 476 -3.522 11.362 -8.300 1.00 31.32 N ATOM 0 H ASN A 476 -6.245 8.735 -11.812 1.00 64.54 H new ATOM 0 HA ASN A 476 -5.975 11.628 -11.496 1.00 31.30 H new ATOM 0 HB2 ASN A 476 -6.213 10.755 -9.169 1.00 24.02 H new ATOM 0 HB3 ASN A 476 -4.910 9.621 -9.460 1.00 24.02 H new ATOM 0 HD21 ASN A 476 -2.812 12.014 -7.966 1.00 31.32 H new ATOM 0 HD22 ASN A 476 -3.656 10.468 -7.828 1.00 31.32 H new ATOM 1317 N LEU A 477 -4.214 10.853 -13.195 1.00 31.45 N ATOM 1318 CA LEU A 477 -3.040 10.635 -14.023 1.00 62.34 C ATOM 1319 C LEU A 477 -2.270 11.949 -14.164 1.00 70.13 C ATOM 1320 O LEU A 477 -1.082 11.945 -14.486 1.00 54.15 O ATOM 1321 CB LEU A 477 -3.435 10.009 -15.362 1.00 11.24 C ATOM 1322 CG LEU A 477 -4.404 8.825 -15.288 1.00 41.14 C ATOM 1323 CD1 LEU A 477 -5.181 8.670 -16.597 1.00 70.10 C ATOM 1324 CD2 LEU A 477 -3.670 7.540 -14.901 1.00 23.54 C ATOM 0 H LEU A 477 -4.937 11.431 -13.623 1.00 31.45 H new ATOM 0 HA LEU A 477 -2.369 9.919 -13.549 1.00 62.34 H new ATOM 0 HB2 LEU A 477 -3.885 10.783 -15.984 1.00 11.24 H new ATOM 0 HB3 LEU A 477 -2.528 9.680 -15.869 1.00 11.24 H new ATOM 0 HG LEU A 477 -5.133 9.028 -14.503 1.00 41.14 H new ATOM 0 HD11 LEU A 477 -5.862 7.822 -16.518 1.00 70.10 H new ATOM 0 HD12 LEU A 477 -5.753 9.578 -16.790 1.00 70.10 H new ATOM 0 HD13 LEU A 477 -4.483 8.499 -17.416 1.00 70.10 H new ATOM 0 HD21 LEU A 477 -4.381 6.715 -14.855 1.00 23.54 H new ATOM 0 HD22 LEU A 477 -2.905 7.320 -15.646 1.00 23.54 H new ATOM 0 HD23 LEU A 477 -3.201 7.669 -13.926 1.00 23.54 H new ATOM 1335 N THR A 478 -2.976 13.042 -13.915 1.00 30.31 N ATOM 1336 CA THR A 478 -2.373 14.361 -14.010 1.00 2.45 C ATOM 1337 C THR A 478 -1.511 14.642 -12.779 1.00 4.01 C ATOM 1338 O THR A 478 -0.924 15.717 -12.660 1.00 42.01 O ATOM 1339 CB THR A 478 -3.496 15.380 -14.210 1.00 15.03 C ATOM 1340 OG1 THR A 478 -2.815 16.589 -14.533 1.00 63.23 O ATOM 1341 CG2 THR A 478 -4.234 15.703 -12.910 1.00 12.21 C ATOM 0 H THR A 478 -3.960 13.041 -13.647 1.00 30.31 H new ATOM 0 HA THR A 478 -1.698 14.427 -14.863 1.00 2.45 H new ATOM 0 HB THR A 478 -4.206 14.997 -14.943 1.00 15.03 H new ATOM 0 HG1 THR A 478 -1.940 16.600 -14.091 1.00 63.23 H new ATOM 0 HG21 THR A 478 -5.020 16.431 -13.109 1.00 12.21 H new ATOM 0 HG22 THR A 478 -4.676 14.792 -12.507 1.00 12.21 H new ATOM 0 HG23 THR A 478 -3.532 16.117 -12.186 1.00 12.21 H new ATOM 1349 N ARG A 479 -1.460 13.658 -11.893 1.00 44.52 N ATOM 1350 CA ARG A 479 -0.678 13.787 -10.675 1.00 1.33 C ATOM 1351 C ARG A 479 0.626 12.996 -10.795 1.00 40.02 C ATOM 1352 O ARG A 479 1.696 13.578 -10.971 1.00 14.55 O ATOM 1353 CB ARG A 479 -1.463 13.281 -9.462 1.00 74.31 C ATOM 1354 CG ARG A 479 -2.429 14.352 -8.950 1.00 44.12 C ATOM 1355 CD ARG A 479 -1.672 15.487 -8.255 1.00 20.41 C ATOM 1356 NE ARG A 479 -1.047 14.989 -7.010 1.00 64.13 N ATOM 1357 CZ ARG A 479 0.197 14.470 -6.942 1.00 60.31 C ATOM 1358 NH1 ARG A 479 0.961 14.375 -8.050 1.00 61.03 N ATOM 1359 NH2 ARG A 479 0.656 14.058 -5.775 1.00 0.14 N ATOM 0 H ARG A 479 -1.948 12.768 -11.994 1.00 44.52 H new ATOM 0 HA ARG A 479 -0.454 14.844 -10.535 1.00 1.33 H new ATOM 0 HB2 ARG A 479 -2.019 12.384 -9.733 1.00 74.31 H new ATOM 0 HB3 ARG A 479 -0.771 13.000 -8.668 1.00 74.31 H new ATOM 0 HG2 ARG A 479 -3.008 14.752 -9.782 1.00 44.12 H new ATOM 0 HG3 ARG A 479 -3.139 13.904 -8.254 1.00 44.12 H new ATOM 0 HD2 ARG A 479 -0.907 15.887 -8.921 1.00 20.41 H new ATOM 0 HD3 ARG A 479 -2.355 16.305 -8.027 1.00 20.41 H new ATOM 0 HE ARG A 479 -1.591 15.041 -6.149 1.00 64.13 H new ATOM 0 HH11 ARG A 479 0.599 14.697 -8.948 1.00 61.03 H new ATOM 0 HH12 ARG A 479 1.900 13.981 -7.990 1.00 61.03 H new ATOM 0 HH21 ARG A 479 0.073 14.134 -4.942 1.00 0.14 H new ATOM 0 HH22 ARG A 479 1.594 13.663 -5.706 1.00 0.14 H new ATOM 1369 N GLN A 480 0.495 11.681 -10.696 1.00 23.12 N ATOM 1370 CA GLN A 480 1.651 10.804 -10.791 1.00 53.42 C ATOM 1371 C GLN A 480 1.543 9.919 -12.033 1.00 35.21 C ATOM 1372 O GLN A 480 2.555 9.556 -12.631 1.00 5.44 O ATOM 1373 CB GLN A 480 1.803 9.959 -9.526 1.00 65.12 C ATOM 1374 CG GLN A 480 0.666 8.943 -9.404 1.00 2.41 C ATOM 1375 CD GLN A 480 -0.604 9.605 -8.864 1.00 10.44 C ATOM 1376 OE1 GLN A 480 -0.563 10.542 -8.086 1.00 50.44 O ATOM 1377 NE2 GLN A 480 -1.731 9.065 -9.320 1.00 55.52 N ATOM 0 H GLN A 480 -0.393 11.201 -10.551 1.00 23.12 H new ATOM 0 HA GLN A 480 2.545 11.421 -10.885 1.00 53.42 H new ATOM 0 HB2 GLN A 480 2.760 9.438 -9.546 1.00 65.12 H new ATOM 0 HB3 GLN A 480 1.811 10.608 -8.650 1.00 65.12 H new ATOM 0 HG2 GLN A 480 0.463 8.500 -10.379 1.00 2.41 H new ATOM 0 HG3 GLN A 480 0.968 8.132 -8.741 1.00 2.41 H new ATOM 0 HE21 GLN A 480 -1.694 8.281 -9.971 1.00 55.52 H new ATOM 0 HE22 GLN A 480 -2.632 9.435 -9.019 1.00 55.52 H new ATOM 1384 N GLY A 481 0.307 9.597 -12.386 1.00 72.03 N ATOM 1385 CA GLY A 481 0.054 8.759 -13.547 1.00 11.23 C ATOM 1386 C GLY A 481 0.904 7.488 -13.502 1.00 54.12 C ATOM 1387 O GLY A 481 1.628 7.187 -14.452 1.00 45.31 O ATOM 0 H GLY A 481 -0.530 9.901 -11.889 1.00 72.03 H new ATOM 0 HA2 GLY A 481 -1.002 8.493 -13.585 1.00 11.23 H new ATOM 0 HA3 GLY A 481 0.275 9.316 -14.457 1.00 11.23 H new ATOM 1391 N SER A 482 0.791 6.777 -12.390 1.00 62.31 N ATOM 1392 CA SER A 482 1.541 5.545 -12.210 1.00 44.23 C ATOM 1393 C SER A 482 0.585 4.352 -12.171 1.00 21.14 C ATOM 1394 O SER A 482 0.041 4.020 -11.118 1.00 62.45 O ATOM 1395 CB SER A 482 2.381 5.594 -10.932 1.00 20.22 C ATOM 1396 OG SER A 482 1.569 5.626 -9.760 1.00 13.10 O ATOM 0 H SER A 482 0.192 7.030 -11.605 1.00 62.31 H new ATOM 0 HA SER A 482 2.220 5.431 -13.055 1.00 44.23 H new ATOM 0 HB2 SER A 482 3.036 4.724 -10.895 1.00 20.22 H new ATOM 0 HB3 SER A 482 3.022 6.475 -10.953 1.00 20.22 H new ATOM 0 HG SER A 482 0.839 4.979 -9.850 1.00 13.10 H new ATOM 1401 N PRO A 483 0.404 3.722 -13.362 1.00 54.54 N ATOM 1402 CA PRO A 483 -0.478 2.572 -13.475 1.00 74.24 C ATOM 1403 C PRO A 483 0.171 1.323 -12.875 1.00 42.12 C ATOM 1404 O PRO A 483 -0.419 0.244 -12.891 1.00 32.03 O ATOM 1405 CB PRO A 483 -0.763 2.438 -14.962 1.00 65.30 C ATOM 1406 CG PRO A 483 0.332 3.222 -15.667 1.00 3.20 C ATOM 1407 CD PRO A 483 1.029 4.087 -14.630 1.00 4.24 C ATOM 0 HA PRO A 483 -1.405 2.697 -12.916 1.00 74.24 H new ATOM 0 HB2 PRO A 483 -0.754 1.392 -15.269 1.00 65.30 H new ATOM 0 HB3 PRO A 483 -1.748 2.834 -15.208 1.00 65.30 H new ATOM 0 HG2 PRO A 483 1.043 2.544 -16.139 1.00 3.20 H new ATOM 0 HG3 PRO A 483 -0.091 3.841 -16.458 1.00 3.20 H new ATOM 0 HD2 PRO A 483 2.102 3.896 -14.612 1.00 4.24 H new ATOM 0 HD3 PRO A 483 0.897 5.147 -14.846 1.00 4.24 H new ATOM 1412 N ASP A 484 1.375 1.512 -12.357 1.00 21.21 N ATOM 1413 CA ASP A 484 2.111 0.415 -11.753 1.00 1.04 C ATOM 1414 C ASP A 484 2.377 0.735 -10.280 1.00 22.04 C ATOM 1415 O ASP A 484 3.480 0.515 -9.783 1.00 61.24 O ATOM 1416 CB ASP A 484 3.461 0.209 -12.442 1.00 55.14 C ATOM 1417 CG ASP A 484 3.388 -0.444 -13.824 1.00 34.01 C ATOM 1418 OD1 ASP A 484 3.054 -1.632 -13.952 1.00 53.13 O ATOM 1419 OD2 ASP A 484 3.697 0.329 -14.810 1.00 30.51 O ATOM 0 H ASP A 484 1.860 2.409 -12.343 1.00 21.21 H new ATOM 0 HA ASP A 484 1.512 -0.489 -11.858 1.00 1.04 H new ATOM 0 HB2 ASP A 484 3.954 1.176 -12.539 1.00 55.14 H new ATOM 0 HB3 ASP A 484 4.090 -0.406 -11.799 1.00 55.14 H new ATOM 1424 N CYS A 485 1.346 1.247 -9.623 1.00 70.13 N ATOM 1425 CA CYS A 485 1.454 1.599 -8.218 1.00 55.23 C ATOM 1426 C CYS A 485 0.591 0.628 -7.412 1.00 0.02 C ATOM 1427 O CYS A 485 -0.029 1.016 -6.422 1.00 61.44 O ATOM 1428 CB CYS A 485 1.059 3.056 -7.968 1.00 1.22 C ATOM 1429 SG CYS A 485 -0.670 3.336 -8.501 1.00 72.12 S ATOM 0 H CYS A 485 0.432 1.426 -10.038 1.00 70.13 H new ATOM 0 HA CYS A 485 2.492 1.513 -7.898 1.00 55.23 H new ATOM 0 HB2 CYS A 485 1.165 3.294 -6.910 1.00 1.22 H new ATOM 0 HB3 CYS A 485 1.729 3.722 -8.513 1.00 1.22 H new ATOM 0 HG CYS A 485 -0.678 3.852 -9.694 1.00 72.12 H new ATOM 1434 N VAL A 486 0.577 -0.618 -7.865 1.00 44.20 N ATOM 1435 CA VAL A 486 -0.202 -1.648 -7.198 1.00 61.45 C ATOM 1436 C VAL A 486 0.736 -2.760 -6.723 1.00 13.32 C ATOM 1437 O VAL A 486 1.445 -3.365 -7.525 1.00 52.11 O ATOM 1438 CB VAL A 486 -1.306 -2.153 -8.127 1.00 35.45 C ATOM 1439 CG1 VAL A 486 -2.439 -2.801 -7.329 1.00 13.41 C ATOM 1440 CG2 VAL A 486 -1.835 -1.026 -9.015 1.00 41.14 C ATOM 0 H VAL A 486 1.092 -0.937 -8.685 1.00 44.20 H new ATOM 0 HA VAL A 486 -0.699 -1.242 -6.317 1.00 61.45 H new ATOM 0 HB VAL A 486 -0.875 -2.915 -8.776 1.00 35.45 H new ATOM 0 HG11 VAL A 486 -3.212 -3.152 -8.013 1.00 13.41 H new ATOM 0 HG12 VAL A 486 -2.047 -3.645 -6.761 1.00 13.41 H new ATOM 0 HG13 VAL A 486 -2.866 -2.069 -6.644 1.00 13.41 H new ATOM 0 HG21 VAL A 486 -2.619 -1.413 -9.666 1.00 41.14 H new ATOM 0 HG22 VAL A 486 -2.242 -0.231 -8.390 1.00 41.14 H new ATOM 0 HG23 VAL A 486 -1.022 -0.630 -9.623 1.00 41.14 H new ATOM 1450 N ILE A 487 0.709 -2.996 -5.419 1.00 74.12 N ATOM 1451 CA ILE A 487 1.548 -4.025 -4.827 1.00 53.10 C ATOM 1452 C ILE A 487 0.699 -4.898 -3.903 1.00 5.12 C ATOM 1453 O ILE A 487 0.571 -4.609 -2.713 1.00 13.20 O ATOM 1454 CB ILE A 487 2.761 -3.397 -4.138 1.00 52.31 C ATOM 1455 CG1 ILE A 487 3.327 -2.243 -4.969 1.00 42.40 C ATOM 1456 CG2 ILE A 487 3.822 -4.453 -3.826 1.00 34.24 C ATOM 1457 CD1 ILE A 487 4.084 -2.767 -6.191 1.00 1.43 C ATOM 0 H ILE A 487 0.120 -2.493 -4.756 1.00 74.12 H new ATOM 0 HA ILE A 487 1.953 -4.678 -5.600 1.00 53.10 H new ATOM 0 HB ILE A 487 2.434 -2.978 -3.186 1.00 52.31 H new ATOM 0 HG12 ILE A 487 2.516 -1.590 -5.292 1.00 42.40 H new ATOM 0 HG13 ILE A 487 3.995 -1.641 -4.354 1.00 42.40 H new ATOM 0 HG21 ILE A 487 4.673 -3.980 -3.337 1.00 34.24 H new ATOM 0 HG22 ILE A 487 3.399 -5.210 -3.166 1.00 34.24 H new ATOM 0 HG23 ILE A 487 4.151 -4.923 -4.753 1.00 34.24 H new ATOM 0 HD11 ILE A 487 4.476 -1.927 -6.764 1.00 1.43 H new ATOM 0 HD12 ILE A 487 4.909 -3.400 -5.864 1.00 1.43 H new ATOM 0 HD13 ILE A 487 3.407 -3.349 -6.817 1.00 1.43 H new ATOM 1468 N PRO A 488 0.125 -5.978 -4.498 1.00 44.35 N ATOM 1469 CA PRO A 488 -0.707 -6.897 -3.740 1.00 52.22 C ATOM 1470 C PRO A 488 0.144 -7.798 -2.845 1.00 20.25 C ATOM 1471 O PRO A 488 0.727 -8.773 -3.316 1.00 23.43 O ATOM 1472 CB PRO A 488 -1.494 -7.669 -4.787 1.00 2.12 C ATOM 1473 CG PRO A 488 -0.740 -7.486 -6.093 1.00 41.40 C ATOM 1474 CD PRO A 488 0.255 -6.354 -5.902 1.00 52.14 C ATOM 0 HA PRO A 488 -1.380 -6.385 -3.052 1.00 52.22 H new ATOM 0 HB2 PRO A 488 -1.566 -8.724 -4.522 1.00 2.12 H new ATOM 0 HB3 PRO A 488 -2.513 -7.290 -4.868 1.00 2.12 H new ATOM 0 HG2 PRO A 488 -0.224 -8.406 -6.368 1.00 41.40 H new ATOM 0 HG3 PRO A 488 -1.431 -7.254 -6.903 1.00 41.40 H new ATOM 0 HD2 PRO A 488 1.270 -6.676 -6.133 1.00 52.14 H new ATOM 0 HD3 PRO A 488 0.030 -5.514 -6.559 1.00 52.14 H new ATOM 1479 N PHE A 489 0.189 -7.441 -1.570 1.00 60.44 N ATOM 1480 CA PHE A 489 0.960 -8.206 -0.604 1.00 1.24 C ATOM 1481 C PHE A 489 0.216 -9.481 -0.196 1.00 73.43 C ATOM 1482 O PHE A 489 -0.961 -9.644 -0.509 1.00 33.21 O ATOM 1483 CB PHE A 489 1.141 -7.319 0.628 1.00 52.51 C ATOM 1484 CG PHE A 489 2.401 -7.629 1.439 1.00 60.22 C ATOM 1485 CD1 PHE A 489 3.598 -7.103 1.062 1.00 1.44 C ATOM 1486 CD2 PHE A 489 2.324 -8.429 2.535 1.00 34.22 C ATOM 1487 CE1 PHE A 489 4.767 -7.390 1.814 1.00 32.24 C ATOM 1488 CE2 PHE A 489 3.494 -8.717 3.287 1.00 4.13 C ATOM 1489 CZ PHE A 489 4.691 -8.192 2.910 1.00 64.31 C ATOM 0 H PHE A 489 -0.296 -6.632 -1.183 1.00 60.44 H new ATOM 0 HA PHE A 489 1.916 -8.498 -1.038 1.00 1.24 H new ATOM 0 HB2 PHE A 489 1.173 -6.277 0.311 1.00 52.51 H new ATOM 0 HB3 PHE A 489 0.270 -7.429 1.274 1.00 52.51 H new ATOM 0 HD1 PHE A 489 3.658 -6.467 0.191 1.00 1.44 H new ATOM 0 HD2 PHE A 489 1.373 -8.846 2.834 1.00 34.22 H new ATOM 0 HE1 PHE A 489 5.717 -6.972 1.516 1.00 32.24 H new ATOM 0 HE2 PHE A 489 3.433 -9.353 4.158 1.00 4.13 H new ATOM 0 HZ PHE A 489 5.581 -8.412 3.481 1.00 64.31 H new ATOM 1498 N LEU A 490 0.936 -10.350 0.498 1.00 61.52 N ATOM 1499 CA LEU A 490 0.361 -11.603 0.952 1.00 1.14 C ATOM 1500 C LEU A 490 1.017 -12.012 2.272 1.00 24.11 C ATOM 1501 O LEU A 490 2.112 -12.575 2.277 1.00 11.02 O ATOM 1502 CB LEU A 490 0.464 -12.669 -0.142 1.00 62.20 C ATOM 1503 CG LEU A 490 -0.311 -13.965 0.109 1.00 14.12 C ATOM 1504 CD1 LEU A 490 0.605 -15.050 0.674 1.00 21.54 C ATOM 1505 CD2 LEU A 490 -1.525 -13.713 1.005 1.00 71.31 C ATOM 0 H LEU A 490 1.913 -10.210 0.757 1.00 61.52 H new ATOM 0 HA LEU A 490 -0.704 -11.483 1.148 1.00 1.14 H new ATOM 0 HB2 LEU A 490 0.114 -12.235 -1.079 1.00 62.20 H new ATOM 0 HB3 LEU A 490 1.516 -12.919 -0.280 1.00 62.20 H new ATOM 0 HG LEU A 490 -0.688 -14.329 -0.847 1.00 14.12 H new ATOM 0 HD11 LEU A 490 0.030 -15.960 0.843 1.00 21.54 H new ATOM 0 HD12 LEU A 490 1.407 -15.254 -0.035 1.00 21.54 H new ATOM 0 HD13 LEU A 490 1.032 -14.710 1.617 1.00 21.54 H new ATOM 0 HD21 LEU A 490 -2.058 -14.650 1.168 1.00 71.31 H new ATOM 0 HD22 LEU A 490 -1.193 -13.313 1.963 1.00 71.31 H new ATOM 0 HD23 LEU A 490 -2.190 -12.996 0.523 1.00 71.31 H new ATOM 1516 N PRO A 491 0.303 -11.708 3.388 1.00 52.40 N ATOM 1517 CA PRO A 491 0.805 -12.038 4.712 1.00 41.43 C ATOM 1518 C PRO A 491 0.667 -13.535 4.992 1.00 64.43 C ATOM 1519 O PRO A 491 -0.001 -14.251 4.249 1.00 71.24 O ATOM 1520 CB PRO A 491 -0.008 -11.177 5.666 1.00 51.31 C ATOM 1521 CG PRO A 491 -1.244 -10.748 4.890 1.00 62.05 C ATOM 1522 CD PRO A 491 -0.997 -11.042 3.420 1.00 14.22 C ATOM 0 HA PRO A 491 1.870 -11.834 4.822 1.00 41.43 H new ATOM 0 HB2 PRO A 491 -0.283 -11.737 6.560 1.00 51.31 H new ATOM 0 HB3 PRO A 491 0.566 -10.311 5.996 1.00 51.31 H new ATOM 0 HG2 PRO A 491 -2.123 -11.286 5.244 1.00 62.05 H new ATOM 0 HG3 PRO A 491 -1.439 -9.686 5.039 1.00 62.05 H new ATOM 0 HD2 PRO A 491 -1.779 -11.679 3.007 1.00 14.22 H new ATOM 0 HD3 PRO A 491 -0.987 -10.126 2.829 1.00 14.22 H new ATOM 1527 N LEU A 492 1.312 -13.964 6.067 1.00 61.43 N ATOM 1528 CA LEU A 492 1.271 -15.363 6.456 1.00 25.23 C ATOM 1529 C LEU A 492 -0.095 -15.677 7.069 1.00 21.15 C ATOM 1530 O LEU A 492 -0.547 -16.822 7.036 1.00 73.23 O ATOM 1531 CB LEU A 492 2.448 -15.701 7.372 1.00 72.05 C ATOM 1532 CG LEU A 492 3.842 -15.509 6.770 1.00 24.54 C ATOM 1533 CD1 LEU A 492 4.094 -14.041 6.427 1.00 73.50 C ATOM 1534 CD2 LEU A 492 4.922 -16.075 7.695 1.00 1.53 C ATOM 0 H LEU A 492 1.866 -13.367 6.681 1.00 61.43 H new ATOM 0 HA LEU A 492 1.385 -16.004 5.582 1.00 25.23 H new ATOM 0 HB2 LEU A 492 2.373 -15.086 8.269 1.00 72.05 H new ATOM 0 HB3 LEU A 492 2.350 -16.739 7.688 1.00 72.05 H new ATOM 0 HG LEU A 492 3.891 -16.070 5.837 1.00 24.54 H new ATOM 0 HD11 LEU A 492 5.091 -13.933 6.001 1.00 73.50 H new ATOM 0 HD12 LEU A 492 3.352 -13.704 5.703 1.00 73.50 H new ATOM 0 HD13 LEU A 492 4.019 -13.438 7.332 1.00 73.50 H new ATOM 0 HD21 LEU A 492 5.903 -15.926 7.243 1.00 1.53 H new ATOM 0 HD22 LEU A 492 4.883 -15.562 8.656 1.00 1.53 H new ATOM 0 HD23 LEU A 492 4.750 -17.141 7.845 1.00 1.53 H new ATOM 1545 N GLU A 493 -0.714 -14.642 7.617 1.00 0.32 N ATOM 1546 CA GLU A 493 -2.020 -14.795 8.237 1.00 62.34 C ATOM 1547 C GLU A 493 -3.059 -15.211 7.195 1.00 73.34 C ATOM 1548 O GLU A 493 -4.012 -15.920 7.512 1.00 12.15 O ATOM 1549 CB GLU A 493 -2.442 -13.507 8.947 1.00 44.00 C ATOM 1550 CG GLU A 493 -2.054 -13.544 10.427 1.00 3.35 C ATOM 1551 CD GLU A 493 -3.062 -14.362 11.237 1.00 53.43 C ATOM 1552 OE1 GLU A 493 -4.048 -13.805 11.746 1.00 33.25 O ATOM 1553 OE2 GLU A 493 -2.796 -15.621 11.329 1.00 63.34 O ATOM 0 H GLU A 493 -0.336 -13.695 7.645 1.00 0.32 H new ATOM 0 HA GLU A 493 -1.954 -15.582 8.988 1.00 62.34 H new ATOM 0 HB2 GLU A 493 -1.970 -12.651 8.465 1.00 44.00 H new ATOM 0 HB3 GLU A 493 -3.520 -13.372 8.853 1.00 44.00 H new ATOM 0 HG2 GLU A 493 -1.059 -13.976 10.535 1.00 3.35 H new ATOM 0 HG3 GLU A 493 -2.005 -12.528 10.820 1.00 3.35 H new ATOM 1559 N SER A 494 -2.838 -14.752 5.971 1.00 13.41 N ATOM 1560 CA SER A 494 -3.744 -15.068 4.879 1.00 31.31 C ATOM 1561 C SER A 494 -2.982 -15.775 3.756 1.00 13.12 C ATOM 1562 O SER A 494 -1.772 -15.972 3.851 1.00 34.51 O ATOM 1563 CB SER A 494 -4.425 -13.806 4.346 1.00 0.40 C ATOM 1564 OG SER A 494 -5.447 -13.340 5.223 1.00 42.24 O ATOM 0 H SER A 494 -2.046 -14.164 5.712 1.00 13.41 H new ATOM 0 HA SER A 494 -4.519 -15.733 5.259 1.00 31.31 H new ATOM 0 HB2 SER A 494 -3.680 -13.022 4.209 1.00 0.40 H new ATOM 0 HB3 SER A 494 -4.855 -14.012 3.366 1.00 0.40 H new ATOM 0 HG SER A 494 -5.039 -12.883 5.988 1.00 42.24 H new ATOM 1569 N SER A 495 -3.722 -16.137 2.719 1.00 12.34 N ATOM 1570 CA SER A 495 -3.133 -16.817 1.579 1.00 30.32 C ATOM 1571 C SER A 495 -3.867 -16.422 0.296 1.00 32.24 C ATOM 1572 O SER A 495 -4.972 -15.887 0.349 1.00 3.21 O ATOM 1573 CB SER A 495 -3.168 -18.336 1.765 1.00 41.34 C ATOM 1574 OG SER A 495 -1.898 -18.857 2.147 1.00 61.44 O ATOM 0 H SER A 495 -4.726 -15.972 2.645 1.00 12.34 H new ATOM 0 HA SER A 495 -2.090 -16.512 1.501 1.00 30.32 H new ATOM 0 HB2 SER A 495 -3.908 -18.591 2.524 1.00 41.34 H new ATOM 0 HB3 SER A 495 -3.489 -18.808 0.836 1.00 41.34 H new ATOM 0 HG SER A 495 -1.963 -19.829 2.257 1.00 61.44 H new ATOM 1579 N PRO A 496 -3.205 -16.710 -0.856 1.00 74.52 N ATOM 1580 CA PRO A 496 -3.783 -16.391 -2.151 1.00 72.00 C ATOM 1581 C PRO A 496 -4.902 -17.371 -2.509 1.00 23.51 C ATOM 1582 O PRO A 496 -5.862 -17.002 -3.184 1.00 44.44 O ATOM 1583 CB PRO A 496 -2.617 -16.439 -3.125 1.00 31.13 C ATOM 1584 CG PRO A 496 -1.524 -17.234 -2.429 1.00 11.15 C ATOM 1585 CD PRO A 496 -1.894 -17.345 -0.959 1.00 62.35 C ATOM 0 HA PRO A 496 -4.259 -15.411 -2.169 1.00 72.00 H new ATOM 0 HB2 PRO A 496 -2.910 -16.914 -4.061 1.00 31.13 H new ATOM 0 HB3 PRO A 496 -2.273 -15.435 -3.372 1.00 31.13 H new ATOM 0 HG2 PRO A 496 -1.429 -18.224 -2.875 1.00 11.15 H new ATOM 0 HG3 PRO A 496 -0.560 -16.739 -2.544 1.00 11.15 H new ATOM 0 HD2 PRO A 496 -1.932 -18.386 -0.638 1.00 62.35 H new ATOM 0 HD3 PRO A 496 -1.161 -16.844 -0.327 1.00 62.35 H new ATOM 1590 N ALA A 497 -4.740 -18.600 -2.041 1.00 1.44 N ATOM 1591 CA ALA A 497 -5.726 -19.634 -2.303 1.00 23.54 C ATOM 1592 C ALA A 497 -7.064 -19.228 -1.684 1.00 12.33 C ATOM 1593 O ALA A 497 -8.123 -19.625 -2.169 1.00 30.31 O ATOM 1594 CB ALA A 497 -5.217 -20.973 -1.761 1.00 3.23 C ATOM 0 H ALA A 497 -3.942 -18.902 -1.483 1.00 1.44 H new ATOM 0 HA ALA A 497 -5.881 -19.752 -3.375 1.00 23.54 H new ATOM 0 HB1 ALA A 497 -5.956 -21.750 -1.957 1.00 3.23 H new ATOM 0 HB2 ALA A 497 -4.279 -21.232 -2.253 1.00 3.23 H new ATOM 0 HB3 ALA A 497 -5.053 -20.892 -0.687 1.00 3.23 H new ATOM 1600 N GLN A 498 -6.974 -18.439 -0.622 1.00 21.33 N ATOM 1601 CA GLN A 498 -8.165 -17.974 0.067 1.00 52.13 C ATOM 1602 C GLN A 498 -8.877 -16.906 -0.765 1.00 71.05 C ATOM 1603 O GLN A 498 -9.979 -16.480 -0.423 1.00 14.53 O ATOM 1604 CB GLN A 498 -7.820 -17.444 1.461 1.00 33.23 C ATOM 1605 CG GLN A 498 -6.629 -18.199 2.055 1.00 31.22 C ATOM 1606 CD GLN A 498 -6.777 -18.350 3.569 1.00 2.33 C ATOM 1607 OE1 GLN A 498 -6.348 -17.514 4.347 1.00 64.25 O ATOM 1608 NE2 GLN A 498 -7.407 -19.459 3.945 1.00 23.21 N ATOM 0 H GLN A 498 -6.095 -18.111 -0.223 1.00 21.33 H new ATOM 0 HA GLN A 498 -8.842 -18.819 0.193 1.00 52.13 H new ATOM 0 HB2 GLN A 498 -7.589 -16.380 1.403 1.00 33.23 H new ATOM 0 HB3 GLN A 498 -8.684 -17.547 2.117 1.00 33.23 H new ATOM 0 HG2 GLN A 498 -6.551 -19.183 1.594 1.00 31.22 H new ATOM 0 HG3 GLN A 498 -5.706 -17.666 1.827 1.00 31.22 H new ATOM 0 HE21 GLN A 498 -7.742 -20.119 3.243 1.00 23.21 H new ATOM 0 HE22 GLN A 498 -7.556 -19.650 4.936 1.00 23.21 H new ATOM 1615 N LEU A 499 -8.219 -16.503 -1.842 1.00 23.13 N ATOM 1616 CA LEU A 499 -8.774 -15.493 -2.725 1.00 32.44 C ATOM 1617 C LEU A 499 -9.433 -16.177 -3.925 1.00 10.43 C ATOM 1618 O LEU A 499 -9.180 -17.351 -4.190 1.00 34.43 O ATOM 1619 CB LEU A 499 -7.703 -14.472 -3.113 1.00 1.22 C ATOM 1620 CG LEU A 499 -6.750 -14.042 -1.995 1.00 34.30 C ATOM 1621 CD1 LEU A 499 -5.832 -12.912 -2.462 1.00 45.52 C ATOM 1622 CD2 LEU A 499 -7.525 -13.666 -0.730 1.00 64.15 C ATOM 0 H LEU A 499 -7.305 -16.859 -2.123 1.00 23.13 H new ATOM 0 HA LEU A 499 -9.551 -14.926 -2.213 1.00 32.44 H new ATOM 0 HB2 LEU A 499 -7.111 -14.888 -3.928 1.00 1.22 H new ATOM 0 HB3 LEU A 499 -8.200 -13.583 -3.502 1.00 1.22 H new ATOM 0 HG LEU A 499 -6.113 -14.890 -1.743 1.00 34.30 H new ATOM 0 HD11 LEU A 499 -5.165 -12.625 -1.649 1.00 45.52 H new ATOM 0 HD12 LEU A 499 -5.242 -13.251 -3.313 1.00 45.52 H new ATOM 0 HD13 LEU A 499 -6.434 -12.053 -2.757 1.00 45.52 H new ATOM 0 HD21 LEU A 499 -6.825 -13.364 0.049 1.00 64.15 H new ATOM 0 HD22 LEU A 499 -8.202 -12.840 -0.950 1.00 64.15 H new ATOM 0 HD23 LEU A 499 -8.101 -14.526 -0.387 1.00 64.15 H new ATOM 1633 N SER A 500 -10.267 -15.414 -4.616 1.00 12.44 N ATOM 1634 CA SER A 500 -10.965 -15.933 -5.780 1.00 12.02 C ATOM 1635 C SER A 500 -9.962 -16.276 -6.882 1.00 74.02 C ATOM 1636 O SER A 500 -8.840 -15.770 -6.885 1.00 2.31 O ATOM 1637 CB SER A 500 -11.998 -14.928 -6.296 1.00 31.41 C ATOM 1638 OG SER A 500 -13.119 -15.573 -6.891 1.00 33.12 O ATOM 0 H SER A 500 -10.475 -14.441 -4.392 1.00 12.44 H new ATOM 0 HA SER A 500 -11.495 -16.839 -5.485 1.00 12.02 H new ATOM 0 HB2 SER A 500 -12.336 -14.300 -5.472 1.00 31.41 H new ATOM 0 HB3 SER A 500 -11.529 -14.269 -7.027 1.00 31.41 H new ATOM 0 HG SER A 500 -13.756 -14.898 -7.206 1.00 33.12 H new ATOM 1643 N SER A 501 -10.399 -17.135 -7.791 1.00 11.43 N ATOM 1644 CA SER A 501 -9.553 -17.552 -8.897 1.00 62.43 C ATOM 1645 C SER A 501 -9.332 -16.381 -9.856 1.00 71.44 C ATOM 1646 O SER A 501 -8.465 -16.444 -10.727 1.00 73.13 O ATOM 1647 CB SER A 501 -10.165 -18.740 -9.641 1.00 20.02 C ATOM 1648 OG SER A 501 -9.175 -19.525 -10.300 1.00 30.40 O ATOM 0 H SER A 501 -11.329 -17.554 -7.784 1.00 11.43 H new ATOM 0 HA SER A 501 -8.592 -17.868 -8.492 1.00 62.43 H new ATOM 0 HB2 SER A 501 -10.714 -19.365 -8.937 1.00 20.02 H new ATOM 0 HB3 SER A 501 -10.886 -18.377 -10.373 1.00 20.02 H new ATOM 0 HG SER A 501 -9.606 -20.274 -10.762 1.00 30.40 H new ATOM 1653 N ASP A 502 -10.128 -15.340 -9.665 1.00 5.14 N ATOM 1654 CA ASP A 502 -10.030 -14.158 -10.502 1.00 11.43 C ATOM 1655 C ASP A 502 -8.974 -13.215 -9.924 1.00 61.04 C ATOM 1656 O ASP A 502 -8.247 -12.558 -10.669 1.00 32.44 O ATOM 1657 CB ASP A 502 -11.361 -13.404 -10.549 1.00 13.10 C ATOM 1658 CG ASP A 502 -12.604 -14.292 -10.627 1.00 11.51 C ATOM 1659 OD1 ASP A 502 -12.507 -15.528 -10.637 1.00 23.25 O ATOM 1660 OD2 ASP A 502 -13.726 -13.657 -10.676 1.00 72.24 O ATOM 0 H ASP A 502 -10.845 -15.291 -8.941 1.00 5.14 H new ATOM 0 HA ASP A 502 -9.761 -14.479 -11.508 1.00 11.43 H new ATOM 0 HB2 ASP A 502 -11.437 -12.775 -9.662 1.00 13.10 H new ATOM 0 HB3 ASP A 502 -11.354 -12.738 -11.412 1.00 13.10 H new ATOM 1665 N THR A 503 -8.920 -13.177 -8.600 1.00 33.22 N ATOM 1666 CA THR A 503 -7.965 -12.327 -7.913 1.00 71.24 C ATOM 1667 C THR A 503 -6.592 -12.416 -8.582 1.00 23.22 C ATOM 1668 O THR A 503 -5.801 -11.477 -8.513 1.00 34.20 O ATOM 1669 CB THR A 503 -7.948 -12.729 -6.437 1.00 30.33 C ATOM 1670 OG1 THR A 503 -9.100 -12.093 -5.890 1.00 20.54 O ATOM 1671 CG2 THR A 503 -6.780 -12.104 -5.672 1.00 32.31 C ATOM 0 H THR A 503 -9.524 -13.723 -7.985 1.00 33.22 H new ATOM 0 HA THR A 503 -8.255 -11.278 -7.976 1.00 71.24 H new ATOM 0 HB THR A 503 -7.894 -13.815 -6.358 1.00 30.33 H new ATOM 0 HG1 THR A 503 -9.082 -12.168 -4.913 1.00 20.54 H new ATOM 0 HG21 THR A 503 -6.816 -12.422 -4.630 1.00 32.31 H new ATOM 0 HG22 THR A 503 -5.839 -12.426 -6.118 1.00 32.31 H new ATOM 0 HG23 THR A 503 -6.852 -11.018 -5.722 1.00 32.31 H new ATOM 1679 N ALA A 504 -6.352 -13.555 -9.217 1.00 64.24 N ATOM 1680 CA ALA A 504 -5.088 -13.780 -9.898 1.00 44.21 C ATOM 1681 C ALA A 504 -4.998 -12.854 -11.114 1.00 10.45 C ATOM 1682 O ALA A 504 -3.987 -12.184 -11.313 1.00 65.21 O ATOM 1683 CB ALA A 504 -4.971 -15.256 -10.280 1.00 25.03 C ATOM 0 H ALA A 504 -7.011 -14.331 -9.274 1.00 64.24 H new ATOM 0 HA ALA A 504 -4.250 -13.545 -9.242 1.00 44.21 H new ATOM 0 HB1 ALA A 504 -4.023 -15.426 -10.791 1.00 25.03 H new ATOM 0 HB2 ALA A 504 -5.013 -15.869 -9.380 1.00 25.03 H new ATOM 0 HB3 ALA A 504 -5.793 -15.527 -10.942 1.00 25.03 H new ATOM 1689 N SER A 505 -6.069 -12.849 -11.893 1.00 53.14 N ATOM 1690 CA SER A 505 -6.123 -12.018 -13.083 1.00 14.14 C ATOM 1691 C SER A 505 -6.350 -10.556 -12.691 1.00 55.55 C ATOM 1692 O SER A 505 -6.085 -9.650 -13.479 1.00 42.22 O ATOM 1693 CB SER A 505 -7.224 -12.489 -14.035 1.00 15.31 C ATOM 1694 OG SER A 505 -7.511 -11.521 -15.043 1.00 3.24 O ATOM 0 H SER A 505 -6.906 -13.407 -11.723 1.00 53.14 H new ATOM 0 HA SER A 505 -5.169 -12.104 -13.603 1.00 14.14 H new ATOM 0 HB2 SER A 505 -6.920 -13.424 -14.506 1.00 15.31 H new ATOM 0 HB3 SER A 505 -8.130 -12.699 -13.466 1.00 15.31 H new ATOM 0 HG SER A 505 -8.218 -11.861 -15.631 1.00 3.24 H new ATOM 1699 N LEU A 506 -6.840 -10.374 -11.473 1.00 54.54 N ATOM 1700 CA LEU A 506 -7.108 -9.038 -10.966 1.00 74.43 C ATOM 1701 C LEU A 506 -5.786 -8.375 -10.571 1.00 4.01 C ATOM 1702 O LEU A 506 -5.664 -7.152 -10.616 1.00 60.02 O ATOM 1703 CB LEU A 506 -8.134 -9.089 -9.834 1.00 1.40 C ATOM 1704 CG LEU A 506 -9.482 -9.725 -10.179 1.00 52.23 C ATOM 1705 CD1 LEU A 506 -10.222 -10.162 -8.913 1.00 62.11 C ATOM 1706 CD2 LEU A 506 -10.327 -8.785 -11.040 1.00 31.35 C ATOM 0 H LEU A 506 -7.058 -11.129 -10.823 1.00 54.54 H new ATOM 0 HA LEU A 506 -7.558 -8.418 -11.742 1.00 74.43 H new ATOM 0 HB2 LEU A 506 -7.698 -9.639 -9.000 1.00 1.40 H new ATOM 0 HB3 LEU A 506 -8.313 -8.072 -9.486 1.00 1.40 H new ATOM 0 HG LEU A 506 -9.295 -10.622 -10.769 1.00 52.23 H new ATOM 0 HD11 LEU A 506 -11.177 -10.611 -9.186 1.00 62.11 H new ATOM 0 HD12 LEU A 506 -9.619 -10.892 -8.373 1.00 62.11 H new ATOM 0 HD13 LEU A 506 -10.398 -9.295 -8.277 1.00 62.11 H new ATOM 0 HD21 LEU A 506 -11.280 -9.261 -11.271 1.00 31.35 H new ATOM 0 HD22 LEU A 506 -10.507 -7.857 -10.497 1.00 31.35 H new ATOM 0 HD23 LEU A 506 -9.797 -8.565 -11.967 1.00 31.35 H new ATOM 1717 N LEU A 507 -4.833 -9.211 -10.192 1.00 64.05 N ATOM 1718 CA LEU A 507 -3.525 -8.721 -9.786 1.00 35.03 C ATOM 1719 C LEU A 507 -2.478 -9.167 -10.811 1.00 0.53 C ATOM 1720 O LEU A 507 -1.279 -9.109 -10.544 1.00 1.52 O ATOM 1721 CB LEU A 507 -3.208 -9.158 -8.355 1.00 10.51 C ATOM 1722 CG LEU A 507 -3.031 -10.662 -8.136 1.00 13.21 C ATOM 1723 CD1 LEU A 507 -1.566 -11.070 -8.301 1.00 53.14 C ATOM 1724 CD2 LEU A 507 -3.595 -11.088 -6.779 1.00 14.41 C ATOM 0 H LEU A 507 -4.939 -10.225 -10.157 1.00 64.05 H new ATOM 0 HA LEU A 507 -3.515 -7.631 -9.771 1.00 35.03 H new ATOM 0 HB2 LEU A 507 -2.295 -8.655 -8.036 1.00 10.51 H new ATOM 0 HB3 LEU A 507 -4.009 -8.808 -7.704 1.00 10.51 H new ATOM 0 HG LEU A 507 -3.601 -11.189 -8.901 1.00 13.21 H new ATOM 0 HD11 LEU A 507 -1.467 -12.144 -8.140 1.00 53.14 H new ATOM 0 HD12 LEU A 507 -1.230 -10.821 -9.308 1.00 53.14 H new ATOM 0 HD13 LEU A 507 -0.955 -10.536 -7.573 1.00 53.14 H new ATOM 0 HD21 LEU A 507 -3.457 -12.161 -6.648 1.00 14.41 H new ATOM 0 HD22 LEU A 507 -3.073 -10.555 -5.984 1.00 14.41 H new ATOM 0 HD23 LEU A 507 -4.658 -10.851 -6.736 1.00 14.41 H new ATOM 1735 N SER A 508 -2.972 -9.601 -11.962 1.00 63.51 N ATOM 1736 CA SER A 508 -2.095 -10.056 -13.028 1.00 31.24 C ATOM 1737 C SER A 508 -1.386 -8.861 -13.669 1.00 20.02 C ATOM 1738 O SER A 508 -1.953 -8.185 -14.526 1.00 64.03 O ATOM 1739 CB SER A 508 -2.874 -10.840 -14.085 1.00 31.34 C ATOM 1740 OG SER A 508 -2.391 -10.587 -15.401 1.00 73.41 O ATOM 0 H SER A 508 -3.968 -9.647 -12.179 1.00 63.51 H new ATOM 0 HA SER A 508 -1.349 -10.723 -12.596 1.00 31.24 H new ATOM 0 HB2 SER A 508 -2.802 -11.906 -13.871 1.00 31.34 H new ATOM 0 HB3 SER A 508 -3.930 -10.574 -14.029 1.00 31.34 H new ATOM 0 HG SER A 508 -2.458 -9.629 -15.595 1.00 73.41 H new ATOM 1745 N GLY A 509 -0.157 -8.638 -13.229 1.00 62.42 N ATOM 1746 CA GLY A 509 0.636 -7.536 -13.748 1.00 1.42 C ATOM 1747 C GLY A 509 1.271 -6.734 -12.611 1.00 72.50 C ATOM 1748 O GLY A 509 2.158 -5.914 -12.845 1.00 13.42 O ATOM 0 H GLY A 509 0.310 -9.202 -12.519 1.00 62.42 H new ATOM 0 HA2 GLY A 509 1.415 -7.922 -14.405 1.00 1.42 H new ATOM 0 HA3 GLY A 509 0.006 -6.882 -14.351 1.00 1.42 H new ATOM 1752 N LEU A 510 0.794 -6.998 -11.404 1.00 50.12 N ATOM 1753 CA LEU A 510 1.303 -6.310 -10.230 1.00 21.21 C ATOM 1754 C LEU A 510 2.479 -7.101 -9.652 1.00 62.14 C ATOM 1755 O LEU A 510 2.755 -8.218 -10.087 1.00 33.30 O ATOM 1756 CB LEU A 510 0.178 -6.059 -9.224 1.00 15.51 C ATOM 1757 CG LEU A 510 -1.184 -5.698 -9.820 1.00 12.44 C ATOM 1758 CD1 LEU A 510 -2.250 -5.595 -8.728 1.00 44.10 C ATOM 1759 CD2 LEU A 510 -1.097 -4.422 -10.659 1.00 21.42 C ATOM 0 H LEU A 510 0.060 -7.680 -11.213 1.00 50.12 H new ATOM 0 HA LEU A 510 1.682 -5.324 -10.501 1.00 21.21 H new ATOM 0 HB2 LEU A 510 0.059 -6.952 -8.611 1.00 15.51 H new ATOM 0 HB3 LEU A 510 0.486 -5.254 -8.557 1.00 15.51 H new ATOM 0 HG LEU A 510 -1.486 -6.502 -10.491 1.00 12.44 H new ATOM 0 HD11 LEU A 510 -3.209 -5.337 -9.178 1.00 44.10 H new ATOM 0 HD12 LEU A 510 -2.337 -6.552 -8.213 1.00 44.10 H new ATOM 0 HD13 LEU A 510 -1.966 -4.823 -8.014 1.00 44.10 H new ATOM 0 HD21 LEU A 510 -2.079 -4.189 -11.070 1.00 21.42 H new ATOM 0 HD22 LEU A 510 -0.761 -3.596 -10.032 1.00 21.42 H new ATOM 0 HD23 LEU A 510 -0.388 -4.570 -11.474 1.00 21.42 H new ATOM 1770 N VAL A 511 3.140 -6.491 -8.678 1.00 1.21 N ATOM 1771 CA VAL A 511 4.279 -7.125 -8.036 1.00 11.32 C ATOM 1772 C VAL A 511 3.886 -7.558 -6.621 1.00 54.54 C ATOM 1773 O VAL A 511 4.117 -6.829 -5.659 1.00 72.04 O ATOM 1774 CB VAL A 511 5.485 -6.182 -8.060 1.00 10.31 C ATOM 1775 CG1 VAL A 511 6.558 -6.642 -7.072 1.00 63.44 C ATOM 1776 CG2 VAL A 511 6.055 -6.058 -9.473 1.00 55.41 C ATOM 0 H VAL A 511 2.908 -5.565 -8.318 1.00 1.21 H new ATOM 0 HA VAL A 511 4.574 -8.022 -8.580 1.00 11.32 H new ATOM 0 HB VAL A 511 5.146 -5.194 -7.749 1.00 10.31 H new ATOM 0 HG11 VAL A 511 7.404 -5.956 -7.108 1.00 63.44 H new ATOM 0 HG12 VAL A 511 6.143 -6.654 -6.064 1.00 63.44 H new ATOM 0 HG13 VAL A 511 6.892 -7.645 -7.339 1.00 63.44 H new ATOM 0 HG21 VAL A 511 6.911 -5.383 -9.462 1.00 55.41 H new ATOM 0 HG22 VAL A 511 6.372 -7.040 -9.825 1.00 55.41 H new ATOM 0 HG23 VAL A 511 5.289 -5.663 -10.141 1.00 55.41 H new ATOM 1786 N ARG A 512 3.297 -8.742 -6.542 1.00 30.41 N ATOM 1787 CA ARG A 512 2.870 -9.280 -5.262 1.00 42.40 C ATOM 1788 C ARG A 512 4.084 -9.694 -4.428 1.00 62.42 C ATOM 1789 O ARG A 512 4.953 -10.420 -4.908 1.00 21.33 O ATOM 1790 CB ARG A 512 1.954 -10.491 -5.451 1.00 12.31 C ATOM 1791 CG ARG A 512 1.814 -11.283 -4.150 1.00 65.32 C ATOM 1792 CD ARG A 512 0.454 -11.980 -4.076 1.00 63.22 C ATOM 1793 NE ARG A 512 0.412 -13.108 -5.033 1.00 2.10 N ATOM 1794 CZ ARG A 512 -0.721 -13.740 -5.408 1.00 62.20 C ATOM 1795 NH1 ARG A 512 -1.916 -13.359 -4.909 1.00 30.14 N ATOM 1796 NH2 ARG A 512 -0.642 -14.737 -6.270 1.00 22.31 N ATOM 0 H ARG A 512 3.106 -9.344 -7.343 1.00 30.41 H new ATOM 0 HA ARG A 512 2.317 -8.498 -4.742 1.00 42.40 H new ATOM 0 HB2 ARG A 512 0.971 -10.159 -5.786 1.00 12.31 H new ATOM 0 HB3 ARG A 512 2.356 -11.137 -6.232 1.00 12.31 H new ATOM 0 HG2 ARG A 512 2.611 -12.024 -4.084 1.00 65.32 H new ATOM 0 HG3 ARG A 512 1.930 -10.613 -3.298 1.00 65.32 H new ATOM 0 HD2 ARG A 512 0.277 -12.344 -3.064 1.00 63.22 H new ATOM 0 HD3 ARG A 512 -0.341 -11.270 -4.303 1.00 63.22 H new ATOM 0 HE ARG A 512 1.293 -13.428 -5.434 1.00 2.10 H new ATOM 0 HH11 ARG A 512 -1.968 -12.588 -4.243 1.00 30.14 H new ATOM 0 HH12 ARG A 512 -2.767 -13.842 -5.198 1.00 30.14 H new ATOM 0 HH21 ARG A 512 0.265 -15.019 -6.642 1.00 22.31 H new ATOM 0 HH22 ARG A 512 -1.488 -15.225 -6.564 1.00 22.31 H new ATOM 1806 N LEU A 513 4.104 -9.215 -3.193 1.00 63.44 N ATOM 1807 CA LEU A 513 5.198 -9.526 -2.288 1.00 22.21 C ATOM 1808 C LEU A 513 4.760 -10.632 -1.325 1.00 41.41 C ATOM 1809 O LEU A 513 3.580 -10.980 -1.271 1.00 42.01 O ATOM 1810 CB LEU A 513 5.690 -8.259 -1.586 1.00 23.41 C ATOM 1811 CG LEU A 513 6.601 -7.347 -2.410 1.00 64.51 C ATOM 1812 CD1 LEU A 513 7.363 -8.145 -3.469 1.00 64.51 C ATOM 1813 CD2 LEU A 513 5.809 -6.190 -3.023 1.00 12.15 C ATOM 0 H LEU A 513 3.381 -8.614 -2.798 1.00 63.44 H new ATOM 0 HA LEU A 513 6.054 -9.908 -2.844 1.00 22.21 H new ATOM 0 HB2 LEU A 513 4.821 -7.682 -1.270 1.00 23.41 H new ATOM 0 HB3 LEU A 513 6.224 -8.552 -0.682 1.00 23.41 H new ATOM 0 HG LEU A 513 7.343 -6.910 -1.741 1.00 64.51 H new ATOM 0 HD11 LEU A 513 8.003 -7.473 -4.040 1.00 64.51 H new ATOM 0 HD12 LEU A 513 7.976 -8.903 -2.982 1.00 64.51 H new ATOM 0 HD13 LEU A 513 6.654 -8.629 -4.140 1.00 64.51 H new ATOM 0 HD21 LEU A 513 6.480 -5.557 -3.604 1.00 12.15 H new ATOM 0 HD22 LEU A 513 5.030 -6.587 -3.674 1.00 12.15 H new ATOM 0 HD23 LEU A 513 5.352 -5.601 -2.228 1.00 12.15 H new ATOM 1824 N ASP A 514 5.730 -11.152 -0.588 1.00 53.22 N ATOM 1825 CA ASP A 514 5.458 -12.211 0.368 1.00 44.42 C ATOM 1826 C ASP A 514 6.290 -11.976 1.632 1.00 11.45 C ATOM 1827 O ASP A 514 7.465 -11.623 1.547 1.00 54.15 O ATOM 1828 CB ASP A 514 5.837 -13.580 -0.200 1.00 63.31 C ATOM 1829 CG ASP A 514 4.654 -14.480 -0.560 1.00 74.44 C ATOM 1830 OD1 ASP A 514 4.809 -15.699 -0.733 1.00 43.15 O ATOM 1831 OD2 ASP A 514 3.519 -13.875 -0.664 1.00 75.31 O ATOM 0 H ASP A 514 6.706 -10.859 -0.634 1.00 53.22 H new ATOM 0 HA ASP A 514 4.391 -12.198 0.591 1.00 44.42 H new ATOM 0 HB2 ASP A 514 6.445 -13.431 -1.092 1.00 63.31 H new ATOM 0 HB3 ASP A 514 6.461 -14.099 0.528 1.00 63.31 H new ATOM 1836 N GLU A 515 5.648 -12.185 2.771 1.00 51.44 N ATOM 1837 CA GLU A 515 6.314 -12.000 4.049 1.00 21.14 C ATOM 1838 C GLU A 515 6.904 -13.325 4.536 1.00 61.04 C ATOM 1839 O GLU A 515 7.420 -13.407 5.650 1.00 2.41 O ATOM 1840 CB GLU A 515 5.357 -11.411 5.087 1.00 1.15 C ATOM 1841 CG GLU A 515 6.039 -11.281 6.450 1.00 40.51 C ATOM 1842 CD GLU A 515 7.461 -10.737 6.302 1.00 41.22 C ATOM 1843 OE1 GLU A 515 8.427 -11.409 6.695 1.00 11.03 O ATOM 1844 OE2 GLU A 515 7.544 -9.570 5.757 1.00 13.22 O ATOM 0 H GLU A 515 4.674 -12.481 2.836 1.00 51.44 H new ATOM 0 HA GLU A 515 7.129 -11.290 3.912 1.00 21.14 H new ATOM 0 HB2 GLU A 515 5.012 -10.432 4.754 1.00 1.15 H new ATOM 0 HB3 GLU A 515 4.476 -12.046 5.176 1.00 1.15 H new ATOM 0 HG2 GLU A 515 5.457 -10.618 7.090 1.00 40.51 H new ATOM 0 HG3 GLU A 515 6.067 -12.254 6.941 1.00 40.51 H new ATOM 1850 N HIS A 516 6.807 -14.330 3.679 1.00 31.22 N ATOM 1851 CA HIS A 516 7.324 -15.649 4.007 1.00 63.15 C ATOM 1852 C HIS A 516 8.248 -16.131 2.888 1.00 25.04 C ATOM 1853 O HIS A 516 8.569 -17.316 2.811 1.00 54.33 O ATOM 1854 CB HIS A 516 6.181 -16.623 4.294 1.00 65.22 C ATOM 1855 CG HIS A 516 5.070 -16.585 3.274 1.00 15.53 C ATOM 1856 ND1 HIS A 516 3.778 -16.994 3.555 1.00 40.20 N ATOM 1857 CD2 HIS A 516 5.070 -16.181 1.971 1.00 15.11 C ATOM 1858 CE1 HIS A 516 3.042 -16.840 2.464 1.00 30.01 C ATOM 1859 NE2 HIS A 516 3.846 -16.337 1.482 1.00 5.21 N ATOM 0 H HIS A 516 6.378 -14.258 2.757 1.00 31.22 H new ATOM 0 HA HIS A 516 7.916 -15.595 4.921 1.00 63.15 H new ATOM 0 HB2 HIS A 516 6.583 -17.635 4.340 1.00 65.22 H new ATOM 0 HB3 HIS A 516 5.766 -16.400 5.277 1.00 65.22 H new ATOM 0 HD2 HIS A 516 5.922 -15.799 1.429 1.00 15.11 H new ATOM 0 HE1 HIS A 516 1.991 -17.072 2.368 1.00 30.01 H new ATOM 0 HE2 HIS A 516 3.554 -16.117 0.530 1.00 5.21 H new ATOM 1866 N SER A 517 8.650 -15.188 2.049 1.00 60.21 N ATOM 1867 CA SER A 517 9.532 -15.501 0.937 1.00 10.24 C ATOM 1868 C SER A 517 10.951 -15.017 1.241 1.00 3.13 C ATOM 1869 O SER A 517 11.136 -14.062 1.994 1.00 75.02 O ATOM 1870 CB SER A 517 9.025 -14.876 -0.362 1.00 51.30 C ATOM 1871 OG SER A 517 9.658 -15.436 -1.509 1.00 40.43 O ATOM 0 H SER A 517 8.381 -14.206 2.117 1.00 60.21 H new ATOM 0 HA SER A 517 9.545 -16.583 0.806 1.00 10.24 H new ATOM 0 HB2 SER A 517 7.947 -15.020 -0.437 1.00 51.30 H new ATOM 0 HB3 SER A 517 9.202 -13.801 -0.340 1.00 51.30 H new ATOM 0 HG SER A 517 9.109 -15.264 -2.302 1.00 40.43 H new ATOM 1876 N GLN A 518 11.917 -15.698 0.640 1.00 1.54 N ATOM 1877 CA GLN A 518 13.312 -15.348 0.838 1.00 63.41 C ATOM 1878 C GLN A 518 13.798 -14.441 -0.295 1.00 43.45 C ATOM 1879 O GLN A 518 14.949 -14.006 -0.297 1.00 41.12 O ATOM 1880 CB GLN A 518 14.181 -16.602 0.947 1.00 1.11 C ATOM 1881 CG GLN A 518 13.919 -17.555 -0.222 1.00 51.51 C ATOM 1882 CD GLN A 518 15.143 -18.428 -0.505 1.00 41.23 C ATOM 1883 OE1 GLN A 518 15.327 -19.488 0.069 1.00 11.54 O ATOM 1884 NE2 GLN A 518 15.967 -17.922 -1.418 1.00 63.42 N ATOM 0 H GLN A 518 11.760 -16.490 0.016 1.00 1.54 H new ATOM 0 HA GLN A 518 13.400 -14.802 1.777 1.00 63.41 H new ATOM 0 HB2 GLN A 518 15.234 -16.319 0.961 1.00 1.11 H new ATOM 0 HB3 GLN A 518 13.975 -17.111 1.889 1.00 1.11 H new ATOM 0 HG2 GLN A 518 13.062 -18.188 0.006 1.00 51.51 H new ATOM 0 HG3 GLN A 518 13.664 -16.981 -1.113 1.00 51.51 H new ATOM 0 HE21 GLN A 518 15.752 -17.028 -1.860 1.00 63.42 H new ATOM 0 HE22 GLN A 518 16.814 -18.428 -1.676 1.00 63.42 H new ATOM 1891 N ILE A 519 12.895 -14.182 -1.230 1.00 21.54 N ATOM 1892 CA ILE A 519 13.217 -13.335 -2.365 1.00 72.31 C ATOM 1893 C ILE A 519 12.462 -12.010 -2.238 1.00 13.20 C ATOM 1894 O ILE A 519 12.915 -10.984 -2.741 1.00 50.35 O ATOM 1895 CB ILE A 519 12.946 -14.072 -3.678 1.00 30.22 C ATOM 1896 CG1 ILE A 519 12.333 -13.132 -4.719 1.00 25.24 C ATOM 1897 CG2 ILE A 519 12.079 -15.311 -3.442 1.00 51.31 C ATOM 1898 CD1 ILE A 519 13.355 -12.096 -5.192 1.00 25.14 C ATOM 0 H ILE A 519 11.941 -14.544 -1.224 1.00 21.54 H new ATOM 0 HA ILE A 519 14.281 -13.098 -2.372 1.00 72.31 H new ATOM 0 HB ILE A 519 13.899 -14.417 -4.079 1.00 30.22 H new ATOM 0 HG12 ILE A 519 11.976 -13.711 -5.571 1.00 25.24 H new ATOM 0 HG13 ILE A 519 11.467 -12.626 -4.292 1.00 25.24 H new ATOM 0 HG21 ILE A 519 11.901 -15.817 -4.391 1.00 51.31 H new ATOM 0 HG22 ILE A 519 12.592 -15.989 -2.760 1.00 51.31 H new ATOM 0 HG23 ILE A 519 11.126 -15.011 -3.007 1.00 51.31 H new ATOM 0 HD11 ILE A 519 12.894 -11.441 -5.931 1.00 25.14 H new ATOM 0 HD12 ILE A 519 13.692 -11.503 -4.342 1.00 25.14 H new ATOM 0 HD13 ILE A 519 14.208 -12.605 -5.641 1.00 25.14 H new ATOM 1909 N PHE A 520 11.325 -12.076 -1.561 1.00 73.00 N ATOM 1910 CA PHE A 520 10.502 -10.895 -1.362 1.00 63.42 C ATOM 1911 C PHE A 520 11.368 -9.671 -1.057 1.00 11.10 C ATOM 1912 O PHE A 520 11.031 -8.554 -1.449 1.00 11.33 O ATOM 1913 CB PHE A 520 9.600 -11.177 -0.160 1.00 23.14 C ATOM 1914 CG PHE A 520 9.197 -9.927 0.625 1.00 63.52 C ATOM 1915 CD1 PHE A 520 8.632 -8.872 -0.021 1.00 5.25 C ATOM 1916 CD2 PHE A 520 9.409 -9.869 1.967 1.00 30.25 C ATOM 1917 CE1 PHE A 520 8.259 -7.710 0.708 1.00 21.21 C ATOM 1918 CE2 PHE A 520 9.037 -8.708 2.696 1.00 14.42 C ATOM 1919 CZ PHE A 520 8.469 -7.654 2.050 1.00 52.21 C ATOM 0 H PHE A 520 10.954 -12.929 -1.143 1.00 73.00 H new ATOM 0 HA PHE A 520 9.926 -10.686 -2.263 1.00 63.42 H new ATOM 0 HB2 PHE A 520 8.698 -11.682 -0.506 1.00 23.14 H new ATOM 0 HB3 PHE A 520 10.113 -11.865 0.512 1.00 23.14 H new ATOM 0 HD1 PHE A 520 8.467 -8.917 -1.087 1.00 5.25 H new ATOM 0 HD2 PHE A 520 9.860 -10.706 2.479 1.00 30.25 H new ATOM 0 HE1 PHE A 520 7.809 -6.872 0.196 1.00 21.21 H new ATOM 0 HE2 PHE A 520 9.205 -8.662 3.762 1.00 14.42 H new ATOM 0 HZ PHE A 520 8.185 -6.772 2.604 1.00 52.21 H new ATOM 1928 N ALA A 521 12.468 -9.920 -0.360 1.00 32.25 N ATOM 1929 CA ALA A 521 13.383 -8.853 0.000 1.00 42.41 C ATOM 1930 C ALA A 521 13.873 -8.154 -1.270 1.00 0.33 C ATOM 1931 O ALA A 521 13.882 -6.926 -1.342 1.00 35.11 O ATOM 1932 CB ALA A 521 14.535 -9.425 0.830 1.00 51.43 C ATOM 0 H ALA A 521 12.745 -10.847 -0.036 1.00 32.25 H new ATOM 0 HA ALA A 521 12.877 -8.107 0.613 1.00 42.41 H new ATOM 0 HB1 ALA A 521 15.222 -8.623 1.100 1.00 51.43 H new ATOM 0 HB2 ALA A 521 14.138 -9.883 1.736 1.00 51.43 H new ATOM 0 HB3 ALA A 521 15.066 -10.176 0.246 1.00 51.43 H new ATOM 1938 N ARG A 522 14.267 -8.967 -2.240 1.00 5.30 N ATOM 1939 CA ARG A 522 14.755 -8.442 -3.503 1.00 11.44 C ATOM 1940 C ARG A 522 13.596 -7.884 -4.331 1.00 61.22 C ATOM 1941 O ARG A 522 13.800 -7.046 -5.206 1.00 75.23 O ATOM 1942 CB ARG A 522 15.473 -9.527 -4.309 1.00 43.43 C ATOM 1943 CG ARG A 522 16.815 -9.887 -3.670 1.00 41.34 C ATOM 1944 CD ARG A 522 16.620 -10.809 -2.465 1.00 72.41 C ATOM 1945 NE ARG A 522 17.931 -11.300 -1.986 1.00 22.13 N ATOM 1946 CZ ARG A 522 18.692 -12.197 -2.649 1.00 4.40 C ATOM 1947 NH1 ARG A 522 18.277 -12.709 -3.828 1.00 45.12 N ATOM 1948 NH2 ARG A 522 19.848 -12.565 -2.127 1.00 31.41 N ATOM 0 H ARG A 522 14.258 -9.985 -2.176 1.00 5.30 H new ATOM 0 HA ARG A 522 15.462 -7.643 -3.279 1.00 11.44 H new ATOM 0 HB2 ARG A 522 14.845 -10.416 -4.369 1.00 43.43 H new ATOM 0 HB3 ARG A 522 15.634 -9.180 -5.330 1.00 43.43 H new ATOM 0 HG2 ARG A 522 17.453 -10.376 -4.407 1.00 41.34 H new ATOM 0 HG3 ARG A 522 17.328 -8.978 -3.357 1.00 41.34 H new ATOM 0 HD2 ARG A 522 16.109 -10.273 -1.665 1.00 72.41 H new ATOM 0 HD3 ARG A 522 15.985 -11.651 -2.740 1.00 72.41 H new ATOM 0 HE ARG A 522 18.282 -10.938 -1.099 1.00 22.13 H new ATOM 0 HH11 ARG A 522 17.383 -12.418 -4.224 1.00 45.12 H new ATOM 0 HH12 ARG A 522 18.858 -13.386 -4.323 1.00 45.12 H new ATOM 0 HH21 ARG A 522 20.153 -12.173 -1.236 1.00 31.41 H new ATOM 0 HH22 ARG A 522 20.435 -13.242 -2.614 1.00 31.41 H new ATOM 1958 N LYS A 523 12.403 -8.374 -4.025 1.00 4.32 N ATOM 1959 CA LYS A 523 11.210 -7.935 -4.729 1.00 61.35 C ATOM 1960 C LYS A 523 10.872 -6.502 -4.309 1.00 2.15 C ATOM 1961 O LYS A 523 10.702 -5.628 -5.157 1.00 41.02 O ATOM 1962 CB LYS A 523 10.064 -8.926 -4.513 1.00 71.24 C ATOM 1963 CG LYS A 523 10.507 -10.355 -4.833 1.00 74.51 C ATOM 1964 CD LYS A 523 11.112 -10.439 -6.237 1.00 4.03 C ATOM 1965 CE LYS A 523 10.113 -9.964 -7.294 1.00 41.23 C ATOM 1966 NZ LYS A 523 10.546 -10.387 -8.643 1.00 12.25 N ATOM 0 H LYS A 523 12.237 -9.071 -3.299 1.00 4.32 H new ATOM 0 HA LYS A 523 11.388 -7.919 -5.804 1.00 61.35 H new ATOM 0 HB2 LYS A 523 9.721 -8.871 -3.480 1.00 71.24 H new ATOM 0 HB3 LYS A 523 9.219 -8.653 -5.145 1.00 71.24 H new ATOM 0 HG2 LYS A 523 11.239 -10.686 -4.097 1.00 74.51 H new ATOM 0 HG3 LYS A 523 9.654 -11.029 -4.760 1.00 74.51 H new ATOM 0 HD2 LYS A 523 12.015 -9.830 -6.285 1.00 4.03 H new ATOM 0 HD3 LYS A 523 11.409 -11.466 -6.448 1.00 4.03 H new ATOM 0 HE2 LYS A 523 9.125 -10.371 -7.078 1.00 41.23 H new ATOM 0 HE3 LYS A 523 10.025 -8.878 -7.258 1.00 41.23 H new ATOM 0 HZ1 LYS A 523 9.857 -10.056 -9.348 1.00 12.25 H new ATOM 0 HZ2 LYS A 523 11.479 -9.978 -8.852 1.00 12.25 H new ATOM 0 HZ3 LYS A 523 10.607 -11.425 -8.679 1.00 12.25 H new ATOM 1975 N VAL A 524 10.787 -6.309 -3.001 1.00 13.32 N ATOM 1976 CA VAL A 524 10.473 -4.999 -2.459 1.00 44.24 C ATOM 1977 C VAL A 524 11.603 -4.024 -2.802 1.00 10.34 C ATOM 1978 O VAL A 524 11.351 -2.859 -3.104 1.00 42.30 O ATOM 1979 CB VAL A 524 10.211 -5.104 -0.954 1.00 40.02 C ATOM 1980 CG1 VAL A 524 11.513 -4.978 -0.162 1.00 43.03 C ATOM 1981 CG2 VAL A 524 9.189 -4.059 -0.500 1.00 71.34 C ATOM 0 H VAL A 524 10.930 -7.038 -2.302 1.00 13.32 H new ATOM 0 HA VAL A 524 9.560 -4.609 -2.909 1.00 44.24 H new ATOM 0 HB VAL A 524 9.791 -6.090 -0.755 1.00 40.02 H new ATOM 0 HG11 VAL A 524 11.299 -5.056 0.904 1.00 43.03 H new ATOM 0 HG12 VAL A 524 12.196 -5.776 -0.455 1.00 43.03 H new ATOM 0 HG13 VAL A 524 11.973 -4.012 -0.370 1.00 43.03 H new ATOM 0 HG21 VAL A 524 9.022 -4.156 0.573 1.00 71.34 H new ATOM 0 HG22 VAL A 524 9.567 -3.061 -0.719 1.00 71.34 H new ATOM 0 HG23 VAL A 524 8.249 -4.215 -1.029 1.00 71.34 H new ATOM 1991 N ALA A 525 12.822 -4.539 -2.744 1.00 14.52 N ATOM 1992 CA ALA A 525 13.990 -3.730 -3.047 1.00 41.13 C ATOM 1993 C ALA A 525 14.087 -3.526 -4.559 1.00 52.14 C ATOM 1994 O ALA A 525 14.973 -2.821 -5.039 1.00 65.23 O ATOM 1995 CB ALA A 525 15.238 -4.400 -2.468 1.00 65.54 C ATOM 0 H ALA A 525 13.026 -5.506 -2.492 1.00 14.52 H new ATOM 0 HA ALA A 525 13.904 -2.745 -2.587 1.00 41.13 H new ATOM 0 HB1 ALA A 525 16.115 -3.794 -2.695 1.00 65.54 H new ATOM 0 HB2 ALA A 525 15.132 -4.495 -1.387 1.00 65.54 H new ATOM 0 HB3 ALA A 525 15.357 -5.390 -2.909 1.00 65.54 H new ATOM 2001 N ASN A 526 13.161 -4.153 -5.270 1.00 0.12 N ATOM 2002 CA ASN A 526 13.131 -4.049 -6.719 1.00 72.31 C ATOM 2003 C ASN A 526 12.029 -3.071 -7.132 1.00 61.44 C ATOM 2004 O ASN A 526 12.181 -2.336 -8.107 1.00 23.22 O ATOM 2005 CB ASN A 526 12.826 -5.403 -7.362 1.00 2.34 C ATOM 2006 CG ASN A 526 14.116 -6.136 -7.734 1.00 75.22 C ATOM 2007 OD1 ASN A 526 15.171 -5.544 -7.901 1.00 0.04 O ATOM 2008 ND2 ASN A 526 13.975 -7.452 -7.857 1.00 71.21 N ATOM 0 H ASN A 526 12.426 -4.735 -4.869 1.00 0.12 H new ATOM 0 HA ASN A 526 14.109 -3.703 -7.053 1.00 72.31 H new ATOM 0 HB2 ASN A 526 12.242 -6.014 -6.673 1.00 2.34 H new ATOM 0 HB3 ASN A 526 12.216 -5.257 -8.254 1.00 2.34 H new ATOM 0 HD21 ASN A 526 14.778 -8.030 -8.105 1.00 71.21 H new ATOM 0 HD22 ASN A 526 13.064 -7.884 -7.703 1.00 71.21 H new ATOM 2014 N THR A 527 10.946 -3.091 -6.369 1.00 20.54 N ATOM 2015 CA THR A 527 9.821 -2.215 -6.644 1.00 14.32 C ATOM 2016 C THR A 527 9.911 -0.948 -5.792 1.00 73.43 C ATOM 2017 O THR A 527 9.851 0.163 -6.318 1.00 1.42 O ATOM 2018 CB THR A 527 8.535 -3.012 -6.414 1.00 61.03 C ATOM 2019 OG1 THR A 527 7.594 -2.418 -7.303 1.00 72.22 O ATOM 2020 CG2 THR A 527 7.938 -2.771 -5.025 1.00 12.11 C ATOM 0 H THR A 527 10.824 -3.701 -5.560 1.00 20.54 H new ATOM 0 HA THR A 527 9.829 -1.874 -7.679 1.00 14.32 H new ATOM 0 HB THR A 527 8.739 -4.075 -6.543 1.00 61.03 H new ATOM 0 HG1 THR A 527 6.732 -2.876 -7.220 1.00 72.22 H new ATOM 0 HG21 THR A 527 7.027 -3.360 -4.913 1.00 12.11 H new ATOM 0 HG22 THR A 527 8.658 -3.068 -4.263 1.00 12.11 H new ATOM 0 HG23 THR A 527 7.703 -1.713 -4.909 1.00 12.11 H new ATOM 2028 N PHE A 528 10.055 -1.155 -4.492 1.00 33.03 N ATOM 2029 CA PHE A 528 10.155 -0.043 -3.563 1.00 53.10 C ATOM 2030 C PHE A 528 11.610 0.393 -3.383 1.00 23.11 C ATOM 2031 O PHE A 528 12.041 0.688 -2.269 1.00 11.34 O ATOM 2032 CB PHE A 528 9.613 -0.534 -2.219 1.00 2.43 C ATOM 2033 CG PHE A 528 8.085 -0.551 -2.134 1.00 2.44 C ATOM 2034 CD1 PHE A 528 7.390 0.619 -2.141 1.00 43.34 C ATOM 2035 CD2 PHE A 528 7.421 -1.735 -2.049 1.00 31.31 C ATOM 2036 CE1 PHE A 528 5.972 0.604 -2.062 1.00 22.54 C ATOM 2037 CE2 PHE A 528 6.004 -1.751 -1.969 1.00 51.11 C ATOM 2038 CZ PHE A 528 5.309 -0.581 -1.977 1.00 30.01 C ATOM 0 H PHE A 528 10.105 -2.077 -4.060 1.00 33.03 H new ATOM 0 HA PHE A 528 9.593 0.810 -3.942 1.00 53.10 H new ATOM 0 HB2 PHE A 528 9.988 -1.540 -2.033 1.00 2.43 H new ATOM 0 HB3 PHE A 528 10.004 0.104 -1.426 1.00 2.43 H new ATOM 0 HD1 PHE A 528 7.917 1.559 -2.207 1.00 43.34 H new ATOM 0 HD2 PHE A 528 7.972 -2.664 -2.042 1.00 31.31 H new ATOM 0 HE1 PHE A 528 5.420 1.533 -2.069 1.00 22.54 H new ATOM 0 HE2 PHE A 528 5.477 -2.692 -1.902 1.00 51.11 H new ATOM 0 HZ PHE A 528 4.231 -0.593 -1.916 1.00 30.01 H new ATOM 2047 N LYS A 529 12.328 0.419 -4.496 1.00 52.13 N ATOM 2048 CA LYS A 529 13.727 0.814 -4.477 1.00 10.40 C ATOM 2049 C LYS A 529 13.902 2.004 -3.530 1.00 13.12 C ATOM 2050 O LYS A 529 12.938 2.700 -3.218 1.00 0.11 O ATOM 2051 CB LYS A 529 14.230 1.078 -5.898 1.00 5.40 C ATOM 2052 CG LYS A 529 14.643 -0.225 -6.584 1.00 71.11 C ATOM 2053 CD LYS A 529 14.304 -0.190 -8.075 1.00 21.40 C ATOM 2054 CE LYS A 529 14.868 -1.419 -8.794 1.00 71.31 C ATOM 2055 NZ LYS A 529 14.684 -1.293 -10.257 1.00 31.00 N ATOM 0 H LYS A 529 11.967 0.173 -5.418 1.00 52.13 H new ATOM 0 HA LYS A 529 14.347 0.005 -4.091 1.00 10.40 H new ATOM 0 HB2 LYS A 529 13.448 1.567 -6.479 1.00 5.40 H new ATOM 0 HB3 LYS A 529 15.079 1.761 -5.866 1.00 5.40 H new ATOM 0 HG2 LYS A 529 15.713 -0.385 -6.454 1.00 71.11 H new ATOM 0 HG3 LYS A 529 14.135 -1.066 -6.111 1.00 71.11 H new ATOM 0 HD2 LYS A 529 13.222 -0.152 -8.205 1.00 21.40 H new ATOM 0 HD3 LYS A 529 14.711 0.717 -8.523 1.00 21.40 H new ATOM 0 HE2 LYS A 529 15.928 -1.529 -8.563 1.00 71.31 H new ATOM 0 HE3 LYS A 529 14.369 -2.319 -8.435 1.00 71.31 H new ATOM 0 HZ1 LYS A 529 15.072 -2.134 -10.729 1.00 31.00 H new ATOM 0 HZ2 LYS A 529 13.670 -1.211 -10.474 1.00 31.00 H new ATOM 0 HZ3 LYS A 529 15.181 -0.445 -10.598 1.00 31.00 H new ATOM 2064 N PRO A 530 15.173 2.205 -3.090 1.00 54.10 N ATOM 2065 CA PRO A 530 15.487 3.299 -2.187 1.00 64.02 C ATOM 2066 C PRO A 530 15.495 4.637 -2.927 1.00 52.35 C ATOM 2067 O PRO A 530 14.713 5.532 -2.608 1.00 73.25 O ATOM 2068 CB PRO A 530 16.839 2.941 -1.592 1.00 43.33 C ATOM 2069 CG PRO A 530 17.444 1.903 -2.524 1.00 41.42 C ATOM 2070 CD PRO A 530 16.339 1.400 -3.439 1.00 75.20 C ATOM 0 HA PRO A 530 14.741 3.424 -1.402 1.00 64.02 H new ATOM 0 HB2 PRO A 530 17.479 3.820 -1.519 1.00 43.33 H new ATOM 0 HB3 PRO A 530 16.729 2.543 -0.583 1.00 43.33 H new ATOM 0 HG2 PRO A 530 18.254 2.340 -3.108 1.00 41.42 H new ATOM 0 HG3 PRO A 530 17.871 1.079 -1.952 1.00 41.42 H new ATOM 0 HD2 PRO A 530 16.606 1.525 -4.488 1.00 75.20 H new ATOM 0 HD3 PRO A 530 16.148 0.338 -3.283 1.00 75.20 H new ATOM 2075 N HIS A 531 16.387 4.733 -3.903 1.00 24.34 N ATOM 2076 CA HIS A 531 16.506 5.947 -4.692 1.00 64.43 C ATOM 2077 C HIS A 531 15.137 6.330 -5.254 1.00 15.21 C ATOM 2078 O HIS A 531 14.912 7.483 -5.619 1.00 55.21 O ATOM 2079 CB HIS A 531 17.571 5.787 -5.778 1.00 24.55 C ATOM 2080 CG HIS A 531 17.603 4.413 -6.407 1.00 33.31 C ATOM 2081 ND1 HIS A 531 16.458 3.693 -6.693 1.00 33.12 N ATOM 2082 CD2 HIS A 531 18.655 3.639 -6.803 1.00 22.14 C ATOM 2083 CE1 HIS A 531 16.815 2.537 -7.235 1.00 21.14 C ATOM 2084 NE2 HIS A 531 18.177 2.506 -7.302 1.00 30.02 N ATOM 0 H HIS A 531 17.034 3.989 -4.165 1.00 24.34 H new ATOM 0 HA HIS A 531 16.840 6.767 -4.056 1.00 64.43 H new ATOM 0 HB2 HIS A 531 17.395 6.529 -6.557 1.00 24.55 H new ATOM 0 HB3 HIS A 531 18.549 6.002 -5.348 1.00 24.55 H new ATOM 0 HD2 HIS A 531 19.699 3.904 -6.724 1.00 22.14 H new ATOM 0 HE1 HIS A 531 16.145 1.757 -7.565 1.00 21.14 H new ATOM 0 HE2 HIS A 531 18.736 1.738 -7.674 1.00 30.02 H new ATOM 2091 N ARG A 532 14.257 5.340 -5.310 1.00 62.41 N ATOM 2092 CA ARG A 532 12.916 5.558 -5.823 1.00 45.32 C ATOM 2093 C ARG A 532 11.986 6.022 -4.699 1.00 62.12 C ATOM 2094 O ARG A 532 11.093 6.838 -4.923 1.00 71.53 O ATOM 2095 CB ARG A 532 12.351 4.283 -6.448 1.00 32.32 C ATOM 2096 CG ARG A 532 12.549 4.282 -7.966 1.00 21.31 C ATOM 2097 CD ARG A 532 14.033 4.392 -8.325 1.00 43.03 C ATOM 2098 NE ARG A 532 14.183 4.732 -9.757 1.00 51.42 N ATOM 2099 CZ ARG A 532 15.263 5.353 -10.278 1.00 15.02 C ATOM 2100 NH1 ARG A 532 16.298 5.708 -9.488 1.00 11.45 N ATOM 2101 NH2 ARG A 532 15.290 5.608 -11.573 1.00 71.54 N ATOM 0 H ARG A 532 14.448 4.385 -5.008 1.00 62.41 H new ATOM 0 HA ARG A 532 12.977 6.329 -6.591 1.00 45.32 H new ATOM 0 HB2 ARG A 532 12.842 3.412 -6.013 1.00 32.32 H new ATOM 0 HB3 ARG A 532 11.289 4.200 -6.216 1.00 32.32 H new ATOM 0 HG2 ARG A 532 12.135 3.367 -8.390 1.00 21.31 H new ATOM 0 HG3 ARG A 532 12.001 5.114 -8.408 1.00 21.31 H new ATOM 0 HD2 ARG A 532 14.509 5.156 -7.710 1.00 43.03 H new ATOM 0 HD3 ARG A 532 14.538 3.450 -8.111 1.00 43.03 H new ATOM 0 HE ARG A 532 13.423 4.482 -10.390 1.00 51.42 H new ATOM 0 HH11 ARG A 532 16.269 5.508 -8.488 1.00 11.45 H new ATOM 0 HH12 ARG A 532 17.110 6.177 -9.891 1.00 11.45 H new ATOM 0 HH21 ARG A 532 14.503 5.337 -12.163 1.00 71.54 H new ATOM 0 HH22 ARG A 532 16.098 6.076 -11.984 1.00 71.54 H new ATOM 2111 N LEU A 533 12.227 5.480 -3.514 1.00 51.15 N ATOM 2112 CA LEU A 533 11.423 5.828 -2.355 1.00 65.51 C ATOM 2113 C LEU A 533 11.715 7.275 -1.952 1.00 4.22 C ATOM 2114 O LEU A 533 10.797 8.080 -1.810 1.00 64.23 O ATOM 2115 CB LEU A 533 11.646 4.818 -1.227 1.00 74.33 C ATOM 2116 CG LEU A 533 10.661 3.648 -1.169 1.00 34.23 C ATOM 2117 CD1 LEU A 533 9.481 3.969 -0.251 1.00 4.22 C ATOM 2118 CD2 LEU A 533 10.202 3.250 -2.573 1.00 54.01 C ATOM 0 H LEU A 533 12.967 4.803 -3.332 1.00 51.15 H new ATOM 0 HA LEU A 533 10.362 5.773 -2.597 1.00 65.51 H new ATOM 0 HB2 LEU A 533 12.654 4.414 -1.322 1.00 74.33 H new ATOM 0 HB3 LEU A 533 11.604 5.350 -0.276 1.00 74.33 H new ATOM 0 HG LEU A 533 11.176 2.788 -0.741 1.00 34.23 H new ATOM 0 HD11 LEU A 533 8.797 3.121 -0.228 1.00 4.22 H new ATOM 0 HD12 LEU A 533 9.847 4.167 0.756 1.00 4.22 H new ATOM 0 HD13 LEU A 533 8.957 4.848 -0.626 1.00 4.22 H new ATOM 0 HD21 LEU A 533 9.503 2.417 -2.505 1.00 54.01 H new ATOM 0 HD22 LEU A 533 9.710 4.098 -3.049 1.00 54.01 H new ATOM 0 HD23 LEU A 533 11.066 2.951 -3.167 1.00 54.01 H new ATOM 2129 N GLN A 534 12.998 7.559 -1.779 1.00 43.22 N ATOM 2130 CA GLN A 534 13.423 8.895 -1.395 1.00 40.00 C ATOM 2131 C GLN A 534 13.068 9.901 -2.492 1.00 32.25 C ATOM 2132 O GLN A 534 12.450 10.929 -2.221 1.00 64.34 O ATOM 2133 CB GLN A 534 14.921 8.926 -1.086 1.00 43.12 C ATOM 2134 CG GLN A 534 15.296 7.835 -0.082 1.00 43.04 C ATOM 2135 CD GLN A 534 16.708 7.308 -0.346 1.00 4.43 C ATOM 2136 OE1 GLN A 534 17.586 7.359 0.500 1.00 73.24 O ATOM 2137 NE2 GLN A 534 16.876 6.801 -1.563 1.00 21.22 N ATOM 0 H GLN A 534 13.756 6.887 -1.898 1.00 43.22 H new ATOM 0 HA GLN A 534 12.892 9.177 -0.486 1.00 40.00 H new ATOM 0 HB2 GLN A 534 15.489 8.789 -2.006 1.00 43.12 H new ATOM 0 HB3 GLN A 534 15.193 9.903 -0.686 1.00 43.12 H new ATOM 0 HG2 GLN A 534 15.236 8.232 0.931 1.00 43.04 H new ATOM 0 HG3 GLN A 534 14.580 7.015 -0.146 1.00 43.04 H new ATOM 0 HE21 GLN A 534 16.098 6.790 -2.223 1.00 21.22 H new ATOM 0 HE22 GLN A 534 17.783 6.423 -1.837 1.00 21.22 H new ATOM 2144 N ALA A 535 13.474 9.569 -3.709 1.00 62.31 N ATOM 2145 CA ALA A 535 13.207 10.429 -4.848 1.00 32.03 C ATOM 2146 C ALA A 535 11.704 10.701 -4.936 1.00 64.04 C ATOM 2147 O ALA A 535 11.280 11.666 -5.569 1.00 13.30 O ATOM 2148 CB ALA A 535 13.756 9.780 -6.119 1.00 32.35 C ATOM 0 H ALA A 535 13.986 8.715 -3.930 1.00 62.31 H new ATOM 0 HA ALA A 535 13.710 11.389 -4.729 1.00 32.03 H new ATOM 0 HB1 ALA A 535 13.555 10.426 -6.973 1.00 32.35 H new ATOM 0 HB2 ALA A 535 14.832 9.635 -6.018 1.00 32.35 H new ATOM 0 HB3 ALA A 535 13.273 8.815 -6.273 1.00 32.35 H new ATOM 2154 N ARG A 536 10.939 9.833 -4.289 1.00 63.22 N ATOM 2155 CA ARG A 536 9.493 9.967 -4.285 1.00 55.14 C ATOM 2156 C ARG A 536 9.077 11.203 -3.485 1.00 14.04 C ATOM 2157 O ARG A 536 8.106 11.874 -3.831 1.00 21.22 O ATOM 2158 CB ARG A 536 8.826 8.729 -3.683 1.00 42.44 C ATOM 2159 CG ARG A 536 7.374 8.607 -4.149 1.00 32.32 C ATOM 2160 CD ARG A 536 7.279 8.690 -5.674 1.00 61.34 C ATOM 2161 NE ARG A 536 8.434 7.999 -6.292 1.00 65.14 N ATOM 2162 CZ ARG A 536 8.925 8.292 -7.514 1.00 53.51 C ATOM 2163 NH1 ARG A 536 8.364 9.266 -8.263 1.00 42.44 N ATOM 2164 NH2 ARG A 536 9.961 7.611 -7.968 1.00 5.33 N ATOM 0 H ARG A 536 11.294 9.034 -3.764 1.00 63.22 H new ATOM 0 HA ARG A 536 9.167 10.073 -5.320 1.00 55.14 H new ATOM 0 HB2 ARG A 536 9.381 7.836 -3.972 1.00 42.44 H new ATOM 0 HB3 ARG A 536 8.859 8.787 -2.595 1.00 42.44 H new ATOM 0 HG2 ARG A 536 6.957 7.660 -3.806 1.00 32.32 H new ATOM 0 HG3 ARG A 536 6.776 9.400 -3.700 1.00 32.32 H new ATOM 0 HD2 ARG A 536 6.348 8.235 -6.014 1.00 61.34 H new ATOM 0 HD3 ARG A 536 7.258 9.733 -5.989 1.00 61.34 H new ATOM 0 HE ARG A 536 8.886 7.255 -5.761 1.00 65.14 H new ATOM 0 HH11 ARG A 536 7.563 9.786 -7.906 1.00 42.44 H new ATOM 0 HH12 ARG A 536 8.742 9.481 -9.186 1.00 42.44 H new ATOM 0 HH21 ARG A 536 10.378 6.876 -7.397 1.00 5.33 H new ATOM 0 HH22 ARG A 536 10.344 7.820 -8.890 1.00 5.33 H new ATOM 2174 N LYS A 537 9.831 11.466 -2.429 1.00 62.31 N ATOM 2175 CA LYS A 537 9.553 12.610 -1.575 1.00 33.15 C ATOM 2176 C LYS A 537 10.447 13.780 -1.991 1.00 42.03 C ATOM 2177 O LYS A 537 10.120 14.938 -1.731 1.00 12.23 O ATOM 2178 CB LYS A 537 9.690 12.225 -0.101 1.00 62.10 C ATOM 2179 CG LYS A 537 9.315 10.758 0.119 1.00 1.44 C ATOM 2180 CD LYS A 537 7.909 10.466 -0.413 1.00 20.44 C ATOM 2181 CE LYS A 537 6.892 11.457 0.153 1.00 35.23 C ATOM 2182 NZ LYS A 537 5.516 10.935 -0.006 1.00 71.43 N ATOM 0 H LYS A 537 10.635 10.907 -2.144 1.00 62.31 H new ATOM 0 HA LYS A 537 8.521 12.937 -1.700 1.00 33.15 H new ATOM 0 HB2 LYS A 537 10.715 12.396 0.230 1.00 62.10 H new ATOM 0 HB3 LYS A 537 9.048 12.863 0.507 1.00 62.10 H new ATOM 0 HG2 LYS A 537 10.038 10.115 -0.382 1.00 1.44 H new ATOM 0 HG3 LYS A 537 9.362 10.522 1.182 1.00 1.44 H new ATOM 0 HD2 LYS A 537 7.909 10.522 -1.502 1.00 20.44 H new ATOM 0 HD3 LYS A 537 7.619 9.450 -0.146 1.00 20.44 H new ATOM 0 HE2 LYS A 537 7.099 11.637 1.208 1.00 35.23 H new ATOM 0 HE3 LYS A 537 6.985 12.415 -0.359 1.00 35.23 H new ATOM 0 HZ1 LYS A 537 4.838 11.620 0.384 1.00 71.43 H new ATOM 0 HZ2 LYS A 537 5.316 10.785 -1.016 1.00 71.43 H new ATOM 0 HZ3 LYS A 537 5.426 10.032 0.502 1.00 71.43 H new ATOM 2191 N ALA A 538 11.556 13.439 -2.630 1.00 25.32 N ATOM 2192 CA ALA A 538 12.499 14.447 -3.084 1.00 1.34 C ATOM 2193 C ALA A 538 11.766 15.465 -3.959 1.00 75.25 C ATOM 2194 O ALA A 538 12.244 16.583 -4.149 1.00 60.24 O ATOM 2195 CB ALA A 538 13.656 13.769 -3.821 1.00 2.41 C ATOM 0 H ALA A 538 11.823 12.478 -2.844 1.00 25.32 H new ATOM 0 HA ALA A 538 12.924 14.985 -2.237 1.00 1.34 H new ATOM 0 HB1 ALA A 538 14.363 14.525 -4.162 1.00 2.41 H new ATOM 0 HB2 ALA A 538 14.161 13.077 -3.147 1.00 2.41 H new ATOM 0 HB3 ALA A 538 13.269 13.221 -4.680 1.00 2.41 H new ATOM 2201 N MET A 539 10.620 15.042 -4.472 1.00 42.04 N ATOM 2202 CA MET A 539 9.818 15.904 -5.323 1.00 12.42 C ATOM 2203 C MET A 539 9.351 17.146 -4.562 1.00 55.14 C ATOM 2204 O MET A 539 9.205 18.219 -5.148 1.00 42.22 O ATOM 2205 CB MET A 539 8.601 15.129 -5.830 1.00 53.41 C ATOM 2206 CG MET A 539 8.978 14.216 -6.997 1.00 64.30 C ATOM 2207 SD MET A 539 7.526 13.388 -7.623 1.00 65.04 S ATOM 2208 CE MET A 539 7.179 12.296 -6.255 1.00 13.43 C ATOM 0 H MET A 539 10.228 14.114 -4.315 1.00 42.04 H new ATOM 0 HA MET A 539 10.432 16.226 -6.164 1.00 12.42 H new ATOM 0 HB2 MET A 539 8.181 14.534 -5.019 1.00 53.41 H new ATOM 0 HB3 MET A 539 7.827 15.828 -6.146 1.00 53.41 H new ATOM 0 HG2 MET A 539 9.443 14.801 -7.791 1.00 64.30 H new ATOM 0 HG3 MET A 539 9.713 13.480 -6.670 1.00 64.30 H new ATOM 0 HE1 MET A 539 6.398 11.592 -6.541 1.00 13.43 H new ATOM 0 HE2 MET A 539 8.083 11.748 -5.989 1.00 13.43 H new ATOM 0 HE3 MET A 539 6.844 12.881 -5.398 1.00 13.43 H new ATOM 2216 N TRP A 540 9.131 16.961 -3.269 1.00 42.44 N ATOM 2217 CA TRP A 540 8.684 18.054 -2.421 1.00 53.51 C ATOM 2218 C TRP A 540 9.669 19.213 -2.586 1.00 63.30 C ATOM 2219 O TRP A 540 9.327 20.366 -2.326 1.00 63.21 O ATOM 2220 CB TRP A 540 8.535 17.597 -0.970 1.00 43.41 C ATOM 2221 CG TRP A 540 9.790 17.806 -0.119 1.00 75.12 C ATOM 2222 CD1 TRP A 540 10.475 18.941 0.076 1.00 43.51 C ATOM 2223 CD2 TRP A 540 10.487 16.799 0.646 1.00 52.44 C ATOM 2224 NE1 TRP A 540 11.556 18.741 0.910 1.00 73.55 N ATOM 2225 CE2 TRP A 540 11.564 17.398 1.266 1.00 73.33 C ATOM 2226 CE3 TRP A 540 10.214 15.429 0.809 1.00 71.55 C ATOM 2227 CZ2 TRP A 540 12.457 16.703 2.091 1.00 44.22 C ATOM 2228 CZ3 TRP A 540 11.116 14.749 1.636 1.00 25.33 C ATOM 2229 CH2 TRP A 540 12.206 15.338 2.268 1.00 32.21 C ATOM 0 H TRP A 540 9.254 16.070 -2.787 1.00 42.44 H new ATOM 0 HA TRP A 540 7.693 18.394 -2.721 1.00 53.51 H new ATOM 0 HB2 TRP A 540 7.705 18.136 -0.513 1.00 43.41 H new ATOM 0 HB3 TRP A 540 8.273 16.539 -0.958 1.00 43.41 H new ATOM 0 HD1 TRP A 540 10.214 19.892 -0.364 1.00 43.51 H new ATOM 0 HE1 TRP A 540 12.226 19.449 1.210 1.00 73.55 H new ATOM 0 HE3 TRP A 540 9.376 14.941 0.334 1.00 71.55 H new ATOM 0 HZ2 TRP A 540 13.294 17.194 2.565 1.00 44.22 H new ATOM 0 HZ3 TRP A 540 10.954 13.693 1.794 1.00 25.33 H new ATOM 0 HH2 TRP A 540 12.856 14.744 2.893 1.00 32.21 H new ATOM 2239 N ARG A 541 10.875 18.867 -3.014 1.00 5.44 N ATOM 2240 CA ARG A 541 11.913 19.863 -3.215 1.00 23.11 C ATOM 2241 C ARG A 541 11.518 20.822 -4.340 1.00 13.21 C ATOM 2242 O ARG A 541 11.808 22.015 -4.276 1.00 65.10 O ATOM 2243 CB ARG A 541 13.249 19.204 -3.562 1.00 2.22 C ATOM 2244 CG ARG A 541 13.312 18.840 -5.046 1.00 71.14 C ATOM 2245 CD ARG A 541 14.445 17.848 -5.321 1.00 42.31 C ATOM 2246 NE ARG A 541 15.135 18.202 -6.581 1.00 2.31 N ATOM 2247 CZ ARG A 541 14.712 17.825 -7.806 1.00 31.43 C ATOM 2248 NH1 ARG A 541 13.596 17.078 -7.948 1.00 25.52 N ATOM 2249 NH2 ARG A 541 15.406 18.198 -8.866 1.00 65.21 N ATOM 0 H ARG A 541 11.156 17.910 -3.227 1.00 5.44 H new ATOM 0 HA ARG A 541 12.025 20.417 -2.283 1.00 23.11 H new ATOM 0 HB2 ARG A 541 14.067 19.880 -3.315 1.00 2.22 H new ATOM 0 HB3 ARG A 541 13.384 18.307 -2.958 1.00 2.22 H new ATOM 0 HG2 ARG A 541 12.362 18.407 -5.358 1.00 71.14 H new ATOM 0 HG3 ARG A 541 13.462 19.742 -5.639 1.00 71.14 H new ATOM 0 HD2 ARG A 541 15.155 17.856 -4.494 1.00 42.31 H new ATOM 0 HD3 ARG A 541 14.045 16.836 -5.388 1.00 42.31 H new ATOM 0 HE ARG A 541 15.983 18.766 -6.520 1.00 2.31 H new ATOM 0 HH11 ARG A 541 13.065 16.794 -7.125 1.00 25.52 H new ATOM 0 HH12 ARG A 541 13.285 16.798 -8.878 1.00 25.52 H new ATOM 0 HH21 ARG A 541 16.248 18.762 -8.752 1.00 65.21 H new ATOM 0 HH22 ARG A 541 15.100 17.922 -9.799 1.00 65.21 H new ATOM 2259 N LYS A 542 10.861 20.263 -5.347 1.00 4.23 N ATOM 2260 CA LYS A 542 10.423 21.054 -6.484 1.00 32.12 C ATOM 2261 C LYS A 542 9.542 22.204 -5.993 1.00 1.23 C ATOM 2262 O LYS A 542 9.707 23.344 -6.420 1.00 71.15 O ATOM 2263 CB LYS A 542 9.744 20.162 -7.527 1.00 63.31 C ATOM 2264 CG LYS A 542 10.714 19.103 -8.056 1.00 60.12 C ATOM 2265 CD LYS A 542 12.067 19.725 -8.407 1.00 2.21 C ATOM 2266 CE LYS A 542 11.892 20.935 -9.326 1.00 24.51 C ATOM 2267 NZ LYS A 542 11.544 20.498 -10.696 1.00 75.43 N ATOM 0 H LYS A 542 10.622 19.273 -5.398 1.00 4.23 H new ATOM 0 HA LYS A 542 11.279 21.502 -6.988 1.00 32.12 H new ATOM 0 HB2 LYS A 542 8.875 19.676 -7.085 1.00 63.31 H new ATOM 0 HB3 LYS A 542 9.381 20.773 -8.353 1.00 63.31 H new ATOM 0 HG2 LYS A 542 10.852 18.324 -7.306 1.00 60.12 H new ATOM 0 HG3 LYS A 542 10.290 18.625 -8.939 1.00 60.12 H new ATOM 0 HD2 LYS A 542 12.580 20.028 -7.494 1.00 2.21 H new ATOM 0 HD3 LYS A 542 12.698 18.982 -8.895 1.00 2.21 H new ATOM 0 HE2 LYS A 542 11.110 21.586 -8.936 1.00 24.51 H new ATOM 0 HE3 LYS A 542 12.812 21.520 -9.347 1.00 24.51 H new ATOM 0 HZ1 LYS A 542 11.429 21.331 -11.307 1.00 75.43 H new ATOM 0 HZ2 LYS A 542 12.304 19.895 -11.072 1.00 75.43 H new ATOM 0 HZ3 LYS A 542 10.654 19.960 -10.673 1.00 75.43 H new ATOM 2276 N GLU A 543 8.624 21.863 -5.100 1.00 3.31 N ATOM 2277 CA GLU A 543 7.716 22.853 -4.545 1.00 51.44 C ATOM 2278 C GLU A 543 8.495 23.898 -3.744 1.00 12.32 C ATOM 2279 O GLU A 543 8.124 25.070 -3.718 1.00 41.05 O ATOM 2280 CB GLU A 543 6.643 22.189 -3.681 1.00 12.43 C ATOM 2281 CG GLU A 543 5.485 21.675 -4.541 1.00 20.44 C ATOM 2282 CD GLU A 543 4.428 20.981 -3.681 1.00 11.22 C ATOM 2283 OE1 GLU A 543 3.460 20.424 -4.219 1.00 21.01 O ATOM 2284 OE2 GLU A 543 4.639 21.035 -2.410 1.00 21.23 O ATOM 0 H GLU A 543 8.490 20.915 -4.747 1.00 3.31 H new ATOM 0 HA GLU A 543 7.212 23.357 -5.369 1.00 51.44 H new ATOM 0 HB2 GLU A 543 7.081 21.362 -3.123 1.00 12.43 H new ATOM 0 HB3 GLU A 543 6.267 22.904 -2.949 1.00 12.43 H new ATOM 0 HG2 GLU A 543 5.031 22.506 -5.080 1.00 20.44 H new ATOM 0 HG3 GLU A 543 5.864 20.979 -5.289 1.00 20.44 H new ATOM 2290 N GLN A 544 9.563 23.436 -3.110 1.00 1.21 N ATOM 2291 CA GLN A 544 10.398 24.316 -2.310 1.00 21.10 C ATOM 2292 C GLN A 544 11.140 25.306 -3.210 1.00 23.21 C ATOM 2293 O GLN A 544 11.556 26.371 -2.757 1.00 2.23 O ATOM 2294 CB GLN A 544 11.378 23.512 -1.452 1.00 34.33 C ATOM 2295 CG GLN A 544 10.639 22.480 -0.599 1.00 21.43 C ATOM 2296 CD GLN A 544 10.274 23.059 0.769 1.00 62.33 C ATOM 2297 OE1 GLN A 544 10.935 23.941 1.294 1.00 43.43 O ATOM 2298 NE2 GLN A 544 9.190 22.516 1.315 1.00 21.42 N ATOM 0 H GLN A 544 9.869 22.463 -3.134 1.00 1.21 H new ATOM 0 HA GLN A 544 9.755 24.881 -1.635 1.00 21.10 H new ATOM 0 HB2 GLN A 544 12.101 23.008 -2.094 1.00 34.33 H new ATOM 0 HB3 GLN A 544 11.941 24.187 -0.807 1.00 34.33 H new ATOM 0 HG2 GLN A 544 9.734 22.158 -1.114 1.00 21.43 H new ATOM 0 HG3 GLN A 544 11.264 21.596 -0.469 1.00 21.43 H new ATOM 0 HE21 GLN A 544 8.684 21.781 0.821 1.00 21.42 H new ATOM 0 HE22 GLN A 544 8.865 22.834 2.228 1.00 21.42 H new ATOM 2305 N ASP A 545 11.285 24.918 -4.468 1.00 71.13 N ATOM 2306 CA ASP A 545 11.970 25.758 -5.436 1.00 13.21 C ATOM 2307 C ASP A 545 10.935 26.495 -6.288 1.00 31.32 C ATOM 2308 O ASP A 545 11.274 27.434 -7.008 1.00 33.04 O ATOM 2309 CB ASP A 545 12.844 24.920 -6.373 1.00 5.33 C ATOM 2310 CG ASP A 545 13.931 25.700 -7.112 1.00 31.54 C ATOM 2311 OD1 ASP A 545 13.640 26.530 -7.987 1.00 3.43 O ATOM 2312 OD2 ASP A 545 15.140 25.424 -6.754 1.00 12.33 O ATOM 0 H ASP A 545 10.940 24.033 -4.840 1.00 71.13 H new ATOM 0 HA ASP A 545 12.599 26.460 -4.888 1.00 13.21 H new ATOM 0 HB2 ASP A 545 13.317 24.128 -5.793 1.00 5.33 H new ATOM 0 HB3 ASP A 545 12.202 24.436 -7.108 1.00 5.33 H new TER 2317 ASP A 545