USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=33 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= -5.63! C(o=-5!,f=-6.4!) USER MOD Set 1.2: A 480 GLN : amide:sc= 0.643 K(o=-5,f=-6.4) USER MOD Set 2.1: A 473 MET CE :methyl 177:sc= -14.4! (180deg=-11.1!) USER MOD Set 2.2: A 485 CYS SG : rot -98:sc= -6.3! USER MOD Set 3.1: A 462 CYS SG : rot 13:sc= -2.93 USER MOD Set 3.2: A 465 SER OG : rot -150:sc= -2.92! USER MOD Set 4.1: A 390 SER OG : rot -166:sc= 0.393 USER MOD Set 4.2: A 440 SER OG : rot 171:sc= 0.375 USER MOD Set 5.1: A 401 HIS : no HD1:sc= -12.1! C(o=-13!,f=-19!) USER MOD Set 5.2: A 426 THR OG1 : rot 180:sc= 0 USER MOD Set 5.3: A 428 CYS SG : rot -22:sc= -0.983 USER MOD Set 6.1: A 393 LYS NZ :NH3+ 158:sc= -0.12 (180deg=-0.599) USER MOD Set 6.2: A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 386 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 180:sc= 0 USER MOD Single : A 389 SER OG : rot -54:sc= 0.467 USER MOD Single : A 392 GLN : amide:sc= -1.46 X(o=-1.5,f=-1.3) USER MOD Single : A 396 ASN : amide:sc= -11.4! C(o=-11!,f=-9.6!) USER MOD Single : A 407 HIS : no HD1:sc= -2.56! K(o=-2.6!,f=-3.1) USER MOD Single : A 415 LYS NZ :NH3+ -161:sc= -0.204 (180deg=-0.628) USER MOD Single : A 432 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 434 HIS : no HD1:sc= -0.268 X(o=-0.27,f=-0.76) USER MOD Single : A 441 CYS SG : rot 180:sc= 0 USER MOD Single : A 443 GLN : amide:sc= -0.0913 X(o=-0.091,f=0) USER MOD Single : A 448 HIS : no HD1:sc= -7.12! C(o=-7.1!,f=-8!) USER MOD Single : A 449 SER OG : rot 130:sc= -4.87! USER MOD Single : A 457 THR OG1 : rot 156:sc= 0.104 USER MOD Single : A 458 SER OG : rot -21:sc= 0.111 USER MOD Single : A 459 ASN : amide:sc= -0.0598 K(o=-0.06,f=-1.8!) USER MOD Single : A 467 HIS : no HD1:sc= -1.06 K(o=-1.1,f=-2.4!) USER MOD Single : A 468 GLN : amide:sc= -2.19 K(o=-2.2,f=-0.39) USER MOD Single : A 470 ASN : amide:sc= -4.33! K(o=-4.3!,f=-1.6) USER MOD Single : A 471 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 474 MET CE :methyl -124:sc= -0.116 (180deg=-3.13!) USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 478 THR OG1 : rot -22:sc= 0.766 USER MOD Single : A 482 SER OG : rot 180:sc= -0.473 USER MOD Single : A 494 SER OG : rot -47:sc= -0.599 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 498 GLN : amide:sc= -0.245 K(o=-0.25,f=-1.6) 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 99:sc= 0.328 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 23:sc= 0.281 USER MOD Single : A 516 HIS : no HD1:sc= -2.35! K(o=-2.4!,f=-1.5) USER MOD Single : A 517 SER OG : rot -173:sc= 0.329 USER MOD Single : A 518 GLN : amide:sc= -4.14! K(o=-4.1!,f=-2.1) USER MOD Single : A 523 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.215) USER MOD Single : A 526 ASN : amide:sc= -3.42! C(o=-3.4!,f=-5.1!) USER MOD Single : A 527 THR OG1 : rot 13:sc= -0.533 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HE2:sc= -2.94! C(o=-2.9!,f=-3.5!) USER MOD Single : A 534 GLN : amide:sc= -0.833 X(o=-0.83,f=-0.54) USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 539 MET CE :methyl -133:sc= -2.78! (180deg=-4.73!) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 -13.874 14.171 -4.557 1.00 61.02 N ATOM 2 CA MET A 386 -14.786 15.214 -4.120 1.00 10.13 C ATOM 3 C MET A 386 -14.694 15.423 -2.606 1.00 50.12 C ATOM 4 O MET A 386 -15.693 15.306 -1.899 1.00 64.30 O ATOM 5 CB MET A 386 -16.218 14.831 -4.496 1.00 2.10 C ATOM 6 CG MET A 386 -16.265 14.171 -5.876 1.00 32.13 C ATOM 7 SD MET A 386 -17.958 13.849 -6.342 1.00 64.21 S ATOM 8 CE MET A 386 -18.133 15.002 -7.692 1.00 50.40 C ATOM 0 HA MET A 386 -14.508 16.145 -4.615 1.00 10.13 H new ATOM 0 HB2 MET A 386 -16.624 14.149 -3.749 1.00 2.10 H new ATOM 0 HB3 MET A 386 -16.849 15.720 -4.492 1.00 2.10 H new ATOM 0 HG2 MET A 386 -15.793 14.819 -6.614 1.00 32.13 H new ATOM 0 HG3 MET A 386 -15.700 13.239 -5.862 1.00 32.13 H new ATOM 0 HE1 MET A 386 -19.140 14.932 -8.102 1.00 50.40 H new ATOM 0 HE2 MET A 386 -17.959 16.015 -7.330 1.00 50.40 H new ATOM 0 HE3 MET A 386 -17.407 14.765 -8.470 1.00 50.40 H new ATOM 16 N GLU A 387 -13.486 15.732 -2.156 1.00 51.34 N ATOM 17 CA GLU A 387 -13.251 15.959 -0.741 1.00 50.43 C ATOM 18 C GLU A 387 -13.672 17.379 -0.354 1.00 11.21 C ATOM 19 O GLU A 387 -14.224 18.111 -1.173 1.00 14.52 O ATOM 20 CB GLU A 387 -11.787 15.704 -0.381 1.00 70.31 C ATOM 21 CG GLU A 387 -11.456 14.212 -0.453 1.00 72.10 C ATOM 22 CD GLU A 387 -11.063 13.806 -1.875 1.00 23.25 C ATOM 23 OE1 GLU A 387 -11.169 12.624 -2.233 1.00 21.12 O ATOM 24 OE2 GLU A 387 -10.636 14.769 -2.619 1.00 63.14 O ATOM 0 H GLU A 387 -12.660 15.830 -2.747 1.00 51.34 H new ATOM 0 HA GLU A 387 -13.858 15.254 -0.174 1.00 50.43 H new ATOM 0 HB2 GLU A 387 -11.140 16.257 -1.062 1.00 70.31 H new ATOM 0 HB3 GLU A 387 -11.586 16.077 0.623 1.00 70.31 H new ATOM 0 HG2 GLU A 387 -10.640 13.983 0.233 1.00 72.10 H new ATOM 0 HG3 GLU A 387 -12.318 13.629 -0.129 1.00 72.10 H new ATOM 30 N SER A 388 -13.395 17.723 0.894 1.00 10.51 N ATOM 31 CA SER A 388 -13.737 19.043 1.401 1.00 13.53 C ATOM 32 C SER A 388 -12.467 19.801 1.790 1.00 1.13 C ATOM 33 O SER A 388 -12.376 20.340 2.892 1.00 43.40 O ATOM 34 CB SER A 388 -14.685 18.944 2.596 1.00 43.21 C ATOM 35 OG SER A 388 -15.993 18.531 2.209 1.00 23.25 O ATOM 0 H SER A 388 -12.938 17.112 1.570 1.00 10.51 H new ATOM 0 HA SER A 388 -14.249 19.591 0.610 1.00 13.53 H new ATOM 0 HB2 SER A 388 -14.282 18.237 3.321 1.00 43.21 H new ATOM 0 HB3 SER A 388 -14.743 19.912 3.093 1.00 43.21 H new ATOM 0 HG SER A 388 -16.567 18.478 3.001 1.00 23.25 H new ATOM 40 N SER A 389 -11.518 19.815 0.867 1.00 41.04 N ATOM 41 CA SER A 389 -10.256 20.497 1.100 1.00 50.23 C ATOM 42 C SER A 389 -9.468 19.779 2.198 1.00 15.41 C ATOM 43 O SER A 389 -8.910 20.421 3.086 1.00 4.21 O ATOM 44 CB SER A 389 -10.485 21.961 1.482 1.00 31.12 C ATOM 45 OG SER A 389 -9.260 22.680 1.592 1.00 50.02 O ATOM 0 H SER A 389 -11.597 19.365 -0.045 1.00 41.04 H new ATOM 0 HA SER A 389 -9.679 20.476 0.175 1.00 50.23 H new ATOM 0 HB2 SER A 389 -11.119 22.436 0.733 1.00 31.12 H new ATOM 0 HB3 SER A 389 -11.020 22.009 2.430 1.00 31.12 H new ATOM 0 HG SER A 389 -8.662 22.214 2.213 1.00 50.02 H new ATOM 50 N SER A 390 -9.450 18.458 2.101 1.00 31.52 N ATOM 51 CA SER A 390 -8.739 17.645 3.074 1.00 61.13 C ATOM 52 C SER A 390 -7.256 18.019 3.085 1.00 41.12 C ATOM 53 O SER A 390 -6.781 18.714 2.189 1.00 33.42 O ATOM 54 CB SER A 390 -8.909 16.155 2.775 1.00 23.11 C ATOM 55 OG SER A 390 -8.753 15.355 3.944 1.00 41.34 O ATOM 0 H SER A 390 -9.916 17.930 1.363 1.00 31.52 H new ATOM 0 HA SER A 390 -9.163 17.841 4.059 1.00 61.13 H new ATOM 0 HB2 SER A 390 -9.896 15.982 2.346 1.00 23.11 H new ATOM 0 HB3 SER A 390 -8.178 15.850 2.026 1.00 23.11 H new ATOM 0 HG SER A 390 -8.642 14.416 3.686 1.00 41.34 H new ATOM 60 N GLU A 391 -6.566 17.541 4.110 1.00 50.30 N ATOM 61 CA GLU A 391 -5.145 17.817 4.250 1.00 51.21 C ATOM 62 C GLU A 391 -4.325 16.743 3.535 1.00 32.30 C ATOM 63 O GLU A 391 -4.880 15.787 2.995 1.00 23.04 O ATOM 64 CB GLU A 391 -4.749 17.919 5.724 1.00 11.51 C ATOM 65 CG GLU A 391 -4.652 16.532 6.363 1.00 70.13 C ATOM 66 CD GLU A 391 -5.014 16.585 7.848 1.00 71.34 C ATOM 67 OE1 GLU A 391 -6.107 16.149 8.236 1.00 44.41 O ATOM 68 OE2 GLU A 391 -4.110 17.104 8.611 1.00 3.42 O ATOM 0 H GLU A 391 -6.964 16.964 4.852 1.00 50.30 H new ATOM 0 HA GLU A 391 -4.933 18.779 3.784 1.00 51.21 H new ATOM 0 HB2 GLU A 391 -3.791 18.432 5.812 1.00 11.51 H new ATOM 0 HB3 GLU A 391 -5.483 18.520 6.261 1.00 11.51 H new ATOM 0 HG2 GLU A 391 -5.320 15.843 5.847 1.00 70.13 H new ATOM 0 HG3 GLU A 391 -3.640 16.144 6.245 1.00 70.13 H new ATOM 74 N GLN A 392 -3.013 16.936 3.552 1.00 12.51 N ATOM 75 CA GLN A 392 -2.109 15.996 2.912 1.00 0.30 C ATOM 76 C GLN A 392 -1.233 15.306 3.959 1.00 2.14 C ATOM 77 O GLN A 392 -0.887 15.904 4.976 1.00 21.22 O ATOM 78 CB GLN A 392 -1.252 16.694 1.853 1.00 4.51 C ATOM 79 CG GLN A 392 -0.586 15.673 0.928 1.00 31.20 C ATOM 80 CD GLN A 392 -1.435 15.433 -0.322 1.00 1.25 C ATOM 81 OE1 GLN A 392 -2.650 15.540 -0.309 1.00 31.11 O ATOM 82 NE2 GLN A 392 -0.729 15.100 -1.399 1.00 64.41 N ATOM 0 H GLN A 392 -2.555 17.730 3.999 1.00 12.51 H new ATOM 0 HA GLN A 392 -2.704 15.235 2.407 1.00 0.30 H new ATOM 0 HB2 GLN A 392 -1.872 17.371 1.266 1.00 4.51 H new ATOM 0 HB3 GLN A 392 -0.489 17.301 2.340 1.00 4.51 H new ATOM 0 HG2 GLN A 392 0.402 16.029 0.638 1.00 31.20 H new ATOM 0 HG3 GLN A 392 -0.442 14.733 1.461 1.00 31.20 H new ATOM 0 HE21 GLN A 392 0.287 15.028 -1.341 1.00 64.41 H new ATOM 0 HE22 GLN A 392 -1.203 14.917 -2.283 1.00 64.41 H new ATOM 89 N LYS A 393 -0.900 14.056 3.673 1.00 64.42 N ATOM 90 CA LYS A 393 -0.071 13.276 4.577 1.00 72.23 C ATOM 91 C LYS A 393 1.118 12.701 3.804 1.00 55.03 C ATOM 92 O LYS A 393 1.047 12.525 2.589 1.00 61.15 O ATOM 93 CB LYS A 393 -0.909 12.216 5.294 1.00 51.43 C ATOM 94 CG LYS A 393 -0.065 11.444 6.310 1.00 54.01 C ATOM 95 CD LYS A 393 0.306 12.329 7.501 1.00 24.03 C ATOM 96 CE LYS A 393 -0.931 12.681 8.328 1.00 13.21 C ATOM 97 NZ LYS A 393 -1.589 11.453 8.826 1.00 4.02 N ATOM 0 H LYS A 393 -1.189 13.564 2.828 1.00 64.42 H new ATOM 0 HA LYS A 393 0.336 13.911 5.363 1.00 72.23 H new ATOM 0 HB2 LYS A 393 -1.748 12.692 5.801 1.00 51.43 H new ATOM 0 HB3 LYS A 393 -1.329 11.524 4.564 1.00 51.43 H new ATOM 0 HG2 LYS A 393 -0.618 10.572 6.659 1.00 54.01 H new ATOM 0 HG3 LYS A 393 0.842 11.076 5.830 1.00 54.01 H new ATOM 0 HD2 LYS A 393 1.033 11.814 8.129 1.00 24.03 H new ATOM 0 HD3 LYS A 393 0.782 13.243 7.145 1.00 24.03 H new ATOM 0 HE2 LYS A 393 -0.646 13.314 9.168 1.00 13.21 H new ATOM 0 HE3 LYS A 393 -1.631 13.255 7.720 1.00 13.21 H new ATOM 0 HZ1 LYS A 393 -2.171 11.683 9.657 1.00 4.02 H new ATOM 0 HZ2 LYS A 393 -2.194 11.056 8.079 1.00 4.02 H new ATOM 0 HZ3 LYS A 393 -0.865 10.755 9.093 1.00 4.02 H new ATOM 106 N PHE A 394 2.184 12.425 4.542 1.00 12.33 N ATOM 107 CA PHE A 394 3.386 11.873 3.940 1.00 22.53 C ATOM 108 C PHE A 394 3.434 10.353 4.106 1.00 0.14 C ATOM 109 O PHE A 394 3.662 9.851 5.205 1.00 33.04 O ATOM 110 CB PHE A 394 4.577 12.490 4.675 1.00 74.04 C ATOM 111 CG PHE A 394 5.863 11.668 4.579 1.00 4.21 C ATOM 112 CD1 PHE A 394 6.107 10.914 3.474 1.00 54.11 C ATOM 113 CD2 PHE A 394 6.762 11.688 5.600 1.00 23.12 C ATOM 114 CE1 PHE A 394 7.301 10.149 3.385 1.00 70.02 C ATOM 115 CE2 PHE A 394 7.955 10.924 5.513 1.00 33.12 C ATOM 116 CZ PHE A 394 8.199 10.171 4.406 1.00 71.31 C ATOM 0 H PHE A 394 2.240 12.573 5.550 1.00 12.33 H new ATOM 0 HA PHE A 394 3.404 12.097 2.873 1.00 22.53 H new ATOM 0 HB2 PHE A 394 4.764 13.485 4.271 1.00 74.04 H new ATOM 0 HB3 PHE A 394 4.316 12.616 5.726 1.00 74.04 H new ATOM 0 HD1 PHE A 394 5.393 10.897 2.664 1.00 54.11 H new ATOM 0 HD2 PHE A 394 6.568 12.286 6.478 1.00 23.12 H new ATOM 0 HE1 PHE A 394 7.495 9.551 2.507 1.00 70.02 H new ATOM 0 HE2 PHE A 394 8.668 10.940 6.324 1.00 33.12 H new ATOM 0 HZ PHE A 394 9.107 9.590 4.338 1.00 71.31 H new ATOM 125 N TYR A 395 3.214 9.661 2.997 1.00 21.32 N ATOM 126 CA TYR A 395 3.229 8.208 3.004 1.00 22.11 C ATOM 127 C TYR A 395 3.952 7.660 1.772 1.00 12.41 C ATOM 128 O TYR A 395 4.139 8.376 0.790 1.00 14.11 O ATOM 129 CB TYR A 395 1.764 7.772 2.959 1.00 0.12 C ATOM 130 CG TYR A 395 1.027 7.920 4.292 1.00 61.55 C ATOM 131 CD1 TYR A 395 1.666 7.598 5.472 1.00 54.32 C ATOM 132 CD2 TYR A 395 -0.275 8.378 4.314 1.00 34.24 C ATOM 133 CE1 TYR A 395 0.973 7.740 6.727 1.00 75.41 C ATOM 134 CE2 TYR A 395 -0.967 8.517 5.567 1.00 55.25 C ATOM 135 CZ TYR A 395 -0.309 8.193 6.712 1.00 23.35 C ATOM 136 OH TYR A 395 -0.964 8.325 7.898 1.00 60.01 O ATOM 0 H TYR A 395 3.024 10.081 2.087 1.00 21.32 H new ATOM 0 HA TYR A 395 3.750 7.834 3.885 1.00 22.11 H new ATOM 0 HB2 TYR A 395 1.244 8.359 2.202 1.00 0.12 H new ATOM 0 HB3 TYR A 395 1.716 6.730 2.643 1.00 0.12 H new ATOM 0 HD1 TYR A 395 2.685 7.240 5.455 1.00 54.32 H new ATOM 0 HD2 TYR A 395 -0.774 8.632 3.390 1.00 34.24 H new ATOM 0 HE1 TYR A 395 1.461 7.492 7.658 1.00 75.41 H new ATOM 0 HE2 TYR A 395 -1.987 8.871 5.598 1.00 55.25 H new ATOM 0 HH TYR A 395 -1.871 8.659 7.735 1.00 60.01 H new ATOM 145 N ASN A 396 4.338 6.397 1.865 1.00 50.41 N ATOM 146 CA ASN A 396 5.035 5.744 0.770 1.00 74.03 C ATOM 147 C ASN A 396 4.144 4.645 0.185 1.00 64.23 C ATOM 148 O ASN A 396 4.210 4.356 -1.008 1.00 52.55 O ATOM 149 CB ASN A 396 6.333 5.095 1.252 1.00 5.35 C ATOM 150 CG ASN A 396 6.349 4.969 2.778 1.00 35.50 C ATOM 151 OD1 ASN A 396 6.159 5.928 3.508 1.00 33.42 O ATOM 152 ND2 ASN A 396 6.586 3.736 3.217 1.00 34.34 N ATOM 0 H ASN A 396 4.181 5.807 2.682 1.00 50.41 H new ATOM 0 HA ASN A 396 5.267 6.500 0.020 1.00 74.03 H new ATOM 0 HB2 ASN A 396 6.440 4.109 0.801 1.00 5.35 H new ATOM 0 HB3 ASN A 396 7.185 5.690 0.924 1.00 5.35 H new ATOM 0 HD21 ASN A 396 6.617 3.549 4.219 1.00 34.34 H new ATOM 0 HD22 ASN A 396 6.737 2.978 2.551 1.00 34.34 H new ATOM 158 N PHE A 397 3.333 4.062 1.055 1.00 64.11 N ATOM 159 CA PHE A 397 2.431 3.002 0.641 1.00 15.33 C ATOM 160 C PHE A 397 1.291 2.826 1.648 1.00 4.15 C ATOM 161 O PHE A 397 1.500 2.946 2.853 1.00 24.42 O ATOM 162 CB PHE A 397 3.251 1.712 0.587 1.00 25.34 C ATOM 163 CG PHE A 397 3.668 1.181 1.960 1.00 24.10 C ATOM 164 CD1 PHE A 397 2.730 0.686 2.812 1.00 33.25 C ATOM 165 CD2 PHE A 397 4.977 1.206 2.330 1.00 43.21 C ATOM 166 CE1 PHE A 397 3.117 0.193 4.086 1.00 60.32 C ATOM 167 CE2 PHE A 397 5.363 0.714 3.605 1.00 13.12 C ATOM 168 CZ PHE A 397 4.426 0.218 4.456 1.00 61.04 C ATOM 0 H PHE A 397 3.282 4.304 2.045 1.00 64.11 H new ATOM 0 HA PHE A 397 1.991 3.245 -0.326 1.00 15.33 H new ATOM 0 HB2 PHE A 397 2.670 0.946 0.074 1.00 25.34 H new ATOM 0 HB3 PHE A 397 4.146 1.887 -0.010 1.00 25.34 H new ATOM 0 HD1 PHE A 397 1.691 0.668 2.519 1.00 33.25 H new ATOM 0 HD2 PHE A 397 5.722 1.600 1.655 1.00 43.21 H new ATOM 0 HE1 PHE A 397 2.372 -0.202 4.761 1.00 60.32 H new ATOM 0 HE2 PHE A 397 6.402 0.734 3.899 1.00 13.12 H new ATOM 0 HZ PHE A 397 4.721 -0.156 5.425 1.00 61.04 H new ATOM 177 N VAL A 398 0.112 2.543 1.115 1.00 4.20 N ATOM 178 CA VAL A 398 -1.059 2.349 1.952 1.00 42.45 C ATOM 179 C VAL A 398 -1.467 0.874 1.920 1.00 60.24 C ATOM 180 O VAL A 398 -2.072 0.415 0.955 1.00 31.53 O ATOM 181 CB VAL A 398 -2.183 3.288 1.507 1.00 73.45 C ATOM 182 CG1 VAL A 398 -2.899 2.738 0.272 1.00 73.14 C ATOM 183 CG2 VAL A 398 -3.172 3.542 2.647 1.00 30.53 C ATOM 0 H VAL A 398 -0.057 2.443 0.114 1.00 4.20 H new ATOM 0 HA VAL A 398 -0.832 2.602 2.988 1.00 42.45 H new ATOM 0 HB VAL A 398 -1.733 4.243 1.237 1.00 73.45 H new ATOM 0 HG11 VAL A 398 -3.693 3.424 -0.024 1.00 73.14 H new ATOM 0 HG12 VAL A 398 -2.186 2.634 -0.546 1.00 73.14 H new ATOM 0 HG13 VAL A 398 -3.329 1.764 0.504 1.00 73.14 H new ATOM 0 HG21 VAL A 398 -3.960 4.212 2.303 1.00 30.53 H new ATOM 0 HG22 VAL A 398 -3.613 2.597 2.964 1.00 30.53 H new ATOM 0 HG23 VAL A 398 -2.649 3.998 3.487 1.00 30.53 H new ATOM 193 N ILE A 399 -1.117 0.175 2.989 1.00 24.22 N ATOM 194 CA ILE A 399 -1.437 -1.239 3.096 1.00 73.01 C ATOM 195 C ILE A 399 -2.946 -1.402 3.288 1.00 25.40 C ATOM 196 O ILE A 399 -3.448 -1.291 4.406 1.00 61.23 O ATOM 197 CB ILE A 399 -0.601 -1.896 4.196 1.00 3.42 C ATOM 198 CG1 ILE A 399 0.862 -2.027 3.769 1.00 25.01 C ATOM 199 CG2 ILE A 399 -1.200 -3.242 4.609 1.00 33.04 C ATOM 200 CD1 ILE A 399 1.734 -2.495 4.936 1.00 20.02 C ATOM 0 H ILE A 399 -0.615 0.561 3.789 1.00 24.22 H new ATOM 0 HA ILE A 399 -1.175 -1.760 2.175 1.00 73.01 H new ATOM 0 HB ILE A 399 -0.623 -1.250 5.074 1.00 3.42 H new ATOM 0 HG12 ILE A 399 0.942 -2.735 2.944 1.00 25.01 H new ATOM 0 HG13 ILE A 399 1.225 -1.067 3.401 1.00 25.01 H new ATOM 0 HG21 ILE A 399 -0.587 -3.688 5.392 1.00 33.04 H new ATOM 0 HG22 ILE A 399 -2.213 -3.090 4.983 1.00 33.04 H new ATOM 0 HG23 ILE A 399 -1.228 -3.908 3.746 1.00 33.04 H new ATOM 0 HD11 ILE A 399 2.769 -2.580 4.605 1.00 20.02 H new ATOM 0 HD12 ILE A 399 1.671 -1.773 5.750 1.00 20.02 H new ATOM 0 HD13 ILE A 399 1.384 -3.466 5.285 1.00 20.02 H new ATOM 211 N LEU A 400 -3.628 -1.663 2.183 1.00 61.54 N ATOM 212 CA LEU A 400 -5.068 -1.843 2.217 1.00 52.30 C ATOM 213 C LEU A 400 -5.391 -3.247 2.731 1.00 35.14 C ATOM 214 O LEU A 400 -5.155 -4.236 2.037 1.00 13.32 O ATOM 215 CB LEU A 400 -5.679 -1.534 0.848 1.00 11.21 C ATOM 216 CG LEU A 400 -5.757 -0.055 0.467 1.00 71.52 C ATOM 217 CD1 LEU A 400 -5.635 0.130 -1.047 1.00 14.44 C ATOM 218 CD2 LEU A 400 -7.030 0.589 1.023 1.00 35.25 C ATOM 0 H LEU A 400 -3.209 -1.754 1.258 1.00 61.54 H new ATOM 0 HA LEU A 400 -5.523 -1.137 2.911 1.00 52.30 H new ATOM 0 HB2 LEU A 400 -5.098 -2.055 0.087 1.00 11.21 H new ATOM 0 HB3 LEU A 400 -6.686 -1.950 0.820 1.00 11.21 H new ATOM 0 HG LEU A 400 -4.911 0.459 0.923 1.00 71.52 H new ATOM 0 HD11 LEU A 400 -5.694 1.191 -1.290 1.00 14.44 H new ATOM 0 HD12 LEU A 400 -4.678 -0.267 -1.386 1.00 14.44 H new ATOM 0 HD13 LEU A 400 -6.446 -0.402 -1.545 1.00 14.44 H new ATOM 0 HD21 LEU A 400 -7.060 1.641 0.738 1.00 35.25 H new ATOM 0 HD22 LEU A 400 -7.903 0.078 0.618 1.00 35.25 H new ATOM 0 HD23 LEU A 400 -7.034 0.508 2.110 1.00 35.25 H new ATOM 229 N HIS A 401 -5.924 -3.291 3.943 1.00 11.42 N ATOM 230 CA HIS A 401 -6.282 -4.558 4.558 1.00 14.34 C ATOM 231 C HIS A 401 -7.657 -4.438 5.217 1.00 44.53 C ATOM 232 O HIS A 401 -8.335 -3.423 5.068 1.00 42.33 O ATOM 233 CB HIS A 401 -5.195 -5.015 5.532 1.00 52.52 C ATOM 234 CG HIS A 401 -5.156 -4.229 6.821 1.00 55.02 C ATOM 235 ND1 HIS A 401 -5.890 -4.585 7.938 1.00 4.31 N ATOM 236 CD2 HIS A 401 -4.463 -3.104 7.159 1.00 61.13 C ATOM 237 CE1 HIS A 401 -5.643 -3.706 8.899 1.00 11.12 C ATOM 238 NE2 HIS A 401 -4.759 -2.788 8.413 1.00 44.41 N ATOM 0 H HIS A 401 -6.117 -2.469 4.516 1.00 11.42 H new ATOM 0 HA HIS A 401 -6.351 -5.331 3.793 1.00 14.34 H new ATOM 0 HB2 HIS A 401 -5.350 -6.068 5.765 1.00 52.52 H new ATOM 0 HB3 HIS A 401 -4.225 -4.937 5.041 1.00 52.52 H new ATOM 0 HD2 HIS A 401 -3.787 -2.562 6.514 1.00 61.13 H new ATOM 0 HE1 HIS A 401 -6.067 -3.715 9.892 1.00 11.12 H new ATOM 0 HE2 HIS A 401 -4.387 -1.990 8.929 1.00 44.41 H new ATOM 246 N ALA A 402 -8.028 -5.488 5.935 1.00 22.31 N ATOM 247 CA ALA A 402 -9.309 -5.515 6.619 1.00 53.43 C ATOM 248 C ALA A 402 -9.192 -4.754 7.942 1.00 13.24 C ATOM 249 O ALA A 402 -8.294 -3.931 8.111 1.00 34.50 O ATOM 250 CB ALA A 402 -9.755 -6.965 6.817 1.00 21.32 C ATOM 0 H ALA A 402 -7.462 -6.328 6.058 1.00 22.31 H new ATOM 0 HA ALA A 402 -10.073 -5.020 6.020 1.00 53.43 H new ATOM 0 HB1 ALA A 402 -10.716 -6.983 7.330 1.00 21.32 H new ATOM 0 HB2 ALA A 402 -9.853 -7.451 5.846 1.00 21.32 H new ATOM 0 HB3 ALA A 402 -9.014 -7.495 7.415 1.00 21.32 H new ATOM 256 N ARG A 403 -10.114 -5.057 8.845 1.00 72.14 N ATOM 257 CA ARG A 403 -10.124 -4.413 10.147 1.00 3.21 C ATOM 258 C ARG A 403 -9.468 -5.317 11.192 1.00 22.24 C ATOM 259 O ARG A 403 -9.053 -4.850 12.250 1.00 44.51 O ATOM 260 CB ARG A 403 -11.553 -4.088 10.589 1.00 33.21 C ATOM 261 CG ARG A 403 -11.553 -3.101 11.759 1.00 23.25 C ATOM 262 CD ARG A 403 -12.621 -3.475 12.789 1.00 11.35 C ATOM 263 NE ARG A 403 -12.478 -2.629 13.995 1.00 24.44 N ATOM 264 CZ ARG A 403 -13.399 -2.553 14.979 1.00 41.11 C ATOM 265 NH1 ARG A 403 -14.539 -3.273 14.908 1.00 41.45 N ATOM 266 NH2 ARG A 403 -13.168 -1.763 16.012 1.00 34.43 N ATOM 0 H ARG A 403 -10.858 -5.739 8.700 1.00 72.14 H new ATOM 0 HA ARG A 403 -9.561 -3.484 10.061 1.00 3.21 H new ATOM 0 HB2 ARG A 403 -12.109 -3.666 9.752 1.00 33.21 H new ATOM 0 HB3 ARG A 403 -12.065 -5.005 10.882 1.00 33.21 H new ATOM 0 HG2 ARG A 403 -10.572 -3.093 12.233 1.00 23.25 H new ATOM 0 HG3 ARG A 403 -11.736 -2.092 11.389 1.00 23.25 H new ATOM 0 HD2 ARG A 403 -13.614 -3.345 12.359 1.00 11.35 H new ATOM 0 HD3 ARG A 403 -12.526 -4.527 13.059 1.00 11.35 H new ATOM 0 HE ARG A 403 -11.631 -2.069 14.088 1.00 24.44 H new ATOM 0 HH11 ARG A 403 -14.710 -3.880 14.106 1.00 41.45 H new ATOM 0 HH12 ARG A 403 -15.230 -3.210 15.656 1.00 41.45 H new ATOM 0 HH21 ARG A 403 -12.304 -1.222 16.057 1.00 34.43 H new ATOM 0 HH22 ARG A 403 -13.853 -1.694 16.764 1.00 34.43 H new ATOM 276 N ALA A 404 -9.396 -6.598 10.859 1.00 35.22 N ATOM 277 CA ALA A 404 -8.797 -7.572 11.755 1.00 5.44 C ATOM 278 C ALA A 404 -7.423 -7.978 11.216 1.00 11.42 C ATOM 279 O ALA A 404 -6.868 -8.996 11.628 1.00 50.34 O ATOM 280 CB ALA A 404 -9.738 -8.768 11.912 1.00 54.44 C ATOM 0 H ALA A 404 -9.743 -6.983 9.981 1.00 35.22 H new ATOM 0 HA ALA A 404 -8.649 -7.142 12.745 1.00 5.44 H new ATOM 0 HB1 ALA A 404 -9.289 -9.499 12.584 1.00 54.44 H new ATOM 0 HB2 ALA A 404 -10.689 -8.431 12.325 1.00 54.44 H new ATOM 0 HB3 ALA A 404 -9.908 -9.227 10.938 1.00 54.44 H new ATOM 286 N ASP A 405 -6.916 -7.162 10.304 1.00 51.24 N ATOM 287 CA ASP A 405 -5.618 -7.424 9.705 1.00 51.32 C ATOM 288 C ASP A 405 -4.686 -6.242 9.983 1.00 12.11 C ATOM 289 O ASP A 405 -3.793 -5.951 9.188 1.00 33.13 O ATOM 290 CB ASP A 405 -5.734 -7.589 8.189 1.00 11.00 C ATOM 291 CG ASP A 405 -5.219 -8.921 7.643 1.00 14.14 C ATOM 292 OD1 ASP A 405 -5.992 -9.872 7.446 1.00 70.54 O ATOM 293 OD2 ASP A 405 -3.951 -8.963 7.414 1.00 62.21 O ATOM 0 H ASP A 405 -7.380 -6.319 9.965 1.00 51.24 H new ATOM 0 HA ASP A 405 -5.226 -8.344 10.138 1.00 51.32 H new ATOM 0 HB2 ASP A 405 -6.781 -7.478 7.905 1.00 11.00 H new ATOM 0 HB3 ASP A 405 -5.185 -6.780 7.707 1.00 11.00 H new ATOM 298 N GLU A 406 -4.927 -5.593 11.112 1.00 72.04 N ATOM 299 CA GLU A 406 -4.120 -4.449 11.503 1.00 60.41 C ATOM 300 C GLU A 406 -2.729 -4.908 11.947 1.00 51.24 C ATOM 301 O GLU A 406 -1.758 -4.760 11.207 1.00 23.44 O ATOM 302 CB GLU A 406 -4.810 -3.642 12.606 1.00 24.40 C ATOM 303 CG GLU A 406 -4.026 -2.369 12.926 1.00 74.41 C ATOM 304 CD GLU A 406 -4.940 -1.297 13.523 1.00 21.43 C ATOM 305 OE1 GLU A 406 -4.571 -0.648 14.513 1.00 62.13 O ATOM 306 OE2 GLU A 406 -6.070 -1.148 12.919 1.00 50.21 O ATOM 0 H GLU A 406 -5.669 -5.837 11.768 1.00 72.04 H new ATOM 0 HA GLU A 406 -4.007 -3.796 10.638 1.00 60.41 H new ATOM 0 HB2 GLU A 406 -5.821 -3.382 12.293 1.00 24.40 H new ATOM 0 HB3 GLU A 406 -4.902 -4.252 13.505 1.00 24.40 H new ATOM 0 HG2 GLU A 406 -3.223 -2.599 13.627 1.00 74.41 H new ATOM 0 HG3 GLU A 406 -3.558 -1.988 12.018 1.00 74.41 H new ATOM 312 N HIS A 407 -2.678 -5.453 13.153 1.00 0.00 N ATOM 313 CA HIS A 407 -1.422 -5.933 13.705 1.00 4.42 C ATOM 314 C HIS A 407 -0.602 -6.606 12.602 1.00 44.34 C ATOM 315 O HIS A 407 0.624 -6.498 12.584 1.00 33.21 O ATOM 316 CB HIS A 407 -1.672 -6.851 14.904 1.00 33.41 C ATOM 317 CG HIS A 407 -2.382 -8.138 14.553 1.00 62.40 C ATOM 318 ND1 HIS A 407 -3.513 -8.178 13.757 1.00 33.31 N ATOM 319 CD2 HIS A 407 -2.108 -9.429 14.898 1.00 62.10 C ATOM 320 CE1 HIS A 407 -3.895 -9.441 13.637 1.00 74.35 C ATOM 321 NE2 HIS A 407 -3.023 -10.214 14.345 1.00 33.11 N ATOM 0 H HIS A 407 -3.486 -5.573 13.764 1.00 0.00 H new ATOM 0 HA HIS A 407 -0.839 -5.092 14.081 1.00 4.42 H new ATOM 0 HB2 HIS A 407 -0.717 -7.090 15.371 1.00 33.41 H new ATOM 0 HB3 HIS A 407 -2.263 -6.312 15.645 1.00 33.41 H new ATOM 0 HD2 HIS A 407 -1.285 -9.756 15.517 1.00 62.10 H new ATOM 0 HE1 HIS A 407 -4.747 -9.796 13.077 1.00 74.35 H new ATOM 0 HE2 HIS A 407 -3.067 -11.229 14.435 1.00 33.11 H new ATOM 328 N ILE A 408 -1.310 -7.284 11.712 1.00 11.53 N ATOM 329 CA ILE A 408 -0.663 -7.974 10.609 1.00 2.13 C ATOM 330 C ILE A 408 0.143 -6.966 9.786 1.00 21.54 C ATOM 331 O ILE A 408 1.335 -7.160 9.557 1.00 70.24 O ATOM 332 CB ILE A 408 -1.692 -8.755 9.789 1.00 24.44 C ATOM 333 CG1 ILE A 408 -2.431 -9.771 10.662 1.00 21.52 C ATOM 334 CG2 ILE A 408 -1.035 -9.414 8.574 1.00 14.53 C ATOM 335 CD1 ILE A 408 -3.428 -10.584 9.833 1.00 44.14 C ATOM 0 H ILE A 408 -2.326 -7.371 11.732 1.00 11.53 H new ATOM 0 HA ILE A 408 0.042 -8.716 10.984 1.00 2.13 H new ATOM 0 HB ILE A 408 -2.436 -8.053 9.413 1.00 24.44 H new ATOM 0 HG12 ILE A 408 -1.712 -10.442 11.133 1.00 21.52 H new ATOM 0 HG13 ILE A 408 -2.957 -9.253 11.464 1.00 21.52 H new ATOM 0 HG21 ILE A 408 -1.787 -9.963 8.007 1.00 14.53 H new ATOM 0 HG22 ILE A 408 -0.591 -8.647 7.940 1.00 14.53 H new ATOM 0 HG23 ILE A 408 -0.259 -10.102 8.909 1.00 14.53 H new ATOM 0 HD11 ILE A 408 -3.940 -11.299 10.478 1.00 44.14 H new ATOM 0 HD12 ILE A 408 -4.159 -9.913 9.383 1.00 44.14 H new ATOM 0 HD13 ILE A 408 -2.896 -11.120 9.047 1.00 44.14 H new ATOM 346 N ALA A 409 -0.540 -5.914 9.364 1.00 12.44 N ATOM 347 CA ALA A 409 0.096 -4.876 8.571 1.00 23.54 C ATOM 348 C ALA A 409 1.157 -4.171 9.420 1.00 1.43 C ATOM 349 O ALA A 409 2.233 -3.842 8.926 1.00 62.35 O ATOM 350 CB ALA A 409 -0.967 -3.910 8.045 1.00 2.51 C ATOM 0 H ALA A 409 -1.529 -5.757 9.556 1.00 12.44 H new ATOM 0 HA ALA A 409 0.599 -5.308 7.706 1.00 23.54 H new ATOM 0 HB1 ALA A 409 -0.489 -3.132 7.450 1.00 2.51 H new ATOM 0 HB2 ALA A 409 -1.679 -4.455 7.425 1.00 2.51 H new ATOM 0 HB3 ALA A 409 -1.492 -3.454 8.885 1.00 2.51 H new ATOM 356 N LEU A 410 0.814 -3.959 10.681 1.00 51.32 N ATOM 357 CA LEU A 410 1.721 -3.299 11.603 1.00 63.23 C ATOM 358 C LEU A 410 3.019 -4.104 11.700 1.00 54.12 C ATOM 359 O LEU A 410 4.080 -3.549 11.978 1.00 60.04 O ATOM 360 CB LEU A 410 1.040 -3.068 12.953 1.00 60.44 C ATOM 361 CG LEU A 410 -0.289 -2.311 12.914 1.00 54.50 C ATOM 362 CD1 LEU A 410 -0.487 -1.480 14.181 1.00 22.11 C ATOM 363 CD2 LEU A 410 -0.398 -1.460 11.648 1.00 33.25 C ATOM 0 H LEU A 410 -0.081 -4.233 11.086 1.00 51.32 H new ATOM 0 HA LEU A 410 1.986 -2.309 11.232 1.00 63.23 H new ATOM 0 HB2 LEU A 410 0.870 -4.037 13.422 1.00 60.44 H new ATOM 0 HB3 LEU A 410 1.729 -2.520 13.596 1.00 60.44 H new ATOM 0 HG LEU A 410 -1.096 -3.043 12.882 1.00 54.50 H new ATOM 0 HD11 LEU A 410 -1.440 -0.953 14.125 1.00 22.11 H new ATOM 0 HD12 LEU A 410 -0.486 -2.137 15.051 1.00 22.11 H new ATOM 0 HD13 LEU A 410 0.323 -0.756 14.272 1.00 22.11 H new ATOM 0 HD21 LEU A 410 -1.352 -0.932 11.645 1.00 33.25 H new ATOM 0 HD22 LEU A 410 0.417 -0.736 11.625 1.00 33.25 H new ATOM 0 HD23 LEU A 410 -0.337 -2.104 10.771 1.00 33.25 H new ATOM 374 N ARG A 411 2.890 -5.401 11.463 1.00 22.42 N ATOM 375 CA ARG A 411 4.040 -6.289 11.519 1.00 23.45 C ATOM 376 C ARG A 411 4.828 -6.219 10.210 1.00 22.32 C ATOM 377 O ARG A 411 5.968 -6.678 10.143 1.00 11.11 O ATOM 378 CB ARG A 411 3.606 -7.736 11.770 1.00 73.52 C ATOM 379 CG ARG A 411 4.749 -8.553 12.375 1.00 25.24 C ATOM 380 CD ARG A 411 4.259 -9.931 12.825 1.00 41.23 C ATOM 381 NE ARG A 411 3.302 -10.475 11.835 1.00 20.20 N ATOM 382 CZ ARG A 411 1.968 -10.286 11.890 1.00 54.24 C ATOM 383 NH1 ARG A 411 1.419 -9.560 12.888 1.00 12.45 N ATOM 384 NH2 ARG A 411 1.206 -10.819 10.953 1.00 53.43 N ATOM 0 H ARG A 411 2.008 -5.858 11.232 1.00 22.42 H new ATOM 0 HA ARG A 411 4.672 -5.963 12.345 1.00 23.45 H new ATOM 0 HB2 ARG A 411 2.748 -7.751 12.442 1.00 73.52 H new ATOM 0 HB3 ARG A 411 3.285 -8.191 10.833 1.00 73.52 H new ATOM 0 HG2 ARG A 411 5.547 -8.668 11.641 1.00 25.24 H new ATOM 0 HG3 ARG A 411 5.173 -8.018 13.225 1.00 25.24 H new ATOM 0 HD2 ARG A 411 5.105 -10.609 12.936 1.00 41.23 H new ATOM 0 HD3 ARG A 411 3.781 -9.855 13.802 1.00 41.23 H new ATOM 0 HE ARG A 411 3.675 -11.027 11.063 1.00 20.20 H new ATOM 0 HH11 ARG A 411 2.014 -9.150 13.607 1.00 12.45 H new ATOM 0 HH12 ARG A 411 0.409 -9.422 12.922 1.00 12.45 H new ATOM 0 HH21 ARG A 411 1.628 -11.365 10.202 1.00 53.43 H new ATOM 0 HH22 ARG A 411 0.195 -10.685 10.980 1.00 53.43 H new ATOM 394 N VAL A 412 4.191 -5.643 9.203 1.00 73.05 N ATOM 395 CA VAL A 412 4.818 -5.507 7.899 1.00 20.51 C ATOM 396 C VAL A 412 5.565 -4.173 7.833 1.00 24.30 C ATOM 397 O VAL A 412 6.749 -4.135 7.501 1.00 24.33 O ATOM 398 CB VAL A 412 3.772 -5.662 6.795 1.00 22.00 C ATOM 399 CG1 VAL A 412 4.231 -4.980 5.504 1.00 43.12 C ATOM 400 CG2 VAL A 412 3.446 -7.135 6.549 1.00 25.01 C ATOM 0 H VAL A 412 3.246 -5.264 9.263 1.00 73.05 H new ATOM 0 HA VAL A 412 5.552 -6.298 7.745 1.00 20.51 H new ATOM 0 HB VAL A 412 2.859 -5.169 7.129 1.00 22.00 H new ATOM 0 HG11 VAL A 412 3.469 -5.105 4.735 1.00 43.12 H new ATOM 0 HG12 VAL A 412 4.388 -3.917 5.690 1.00 43.12 H new ATOM 0 HG13 VAL A 412 5.164 -5.431 5.166 1.00 43.12 H new ATOM 0 HG21 VAL A 412 2.699 -7.215 5.759 1.00 25.01 H new ATOM 0 HG22 VAL A 412 4.351 -7.663 6.248 1.00 25.01 H new ATOM 0 HG23 VAL A 412 3.055 -7.579 7.464 1.00 25.01 H new ATOM 410 N ARG A 413 4.843 -3.111 8.156 1.00 73.21 N ATOM 411 CA ARG A 413 5.422 -1.779 8.138 1.00 41.44 C ATOM 412 C ARG A 413 6.863 -1.818 8.651 1.00 35.13 C ATOM 413 O ARG A 413 7.779 -1.356 7.972 1.00 11.20 O ATOM 414 CB ARG A 413 4.608 -0.812 9.002 1.00 33.11 C ATOM 415 CG ARG A 413 3.107 -0.998 8.766 1.00 33.11 C ATOM 416 CD ARG A 413 2.350 0.310 9.003 1.00 4.50 C ATOM 417 NE ARG A 413 2.953 1.047 10.135 1.00 71.31 N ATOM 418 CZ ARG A 413 2.272 1.890 10.939 1.00 41.42 C ATOM 419 NH1 ARG A 413 0.955 2.112 10.741 1.00 32.03 N ATOM 420 NH2 ARG A 413 2.912 2.496 11.922 1.00 11.40 N ATOM 0 H ARG A 413 3.862 -3.146 8.432 1.00 73.21 H new ATOM 0 HA ARG A 413 5.409 -1.427 7.106 1.00 41.44 H new ATOM 0 HB2 ARG A 413 4.838 -0.977 10.055 1.00 33.11 H new ATOM 0 HB3 ARG A 413 4.892 0.215 8.771 1.00 33.11 H new ATOM 0 HG2 ARG A 413 2.935 -1.342 7.746 1.00 33.11 H new ATOM 0 HG3 ARG A 413 2.723 -1.771 9.432 1.00 33.11 H new ATOM 0 HD2 ARG A 413 2.378 0.924 8.103 1.00 4.50 H new ATOM 0 HD3 ARG A 413 1.301 0.100 9.213 1.00 4.50 H new ATOM 0 HE ARG A 413 3.947 0.909 10.320 1.00 71.31 H new ATOM 0 HH11 ARG A 413 0.467 1.641 9.979 1.00 32.03 H new ATOM 0 HH12 ARG A 413 0.448 2.751 11.353 1.00 32.03 H new ATOM 0 HH21 ARG A 413 3.907 2.324 12.065 1.00 11.40 H new ATOM 0 HH22 ARG A 413 2.411 3.136 12.538 1.00 11.40 H new ATOM 430 N GLU A 414 7.018 -2.376 9.842 1.00 71.24 N ATOM 431 CA GLU A 414 8.332 -2.482 10.453 1.00 61.22 C ATOM 432 C GLU A 414 9.263 -3.312 9.568 1.00 32.04 C ATOM 433 O GLU A 414 10.307 -2.827 9.131 1.00 71.13 O ATOM 434 CB GLU A 414 8.237 -3.079 11.858 1.00 24.24 C ATOM 435 CG GLU A 414 7.090 -2.444 12.648 1.00 13.15 C ATOM 436 CD GLU A 414 7.435 -2.348 14.136 1.00 12.14 C ATOM 437 OE1 GLU A 414 6.786 -1.593 14.875 1.00 25.04 O ATOM 438 OE2 GLU A 414 8.414 -3.095 14.518 1.00 34.14 O ATOM 0 H GLU A 414 6.256 -2.760 10.401 1.00 71.24 H new ATOM 0 HA GLU A 414 8.749 -1.479 10.547 1.00 61.22 H new ATOM 0 HB2 GLU A 414 8.084 -4.156 11.790 1.00 24.24 H new ATOM 0 HB3 GLU A 414 9.177 -2.924 12.387 1.00 24.24 H new ATOM 0 HG2 GLU A 414 6.880 -1.449 12.255 1.00 13.15 H new ATOM 0 HG3 GLU A 414 6.184 -3.036 12.519 1.00 13.15 H new ATOM 444 N LYS A 415 8.854 -4.548 9.328 1.00 25.52 N ATOM 445 CA LYS A 415 9.638 -5.450 8.502 1.00 34.45 C ATOM 446 C LYS A 415 10.227 -4.672 7.323 1.00 44.31 C ATOM 447 O LYS A 415 11.420 -4.779 7.038 1.00 24.03 O ATOM 448 CB LYS A 415 8.801 -6.659 8.084 1.00 31.14 C ATOM 449 CG LYS A 415 9.564 -7.964 8.320 1.00 41.42 C ATOM 450 CD LYS A 415 10.932 -7.931 7.636 1.00 31.03 C ATOM 451 CE LYS A 415 10.786 -7.703 6.131 1.00 14.23 C ATOM 452 NZ LYS A 415 10.134 -8.868 5.491 1.00 11.23 N ATOM 0 H LYS A 415 7.989 -4.947 9.692 1.00 25.52 H new ATOM 0 HA LYS A 415 10.476 -5.854 9.069 1.00 34.45 H new ATOM 0 HB2 LYS A 415 7.868 -6.672 8.648 1.00 31.14 H new ATOM 0 HB3 LYS A 415 8.535 -6.575 7.030 1.00 31.14 H new ATOM 0 HG2 LYS A 415 9.692 -8.126 9.390 1.00 41.42 H new ATOM 0 HG3 LYS A 415 8.983 -8.803 7.938 1.00 41.42 H new ATOM 0 HD2 LYS A 415 11.541 -7.138 8.070 1.00 31.03 H new ATOM 0 HD3 LYS A 415 11.456 -8.870 7.816 1.00 31.03 H new ATOM 0 HE2 LYS A 415 10.197 -6.804 5.949 1.00 14.23 H new ATOM 0 HE3 LYS A 415 11.767 -7.538 5.685 1.00 14.23 H new ATOM 0 HZ1 LYS A 415 10.325 -8.855 4.469 1.00 11.23 H new ATOM 0 HZ2 LYS A 415 10.511 -9.746 5.902 1.00 11.23 H new ATOM 0 HZ3 LYS A 415 9.107 -8.823 5.652 1.00 11.23 H new ATOM 461 N LEU A 416 9.365 -3.909 6.669 1.00 51.42 N ATOM 462 CA LEU A 416 9.785 -3.114 5.527 1.00 44.32 C ATOM 463 C LEU A 416 11.069 -2.361 5.881 1.00 73.10 C ATOM 464 O LEU A 416 12.103 -2.561 5.248 1.00 74.33 O ATOM 465 CB LEU A 416 8.646 -2.204 5.060 1.00 45.31 C ATOM 466 CG LEU A 416 7.381 -2.912 4.570 1.00 75.33 C ATOM 467 CD1 LEU A 416 6.239 -1.914 4.370 1.00 4.31 C ATOM 468 CD2 LEU A 416 7.663 -3.722 3.302 1.00 42.03 C ATOM 0 H LEU A 416 8.377 -3.824 6.908 1.00 51.42 H new ATOM 0 HA LEU A 416 10.016 -3.757 4.678 1.00 44.32 H new ATOM 0 HB2 LEU A 416 8.373 -1.544 5.884 1.00 45.31 H new ATOM 0 HB3 LEU A 416 9.020 -1.571 4.255 1.00 45.31 H new ATOM 0 HG LEU A 416 7.063 -3.617 5.338 1.00 75.33 H new ATOM 0 HD11 LEU A 416 5.351 -2.442 4.022 1.00 4.31 H new ATOM 0 HD12 LEU A 416 6.019 -1.419 5.316 1.00 4.31 H new ATOM 0 HD13 LEU A 416 6.532 -1.169 3.630 1.00 4.31 H new ATOM 0 HD21 LEU A 416 6.748 -4.215 2.974 1.00 42.03 H new ATOM 0 HD22 LEU A 416 8.017 -3.055 2.516 1.00 42.03 H new ATOM 0 HD23 LEU A 416 8.425 -4.473 3.512 1.00 42.03 H new ATOM 479 N GLU A 417 10.959 -1.510 6.891 1.00 52.40 N ATOM 480 CA GLU A 417 12.098 -0.725 7.336 1.00 43.22 C ATOM 481 C GLU A 417 13.376 -1.564 7.276 1.00 21.35 C ATOM 482 O GLU A 417 14.464 -1.031 7.069 1.00 74.52 O ATOM 483 CB GLU A 417 11.868 -0.176 8.745 1.00 61.22 C ATOM 484 CG GLU A 417 10.709 0.822 8.762 1.00 0.43 C ATOM 485 CD GLU A 417 10.240 1.093 10.194 1.00 15.02 C ATOM 486 OE1 GLU A 417 9.029 1.093 10.460 1.00 51.11 O ATOM 487 OE2 GLU A 417 11.184 1.308 11.045 1.00 61.20 O ATOM 0 H GLU A 417 10.098 -1.347 7.414 1.00 52.40 H new ATOM 0 HA GLU A 417 12.213 0.126 6.665 1.00 43.22 H new ATOM 0 HB2 GLU A 417 11.655 -0.998 9.429 1.00 61.22 H new ATOM 0 HB3 GLU A 417 12.776 0.310 9.103 1.00 61.22 H new ATOM 0 HG2 GLU A 417 11.022 1.756 8.295 1.00 0.43 H new ATOM 0 HG3 GLU A 417 9.880 0.432 8.171 1.00 0.43 H new ATOM 493 N ALA A 418 13.201 -2.864 7.461 1.00 1.05 N ATOM 494 CA ALA A 418 14.327 -3.782 7.431 1.00 61.01 C ATOM 495 C ALA A 418 14.940 -3.786 6.029 1.00 11.20 C ATOM 496 O ALA A 418 16.137 -3.560 5.869 1.00 65.13 O ATOM 497 CB ALA A 418 13.864 -5.174 7.867 1.00 23.12 C ATOM 0 H ALA A 418 12.297 -3.304 7.632 1.00 1.05 H new ATOM 0 HA ALA A 418 15.100 -3.462 8.129 1.00 61.01 H new ATOM 0 HB1 ALA A 418 14.709 -5.862 7.844 1.00 23.12 H new ATOM 0 HB2 ALA A 418 13.464 -5.124 8.880 1.00 23.12 H new ATOM 0 HB3 ALA A 418 13.089 -5.529 7.188 1.00 23.12 H new ATOM 503 N LEU A 419 14.088 -4.046 5.047 1.00 64.23 N ATOM 504 CA LEU A 419 14.531 -4.081 3.663 1.00 2.53 C ATOM 505 C LEU A 419 14.919 -2.671 3.219 1.00 74.24 C ATOM 506 O LEU A 419 15.963 -2.476 2.598 1.00 50.31 O ATOM 507 CB LEU A 419 13.466 -4.733 2.778 1.00 33.51 C ATOM 508 CG LEU A 419 12.834 -6.017 3.322 1.00 31.40 C ATOM 509 CD1 LEU A 419 11.338 -6.064 3.012 1.00 22.31 C ATOM 510 CD2 LEU A 419 13.568 -7.253 2.797 1.00 22.11 C ATOM 0 H LEU A 419 13.095 -4.234 5.182 1.00 64.23 H new ATOM 0 HA LEU A 419 15.421 -4.702 3.564 1.00 2.53 H new ATOM 0 HB2 LEU A 419 12.672 -4.007 2.604 1.00 33.51 H new ATOM 0 HB3 LEU A 419 13.913 -4.954 1.809 1.00 33.51 H new ATOM 0 HG LEU A 419 12.938 -6.017 4.407 1.00 31.40 H new ATOM 0 HD11 LEU A 419 10.913 -6.986 3.409 1.00 22.31 H new ATOM 0 HD12 LEU A 419 10.844 -5.209 3.473 1.00 22.31 H new ATOM 0 HD13 LEU A 419 11.189 -6.031 1.933 1.00 22.31 H new ATOM 0 HD21 LEU A 419 13.100 -8.152 3.198 1.00 22.11 H new ATOM 0 HD22 LEU A 419 13.516 -7.272 1.708 1.00 22.11 H new ATOM 0 HD23 LEU A 419 14.611 -7.217 3.110 1.00 22.11 H new ATOM 521 N GLY A 420 14.058 -1.721 3.556 1.00 50.03 N ATOM 522 CA GLY A 420 14.298 -0.333 3.200 1.00 51.12 C ATOM 523 C GLY A 420 13.056 0.522 3.456 1.00 51.24 C ATOM 524 O GLY A 420 13.043 1.346 4.369 1.00 55.23 O ATOM 0 H GLY A 420 13.194 -1.886 4.072 1.00 50.03 H new ATOM 0 HA2 GLY A 420 15.136 0.055 3.779 1.00 51.12 H new ATOM 0 HA3 GLY A 420 14.579 -0.267 2.149 1.00 51.12 H new ATOM 528 N VAL A 421 12.043 0.296 2.635 1.00 14.42 N ATOM 529 CA VAL A 421 10.797 1.034 2.760 1.00 64.50 C ATOM 530 C VAL A 421 10.460 1.210 4.242 1.00 13.34 C ATOM 531 O VAL A 421 10.694 0.309 5.046 1.00 43.33 O ATOM 532 CB VAL A 421 9.689 0.331 1.975 1.00 34.45 C ATOM 533 CG1 VAL A 421 9.818 -1.190 2.088 1.00 2.11 C ATOM 534 CG2 VAL A 421 8.308 0.801 2.434 1.00 2.32 C ATOM 0 H VAL A 421 12.059 -0.389 1.879 1.00 14.42 H new ATOM 0 HA VAL A 421 10.899 2.030 2.329 1.00 64.50 H new ATOM 0 HB VAL A 421 9.800 0.599 0.924 1.00 34.45 H new ATOM 0 HG11 VAL A 421 9.018 -1.666 1.521 1.00 2.11 H new ATOM 0 HG12 VAL A 421 10.782 -1.504 1.689 1.00 2.11 H new ATOM 0 HG13 VAL A 421 9.745 -1.485 3.135 1.00 2.11 H new ATOM 0 HG21 VAL A 421 7.539 0.285 1.859 1.00 2.32 H new ATOM 0 HG22 VAL A 421 8.181 0.577 3.493 1.00 2.32 H new ATOM 0 HG23 VAL A 421 8.219 1.876 2.277 1.00 2.32 H new ATOM 544 N PRO A 422 9.902 2.406 4.567 1.00 63.20 N ATOM 545 CA PRO A 422 9.531 2.710 5.939 1.00 54.42 C ATOM 546 C PRO A 422 8.254 1.967 6.340 1.00 31.20 C ATOM 547 O PRO A 422 7.861 1.004 5.684 1.00 32.43 O ATOM 548 CB PRO A 422 9.374 4.222 5.978 1.00 63.32 C ATOM 549 CG PRO A 422 9.207 4.662 4.533 1.00 75.21 C ATOM 550 CD PRO A 422 9.610 3.497 3.642 1.00 14.51 C ATOM 0 HA PRO A 422 10.280 2.381 6.660 1.00 54.42 H new ATOM 0 HB2 PRO A 422 8.509 4.509 6.576 1.00 63.32 H new ATOM 0 HB3 PRO A 422 10.246 4.693 6.431 1.00 63.32 H new ATOM 0 HG2 PRO A 422 8.174 4.952 4.339 1.00 75.21 H new ATOM 0 HG3 PRO A 422 9.827 5.534 4.325 1.00 75.21 H new ATOM 0 HD2 PRO A 422 8.808 3.229 2.954 1.00 14.51 H new ATOM 0 HD3 PRO A 422 10.481 3.745 3.035 1.00 14.51 H new ATOM 555 N ASP A 423 7.644 2.443 7.415 1.00 34.13 N ATOM 556 CA ASP A 423 6.420 1.836 7.911 1.00 32.33 C ATOM 557 C ASP A 423 5.286 2.103 6.919 1.00 5.24 C ATOM 558 O ASP A 423 4.291 1.379 6.901 1.00 51.25 O ATOM 559 CB ASP A 423 6.019 2.430 9.262 1.00 51.21 C ATOM 560 CG ASP A 423 6.316 3.922 9.425 1.00 42.23 C ATOM 561 OD1 ASP A 423 7.278 4.310 10.106 1.00 42.43 O ATOM 562 OD2 ASP A 423 5.502 4.711 8.810 1.00 23.21 O ATOM 0 H ASP A 423 7.974 3.242 7.957 1.00 34.13 H new ATOM 0 HA ASP A 423 6.596 0.767 8.027 1.00 32.33 H new ATOM 0 HB2 ASP A 423 4.951 2.269 9.410 1.00 51.21 H new ATOM 0 HB3 ASP A 423 6.536 1.883 10.050 1.00 51.21 H new ATOM 567 N GLY A 424 5.472 3.144 6.122 1.00 72.31 N ATOM 568 CA GLY A 424 4.477 3.516 5.131 1.00 31.24 C ATOM 569 C GLY A 424 3.141 3.856 5.796 1.00 62.31 C ATOM 570 O GLY A 424 2.931 4.987 6.231 1.00 1.43 O ATOM 0 H GLY A 424 6.298 3.742 6.142 1.00 72.31 H new ATOM 0 HA2 GLY A 424 4.831 4.374 4.559 1.00 31.24 H new ATOM 0 HA3 GLY A 424 4.338 2.697 4.425 1.00 31.24 H new ATOM 574 N ALA A 425 2.275 2.855 5.855 1.00 23.02 N ATOM 575 CA ALA A 425 0.965 3.033 6.461 1.00 70.53 C ATOM 576 C ALA A 425 0.051 1.886 6.031 1.00 41.32 C ATOM 577 O ALA A 425 0.474 0.984 5.309 1.00 72.22 O ATOM 578 CB ALA A 425 0.406 4.403 6.071 1.00 14.03 C ATOM 0 H ALA A 425 2.454 1.918 5.494 1.00 23.02 H new ATOM 0 HA ALA A 425 1.036 3.007 7.548 1.00 70.53 H new ATOM 0 HB1 ALA A 425 -0.576 4.538 6.525 1.00 14.03 H new ATOM 0 HB2 ALA A 425 1.079 5.184 6.424 1.00 14.03 H new ATOM 0 HB3 ALA A 425 0.316 4.464 4.986 1.00 14.03 H new ATOM 584 N THR A 426 -1.190 1.955 6.494 1.00 74.31 N ATOM 585 CA THR A 426 -2.169 0.934 6.167 1.00 1.12 C ATOM 586 C THR A 426 -3.583 1.516 6.214 1.00 63.20 C ATOM 587 O THR A 426 -3.883 2.360 7.057 1.00 70.21 O ATOM 588 CB THR A 426 -1.963 -0.243 7.124 1.00 1.30 C ATOM 589 OG1 THR A 426 -2.714 0.117 8.281 1.00 63.14 O ATOM 590 CG2 THR A 426 -0.523 -0.340 7.630 1.00 61.34 C ATOM 0 H THR A 426 -1.539 2.703 7.093 1.00 74.31 H new ATOM 0 HA THR A 426 -2.036 0.570 5.148 1.00 1.12 H new ATOM 0 HB THR A 426 -2.235 -1.172 6.622 1.00 1.30 H new ATOM 0 HG1 THR A 426 -2.638 -0.591 8.954 1.00 63.14 H new ATOM 0 HG21 THR A 426 -0.431 -1.191 8.305 1.00 61.34 H new ATOM 0 HG22 THR A 426 0.152 -0.473 6.784 1.00 61.34 H new ATOM 0 HG23 THR A 426 -0.262 0.575 8.162 1.00 61.34 H new ATOM 598 N PHE A 427 -4.417 1.040 5.300 1.00 22.21 N ATOM 599 CA PHE A 427 -5.791 1.503 5.228 1.00 14.33 C ATOM 600 C PHE A 427 -6.771 0.355 5.485 1.00 74.51 C ATOM 601 O PHE A 427 -6.872 -0.571 4.682 1.00 62.21 O ATOM 602 CB PHE A 427 -6.010 2.035 3.810 1.00 73.44 C ATOM 603 CG PHE A 427 -5.772 3.540 3.667 1.00 11.10 C ATOM 604 CD1 PHE A 427 -5.018 4.199 4.585 1.00 65.22 C ATOM 605 CD2 PHE A 427 -6.316 4.218 2.621 1.00 71.11 C ATOM 606 CE1 PHE A 427 -4.797 5.597 4.453 1.00 24.30 C ATOM 607 CE2 PHE A 427 -6.096 5.614 2.489 1.00 72.10 C ATOM 608 CZ PHE A 427 -5.341 6.274 3.407 1.00 64.42 C ATOM 0 H PHE A 427 -4.166 0.338 4.603 1.00 22.21 H new ATOM 0 HA PHE A 427 -5.965 2.270 5.983 1.00 14.33 H new ATOM 0 HB2 PHE A 427 -5.345 1.506 3.128 1.00 73.44 H new ATOM 0 HB3 PHE A 427 -7.030 1.808 3.501 1.00 73.44 H new ATOM 0 HD1 PHE A 427 -4.586 3.660 5.416 1.00 65.22 H new ATOM 0 HD2 PHE A 427 -6.915 3.694 1.891 1.00 71.11 H new ATOM 0 HE1 PHE A 427 -4.198 6.121 5.183 1.00 24.30 H new ATOM 0 HE2 PHE A 427 -6.529 6.152 1.659 1.00 72.10 H new ATOM 0 HZ PHE A 427 -5.173 7.336 3.305 1.00 64.42 H new ATOM 617 N CYS A 428 -7.466 0.454 6.608 1.00 23.01 N ATOM 618 CA CYS A 428 -8.433 -0.564 6.981 1.00 64.02 C ATOM 619 C CYS A 428 -9.759 -0.245 6.286 1.00 61.21 C ATOM 620 O CYS A 428 -10.347 0.809 6.520 1.00 5.23 O ATOM 621 CB CYS A 428 -8.593 -0.662 8.499 1.00 74.22 C ATOM 622 SG CYS A 428 -6.960 -0.914 9.286 1.00 25.22 S ATOM 0 H CYS A 428 -7.379 1.223 7.272 1.00 23.01 H new ATOM 0 HA CYS A 428 -8.080 -1.542 6.655 1.00 64.02 H new ATOM 0 HB2 CYS A 428 -9.055 0.247 8.884 1.00 74.22 H new ATOM 0 HB3 CYS A 428 -9.258 -1.488 8.750 1.00 74.22 H new ATOM 0 HG CYS A 428 -6.132 -1.414 8.417 1.00 25.22 H new ATOM 627 N GLU A 429 -10.189 -1.174 5.447 1.00 15.11 N ATOM 628 CA GLU A 429 -11.434 -1.006 4.717 1.00 41.11 C ATOM 629 C GLU A 429 -12.580 -0.706 5.685 1.00 55.03 C ATOM 630 O GLU A 429 -12.674 -1.315 6.749 1.00 43.32 O ATOM 631 CB GLU A 429 -11.743 -2.239 3.867 1.00 51.01 C ATOM 632 CG GLU A 429 -13.141 -2.147 3.253 1.00 43.21 C ATOM 633 CD GLU A 429 -13.177 -1.115 2.123 1.00 4.25 C ATOM 634 OE1 GLU A 429 -12.154 -0.885 1.461 1.00 33.22 O ATOM 635 OE2 GLU A 429 -14.319 -0.544 1.942 1.00 51.40 O ATOM 0 H GLU A 429 -9.697 -2.047 5.256 1.00 15.11 H new ATOM 0 HA GLU A 429 -11.324 -0.158 4.041 1.00 41.11 H new ATOM 0 HB2 GLU A 429 -11.000 -2.334 3.075 1.00 51.01 H new ATOM 0 HB3 GLU A 429 -11.671 -3.136 4.482 1.00 51.01 H new ATOM 0 HG2 GLU A 429 -13.438 -3.123 2.869 1.00 43.21 H new ATOM 0 HG3 GLU A 429 -13.863 -1.874 4.023 1.00 43.21 H new ATOM 641 N ASP A 430 -13.422 0.232 5.281 1.00 42.42 N ATOM 642 CA ASP A 430 -14.559 0.621 6.099 1.00 13.22 C ATOM 643 C ASP A 430 -15.852 0.368 5.322 1.00 10.33 C ATOM 644 O ASP A 430 -15.828 0.219 4.101 1.00 52.33 O ATOM 645 CB ASP A 430 -14.503 2.110 6.450 1.00 63.33 C ATOM 646 CG ASP A 430 -13.546 2.470 7.589 1.00 31.40 C ATOM 647 OD1 ASP A 430 -13.844 2.238 8.769 1.00 24.43 O ATOM 648 OD2 ASP A 430 -12.439 3.019 7.218 1.00 2.44 O ATOM 0 H ASP A 430 -13.340 0.735 4.397 1.00 42.42 H new ATOM 0 HA ASP A 430 -14.530 0.033 7.016 1.00 13.22 H new ATOM 0 HB2 ASP A 430 -14.210 2.667 5.560 1.00 63.33 H new ATOM 0 HB3 ASP A 430 -15.506 2.443 6.719 1.00 63.33 H new ATOM 653 N PHE A 431 -16.951 0.326 6.061 1.00 21.55 N ATOM 654 CA PHE A 431 -18.251 0.092 5.456 1.00 41.03 C ATOM 655 C PHE A 431 -18.966 1.413 5.168 1.00 55.05 C ATOM 656 O PHE A 431 -20.107 1.611 5.584 1.00 40.31 O ATOM 657 CB PHE A 431 -19.076 -0.710 6.466 1.00 12.11 C ATOM 658 CG PHE A 431 -18.268 -1.754 7.240 1.00 42.32 C ATOM 659 CD1 PHE A 431 -17.404 -2.571 6.580 1.00 2.03 C ATOM 660 CD2 PHE A 431 -18.414 -1.864 8.587 1.00 15.25 C ATOM 661 CE1 PHE A 431 -16.654 -3.539 7.299 1.00 1.34 C ATOM 662 CE2 PHE A 431 -17.666 -2.832 9.305 1.00 64.54 C ATOM 663 CZ PHE A 431 -16.801 -3.650 8.646 1.00 4.21 C ATOM 0 H PHE A 431 -16.968 0.450 7.073 1.00 21.55 H new ATOM 0 HA PHE A 431 -18.132 -0.440 4.512 1.00 41.03 H new ATOM 0 HB2 PHE A 431 -19.533 -0.020 7.175 1.00 12.11 H new ATOM 0 HB3 PHE A 431 -19.888 -1.211 5.940 1.00 12.11 H new ATOM 0 HD1 PHE A 431 -17.288 -2.484 5.510 1.00 2.03 H new ATOM 0 HD2 PHE A 431 -19.100 -1.214 9.111 1.00 15.25 H new ATOM 0 HE1 PHE A 431 -15.967 -4.187 6.776 1.00 1.34 H new ATOM 0 HE2 PHE A 431 -17.783 -2.920 10.375 1.00 64.54 H new ATOM 0 HZ PHE A 431 -16.232 -4.387 9.193 1.00 4.21 H new ATOM 672 N GLN A 432 -18.267 2.285 4.455 1.00 60.43 N ATOM 673 CA GLN A 432 -18.820 3.582 4.105 1.00 70.04 C ATOM 674 C GLN A 432 -19.101 4.398 5.369 1.00 4.52 C ATOM 675 O GLN A 432 -20.049 5.179 5.409 1.00 72.25 O ATOM 676 CB GLN A 432 -20.085 3.428 3.261 1.00 55.04 C ATOM 677 CG GLN A 432 -19.743 2.979 1.838 1.00 72.25 C ATOM 678 CD GLN A 432 -19.676 4.177 0.888 1.00 33.42 C ATOM 679 OE1 GLN A 432 -20.656 4.575 0.280 1.00 73.53 O ATOM 680 NE2 GLN A 432 -18.468 4.725 0.792 1.00 31.24 N ATOM 0 H GLN A 432 -17.322 2.118 4.110 1.00 60.43 H new ATOM 0 HA GLN A 432 -18.085 4.119 3.505 1.00 70.04 H new ATOM 0 HB2 GLN A 432 -20.750 2.700 3.726 1.00 55.04 H new ATOM 0 HB3 GLN A 432 -20.622 4.376 3.228 1.00 55.04 H new ATOM 0 HG2 GLN A 432 -18.787 2.456 1.838 1.00 72.25 H new ATOM 0 HG3 GLN A 432 -20.494 2.272 1.485 1.00 72.25 H new ATOM 0 HE21 GLN A 432 -17.690 4.342 1.329 1.00 31.24 H new ATOM 0 HE22 GLN A 432 -18.319 5.528 0.181 1.00 31.24 H new ATOM 687 N VAL A 433 -18.261 4.186 6.371 1.00 70.54 N ATOM 688 CA VAL A 433 -18.406 4.893 7.632 1.00 42.03 C ATOM 689 C VAL A 433 -18.406 6.400 7.371 1.00 13.12 C ATOM 690 O VAL A 433 -18.436 6.834 6.220 1.00 43.24 O ATOM 691 CB VAL A 433 -17.310 4.455 8.608 1.00 14.42 C ATOM 692 CG1 VAL A 433 -17.334 2.938 8.814 1.00 75.33 C ATOM 693 CG2 VAL A 433 -15.934 4.922 8.131 1.00 51.10 C ATOM 0 H VAL A 433 -17.477 3.534 6.335 1.00 70.54 H new ATOM 0 HA VAL A 433 -19.358 4.645 8.101 1.00 42.03 H new ATOM 0 HB VAL A 433 -17.509 4.927 9.570 1.00 14.42 H new ATOM 0 HG11 VAL A 433 -16.546 2.653 9.511 1.00 75.33 H new ATOM 0 HG12 VAL A 433 -18.302 2.641 9.219 1.00 75.33 H new ATOM 0 HG13 VAL A 433 -17.171 2.439 7.859 1.00 75.33 H new ATOM 0 HG21 VAL A 433 -15.173 4.598 8.841 1.00 51.10 H new ATOM 0 HG22 VAL A 433 -15.723 4.492 7.152 1.00 51.10 H new ATOM 0 HG23 VAL A 433 -15.924 6.010 8.059 1.00 51.10 H new ATOM 703 N HIS A 434 -18.372 7.157 8.459 1.00 13.12 N ATOM 704 CA HIS A 434 -18.368 8.606 8.361 1.00 1.11 C ATOM 705 C HIS A 434 -17.425 9.043 7.239 1.00 32.14 C ATOM 706 O HIS A 434 -17.806 9.829 6.373 1.00 31.21 O ATOM 707 CB HIS A 434 -18.018 9.241 9.710 1.00 31.42 C ATOM 708 CG HIS A 434 -17.083 8.409 10.554 1.00 63.21 C ATOM 709 ND1 HIS A 434 -15.707 8.434 10.397 1.00 1.42 N ATOM 710 CD2 HIS A 434 -17.339 7.531 11.566 1.00 22.35 C ATOM 711 CE1 HIS A 434 -15.171 7.602 11.279 1.00 71.24 C ATOM 712 NE2 HIS A 434 -16.183 7.043 12.002 1.00 33.25 N ATOM 0 H HIS A 434 -18.347 6.794 9.412 1.00 13.12 H new ATOM 0 HA HIS A 434 -19.367 8.959 8.106 1.00 1.11 H new ATOM 0 HB2 HIS A 434 -17.563 10.216 9.534 1.00 31.42 H new ATOM 0 HB3 HIS A 434 -18.938 9.415 10.268 1.00 31.42 H new ATOM 0 HD2 HIS A 434 -18.316 7.276 11.948 1.00 22.35 H new ATOM 0 HE1 HIS A 434 -14.117 7.402 11.403 1.00 71.24 H new ATOM 0 HE2 HIS A 434 -16.071 6.363 12.754 1.00 33.25 H new ATOM 719 N GLY A 435 -16.211 8.515 7.289 1.00 24.34 N ATOM 720 CA GLY A 435 -15.210 8.838 6.287 1.00 44.11 C ATOM 721 C GLY A 435 -14.315 9.987 6.758 1.00 41.40 C ATOM 722 O GLY A 435 -13.263 10.240 6.173 1.00 23.21 O ATOM 0 H GLY A 435 -15.898 7.864 8.009 1.00 24.34 H new ATOM 0 HA2 GLY A 435 -14.600 7.959 6.080 1.00 44.11 H new ATOM 0 HA3 GLY A 435 -15.700 9.113 5.353 1.00 44.11 H new ATOM 726 N ARG A 436 -14.768 10.653 7.810 1.00 64.25 N ATOM 727 CA ARG A 436 -14.022 11.770 8.367 1.00 31.33 C ATOM 728 C ARG A 436 -13.528 11.430 9.774 1.00 31.33 C ATOM 729 O ARG A 436 -13.901 12.090 10.742 1.00 1.11 O ATOM 730 CB ARG A 436 -14.883 13.032 8.427 1.00 70.11 C ATOM 731 CG ARG A 436 -15.392 13.417 7.035 1.00 21.33 C ATOM 732 CD ARG A 436 -16.554 12.517 6.610 1.00 64.01 C ATOM 733 NE ARG A 436 -17.407 13.223 5.627 1.00 24.50 N ATOM 734 CZ ARG A 436 -18.713 12.953 5.426 1.00 22.15 C ATOM 735 NH1 ARG A 436 -19.331 11.988 6.141 1.00 14.01 N ATOM 736 NH2 ARG A 436 -19.380 13.645 4.522 1.00 60.35 N ATOM 0 H ARG A 436 -15.642 10.441 8.292 1.00 64.25 H new ATOM 0 HA ARG A 436 -13.169 11.957 7.715 1.00 31.33 H new ATOM 0 HB2 ARG A 436 -15.729 12.868 9.095 1.00 70.11 H new ATOM 0 HB3 ARG A 436 -14.301 13.854 8.845 1.00 70.11 H new ATOM 0 HG2 ARG A 436 -15.715 14.458 7.037 1.00 21.33 H new ATOM 0 HG3 ARG A 436 -14.581 13.336 6.312 1.00 21.33 H new ATOM 0 HD2 ARG A 436 -16.170 11.594 6.175 1.00 64.01 H new ATOM 0 HD3 ARG A 436 -17.145 12.236 7.482 1.00 64.01 H new ATOM 0 HE ARG A 436 -16.980 13.960 5.066 1.00 24.50 H new ATOM 0 HH11 ARG A 436 -18.810 11.457 6.839 1.00 14.01 H new ATOM 0 HH12 ARG A 436 -20.319 11.790 5.983 1.00 14.01 H new ATOM 0 HH21 ARG A 436 -18.907 14.373 3.986 1.00 60.35 H new ATOM 0 HH22 ARG A 436 -20.368 13.452 4.359 1.00 60.35 H new ATOM 746 N GLY A 437 -12.696 10.401 9.842 1.00 44.25 N ATOM 747 CA GLY A 437 -12.148 9.966 11.115 1.00 61.53 C ATOM 748 C GLY A 437 -10.998 8.977 10.909 1.00 34.40 C ATOM 749 O GLY A 437 -9.972 9.062 11.583 1.00 71.31 O ATOM 0 H GLY A 437 -12.388 9.856 9.036 1.00 44.25 H new ATOM 0 HA2 GLY A 437 -11.793 10.830 11.676 1.00 61.53 H new ATOM 0 HA3 GLY A 437 -12.932 9.499 11.711 1.00 61.53 H new ATOM 753 N GLU A 438 -11.207 8.064 9.973 1.00 35.33 N ATOM 754 CA GLU A 438 -10.200 7.060 9.667 1.00 52.33 C ATOM 755 C GLU A 438 -9.171 7.624 8.686 1.00 24.24 C ATOM 756 O GLU A 438 -8.035 7.908 9.065 1.00 22.24 O ATOM 757 CB GLU A 438 -10.844 5.788 9.117 1.00 15.05 C ATOM 758 CG GLU A 438 -12.084 5.406 9.926 1.00 10.34 C ATOM 759 CD GLU A 438 -11.747 5.259 11.411 1.00 60.45 C ATOM 760 OE1 GLU A 438 -11.596 6.270 12.115 1.00 1.54 O ATOM 761 OE2 GLU A 438 -11.642 4.044 11.830 1.00 71.53 O ATOM 0 H GLU A 438 -12.059 7.997 9.416 1.00 35.33 H new ATOM 0 HA GLU A 438 -9.685 6.795 10.591 1.00 52.33 H new ATOM 0 HB2 GLU A 438 -11.119 5.938 8.073 1.00 15.05 H new ATOM 0 HB3 GLU A 438 -10.123 4.971 9.143 1.00 15.05 H new ATOM 0 HG2 GLU A 438 -12.854 6.166 9.798 1.00 10.34 H new ATOM 0 HG3 GLU A 438 -12.495 4.470 9.548 1.00 10.34 H new ATOM 767 N LEU A 439 -9.603 7.767 7.442 1.00 53.33 N ATOM 768 CA LEU A 439 -8.732 8.291 6.403 1.00 14.51 C ATOM 769 C LEU A 439 -9.556 9.148 5.439 1.00 15.20 C ATOM 770 O LEU A 439 -10.739 9.389 5.672 1.00 40.13 O ATOM 771 CB LEU A 439 -7.970 7.154 5.719 1.00 54.51 C ATOM 772 CG LEU A 439 -8.786 6.277 4.768 1.00 5.22 C ATOM 773 CD1 LEU A 439 -8.813 6.873 3.359 1.00 50.01 C ATOM 774 CD2 LEU A 439 -8.269 4.836 4.771 1.00 52.15 C ATOM 0 H LEU A 439 -10.544 7.529 7.130 1.00 53.33 H new ATOM 0 HA LEU A 439 -7.969 8.939 6.835 1.00 14.51 H new ATOM 0 HB2 LEU A 439 -7.139 7.585 5.161 1.00 54.51 H new ATOM 0 HB3 LEU A 439 -7.540 6.516 6.491 1.00 54.51 H new ATOM 0 HG LEU A 439 -9.815 6.251 5.126 1.00 5.22 H new ATOM 0 HD11 LEU A 439 -9.400 6.230 2.703 1.00 50.01 H new ATOM 0 HD12 LEU A 439 -9.263 7.865 3.392 1.00 50.01 H new ATOM 0 HD13 LEU A 439 -7.795 6.949 2.977 1.00 50.01 H new ATOM 0 HD21 LEU A 439 -8.866 4.234 4.087 1.00 52.15 H new ATOM 0 HD22 LEU A 439 -7.227 4.823 4.451 1.00 52.15 H new ATOM 0 HD23 LEU A 439 -8.345 4.424 5.777 1.00 52.15 H new ATOM 785 N SER A 440 -8.898 9.582 4.373 1.00 70.23 N ATOM 786 CA SER A 440 -9.552 10.406 3.372 1.00 51.10 C ATOM 787 C SER A 440 -10.150 9.521 2.276 1.00 23.53 C ATOM 788 O SER A 440 -11.368 9.467 2.112 1.00 53.03 O ATOM 789 CB SER A 440 -8.578 11.417 2.766 1.00 32.43 C ATOM 790 OG SER A 440 -8.194 12.417 3.705 1.00 50.54 O ATOM 0 H SER A 440 -7.917 9.378 4.182 1.00 70.23 H new ATOM 0 HA SER A 440 -10.353 10.963 3.858 1.00 51.10 H new ATOM 0 HB2 SER A 440 -7.690 10.896 2.408 1.00 32.43 H new ATOM 0 HB3 SER A 440 -9.040 11.891 1.900 1.00 32.43 H new ATOM 0 HG SER A 440 -7.466 12.955 3.330 1.00 50.54 H new ATOM 795 N CYS A 441 -9.265 8.850 1.554 1.00 64.52 N ATOM 796 CA CYS A 441 -9.689 7.970 0.478 1.00 52.41 C ATOM 797 C CYS A 441 -8.492 7.115 0.058 1.00 63.32 C ATOM 798 O CYS A 441 -7.347 7.551 0.156 1.00 22.30 O ATOM 799 CB CYS A 441 -10.270 8.756 -0.698 1.00 33.53 C ATOM 800 SG CYS A 441 -11.381 7.681 -1.680 1.00 72.25 S ATOM 0 H CYS A 441 -8.256 8.898 1.693 1.00 64.52 H new ATOM 0 HA CYS A 441 -10.492 7.322 0.829 1.00 52.41 H new ATOM 0 HB2 CYS A 441 -10.820 9.623 -0.331 1.00 33.53 H new ATOM 0 HB3 CYS A 441 -9.464 9.133 -1.328 1.00 33.53 H new ATOM 0 HG CYS A 441 -11.872 8.358 -2.675 1.00 72.25 H new ATOM 805 N LEU A 442 -8.799 5.911 -0.403 1.00 32.53 N ATOM 806 CA LEU A 442 -7.763 4.991 -0.840 1.00 31.15 C ATOM 807 C LEU A 442 -6.879 5.679 -1.881 1.00 12.30 C ATOM 808 O LEU A 442 -5.657 5.705 -1.745 1.00 21.01 O ATOM 809 CB LEU A 442 -8.383 3.680 -1.330 1.00 44.04 C ATOM 810 CG LEU A 442 -7.614 2.944 -2.429 1.00 71.30 C ATOM 811 CD1 LEU A 442 -7.843 1.434 -2.341 1.00 14.11 C ATOM 812 CD2 LEU A 442 -7.966 3.498 -3.811 1.00 45.32 C ATOM 0 H LEU A 442 -9.750 5.552 -0.483 1.00 32.53 H new ATOM 0 HA LEU A 442 -7.118 4.720 -0.004 1.00 31.15 H new ATOM 0 HB2 LEU A 442 -8.489 3.010 -0.477 1.00 44.04 H new ATOM 0 HB3 LEU A 442 -9.388 3.891 -1.696 1.00 44.04 H new ATOM 0 HG LEU A 442 -6.549 3.118 -2.275 1.00 71.30 H new ATOM 0 HD11 LEU A 442 -7.285 0.935 -3.133 1.00 14.11 H new ATOM 0 HD12 LEU A 442 -7.501 1.070 -1.372 1.00 14.11 H new ATOM 0 HD13 LEU A 442 -8.906 1.220 -2.455 1.00 14.11 H new ATOM 0 HD21 LEU A 442 -7.405 2.957 -4.573 1.00 45.32 H new ATOM 0 HD22 LEU A 442 -9.034 3.376 -3.991 1.00 45.32 H new ATOM 0 HD23 LEU A 442 -7.710 4.557 -3.855 1.00 45.32 H new ATOM 823 N GLN A 443 -7.532 6.222 -2.897 1.00 54.13 N ATOM 824 CA GLN A 443 -6.820 6.910 -3.962 1.00 50.43 C ATOM 825 C GLN A 443 -6.108 8.147 -3.411 1.00 41.55 C ATOM 826 O GLN A 443 -5.286 8.752 -4.097 1.00 52.33 O ATOM 827 CB GLN A 443 -7.768 7.287 -5.101 1.00 55.33 C ATOM 828 CG GLN A 443 -8.917 8.162 -4.594 1.00 23.20 C ATOM 829 CD GLN A 443 -9.479 9.036 -5.716 1.00 35.12 C ATOM 830 OE1 GLN A 443 -9.687 10.228 -5.566 1.00 32.42 O ATOM 831 NE2 GLN A 443 -9.712 8.377 -6.849 1.00 52.21 N ATOM 0 H GLN A 443 -8.546 6.200 -3.006 1.00 54.13 H new ATOM 0 HA GLN A 443 -6.069 6.232 -4.367 1.00 50.43 H new ATOM 0 HB2 GLN A 443 -7.217 7.819 -5.876 1.00 55.33 H new ATOM 0 HB3 GLN A 443 -8.170 6.383 -5.558 1.00 55.33 H new ATOM 0 HG2 GLN A 443 -9.708 7.531 -4.190 1.00 23.20 H new ATOM 0 HG3 GLN A 443 -8.565 8.794 -3.778 1.00 23.20 H new ATOM 0 HE21 GLN A 443 -9.515 7.378 -6.908 1.00 52.21 H new ATOM 0 HE22 GLN A 443 -10.087 8.871 -7.659 1.00 52.21 H new ATOM 838 N ASP A 444 -6.449 8.487 -2.177 1.00 43.53 N ATOM 839 CA ASP A 444 -5.853 9.640 -1.525 1.00 75.45 C ATOM 840 C ASP A 444 -4.427 9.296 -1.094 1.00 71.40 C ATOM 841 O ASP A 444 -3.710 10.148 -0.570 1.00 30.34 O ATOM 842 CB ASP A 444 -6.642 10.036 -0.276 1.00 71.53 C ATOM 843 CG ASP A 444 -6.709 11.540 -0.002 1.00 74.43 C ATOM 844 OD1 ASP A 444 -5.725 12.154 0.439 1.00 23.14 O ATOM 845 OD2 ASP A 444 -7.845 12.092 -0.264 1.00 23.21 O ATOM 0 H ASP A 444 -7.132 7.983 -1.611 1.00 43.53 H new ATOM 0 HA ASP A 444 -5.860 10.468 -2.233 1.00 75.45 H new ATOM 0 HB2 ASP A 444 -7.658 9.654 -0.371 1.00 71.53 H new ATOM 0 HB3 ASP A 444 -6.196 9.544 0.588 1.00 71.53 H new ATOM 850 N ALA A 445 -4.056 8.047 -1.330 1.00 12.35 N ATOM 851 CA ALA A 445 -2.727 7.578 -0.973 1.00 34.20 C ATOM 852 C ALA A 445 -1.857 7.521 -2.231 1.00 42.13 C ATOM 853 O ALA A 445 -0.708 7.961 -2.214 1.00 21.22 O ATOM 854 CB ALA A 445 -2.833 6.221 -0.275 1.00 0.33 C ATOM 0 H ALA A 445 -4.653 7.344 -1.765 1.00 12.35 H new ATOM 0 HA ALA A 445 -2.252 8.266 -0.274 1.00 34.20 H new ATOM 0 HB1 ALA A 445 -1.836 5.870 -0.008 1.00 0.33 H new ATOM 0 HB2 ALA A 445 -3.436 6.322 0.627 1.00 0.33 H new ATOM 0 HB3 ALA A 445 -3.303 5.502 -0.946 1.00 0.33 H new ATOM 860 N ILE A 446 -2.437 6.975 -3.289 1.00 72.34 N ATOM 861 CA ILE A 446 -1.729 6.855 -4.552 1.00 53.24 C ATOM 862 C ILE A 446 -1.240 8.236 -4.991 1.00 53.22 C ATOM 863 O ILE A 446 -0.342 8.344 -5.825 1.00 64.33 O ATOM 864 CB ILE A 446 -2.604 6.152 -5.592 1.00 30.24 C ATOM 865 CG1 ILE A 446 -1.773 5.199 -6.453 1.00 11.34 C ATOM 866 CG2 ILE A 446 -3.372 7.169 -6.440 1.00 71.40 C ATOM 867 CD1 ILE A 446 -2.660 4.135 -7.104 1.00 21.42 C ATOM 0 H ILE A 446 -3.390 6.611 -3.298 1.00 72.34 H new ATOM 0 HA ILE A 446 -0.846 6.227 -4.436 1.00 53.24 H new ATOM 0 HB ILE A 446 -3.343 5.548 -5.065 1.00 30.24 H new ATOM 0 HG12 ILE A 446 -1.249 5.763 -7.225 1.00 11.34 H new ATOM 0 HG13 ILE A 446 -1.012 4.717 -5.839 1.00 11.34 H new ATOM 0 HG21 ILE A 446 -3.986 6.643 -7.171 1.00 71.40 H new ATOM 0 HG22 ILE A 446 -4.012 7.771 -5.795 1.00 71.40 H new ATOM 0 HG23 ILE A 446 -2.666 7.818 -6.959 1.00 71.40 H new ATOM 0 HD11 ILE A 446 -2.045 3.470 -7.711 1.00 21.42 H new ATOM 0 HD12 ILE A 446 -3.163 3.557 -6.329 1.00 21.42 H new ATOM 0 HD13 ILE A 446 -3.404 4.619 -7.737 1.00 21.42 H new ATOM 878 N ASP A 447 -1.854 9.258 -4.412 1.00 3.14 N ATOM 879 CA ASP A 447 -1.492 10.628 -4.735 1.00 62.11 C ATOM 880 C ASP A 447 -0.265 11.032 -3.914 1.00 53.53 C ATOM 881 O ASP A 447 0.634 11.696 -4.425 1.00 71.45 O ATOM 882 CB ASP A 447 -2.629 11.593 -4.392 1.00 3.11 C ATOM 883 CG ASP A 447 -2.662 12.062 -2.936 1.00 63.40 C ATOM 884 OD1 ASP A 447 -1.696 12.655 -2.434 1.00 62.32 O ATOM 885 OD2 ASP A 447 -3.752 11.793 -2.302 1.00 44.33 O ATOM 0 H ASP A 447 -2.599 9.165 -3.722 1.00 3.14 H new ATOM 0 HA ASP A 447 -1.285 10.680 -5.804 1.00 62.11 H new ATOM 0 HB2 ASP A 447 -2.550 12.467 -5.038 1.00 3.11 H new ATOM 0 HB3 ASP A 447 -3.578 11.110 -4.624 1.00 3.11 H new ATOM 890 N HIS A 448 -0.269 10.616 -2.657 1.00 52.30 N ATOM 891 CA HIS A 448 0.832 10.928 -1.761 1.00 11.21 C ATOM 892 C HIS A 448 1.409 9.633 -1.189 1.00 1.14 C ATOM 893 O HIS A 448 1.597 9.514 0.021 1.00 22.25 O ATOM 894 CB HIS A 448 0.387 11.911 -0.676 1.00 61.11 C ATOM 895 CG HIS A 448 -0.722 11.391 0.207 1.00 23.13 C ATOM 896 ND1 HIS A 448 -1.621 12.223 0.849 1.00 72.14 N ATOM 897 CD2 HIS A 448 -1.068 10.115 0.545 1.00 20.10 C ATOM 898 CE1 HIS A 448 -2.466 11.472 1.542 1.00 74.24 C ATOM 899 NE2 HIS A 448 -2.121 10.166 1.352 1.00 2.33 N ATOM 0 H HIS A 448 -1.018 10.065 -2.237 1.00 52.30 H new ATOM 0 HA HIS A 448 1.628 11.426 -2.315 1.00 11.21 H new ATOM 0 HB2 HIS A 448 1.246 12.162 -0.053 1.00 61.11 H new ATOM 0 HB3 HIS A 448 0.057 12.835 -1.151 1.00 61.11 H new ATOM 0 HD2 HIS A 448 -0.570 9.216 0.213 1.00 20.10 H new ATOM 0 HE1 HIS A 448 -3.283 11.831 2.150 1.00 74.24 H new ATOM 0 HE2 HIS A 448 -2.594 9.361 1.762 1.00 2.33 H new ATOM 906 N SER A 449 1.674 8.693 -2.085 1.00 21.45 N ATOM 907 CA SER A 449 2.225 7.410 -1.684 1.00 70.21 C ATOM 908 C SER A 449 2.931 6.750 -2.870 1.00 14.14 C ATOM 909 O SER A 449 2.320 6.530 -3.916 1.00 73.44 O ATOM 910 CB SER A 449 1.135 6.488 -1.135 1.00 23.11 C ATOM 911 OG SER A 449 1.673 5.453 -0.316 1.00 44.34 O ATOM 0 H SER A 449 1.517 8.795 -3.088 1.00 21.45 H new ATOM 0 HA SER A 449 2.950 7.584 -0.888 1.00 70.21 H new ATOM 0 HB2 SER A 449 0.422 7.075 -0.556 1.00 23.11 H new ATOM 0 HB3 SER A 449 0.584 6.044 -1.964 1.00 23.11 H new ATOM 0 HG SER A 449 1.185 5.421 0.533 1.00 44.34 H new ATOM 916 N ALA A 450 4.205 6.451 -2.669 1.00 24.44 N ATOM 917 CA ALA A 450 4.999 5.820 -3.709 1.00 63.42 C ATOM 918 C ALA A 450 4.152 4.764 -4.422 1.00 21.42 C ATOM 919 O ALA A 450 3.642 5.007 -5.515 1.00 63.11 O ATOM 920 CB ALA A 450 6.270 5.230 -3.093 1.00 20.15 C ATOM 0 H ALA A 450 4.708 6.634 -1.801 1.00 24.44 H new ATOM 0 HA ALA A 450 5.307 6.553 -4.455 1.00 63.42 H new ATOM 0 HB1 ALA A 450 6.866 4.756 -3.873 1.00 20.15 H new ATOM 0 HB2 ALA A 450 6.850 6.025 -2.625 1.00 20.15 H new ATOM 0 HB3 ALA A 450 6.000 4.488 -2.342 1.00 20.15 H new ATOM 926 N PHE A 451 4.029 3.614 -3.776 1.00 62.21 N ATOM 927 CA PHE A 451 3.252 2.520 -4.335 1.00 43.13 C ATOM 928 C PHE A 451 2.222 2.008 -3.326 1.00 11.01 C ATOM 929 O PHE A 451 2.573 1.653 -2.202 1.00 45.44 O ATOM 930 CB PHE A 451 4.236 1.394 -4.658 1.00 54.22 C ATOM 931 CG PHE A 451 5.514 1.864 -5.355 1.00 70.54 C ATOM 932 CD1 PHE A 451 6.426 2.608 -4.671 1.00 12.22 C ATOM 933 CD2 PHE A 451 5.739 1.539 -6.656 1.00 64.53 C ATOM 934 CE1 PHE A 451 7.613 3.043 -5.317 1.00 55.25 C ATOM 935 CE2 PHE A 451 6.926 1.976 -7.301 1.00 22.40 C ATOM 936 CZ PHE A 451 7.838 2.719 -6.619 1.00 51.23 C ATOM 0 H PHE A 451 4.454 3.416 -2.870 1.00 62.21 H new ATOM 0 HA PHE A 451 2.715 2.858 -5.221 1.00 43.13 H new ATOM 0 HB2 PHE A 451 4.506 0.885 -3.733 1.00 54.22 H new ATOM 0 HB3 PHE A 451 3.737 0.661 -5.292 1.00 54.22 H new ATOM 0 HD1 PHE A 451 6.247 2.867 -3.638 1.00 12.22 H new ATOM 0 HD2 PHE A 451 5.015 0.949 -7.198 1.00 64.53 H new ATOM 0 HE1 PHE A 451 8.338 3.632 -4.774 1.00 55.25 H new ATOM 0 HE2 PHE A 451 7.105 1.718 -8.334 1.00 22.40 H new ATOM 0 HZ PHE A 451 8.740 3.052 -7.111 1.00 51.23 H new ATOM 945 N ILE A 452 0.972 1.987 -3.765 1.00 60.11 N ATOM 946 CA ILE A 452 -0.112 1.525 -2.915 1.00 21.21 C ATOM 947 C ILE A 452 -0.013 0.006 -2.751 1.00 74.41 C ATOM 948 O ILE A 452 0.103 -0.722 -3.736 1.00 0.51 O ATOM 949 CB ILE A 452 -1.461 1.998 -3.460 1.00 71.53 C ATOM 950 CG1 ILE A 452 -1.492 3.521 -3.599 1.00 62.34 C ATOM 951 CG2 ILE A 452 -2.614 1.477 -2.601 1.00 64.51 C ATOM 952 CD1 ILE A 452 -1.662 4.192 -2.233 1.00 64.43 C ATOM 0 H ILE A 452 0.686 2.283 -4.698 1.00 60.11 H new ATOM 0 HA ILE A 452 -0.027 1.961 -1.919 1.00 21.21 H new ATOM 0 HB ILE A 452 -1.591 1.581 -4.458 1.00 71.53 H new ATOM 0 HG12 ILE A 452 -0.569 3.866 -4.066 1.00 62.34 H new ATOM 0 HG13 ILE A 452 -2.311 3.813 -4.257 1.00 62.34 H new ATOM 0 HG21 ILE A 452 -3.561 1.828 -3.011 1.00 64.51 H new ATOM 0 HG22 ILE A 452 -2.602 0.387 -2.598 1.00 64.51 H new ATOM 0 HG23 ILE A 452 -2.502 1.844 -1.581 1.00 64.51 H new ATOM 0 HD11 ILE A 452 -1.681 5.275 -2.359 1.00 64.43 H new ATOM 0 HD12 ILE A 452 -2.597 3.863 -1.780 1.00 64.43 H new ATOM 0 HD13 ILE A 452 -0.829 3.917 -1.586 1.00 64.43 H new ATOM 963 N ILE A 453 -0.063 -0.427 -1.500 1.00 64.25 N ATOM 964 CA ILE A 453 0.019 -1.844 -1.194 1.00 21.45 C ATOM 965 C ILE A 453 -1.385 -2.384 -0.917 1.00 75.01 C ATOM 966 O ILE A 453 -2.194 -1.718 -0.274 1.00 70.10 O ATOM 967 CB ILE A 453 1.008 -2.090 -0.053 1.00 25.32 C ATOM 968 CG1 ILE A 453 2.452 -2.040 -0.558 1.00 71.03 C ATOM 969 CG2 ILE A 453 0.699 -3.405 0.667 1.00 52.23 C ATOM 970 CD1 ILE A 453 3.421 -1.724 0.583 1.00 63.10 C ATOM 0 H ILE A 453 -0.159 0.180 -0.686 1.00 64.25 H new ATOM 0 HA ILE A 453 0.410 -2.396 -2.049 1.00 21.45 H new ATOM 0 HB ILE A 453 0.893 -1.288 0.676 1.00 25.32 H new ATOM 0 HG12 ILE A 453 2.716 -2.996 -1.010 1.00 71.03 H new ATOM 0 HG13 ILE A 453 2.543 -1.283 -1.337 1.00 71.03 H new ATOM 0 HG21 ILE A 453 1.417 -3.556 1.473 1.00 52.23 H new ATOM 0 HG22 ILE A 453 -0.309 -3.365 1.081 1.00 52.23 H new ATOM 0 HG23 ILE A 453 0.769 -4.232 -0.040 1.00 52.23 H new ATOM 0 HD11 ILE A 453 4.440 -1.694 0.197 1.00 63.10 H new ATOM 0 HD12 ILE A 453 3.169 -0.756 1.017 1.00 63.10 H new ATOM 0 HD13 ILE A 453 3.345 -2.496 1.349 1.00 63.10 H new ATOM 981 N LEU A 454 -1.631 -3.586 -1.418 1.00 10.23 N ATOM 982 CA LEU A 454 -2.925 -4.223 -1.233 1.00 70.43 C ATOM 983 C LEU A 454 -2.741 -5.514 -0.433 1.00 12.23 C ATOM 984 O LEU A 454 -2.278 -6.520 -0.968 1.00 13.51 O ATOM 985 CB LEU A 454 -3.619 -4.427 -2.582 1.00 63.41 C ATOM 986 CG LEU A 454 -3.505 -3.271 -3.577 1.00 64.02 C ATOM 987 CD1 LEU A 454 -4.305 -3.561 -4.847 1.00 35.34 C ATOM 988 CD2 LEU A 454 -3.918 -1.948 -2.929 1.00 62.25 C ATOM 0 H LEU A 454 -0.957 -4.135 -1.951 1.00 10.23 H new ATOM 0 HA LEU A 454 -3.589 -3.581 -0.654 1.00 70.43 H new ATOM 0 HB2 LEU A 454 -3.208 -5.323 -3.048 1.00 63.41 H new ATOM 0 HB3 LEU A 454 -4.676 -4.619 -2.399 1.00 63.41 H new ATOM 0 HG LEU A 454 -2.460 -3.174 -3.870 1.00 64.02 H new ATOM 0 HD11 LEU A 454 -4.207 -2.724 -5.538 1.00 35.34 H new ATOM 0 HD12 LEU A 454 -3.924 -4.467 -5.318 1.00 35.34 H new ATOM 0 HD13 LEU A 454 -5.356 -3.700 -4.592 1.00 35.34 H new ATOM 0 HD21 LEU A 454 -3.828 -1.142 -3.658 1.00 62.25 H new ATOM 0 HD22 LEU A 454 -4.951 -2.016 -2.589 1.00 62.25 H new ATOM 0 HD23 LEU A 454 -3.269 -1.742 -2.078 1.00 62.25 H new ATOM 999 N LEU A 455 -3.116 -5.444 0.836 1.00 11.13 N ATOM 1000 CA LEU A 455 -3.000 -6.595 1.716 1.00 12.04 C ATOM 1001 C LEU A 455 -4.020 -7.656 1.297 1.00 45.31 C ATOM 1002 O LEU A 455 -5.157 -7.648 1.766 1.00 74.13 O ATOM 1003 CB LEU A 455 -3.123 -6.167 3.179 1.00 43.10 C ATOM 1004 CG LEU A 455 -2.387 -7.040 4.198 1.00 72.04 C ATOM 1005 CD1 LEU A 455 -0.974 -7.373 3.716 1.00 31.31 C ATOM 1006 CD2 LEU A 455 -2.381 -6.383 5.579 1.00 45.02 C ATOM 0 H LEU A 455 -3.501 -4.608 1.276 1.00 11.13 H new ATOM 0 HA LEU A 455 -2.012 -7.047 1.624 1.00 12.04 H new ATOM 0 HB2 LEU A 455 -2.753 -5.146 3.270 1.00 43.10 H new ATOM 0 HB3 LEU A 455 -4.180 -6.148 3.443 1.00 43.10 H new ATOM 0 HG LEU A 455 -2.926 -7.983 4.292 1.00 72.04 H new ATOM 0 HD11 LEU A 455 -0.473 -7.994 4.459 1.00 31.31 H new ATOM 0 HD12 LEU A 455 -1.030 -7.912 2.770 1.00 31.31 H new ATOM 0 HD13 LEU A 455 -0.411 -6.450 3.575 1.00 31.31 H new ATOM 0 HD21 LEU A 455 -1.852 -7.024 6.284 1.00 45.02 H new ATOM 0 HD22 LEU A 455 -1.880 -5.417 5.520 1.00 45.02 H new ATOM 0 HD23 LEU A 455 -3.407 -6.240 5.918 1.00 45.02 H new ATOM 1017 N LEU A 456 -3.576 -8.546 0.421 1.00 53.51 N ATOM 1018 CA LEU A 456 -4.437 -9.610 -0.065 1.00 53.22 C ATOM 1019 C LEU A 456 -4.624 -10.653 1.039 1.00 1.34 C ATOM 1020 O LEU A 456 -3.804 -11.559 1.188 1.00 53.52 O ATOM 1021 CB LEU A 456 -3.888 -10.189 -1.370 1.00 14.12 C ATOM 1022 CG LEU A 456 -3.500 -9.171 -2.444 1.00 61.11 C ATOM 1023 CD1 LEU A 456 -3.483 -9.816 -3.831 1.00 11.35 C ATOM 1024 CD2 LEU A 456 -4.414 -7.945 -2.394 1.00 41.05 C ATOM 0 H LEU A 456 -2.632 -8.552 0.036 1.00 53.51 H new ATOM 0 HA LEU A 456 -5.426 -9.220 -0.307 1.00 53.22 H new ATOM 0 HB2 LEU A 456 -3.011 -10.793 -1.136 1.00 14.12 H new ATOM 0 HB3 LEU A 456 -4.636 -10.862 -1.789 1.00 14.12 H new ATOM 0 HG LEU A 456 -2.487 -8.826 -2.237 1.00 61.11 H new ATOM 0 HD11 LEU A 456 -3.204 -9.070 -4.576 1.00 11.35 H new ATOM 0 HD12 LEU A 456 -2.759 -10.631 -3.845 1.00 11.35 H new ATOM 0 HD13 LEU A 456 -4.474 -10.207 -4.063 1.00 11.35 H new ATOM 0 HD21 LEU A 456 -4.116 -7.237 -3.168 1.00 41.05 H new ATOM 0 HD22 LEU A 456 -5.446 -8.253 -2.562 1.00 41.05 H new ATOM 0 HD23 LEU A 456 -4.332 -7.470 -1.417 1.00 41.05 H new ATOM 1035 N THR A 457 -5.707 -10.492 1.784 1.00 50.40 N ATOM 1036 CA THR A 457 -6.013 -11.408 2.870 1.00 62.13 C ATOM 1037 C THR A 457 -7.483 -11.825 2.818 1.00 1.30 C ATOM 1038 O THR A 457 -8.326 -11.082 2.319 1.00 41.25 O ATOM 1039 CB THR A 457 -5.618 -10.730 4.184 1.00 1.32 C ATOM 1040 OG1 THR A 457 -6.650 -9.772 4.403 1.00 42.42 O ATOM 1041 CG2 THR A 457 -4.349 -9.889 4.051 1.00 74.42 C ATOM 0 H THR A 457 -6.384 -9.740 1.657 1.00 50.40 H new ATOM 0 HA THR A 457 -5.443 -12.333 2.781 1.00 62.13 H new ATOM 0 HB THR A 457 -5.470 -11.488 4.954 1.00 1.32 H new ATOM 0 HG1 THR A 457 -6.709 -9.568 5.360 1.00 42.42 H new ATOM 0 HG21 THR A 457 -4.114 -9.431 5.012 1.00 74.42 H new ATOM 0 HG22 THR A 457 -3.521 -10.526 3.741 1.00 74.42 H new ATOM 0 HG23 THR A 457 -4.506 -9.109 3.306 1.00 74.42 H new ATOM 1049 N SER A 458 -7.746 -13.014 3.342 1.00 52.20 N ATOM 1050 CA SER A 458 -9.101 -13.539 3.361 1.00 73.41 C ATOM 1051 C SER A 458 -10.007 -12.619 4.182 1.00 45.41 C ATOM 1052 O SER A 458 -11.231 -12.723 4.112 1.00 74.50 O ATOM 1053 CB SER A 458 -9.133 -14.960 3.928 1.00 63.25 C ATOM 1054 OG SER A 458 -10.464 -15.433 4.111 1.00 10.24 O ATOM 0 H SER A 458 -7.044 -13.628 3.756 1.00 52.20 H new ATOM 0 HA SER A 458 -9.467 -13.578 2.335 1.00 73.41 H new ATOM 0 HB2 SER A 458 -8.600 -15.631 3.255 1.00 63.25 H new ATOM 0 HB3 SER A 458 -8.607 -14.981 4.882 1.00 63.25 H new ATOM 0 HG SER A 458 -11.078 -14.671 4.163 1.00 10.24 H new ATOM 1059 N ASN A 459 -9.372 -11.742 4.944 1.00 52.35 N ATOM 1060 CA ASN A 459 -10.105 -10.805 5.777 1.00 51.41 C ATOM 1061 C ASN A 459 -10.372 -9.524 4.985 1.00 73.51 C ATOM 1062 O ASN A 459 -11.248 -8.738 5.343 1.00 55.40 O ATOM 1063 CB ASN A 459 -9.300 -10.429 7.023 1.00 3.53 C ATOM 1064 CG ASN A 459 -9.411 -11.516 8.095 1.00 4.53 C ATOM 1065 OD1 ASN A 459 -10.183 -12.455 7.986 1.00 5.42 O ATOM 1066 ND2 ASN A 459 -8.601 -11.337 9.134 1.00 73.42 N ATOM 0 H ASN A 459 -8.357 -11.660 5.002 1.00 52.35 H new ATOM 0 HA ASN A 459 -11.037 -11.282 6.079 1.00 51.41 H new ATOM 0 HB2 ASN A 459 -8.254 -10.283 6.754 1.00 3.53 H new ATOM 0 HB3 ASN A 459 -9.662 -9.481 7.422 1.00 3.53 H new ATOM 0 HD21 ASN A 459 -8.601 -12.008 9.902 1.00 73.42 H new ATOM 0 HD22 ASN A 459 -7.979 -10.529 9.163 1.00 73.42 H new ATOM 1072 N PHE A 460 -9.599 -9.351 3.921 1.00 25.02 N ATOM 1073 CA PHE A 460 -9.740 -8.179 3.075 1.00 33.11 C ATOM 1074 C PHE A 460 -10.227 -8.569 1.676 1.00 64.45 C ATOM 1075 O PHE A 460 -10.320 -9.752 1.355 1.00 15.11 O ATOM 1076 CB PHE A 460 -8.355 -7.539 2.961 1.00 34.15 C ATOM 1077 CG PHE A 460 -8.327 -6.262 2.118 1.00 1.34 C ATOM 1078 CD1 PHE A 460 -8.888 -5.120 2.595 1.00 41.05 C ATOM 1079 CD2 PHE A 460 -7.742 -6.272 0.890 1.00 24.41 C ATOM 1080 CE1 PHE A 460 -8.862 -3.936 1.813 1.00 54.33 C ATOM 1081 CE2 PHE A 460 -7.715 -5.087 0.108 1.00 32.12 C ATOM 1082 CZ PHE A 460 -8.276 -3.943 0.586 1.00 32.43 C ATOM 0 H PHE A 460 -8.873 -10.004 3.627 1.00 25.02 H new ATOM 0 HA PHE A 460 -10.469 -7.494 3.507 1.00 33.11 H new ATOM 0 HB2 PHE A 460 -7.989 -7.310 3.962 1.00 34.15 H new ATOM 0 HB3 PHE A 460 -7.666 -8.264 2.527 1.00 34.15 H new ATOM 0 HD1 PHE A 460 -9.354 -5.113 3.569 1.00 41.05 H new ATOM 0 HD2 PHE A 460 -7.298 -7.180 0.510 1.00 24.41 H new ATOM 0 HE1 PHE A 460 -9.308 -3.029 2.193 1.00 54.33 H new ATOM 0 HE2 PHE A 460 -7.249 -5.094 -0.866 1.00 32.12 H new ATOM 0 HZ PHE A 460 -8.256 -3.042 -0.009 1.00 32.43 H new ATOM 1091 N ASP A 461 -10.523 -7.550 0.883 1.00 65.32 N ATOM 1092 CA ASP A 461 -10.996 -7.769 -0.473 1.00 4.34 C ATOM 1093 C ASP A 461 -10.115 -6.988 -1.449 1.00 21.52 C ATOM 1094 O ASP A 461 -9.858 -5.802 -1.247 1.00 1.41 O ATOM 1095 CB ASP A 461 -12.437 -7.280 -0.640 1.00 20.51 C ATOM 1096 CG ASP A 461 -13.168 -7.829 -1.865 1.00 32.34 C ATOM 1097 OD1 ASP A 461 -14.032 -7.158 -2.447 1.00 53.34 O ATOM 1098 OD2 ASP A 461 -12.813 -9.017 -2.225 1.00 54.35 O ATOM 0 H ASP A 461 -10.444 -6.570 1.154 1.00 65.32 H new ATOM 0 HA ASP A 461 -10.953 -8.839 -0.676 1.00 4.34 H new ATOM 0 HB2 ASP A 461 -13.002 -7.550 0.252 1.00 20.51 H new ATOM 0 HB3 ASP A 461 -12.431 -6.191 -0.697 1.00 20.51 H new ATOM 1103 N CYS A 462 -9.675 -7.685 -2.486 1.00 14.03 N ATOM 1104 CA CYS A 462 -8.829 -7.070 -3.494 1.00 33.33 C ATOM 1105 C CYS A 462 -9.721 -6.572 -4.633 1.00 35.32 C ATOM 1106 O CYS A 462 -9.540 -5.459 -5.125 1.00 0.41 O ATOM 1107 CB CYS A 462 -7.753 -8.038 -3.995 1.00 70.24 C ATOM 1108 SG CYS A 462 -6.359 -7.101 -4.722 1.00 35.51 S ATOM 0 H CYS A 462 -9.888 -8.669 -2.650 1.00 14.03 H new ATOM 0 HA CYS A 462 -8.294 -6.226 -3.058 1.00 33.33 H new ATOM 0 HB2 CYS A 462 -7.396 -8.656 -3.171 1.00 70.24 H new ATOM 0 HB3 CYS A 462 -8.177 -8.712 -4.739 1.00 70.24 H new ATOM 0 HG CYS A 462 -6.473 -5.844 -4.412 1.00 35.51 H new ATOM 1113 N ARG A 463 -10.663 -7.419 -5.019 1.00 2.02 N ATOM 1114 CA ARG A 463 -11.584 -7.078 -6.089 1.00 33.22 C ATOM 1115 C ARG A 463 -11.985 -5.605 -5.995 1.00 73.21 C ATOM 1116 O ARG A 463 -12.268 -4.968 -7.010 1.00 23.15 O ATOM 1117 CB ARG A 463 -12.842 -7.946 -6.031 1.00 13.50 C ATOM 1118 CG ARG A 463 -12.663 -9.228 -6.847 1.00 44.34 C ATOM 1119 CD ARG A 463 -13.089 -9.017 -8.301 1.00 21.12 C ATOM 1120 NE ARG A 463 -13.598 -10.285 -8.869 1.00 40.32 N ATOM 1121 CZ ARG A 463 -14.477 -10.357 -9.890 1.00 34.35 C ATOM 1122 NH1 ARG A 463 -14.953 -9.233 -10.465 1.00 53.34 N ATOM 1123 NH2 ARG A 463 -14.864 -11.545 -10.318 1.00 5.42 N ATOM 0 H ARG A 463 -10.808 -8.342 -4.609 1.00 2.02 H new ATOM 0 HA ARG A 463 -11.074 -7.260 -7.035 1.00 33.22 H new ATOM 0 HB2 ARG A 463 -13.066 -8.199 -4.995 1.00 13.50 H new ATOM 0 HB3 ARG A 463 -13.694 -7.384 -6.413 1.00 13.50 H new ATOM 0 HG2 ARG A 463 -11.620 -9.543 -6.812 1.00 44.34 H new ATOM 0 HG3 ARG A 463 -13.253 -10.030 -6.404 1.00 44.34 H new ATOM 0 HD2 ARG A 463 -13.861 -8.249 -8.355 1.00 21.12 H new ATOM 0 HD3 ARG A 463 -12.243 -8.660 -8.888 1.00 21.12 H new ATOM 0 HE ARG A 463 -13.263 -11.159 -8.463 1.00 40.32 H new ATOM 0 HH11 ARG A 463 -14.649 -8.320 -10.128 1.00 53.34 H new ATOM 0 HH12 ARG A 463 -15.617 -9.297 -11.236 1.00 53.34 H new ATOM 0 HH21 ARG A 463 -14.499 -12.390 -9.878 1.00 5.42 H new ATOM 0 HH22 ARG A 463 -15.528 -11.618 -11.089 1.00 5.42 H new ATOM 1133 N LEU A 464 -11.995 -5.104 -4.769 1.00 73.23 N ATOM 1134 CA LEU A 464 -12.355 -3.716 -4.530 1.00 20.21 C ATOM 1135 C LEU A 464 -11.113 -2.836 -4.690 1.00 11.15 C ATOM 1136 O LEU A 464 -11.017 -2.061 -5.641 1.00 62.51 O ATOM 1137 CB LEU A 464 -13.043 -3.568 -3.171 1.00 11.10 C ATOM 1138 CG LEU A 464 -13.616 -2.184 -2.857 1.00 13.23 C ATOM 1139 CD1 LEU A 464 -12.649 -1.374 -1.993 1.00 50.51 C ATOM 1140 CD2 LEU A 464 -13.997 -1.445 -4.142 1.00 72.45 C ATOM 0 H LEU A 464 -11.760 -5.634 -3.930 1.00 73.23 H new ATOM 0 HA LEU A 464 -13.082 -3.378 -5.268 1.00 20.21 H new ATOM 0 HB2 LEU A 464 -13.852 -4.296 -3.114 1.00 11.10 H new ATOM 0 HB3 LEU A 464 -12.326 -3.828 -2.393 1.00 11.10 H new ATOM 0 HG LEU A 464 -14.530 -2.315 -2.278 1.00 13.23 H new ATOM 0 HD11 LEU A 464 -13.080 -0.395 -1.784 1.00 50.51 H new ATOM 0 HD12 LEU A 464 -12.472 -1.900 -1.055 1.00 50.51 H new ATOM 0 HD13 LEU A 464 -11.705 -1.249 -2.523 1.00 50.51 H new ATOM 0 HD21 LEU A 464 -14.402 -0.464 -3.891 1.00 72.45 H new ATOM 0 HD22 LEU A 464 -13.113 -1.324 -4.768 1.00 72.45 H new ATOM 0 HD23 LEU A 464 -14.748 -2.020 -4.683 1.00 72.45 H new ATOM 1151 N SER A 465 -10.196 -2.985 -3.747 1.00 5.34 N ATOM 1152 CA SER A 465 -8.965 -2.214 -3.771 1.00 14.44 C ATOM 1153 C SER A 465 -8.435 -2.120 -5.203 1.00 43.24 C ATOM 1154 O SER A 465 -8.315 -1.026 -5.754 1.00 43.14 O ATOM 1155 CB SER A 465 -7.909 -2.834 -2.853 1.00 35.31 C ATOM 1156 OG SER A 465 -7.107 -3.794 -3.536 1.00 1.13 O ATOM 0 H SER A 465 -10.280 -3.629 -2.960 1.00 5.34 H new ATOM 0 HA SER A 465 -9.182 -1.211 -3.404 1.00 14.44 H new ATOM 0 HB2 SER A 465 -7.270 -2.047 -2.452 1.00 35.31 H new ATOM 0 HB3 SER A 465 -8.400 -3.310 -2.004 1.00 35.31 H new ATOM 0 HG SER A 465 -6.806 -4.479 -2.903 1.00 1.13 H new ATOM 1161 N LEU A 466 -8.133 -3.280 -5.766 1.00 73.52 N ATOM 1162 CA LEU A 466 -7.618 -3.342 -7.123 1.00 43.21 C ATOM 1163 C LEU A 466 -8.511 -2.505 -8.041 1.00 2.13 C ATOM 1164 O LEU A 466 -8.022 -1.838 -8.951 1.00 21.21 O ATOM 1165 CB LEU A 466 -7.466 -4.796 -7.572 1.00 72.34 C ATOM 1166 CG LEU A 466 -6.681 -5.019 -8.867 1.00 33.02 C ATOM 1167 CD1 LEU A 466 -7.515 -4.626 -10.088 1.00 40.11 C ATOM 1168 CD2 LEU A 466 -5.340 -4.285 -8.829 1.00 72.13 C ATOM 0 H LEU A 466 -8.235 -4.185 -5.307 1.00 73.52 H new ATOM 0 HA LEU A 466 -6.618 -2.912 -7.171 1.00 43.21 H new ATOM 0 HB2 LEU A 466 -6.977 -5.353 -6.773 1.00 72.34 H new ATOM 0 HB3 LEU A 466 -8.461 -5.223 -7.695 1.00 72.34 H new ATOM 0 HG LEU A 466 -6.463 -6.083 -8.955 1.00 33.02 H new ATOM 0 HD11 LEU A 466 -6.934 -4.794 -10.995 1.00 40.11 H new ATOM 0 HD12 LEU A 466 -8.421 -5.231 -10.120 1.00 40.11 H new ATOM 0 HD13 LEU A 466 -7.785 -3.572 -10.020 1.00 40.11 H new ATOM 0 HD21 LEU A 466 -4.803 -4.460 -9.761 1.00 72.13 H new ATOM 0 HD22 LEU A 466 -5.514 -3.216 -8.706 1.00 72.13 H new ATOM 0 HD23 LEU A 466 -4.746 -4.655 -7.993 1.00 72.13 H new ATOM 1179 N HIS A 467 -9.806 -2.567 -7.770 1.00 50.04 N ATOM 1180 CA HIS A 467 -10.774 -1.823 -8.560 1.00 70.22 C ATOM 1181 C HIS A 467 -10.663 -0.332 -8.235 1.00 71.14 C ATOM 1182 O HIS A 467 -10.956 0.515 -9.079 1.00 0.22 O ATOM 1183 CB HIS A 467 -12.186 -2.372 -8.349 1.00 31.24 C ATOM 1184 CG HIS A 467 -13.280 -1.360 -8.587 1.00 10.53 C ATOM 1185 ND1 HIS A 467 -13.298 -0.521 -9.688 1.00 44.44 N ATOM 1186 CD2 HIS A 467 -14.394 -1.063 -7.858 1.00 61.24 C ATOM 1187 CE1 HIS A 467 -14.378 0.244 -9.612 1.00 74.43 C ATOM 1188 NE2 HIS A 467 -15.055 -0.093 -8.476 1.00 70.34 N ATOM 0 H HIS A 467 -10.209 -3.121 -7.014 1.00 50.04 H new ATOM 0 HA HIS A 467 -10.555 -1.946 -9.621 1.00 70.22 H new ATOM 0 HB2 HIS A 467 -12.338 -3.220 -9.016 1.00 31.24 H new ATOM 0 HB3 HIS A 467 -12.270 -2.749 -7.330 1.00 31.24 H new ATOM 0 HD2 HIS A 467 -14.688 -1.538 -6.934 1.00 61.24 H new ATOM 0 HE1 HIS A 467 -14.671 1.001 -10.324 1.00 74.43 H new ATOM 0 HE2 HIS A 467 -15.925 0.331 -8.155 1.00 70.34 H new ATOM 1195 N GLN A 468 -10.239 -0.055 -7.011 1.00 63.42 N ATOM 1196 CA GLN A 468 -10.085 1.319 -6.563 1.00 14.22 C ATOM 1197 C GLN A 468 -8.758 1.894 -7.062 1.00 63.41 C ATOM 1198 O GLN A 468 -8.741 2.772 -7.923 1.00 30.21 O ATOM 1199 CB GLN A 468 -10.188 1.414 -5.041 1.00 11.22 C ATOM 1200 CG GLN A 468 -11.608 1.099 -4.567 1.00 43.44 C ATOM 1201 CD GLN A 468 -11.919 1.817 -3.252 1.00 42.24 C ATOM 1202 OE1 GLN A 468 -12.681 2.770 -3.199 1.00 72.11 O ATOM 1203 NE2 GLN A 468 -11.290 1.309 -2.195 1.00 72.11 N ATOM 0 H GLN A 468 -9.997 -0.760 -6.314 1.00 63.42 H new ATOM 0 HA GLN A 468 -10.896 1.912 -6.985 1.00 14.22 H new ATOM 0 HB2 GLN A 468 -9.485 0.719 -4.581 1.00 11.22 H new ATOM 0 HB3 GLN A 468 -9.906 2.415 -4.716 1.00 11.22 H new ATOM 0 HG2 GLN A 468 -12.325 1.402 -5.330 1.00 43.44 H new ATOM 0 HG3 GLN A 468 -11.720 0.023 -4.433 1.00 43.44 H new ATOM 0 HE21 GLN A 468 -10.666 0.510 -2.308 1.00 72.11 H new ATOM 0 HE22 GLN A 468 -11.432 1.718 -1.272 1.00 72.11 H new ATOM 1210 N VAL A 469 -7.677 1.376 -6.498 1.00 23.34 N ATOM 1211 CA VAL A 469 -6.347 1.826 -6.872 1.00 52.51 C ATOM 1212 C VAL A 469 -6.292 2.035 -8.388 1.00 4.22 C ATOM 1213 O VAL A 469 -5.867 3.090 -8.857 1.00 4.53 O ATOM 1214 CB VAL A 469 -5.298 0.835 -6.367 1.00 72.21 C ATOM 1215 CG1 VAL A 469 -5.273 -0.427 -7.231 1.00 14.20 C ATOM 1216 CG2 VAL A 469 -3.913 1.485 -6.309 1.00 72.42 C ATOM 0 H VAL A 469 -7.695 0.648 -5.784 1.00 23.34 H new ATOM 0 HA VAL A 469 -6.122 2.784 -6.403 1.00 52.51 H new ATOM 0 HB VAL A 469 -5.575 0.542 -5.354 1.00 72.21 H new ATOM 0 HG11 VAL A 469 -4.518 -1.114 -6.849 1.00 14.20 H new ATOM 0 HG12 VAL A 469 -6.251 -0.908 -7.200 1.00 14.20 H new ATOM 0 HG13 VAL A 469 -5.033 -0.159 -8.260 1.00 14.20 H new ATOM 0 HG21 VAL A 469 -3.185 0.759 -5.947 1.00 72.42 H new ATOM 0 HG22 VAL A 469 -3.626 1.820 -7.306 1.00 72.42 H new ATOM 0 HG23 VAL A 469 -3.940 2.340 -5.633 1.00 72.42 H new ATOM 1226 N ASN A 470 -6.729 1.013 -9.109 1.00 55.31 N ATOM 1227 CA ASN A 470 -6.736 1.073 -10.562 1.00 45.24 C ATOM 1228 C ASN A 470 -7.237 2.446 -11.009 1.00 43.51 C ATOM 1229 O ASN A 470 -6.559 3.145 -11.759 1.00 74.32 O ATOM 1230 CB ASN A 470 -7.668 0.012 -11.150 1.00 71.13 C ATOM 1231 CG ASN A 470 -6.902 -1.272 -11.477 1.00 64.12 C ATOM 1232 OD1 ASN A 470 -7.051 -1.865 -12.532 1.00 65.13 O ATOM 1233 ND2 ASN A 470 -6.074 -1.666 -10.512 1.00 34.14 N ATOM 0 H ASN A 470 -7.080 0.140 -8.716 1.00 55.31 H new ATOM 0 HA ASN A 470 -5.720 0.895 -10.913 1.00 45.24 H new ATOM 0 HB2 ASN A 470 -8.467 -0.208 -10.442 1.00 71.13 H new ATOM 0 HB3 ASN A 470 -8.140 0.398 -12.054 1.00 71.13 H new ATOM 0 HD21 ASN A 470 -5.516 -2.512 -10.632 1.00 34.14 H new ATOM 0 HD22 ASN A 470 -5.997 -1.122 -9.652 1.00 34.14 H new ATOM 1239 N GLN A 471 -8.424 2.792 -10.531 1.00 12.24 N ATOM 1240 CA GLN A 471 -9.027 4.070 -10.873 1.00 71.40 C ATOM 1241 C GLN A 471 -8.215 5.217 -10.268 1.00 31.31 C ATOM 1242 O GLN A 471 -8.155 6.306 -10.837 1.00 12.32 O ATOM 1243 CB GLN A 471 -10.485 4.128 -10.416 1.00 22.22 C ATOM 1244 CG GLN A 471 -11.250 2.880 -10.861 1.00 41.13 C ATOM 1245 CD GLN A 471 -12.082 3.164 -12.113 1.00 41.44 C ATOM 1246 OE1 GLN A 471 -13.282 3.380 -12.056 1.00 0.25 O ATOM 1247 NE2 GLN A 471 -11.381 3.152 -13.242 1.00 73.30 N ATOM 0 H GLN A 471 -8.985 2.209 -9.909 1.00 12.24 H new ATOM 0 HA GLN A 471 -9.018 4.177 -11.958 1.00 71.40 H new ATOM 0 HB2 GLN A 471 -10.526 4.216 -9.330 1.00 22.22 H new ATOM 0 HB3 GLN A 471 -10.963 5.017 -10.826 1.00 22.22 H new ATOM 0 HG2 GLN A 471 -10.548 2.071 -11.063 1.00 41.13 H new ATOM 0 HG3 GLN A 471 -11.902 2.542 -10.056 1.00 41.13 H new ATOM 0 HE21 GLN A 471 -10.379 2.964 -13.218 1.00 73.30 H new ATOM 0 HE22 GLN A 471 -11.845 3.331 -14.132 1.00 73.30 H new ATOM 1254 N ALA A 472 -7.611 4.934 -9.124 1.00 32.21 N ATOM 1255 CA ALA A 472 -6.807 5.929 -8.436 1.00 62.04 C ATOM 1256 C ALA A 472 -5.620 6.319 -9.319 1.00 2.31 C ATOM 1257 O ALA A 472 -4.991 7.353 -9.101 1.00 14.54 O ATOM 1258 CB ALA A 472 -6.367 5.379 -7.078 1.00 70.22 C ATOM 0 H ALA A 472 -7.662 4.029 -8.656 1.00 32.21 H new ATOM 0 HA ALA A 472 -7.390 6.831 -8.250 1.00 62.04 H new ATOM 0 HB1 ALA A 472 -5.764 6.125 -6.561 1.00 70.22 H new ATOM 0 HB2 ALA A 472 -7.246 5.145 -6.478 1.00 70.22 H new ATOM 0 HB3 ALA A 472 -5.777 4.474 -7.226 1.00 70.22 H new ATOM 1264 N MET A 473 -5.348 5.467 -10.299 1.00 71.44 N ATOM 1265 CA MET A 473 -4.248 5.711 -11.216 1.00 33.23 C ATOM 1266 C MET A 473 -4.715 6.512 -12.433 1.00 72.33 C ATOM 1267 O MET A 473 -4.125 7.537 -12.769 1.00 40.33 O ATOM 1268 CB MET A 473 -3.664 4.374 -11.678 1.00 22.13 C ATOM 1269 CG MET A 473 -3.150 3.559 -10.489 1.00 72.23 C ATOM 1270 SD MET A 473 -2.848 1.872 -10.989 1.00 45.43 S ATOM 1271 CE MET A 473 -1.278 1.590 -10.188 1.00 30.35 C ATOM 0 H MET A 473 -5.870 4.609 -10.477 1.00 71.44 H new ATOM 0 HA MET A 473 -3.486 6.291 -10.695 1.00 33.23 H new ATOM 0 HB2 MET A 473 -4.426 3.805 -12.211 1.00 22.13 H new ATOM 0 HB3 MET A 473 -2.850 4.552 -12.380 1.00 22.13 H new ATOM 0 HG2 MET A 473 -2.232 4.002 -10.103 1.00 72.23 H new ATOM 0 HG3 MET A 473 -3.880 3.582 -9.679 1.00 72.23 H new ATOM 0 HE1 MET A 473 -0.965 0.559 -10.353 1.00 30.35 H new ATOM 0 HE2 MET A 473 -0.531 2.267 -10.603 1.00 30.35 H new ATOM 0 HE3 MET A 473 -1.378 1.772 -9.118 1.00 30.35 H new ATOM 1279 N MET A 474 -5.770 6.013 -13.060 1.00 22.33 N ATOM 1280 CA MET A 474 -6.323 6.669 -14.232 1.00 13.03 C ATOM 1281 C MET A 474 -6.940 8.020 -13.864 1.00 11.22 C ATOM 1282 O MET A 474 -7.325 8.791 -14.743 1.00 64.34 O ATOM 1283 CB MET A 474 -7.391 5.774 -14.863 1.00 45.10 C ATOM 1284 CG MET A 474 -8.704 5.854 -14.082 1.00 42.13 C ATOM 1285 SD MET A 474 -9.746 7.132 -14.765 1.00 71.44 S ATOM 1286 CE MET A 474 -10.735 7.525 -13.333 1.00 61.44 C ATOM 0 H MET A 474 -6.256 5.162 -12.778 1.00 22.33 H new ATOM 0 HA MET A 474 -5.515 6.841 -14.943 1.00 13.03 H new ATOM 0 HB2 MET A 474 -7.559 6.076 -15.897 1.00 45.10 H new ATOM 0 HB3 MET A 474 -7.039 4.743 -14.886 1.00 45.10 H new ATOM 0 HG2 MET A 474 -9.219 4.894 -14.122 1.00 42.13 H new ATOM 0 HG3 MET A 474 -8.500 6.063 -13.032 1.00 42.13 H new ATOM 0 HE1 MET A 474 -11.791 7.412 -13.578 1.00 61.44 H new ATOM 0 HE2 MET A 474 -10.477 6.850 -12.517 1.00 61.44 H new ATOM 0 HE3 MET A 474 -10.542 8.554 -13.028 1.00 61.44 H new ATOM 1294 N SER A 475 -7.017 8.265 -12.565 1.00 73.23 N ATOM 1295 CA SER A 475 -7.581 9.509 -12.070 1.00 35.11 C ATOM 1296 C SER A 475 -6.467 10.419 -11.551 1.00 21.01 C ATOM 1297 O SER A 475 -6.642 11.633 -11.463 1.00 40.45 O ATOM 1298 CB SER A 475 -8.609 9.248 -10.968 1.00 33.35 C ATOM 1299 OG SER A 475 -9.539 10.320 -10.840 1.00 2.22 O ATOM 0 H SER A 475 -6.698 7.623 -11.839 1.00 73.23 H new ATOM 0 HA SER A 475 -8.091 10.005 -12.896 1.00 35.11 H new ATOM 0 HB2 SER A 475 -9.147 8.325 -11.186 1.00 33.35 H new ATOM 0 HB3 SER A 475 -8.093 9.100 -10.019 1.00 33.35 H new ATOM 0 HG SER A 475 -10.179 10.114 -10.127 1.00 2.22 H new ATOM 1304 N ASN A 476 -5.344 9.797 -11.221 1.00 45.24 N ATOM 1305 CA ASN A 476 -4.201 10.536 -10.711 1.00 73.33 C ATOM 1306 C ASN A 476 -3.068 10.483 -11.738 1.00 64.21 C ATOM 1307 O ASN A 476 -1.959 10.055 -11.422 1.00 22.42 O ATOM 1308 CB ASN A 476 -3.686 9.925 -9.407 1.00 31.31 C ATOM 1309 CG ASN A 476 -2.426 10.646 -8.923 1.00 54.42 C ATOM 1310 OD1 ASN A 476 -1.308 10.197 -9.119 1.00 54.22 O ATOM 1311 ND2 ASN A 476 -2.668 11.786 -8.283 1.00 2.25 N ATOM 0 H ASN A 476 -5.201 8.790 -11.297 1.00 45.24 H new ATOM 0 HA ASN A 476 -4.518 11.563 -10.526 1.00 73.33 H new ATOM 0 HB2 ASN A 476 -4.460 9.986 -8.642 1.00 31.31 H new ATOM 0 HB3 ASN A 476 -3.469 8.868 -9.558 1.00 31.31 H new ATOM 0 HD21 ASN A 476 -1.893 12.342 -7.922 1.00 2.25 H new ATOM 0 HD22 ASN A 476 -3.628 12.104 -8.153 1.00 2.25 H new ATOM 1317 N LEU A 477 -3.384 10.924 -12.947 1.00 4.30 N ATOM 1318 CA LEU A 477 -2.407 10.933 -14.021 1.00 1.05 C ATOM 1319 C LEU A 477 -1.755 12.314 -14.101 1.00 54.05 C ATOM 1320 O LEU A 477 -0.689 12.469 -14.695 1.00 22.44 O ATOM 1321 CB LEU A 477 -3.049 10.478 -15.333 1.00 54.20 C ATOM 1322 CG LEU A 477 -3.876 9.193 -15.265 1.00 13.02 C ATOM 1323 CD1 LEU A 477 -5.016 9.220 -16.286 1.00 2.44 C ATOM 1324 CD2 LEU A 477 -2.985 7.960 -15.433 1.00 14.42 C ATOM 0 H LEU A 477 -4.305 11.278 -13.206 1.00 4.30 H new ATOM 0 HA LEU A 477 -1.611 10.217 -13.818 1.00 1.05 H new ATOM 0 HB2 LEU A 477 -3.690 11.280 -15.698 1.00 54.20 H new ATOM 0 HB3 LEU A 477 -2.260 10.340 -16.072 1.00 54.20 H new ATOM 0 HG LEU A 477 -4.331 9.130 -14.276 1.00 13.02 H new ATOM 0 HD11 LEU A 477 -5.588 8.295 -16.217 1.00 2.44 H new ATOM 0 HD12 LEU A 477 -5.670 10.067 -16.079 1.00 2.44 H new ATOM 0 HD13 LEU A 477 -4.603 9.317 -17.290 1.00 2.44 H new ATOM 0 HD21 LEU A 477 -3.597 7.059 -15.381 1.00 14.42 H new ATOM 0 HD22 LEU A 477 -2.483 8.003 -16.400 1.00 14.42 H new ATOM 0 HD23 LEU A 477 -2.239 7.939 -14.638 1.00 14.42 H new ATOM 1335 N THR A 478 -2.424 13.285 -13.495 1.00 31.22 N ATOM 1336 CA THR A 478 -1.923 14.649 -13.491 1.00 4.24 C ATOM 1337 C THR A 478 -0.886 14.833 -12.381 1.00 14.01 C ATOM 1338 O THR A 478 -0.380 15.934 -12.175 1.00 43.33 O ATOM 1339 CB THR A 478 -3.120 15.592 -13.365 1.00 53.53 C ATOM 1340 OG1 THR A 478 -2.549 16.894 -13.457 1.00 45.13 O ATOM 1341 CG2 THR A 478 -3.748 15.559 -11.969 1.00 12.41 C ATOM 0 H THR A 478 -3.308 13.154 -13.004 1.00 31.22 H new ATOM 0 HA THR A 478 -1.404 14.882 -14.421 1.00 4.24 H new ATOM 0 HB THR A 478 -3.871 15.324 -14.108 1.00 53.53 H new ATOM 0 HG1 THR A 478 -1.600 16.852 -13.218 1.00 45.13 H new ATOM 0 HG21 THR A 478 -4.593 16.246 -11.934 1.00 12.41 H new ATOM 0 HG22 THR A 478 -4.093 14.549 -11.749 1.00 12.41 H new ATOM 0 HG23 THR A 478 -3.006 15.859 -11.229 1.00 12.41 H new ATOM 1349 N ARG A 479 -0.599 13.736 -11.696 1.00 24.31 N ATOM 1350 CA ARG A 479 0.369 13.761 -10.613 1.00 4.12 C ATOM 1351 C ARG A 479 1.610 12.950 -10.989 1.00 1.04 C ATOM 1352 O ARG A 479 2.666 13.516 -11.262 1.00 33.51 O ATOM 1353 CB ARG A 479 -0.231 13.194 -9.325 1.00 50.40 C ATOM 1354 CG ARG A 479 0.863 12.875 -8.304 1.00 40.04 C ATOM 1355 CD ARG A 479 1.720 14.108 -8.014 1.00 42.14 C ATOM 1356 NE ARG A 479 2.526 13.891 -6.793 1.00 2.21 N ATOM 1357 CZ ARG A 479 2.012 13.855 -5.544 1.00 43.15 C ATOM 1358 NH1 ARG A 479 0.688 14.022 -5.341 1.00 14.11 N ATOM 1359 NH2 ARG A 479 2.825 13.652 -4.524 1.00 44.24 N ATOM 0 H ARG A 479 -1.020 12.824 -11.870 1.00 24.31 H new ATOM 0 HA ARG A 479 0.649 14.801 -10.444 1.00 4.12 H new ATOM 0 HB2 ARG A 479 -0.932 13.912 -8.900 1.00 50.40 H new ATOM 0 HB3 ARG A 479 -0.797 12.290 -9.551 1.00 50.40 H new ATOM 0 HG2 ARG A 479 0.409 12.518 -7.380 1.00 40.04 H new ATOM 0 HG3 ARG A 479 1.494 12.070 -8.681 1.00 40.04 H new ATOM 0 HD2 ARG A 479 2.376 14.312 -8.860 1.00 42.14 H new ATOM 0 HD3 ARG A 479 1.082 14.982 -7.887 1.00 42.14 H new ATOM 0 HE ARG A 479 3.532 13.760 -6.900 1.00 2.21 H new ATOM 0 HH11 ARG A 479 0.066 14.177 -6.134 1.00 14.11 H new ATOM 0 HH12 ARG A 479 0.310 13.993 -4.394 1.00 14.11 H new ATOM 0 HH21 ARG A 479 3.824 13.525 -4.686 1.00 44.24 H new ATOM 0 HH22 ARG A 479 2.454 13.622 -3.574 1.00 44.24 H new ATOM 1369 N GLN A 480 1.439 11.635 -10.992 1.00 14.10 N ATOM 1370 CA GLN A 480 2.532 10.739 -11.332 1.00 50.15 C ATOM 1371 C GLN A 480 2.173 9.906 -12.563 1.00 2.40 C ATOM 1372 O GLN A 480 3.030 9.624 -13.399 1.00 11.21 O ATOM 1373 CB GLN A 480 2.892 9.841 -10.147 1.00 54.35 C ATOM 1374 CG GLN A 480 2.003 8.597 -10.112 1.00 62.32 C ATOM 1375 CD GLN A 480 1.955 7.996 -8.706 1.00 1.32 C ATOM 1376 OE1 GLN A 480 2.935 7.487 -8.187 1.00 71.13 O ATOM 1377 NE2 GLN A 480 0.764 8.082 -8.121 1.00 12.11 N ATOM 0 H GLN A 480 0.561 11.169 -10.765 1.00 14.10 H new ATOM 0 HA GLN A 480 3.409 11.341 -11.570 1.00 50.15 H new ATOM 0 HB2 GLN A 480 3.938 9.543 -10.217 1.00 54.35 H new ATOM 0 HB3 GLN A 480 2.781 10.398 -9.217 1.00 54.35 H new ATOM 0 HG2 GLN A 480 0.995 8.857 -10.435 1.00 62.32 H new ATOM 0 HG3 GLN A 480 2.381 7.855 -10.815 1.00 62.32 H new ATOM 0 HE21 GLN A 480 -0.015 8.521 -8.612 1.00 12.11 H new ATOM 0 HE22 GLN A 480 0.629 7.709 -7.181 1.00 12.11 H new ATOM 1384 N GLY A 481 0.902 9.534 -12.636 1.00 23.22 N ATOM 1385 CA GLY A 481 0.419 8.738 -13.751 1.00 31.55 C ATOM 1386 C GLY A 481 1.223 7.442 -13.888 1.00 11.32 C ATOM 1387 O GLY A 481 1.687 7.110 -14.978 1.00 33.25 O ATOM 0 H GLY A 481 0.193 9.769 -11.941 1.00 23.22 H new ATOM 0 HA2 GLY A 481 -0.635 8.503 -13.605 1.00 31.55 H new ATOM 0 HA3 GLY A 481 0.492 9.315 -14.673 1.00 31.55 H new ATOM 1391 N SER A 482 1.360 6.746 -12.769 1.00 53.22 N ATOM 1392 CA SER A 482 2.099 5.495 -12.753 1.00 4.32 C ATOM 1393 C SER A 482 1.169 4.344 -12.368 1.00 4.52 C ATOM 1394 O SER A 482 0.833 4.177 -11.196 1.00 22.35 O ATOM 1395 CB SER A 482 3.282 5.568 -11.784 1.00 34.22 C ATOM 1396 OG SER A 482 4.055 6.750 -11.974 1.00 14.01 O ATOM 0 H SER A 482 0.972 7.024 -11.868 1.00 53.22 H new ATOM 0 HA SER A 482 2.493 5.317 -13.754 1.00 4.32 H new ATOM 0 HB2 SER A 482 2.913 5.537 -10.759 1.00 34.22 H new ATOM 0 HB3 SER A 482 3.918 4.693 -11.921 1.00 34.22 H new ATOM 0 HG SER A 482 4.799 6.760 -11.336 1.00 14.01 H new ATOM 1401 N PRO A 483 0.767 3.559 -13.402 1.00 31.32 N ATOM 1402 CA PRO A 483 -0.118 2.428 -13.185 1.00 33.14 C ATOM 1403 C PRO A 483 0.632 1.258 -12.545 1.00 71.44 C ATOM 1404 O PRO A 483 0.053 0.201 -12.304 1.00 43.31 O ATOM 1405 CB PRO A 483 -0.676 2.094 -14.559 1.00 20.21 C ATOM 1406 CG PRO A 483 0.265 2.744 -15.560 1.00 54.11 C ATOM 1407 CD PRO A 483 1.144 3.727 -14.804 1.00 31.13 C ATOM 0 HA PRO A 483 -0.924 2.654 -12.487 1.00 33.14 H new ATOM 0 HB2 PRO A 483 -0.723 1.016 -14.710 1.00 20.21 H new ATOM 0 HB3 PRO A 483 -1.691 2.476 -14.672 1.00 20.21 H new ATOM 0 HG2 PRO A 483 0.875 1.989 -16.056 1.00 54.11 H new ATOM 0 HG3 PRO A 483 -0.300 3.258 -16.338 1.00 54.11 H new ATOM 0 HD2 PRO A 483 2.201 3.512 -14.958 1.00 31.13 H new ATOM 0 HD3 PRO A 483 0.974 4.750 -15.140 1.00 31.13 H new ATOM 1412 N ASP A 484 1.912 1.488 -12.288 1.00 14.22 N ATOM 1413 CA ASP A 484 2.750 0.467 -11.681 1.00 51.53 C ATOM 1414 C ASP A 484 3.079 0.874 -10.243 1.00 51.41 C ATOM 1415 O ASP A 484 4.217 0.729 -9.799 1.00 41.10 O ATOM 1416 CB ASP A 484 4.067 0.310 -12.442 1.00 55.21 C ATOM 1417 CG ASP A 484 4.685 -1.088 -12.383 1.00 71.33 C ATOM 1418 OD1 ASP A 484 4.841 -1.671 -11.301 1.00 31.42 O ATOM 1419 OD2 ASP A 484 5.017 -1.585 -13.526 1.00 54.01 O ATOM 0 H ASP A 484 2.389 2.367 -12.489 1.00 14.22 H new ATOM 0 HA ASP A 484 2.205 -0.477 -11.708 1.00 51.53 H new ATOM 0 HB2 ASP A 484 3.899 0.573 -13.486 1.00 55.21 H new ATOM 0 HB3 ASP A 484 4.786 1.026 -12.045 1.00 55.21 H new ATOM 1424 N CYS A 485 2.064 1.376 -9.556 1.00 2.41 N ATOM 1425 CA CYS A 485 2.232 1.804 -8.178 1.00 23.33 C ATOM 1426 C CYS A 485 1.316 0.954 -7.295 1.00 2.13 C ATOM 1427 O CYS A 485 0.741 1.453 -6.329 1.00 42.50 O ATOM 1428 CB CYS A 485 1.956 3.300 -8.013 1.00 11.40 C ATOM 1429 SG CYS A 485 0.236 3.677 -8.512 1.00 71.34 S ATOM 0 H CYS A 485 1.122 1.496 -9.928 1.00 2.41 H new ATOM 0 HA CYS A 485 3.268 1.656 -7.873 1.00 23.33 H new ATOM 0 HB2 CYS A 485 2.116 3.596 -6.976 1.00 11.40 H new ATOM 0 HB3 CYS A 485 2.654 3.876 -8.620 1.00 11.40 H new ATOM 0 HG CYS A 485 0.227 4.126 -9.732 1.00 71.34 H new ATOM 1434 N VAL A 486 1.207 -0.316 -7.659 1.00 64.43 N ATOM 1435 CA VAL A 486 0.371 -1.240 -6.912 1.00 73.00 C ATOM 1436 C VAL A 486 1.206 -2.452 -6.493 1.00 14.33 C ATOM 1437 O VAL A 486 1.957 -3.000 -7.298 1.00 70.34 O ATOM 1438 CB VAL A 486 -0.859 -1.617 -7.739 1.00 13.43 C ATOM 1439 CG1 VAL A 486 -1.592 -2.808 -7.119 1.00 14.43 C ATOM 1440 CG2 VAL A 486 -1.798 -0.420 -7.906 1.00 65.01 C ATOM 0 H VAL A 486 1.684 -0.726 -8.462 1.00 64.43 H new ATOM 0 HA VAL A 486 0.001 -0.770 -6.001 1.00 73.00 H new ATOM 0 HB VAL A 486 -0.517 -1.913 -8.731 1.00 13.43 H new ATOM 0 HG11 VAL A 486 -2.463 -3.056 -7.726 1.00 14.43 H new ATOM 0 HG12 VAL A 486 -0.922 -3.667 -7.078 1.00 14.43 H new ATOM 0 HG13 VAL A 486 -1.915 -2.551 -6.110 1.00 14.43 H new ATOM 0 HG21 VAL A 486 -2.664 -0.717 -8.498 1.00 65.01 H new ATOM 0 HG22 VAL A 486 -2.129 -0.078 -6.926 1.00 65.01 H new ATOM 0 HG23 VAL A 486 -1.271 0.388 -8.414 1.00 65.01 H new ATOM 1450 N ILE A 487 1.045 -2.835 -5.236 1.00 41.33 N ATOM 1451 CA ILE A 487 1.773 -3.972 -4.700 1.00 41.03 C ATOM 1452 C ILE A 487 0.847 -4.786 -3.793 1.00 54.44 C ATOM 1453 O ILE A 487 0.674 -4.455 -2.621 1.00 42.54 O ATOM 1454 CB ILE A 487 3.057 -3.509 -4.010 1.00 73.04 C ATOM 1455 CG1 ILE A 487 3.665 -2.305 -4.734 1.00 13.33 C ATOM 1456 CG2 ILE A 487 4.056 -4.661 -3.878 1.00 4.13 C ATOM 1457 CD1 ILE A 487 4.239 -2.714 -6.093 1.00 44.44 C ATOM 0 H ILE A 487 0.420 -2.378 -4.572 1.00 41.33 H new ATOM 0 HA ILE A 487 2.091 -4.633 -5.506 1.00 41.03 H new ATOM 0 HB ILE A 487 2.804 -3.185 -3.001 1.00 73.04 H new ATOM 0 HG12 ILE A 487 2.904 -1.537 -4.873 1.00 13.33 H new ATOM 0 HG13 ILE A 487 4.452 -1.866 -4.120 1.00 13.33 H new ATOM 0 HG21 ILE A 487 4.960 -4.304 -3.384 1.00 4.13 H new ATOM 0 HG22 ILE A 487 3.612 -5.462 -3.287 1.00 4.13 H new ATOM 0 HG23 ILE A 487 4.309 -5.039 -4.869 1.00 4.13 H new ATOM 0 HD11 ILE A 487 4.665 -1.840 -6.586 1.00 44.44 H new ATOM 0 HD12 ILE A 487 5.017 -3.464 -5.949 1.00 44.44 H new ATOM 0 HD13 ILE A 487 3.445 -3.130 -6.713 1.00 44.44 H new ATOM 1468 N PRO A 488 0.260 -5.859 -4.386 1.00 73.41 N ATOM 1469 CA PRO A 488 -0.644 -6.721 -3.645 1.00 42.10 C ATOM 1470 C PRO A 488 0.127 -7.628 -2.685 1.00 25.31 C ATOM 1471 O PRO A 488 0.718 -8.624 -3.104 1.00 72.33 O ATOM 1472 CB PRO A 488 -1.410 -7.494 -4.707 1.00 64.12 C ATOM 1473 CG PRO A 488 -0.588 -7.379 -5.980 1.00 33.02 C ATOM 1474 CD PRO A 488 0.441 -6.279 -5.773 1.00 72.23 C ATOM 0 HA PRO A 488 -1.329 -6.163 -3.007 1.00 42.10 H new ATOM 0 HB2 PRO A 488 -1.536 -8.537 -4.416 1.00 64.12 H new ATOM 0 HB3 PRO A 488 -2.408 -7.080 -4.848 1.00 64.12 H new ATOM 0 HG2 PRO A 488 -0.095 -8.325 -6.203 1.00 33.02 H new ATOM 0 HG3 PRO A 488 -1.230 -7.146 -6.829 1.00 33.02 H new ATOM 0 HD2 PRO A 488 1.453 -6.645 -5.947 1.00 72.23 H new ATOM 0 HD3 PRO A 488 0.279 -5.450 -6.462 1.00 72.23 H new ATOM 1479 N PHE A 489 0.098 -7.254 -1.415 1.00 23.50 N ATOM 1480 CA PHE A 489 0.788 -8.021 -0.391 1.00 13.04 C ATOM 1481 C PHE A 489 -0.009 -9.272 -0.014 1.00 3.31 C ATOM 1482 O PHE A 489 -1.165 -9.419 -0.411 1.00 24.45 O ATOM 1483 CB PHE A 489 0.910 -7.120 0.838 1.00 41.03 C ATOM 1484 CG PHE A 489 2.123 -7.431 1.719 1.00 51.45 C ATOM 1485 CD1 PHE A 489 2.032 -8.381 2.688 1.00 51.14 C ATOM 1486 CD2 PHE A 489 3.290 -6.757 1.534 1.00 1.23 C ATOM 1487 CE1 PHE A 489 3.156 -8.670 3.506 1.00 4.11 C ATOM 1488 CE2 PHE A 489 4.414 -7.046 2.353 1.00 54.31 C ATOM 1489 CZ PHE A 489 4.323 -7.997 3.322 1.00 74.11 C ATOM 0 H PHE A 489 -0.393 -6.429 -1.071 1.00 23.50 H new ATOM 0 HA PHE A 489 1.763 -8.340 -0.759 1.00 13.04 H new ATOM 0 HB2 PHE A 489 0.968 -6.082 0.511 1.00 41.03 H new ATOM 0 HB3 PHE A 489 0.004 -7.215 1.437 1.00 41.03 H new ATOM 0 HD1 PHE A 489 1.105 -8.915 2.835 1.00 51.14 H new ATOM 0 HD2 PHE A 489 3.362 -6.002 0.765 1.00 1.23 H new ATOM 0 HE1 PHE A 489 3.084 -9.425 4.275 1.00 4.11 H new ATOM 0 HE2 PHE A 489 5.341 -6.511 2.207 1.00 54.31 H new ATOM 0 HZ PHE A 489 5.177 -8.217 3.945 1.00 74.11 H new ATOM 1498 N LEU A 490 0.639 -10.141 0.750 1.00 15.02 N ATOM 1499 CA LEU A 490 0.005 -11.373 1.185 1.00 54.13 C ATOM 1500 C LEU A 490 0.697 -11.877 2.452 1.00 23.30 C ATOM 1501 O LEU A 490 1.800 -12.419 2.387 1.00 33.14 O ATOM 1502 CB LEU A 490 -0.017 -12.395 0.046 1.00 22.25 C ATOM 1503 CG LEU A 490 -1.003 -13.555 0.205 1.00 23.34 C ATOM 1504 CD1 LEU A 490 -0.881 -14.541 -0.959 1.00 11.31 C ATOM 1505 CD2 LEU A 490 -0.826 -14.243 1.561 1.00 55.50 C ATOM 0 H LEU A 490 1.597 -10.015 1.078 1.00 15.02 H new ATOM 0 HA LEU A 490 -1.039 -11.195 1.442 1.00 54.13 H new ATOM 0 HB2 LEU A 490 -0.249 -11.871 -0.881 1.00 22.25 H new ATOM 0 HB3 LEU A 490 0.985 -12.809 -0.064 1.00 22.25 H new ATOM 0 HG LEU A 490 -2.015 -13.150 0.179 1.00 23.34 H new ATOM 0 HD11 LEU A 490 -1.592 -15.356 -0.822 1.00 11.31 H new ATOM 0 HD12 LEU A 490 -1.095 -14.026 -1.896 1.00 11.31 H new ATOM 0 HD13 LEU A 490 0.131 -14.944 -0.990 1.00 11.31 H new ATOM 0 HD21 LEU A 490 -1.538 -15.063 1.649 1.00 55.50 H new ATOM 0 HD22 LEU A 490 0.189 -14.633 1.641 1.00 55.50 H new ATOM 0 HD23 LEU A 490 -1.002 -13.523 2.360 1.00 55.50 H new ATOM 1516 N PRO A 491 0.006 -11.676 3.604 1.00 13.23 N ATOM 1517 CA PRO A 491 0.542 -12.104 4.885 1.00 40.54 C ATOM 1518 C PRO A 491 0.435 -13.622 5.044 1.00 45.22 C ATOM 1519 O PRO A 491 -0.193 -14.293 4.227 1.00 13.31 O ATOM 1520 CB PRO A 491 -0.261 -11.339 5.924 1.00 71.23 C ATOM 1521 CG PRO A 491 -1.520 -10.867 5.215 1.00 70.13 C ATOM 1522 CD PRO A 491 -1.302 -11.037 3.719 1.00 11.21 C ATOM 0 HA PRO A 491 1.606 -11.890 4.988 1.00 40.54 H new ATOM 0 HB2 PRO A 491 -0.507 -11.976 6.774 1.00 71.23 H new ATOM 0 HB3 PRO A 491 0.308 -10.494 6.313 1.00 71.23 H new ATOM 0 HG2 PRO A 491 -2.383 -11.446 5.544 1.00 70.13 H new ATOM 0 HG3 PRO A 491 -1.725 -9.824 5.455 1.00 70.13 H new ATOM 0 HD2 PRO A 491 -2.083 -11.652 3.273 1.00 11.21 H new ATOM 0 HD3 PRO A 491 -1.320 -10.076 3.205 1.00 11.21 H new ATOM 1527 N LEU A 492 1.056 -14.119 6.104 1.00 70.01 N ATOM 1528 CA LEU A 492 1.038 -15.545 6.382 1.00 32.12 C ATOM 1529 C LEU A 492 -0.313 -15.923 6.996 1.00 72.41 C ATOM 1530 O LEU A 492 -0.723 -17.081 6.935 1.00 54.14 O ATOM 1531 CB LEU A 492 2.237 -15.939 7.245 1.00 2.31 C ATOM 1532 CG LEU A 492 3.617 -15.645 6.650 1.00 3.24 C ATOM 1533 CD1 LEU A 492 3.811 -14.145 6.431 1.00 70.42 C ATOM 1534 CD2 LEU A 492 4.724 -16.248 7.517 1.00 73.43 C ATOM 0 H LEU A 492 1.575 -13.559 6.781 1.00 70.01 H new ATOM 0 HA LEU A 492 1.140 -16.114 5.458 1.00 32.12 H new ATOM 0 HB2 LEU A 492 2.157 -15.421 8.201 1.00 2.31 H new ATOM 0 HB3 LEU A 492 2.173 -17.007 7.455 1.00 2.31 H new ATOM 0 HG LEU A 492 3.678 -16.121 5.672 1.00 3.24 H new ATOM 0 HD11 LEU A 492 4.799 -13.964 6.008 1.00 70.42 H new ATOM 0 HD12 LEU A 492 3.049 -13.776 5.745 1.00 70.42 H new ATOM 0 HD13 LEU A 492 3.724 -13.624 7.384 1.00 70.42 H new ATOM 0 HD21 LEU A 492 5.695 -16.026 7.074 1.00 73.43 H new ATOM 0 HD22 LEU A 492 4.676 -15.820 8.518 1.00 73.43 H new ATOM 0 HD23 LEU A 492 4.591 -17.328 7.577 1.00 73.43 H new ATOM 1545 N GLU A 493 -0.964 -14.925 7.572 1.00 3.51 N ATOM 1546 CA GLU A 493 -2.259 -15.138 8.196 1.00 0.52 C ATOM 1547 C GLU A 493 -3.286 -15.579 7.152 1.00 11.31 C ATOM 1548 O GLU A 493 -4.109 -16.455 7.416 1.00 64.33 O ATOM 1549 CB GLU A 493 -2.729 -13.879 8.929 1.00 33.12 C ATOM 1550 CG GLU A 493 -2.243 -13.876 10.379 1.00 41.03 C ATOM 1551 CD GLU A 493 -3.322 -14.415 11.321 1.00 22.22 C ATOM 1552 OE1 GLU A 493 -4.210 -15.163 10.881 1.00 44.34 O ATOM 1553 OE2 GLU A 493 -3.216 -14.034 12.549 1.00 22.04 O ATOM 0 H GLU A 493 -0.620 -13.966 7.620 1.00 3.51 H new ATOM 0 HA GLU A 493 -2.157 -15.933 8.935 1.00 0.52 H new ATOM 0 HB2 GLU A 493 -2.356 -12.994 8.415 1.00 33.12 H new ATOM 0 HB3 GLU A 493 -3.817 -13.826 8.906 1.00 33.12 H new ATOM 0 HG2 GLU A 493 -1.343 -14.484 10.466 1.00 41.03 H new ATOM 0 HG3 GLU A 493 -1.972 -12.862 10.673 1.00 41.03 H new ATOM 1559 N SER A 494 -3.205 -14.953 5.987 1.00 33.51 N ATOM 1560 CA SER A 494 -4.116 -15.270 4.901 1.00 24.14 C ATOM 1561 C SER A 494 -3.365 -15.997 3.782 1.00 41.14 C ATOM 1562 O SER A 494 -2.167 -16.250 3.897 1.00 11.12 O ATOM 1563 CB SER A 494 -4.787 -14.008 4.359 1.00 14.00 C ATOM 1564 OG SER A 494 -5.909 -13.618 5.146 1.00 72.02 O ATOM 0 H SER A 494 -2.522 -14.227 5.772 1.00 33.51 H new ATOM 0 HA SER A 494 -4.896 -15.924 5.289 1.00 24.14 H new ATOM 0 HB2 SER A 494 -4.062 -13.195 4.334 1.00 14.00 H new ATOM 0 HB3 SER A 494 -5.108 -14.181 3.332 1.00 14.00 H new ATOM 0 HG SER A 494 -6.473 -14.400 5.321 1.00 72.02 H new ATOM 1569 N SER A 495 -4.101 -16.308 2.726 1.00 73.33 N ATOM 1570 CA SER A 495 -3.519 -16.999 1.588 1.00 73.51 C ATOM 1571 C SER A 495 -4.181 -16.524 0.293 1.00 10.35 C ATOM 1572 O SER A 495 -5.234 -15.887 0.326 1.00 64.44 O ATOM 1573 CB SER A 495 -3.663 -18.516 1.731 1.00 31.20 C ATOM 1574 OG SER A 495 -2.456 -19.126 2.180 1.00 4.34 O ATOM 0 H SER A 495 -5.094 -16.095 2.634 1.00 73.33 H new ATOM 0 HA SER A 495 -2.455 -16.764 1.553 1.00 73.51 H new ATOM 0 HB2 SER A 495 -4.466 -18.739 2.434 1.00 31.20 H new ATOM 0 HB3 SER A 495 -3.951 -18.945 0.771 1.00 31.20 H new ATOM 0 HG SER A 495 -2.589 -20.094 2.260 1.00 4.34 H new ATOM 1579 N PRO A 496 -3.522 -16.859 -0.848 1.00 22.45 N ATOM 1580 CA PRO A 496 -4.035 -16.474 -2.151 1.00 73.12 C ATOM 1581 C PRO A 496 -5.233 -17.340 -2.547 1.00 22.54 C ATOM 1582 O PRO A 496 -6.132 -16.880 -3.248 1.00 53.42 O ATOM 1583 CB PRO A 496 -2.855 -16.623 -3.098 1.00 11.32 C ATOM 1584 CG PRO A 496 -1.859 -17.525 -2.386 1.00 44.45 C ATOM 1585 CD PRO A 496 -2.274 -17.614 -0.926 1.00 31.12 C ATOM 0 HA PRO A 496 -4.416 -15.453 -2.168 1.00 73.12 H new ATOM 0 HB2 PRO A 496 -3.168 -17.059 -4.046 1.00 11.32 H new ATOM 0 HB3 PRO A 496 -2.411 -15.653 -3.324 1.00 11.32 H new ATOM 0 HG2 PRO A 496 -1.847 -18.515 -2.841 1.00 44.45 H new ATOM 0 HG3 PRO A 496 -0.850 -17.123 -2.472 1.00 44.45 H new ATOM 0 HD2 PRO A 496 -2.418 -18.650 -0.618 1.00 31.12 H new ATOM 0 HD3 PRO A 496 -1.513 -17.189 -0.271 1.00 31.12 H new ATOM 1590 N ALA A 497 -5.205 -18.581 -2.081 1.00 52.34 N ATOM 1591 CA ALA A 497 -6.277 -19.516 -2.378 1.00 63.02 C ATOM 1592 C ALA A 497 -7.569 -19.029 -1.720 1.00 75.30 C ATOM 1593 O ALA A 497 -8.664 -19.361 -2.172 1.00 33.03 O ATOM 1594 CB ALA A 497 -5.877 -20.917 -1.910 1.00 71.31 C ATOM 0 H ALA A 497 -4.457 -18.960 -1.500 1.00 52.34 H new ATOM 0 HA ALA A 497 -6.453 -19.569 -3.452 1.00 63.02 H new ATOM 0 HB1 ALA A 497 -6.681 -21.618 -2.133 1.00 71.31 H new ATOM 0 HB2 ALA A 497 -4.970 -21.228 -2.428 1.00 71.31 H new ATOM 0 HB3 ALA A 497 -5.695 -20.903 -0.835 1.00 71.31 H new ATOM 1600 N GLN A 498 -7.399 -18.248 -0.663 1.00 10.12 N ATOM 1601 CA GLN A 498 -8.539 -17.712 0.062 1.00 52.40 C ATOM 1602 C GLN A 498 -9.216 -16.608 -0.754 1.00 31.25 C ATOM 1603 O GLN A 498 -10.296 -16.143 -0.399 1.00 3.51 O ATOM 1604 CB GLN A 498 -8.119 -17.195 1.439 1.00 44.30 C ATOM 1605 CG GLN A 498 -6.963 -18.022 2.006 1.00 5.23 C ATOM 1606 CD GLN A 498 -7.002 -18.042 3.535 1.00 43.15 C ATOM 1607 OE1 GLN A 498 -6.736 -17.054 4.202 1.00 14.23 O ATOM 1608 NE2 GLN A 498 -7.346 -19.217 4.053 1.00 22.03 N ATOM 0 H GLN A 498 -6.490 -17.974 -0.291 1.00 10.12 H new ATOM 0 HA GLN A 498 -9.258 -18.517 0.216 1.00 52.40 H new ATOM 0 HB2 GLN A 498 -7.820 -16.150 1.363 1.00 44.30 H new ATOM 0 HB3 GLN A 498 -8.968 -17.235 2.121 1.00 44.30 H new ATOM 0 HG2 GLN A 498 -7.019 -19.041 1.624 1.00 5.23 H new ATOM 0 HG3 GLN A 498 -6.014 -17.606 1.668 1.00 5.23 H new ATOM 0 HE21 GLN A 498 -7.556 -20.003 3.438 1.00 22.03 H new ATOM 0 HE22 GLN A 498 -7.400 -19.332 5.065 1.00 22.03 H new ATOM 1615 N LEU A 499 -8.552 -16.225 -1.834 1.00 54.34 N ATOM 1616 CA LEU A 499 -9.076 -15.184 -2.704 1.00 73.31 C ATOM 1617 C LEU A 499 -9.785 -15.832 -3.896 1.00 70.23 C ATOM 1618 O LEU A 499 -9.600 -17.018 -4.161 1.00 11.24 O ATOM 1619 CB LEU A 499 -7.966 -14.210 -3.103 1.00 13.12 C ATOM 1620 CG LEU A 499 -6.905 -13.929 -2.038 1.00 42.21 C ATOM 1621 CD1 LEU A 499 -5.981 -12.788 -2.470 1.00 14.02 C ATOM 1622 CD2 LEU A 499 -7.551 -13.657 -0.678 1.00 12.13 C ATOM 0 H LEU A 499 -7.657 -16.616 -2.127 1.00 54.34 H new ATOM 0 HA LEU A 499 -9.819 -14.585 -2.178 1.00 73.31 H new ATOM 0 HB2 LEU A 499 -7.467 -14.602 -3.989 1.00 13.12 H new ATOM 0 HB3 LEU A 499 -8.426 -13.264 -3.388 1.00 13.12 H new ATOM 0 HG LEU A 499 -6.287 -14.821 -1.930 1.00 42.21 H new ATOM 0 HD11 LEU A 499 -5.236 -12.609 -1.694 1.00 14.02 H new ATOM 0 HD12 LEU A 499 -5.479 -13.058 -3.399 1.00 14.02 H new ATOM 0 HD13 LEU A 499 -6.568 -11.883 -2.624 1.00 14.02 H new ATOM 0 HD21 LEU A 499 -6.774 -13.460 0.061 1.00 12.13 H new ATOM 0 HD22 LEU A 499 -8.208 -12.790 -0.754 1.00 12.13 H new ATOM 0 HD23 LEU A 499 -8.132 -14.526 -0.371 1.00 12.13 H new ATOM 1633 N SER A 500 -10.580 -15.023 -4.581 1.00 63.32 N ATOM 1634 CA SER A 500 -11.317 -15.502 -5.738 1.00 5.25 C ATOM 1635 C SER A 500 -10.346 -15.866 -6.863 1.00 64.22 C ATOM 1636 O SER A 500 -9.210 -15.393 -6.885 1.00 2.44 O ATOM 1637 CB SER A 500 -12.322 -14.456 -6.223 1.00 51.13 C ATOM 1638 OG SER A 500 -13.323 -14.184 -5.246 1.00 3.13 O ATOM 0 H SER A 500 -10.730 -14.039 -4.357 1.00 63.32 H new ATOM 0 HA SER A 500 -11.873 -16.392 -5.444 1.00 5.25 H new ATOM 0 HB2 SER A 500 -11.795 -13.534 -6.469 1.00 51.13 H new ATOM 0 HB3 SER A 500 -12.796 -14.806 -7.140 1.00 51.13 H new ATOM 0 HG SER A 500 -13.944 -13.510 -5.593 1.00 3.13 H new ATOM 1643 N SER A 501 -10.827 -16.703 -7.770 1.00 3.14 N ATOM 1644 CA SER A 501 -10.016 -17.137 -8.894 1.00 32.13 C ATOM 1645 C SER A 501 -9.740 -15.954 -9.826 1.00 13.54 C ATOM 1646 O SER A 501 -8.930 -16.060 -10.745 1.00 12.02 O ATOM 1647 CB SER A 501 -10.700 -18.269 -9.662 1.00 33.52 C ATOM 1648 OG SER A 501 -10.339 -19.552 -9.156 1.00 72.02 O ATOM 0 H SER A 501 -11.769 -17.093 -7.749 1.00 3.14 H new ATOM 0 HA SER A 501 -9.070 -17.517 -8.508 1.00 32.13 H new ATOM 0 HB2 SER A 501 -11.781 -18.147 -9.601 1.00 33.52 H new ATOM 0 HB3 SER A 501 -10.431 -18.206 -10.716 1.00 33.52 H new ATOM 0 HG SER A 501 -10.798 -20.248 -9.672 1.00 72.02 H new ATOM 1653 N ASP A 502 -10.431 -14.856 -9.556 1.00 32.41 N ATOM 1654 CA ASP A 502 -10.271 -13.656 -10.360 1.00 61.44 C ATOM 1655 C ASP A 502 -9.020 -12.903 -9.901 1.00 21.32 C ATOM 1656 O ASP A 502 -8.297 -12.336 -10.718 1.00 31.21 O ATOM 1657 CB ASP A 502 -11.471 -12.720 -10.197 1.00 20.44 C ATOM 1658 CG ASP A 502 -12.822 -13.333 -10.570 1.00 63.14 C ATOM 1659 OD1 ASP A 502 -13.416 -14.091 -9.789 1.00 11.11 O ATOM 1660 OD2 ASP A 502 -13.270 -12.997 -11.731 1.00 12.45 O ATOM 0 H ASP A 502 -11.102 -14.772 -8.793 1.00 32.41 H new ATOM 0 HA ASP A 502 -10.187 -13.958 -11.404 1.00 61.44 H new ATOM 0 HB2 ASP A 502 -11.514 -12.386 -9.160 1.00 20.44 H new ATOM 0 HB3 ASP A 502 -11.308 -11.834 -10.811 1.00 20.44 H new ATOM 1665 N THR A 503 -8.802 -12.924 -8.593 1.00 14.23 N ATOM 1666 CA THR A 503 -7.651 -12.251 -8.016 1.00 62.44 C ATOM 1667 C THR A 503 -6.413 -12.473 -8.885 1.00 73.05 C ATOM 1668 O THR A 503 -5.742 -11.515 -9.272 1.00 11.14 O ATOM 1669 CB THR A 503 -7.483 -12.753 -6.579 1.00 71.32 C ATOM 1670 OG1 THR A 503 -8.783 -12.624 -6.013 1.00 1.50 O ATOM 1671 CG2 THR A 503 -6.614 -11.820 -5.733 1.00 34.44 C ATOM 0 H THR A 503 -9.403 -13.396 -7.918 1.00 14.23 H new ATOM 0 HA THR A 503 -7.798 -11.171 -7.985 1.00 62.44 H new ATOM 0 HB THR A 503 -7.042 -13.750 -6.591 1.00 71.32 H new ATOM 0 HG1 THR A 503 -9.236 -13.493 -6.033 1.00 1.50 H new ATOM 0 HG21 THR A 503 -6.526 -12.221 -4.723 1.00 34.44 H new ATOM 0 HG22 THR A 503 -5.623 -11.741 -6.180 1.00 34.44 H new ATOM 0 HG23 THR A 503 -7.073 -10.832 -5.693 1.00 34.44 H new ATOM 1679 N ALA A 504 -6.146 -13.738 -9.168 1.00 71.51 N ATOM 1680 CA ALA A 504 -4.999 -14.097 -9.987 1.00 4.40 C ATOM 1681 C ALA A 504 -4.955 -13.195 -11.221 1.00 50.31 C ATOM 1682 O ALA A 504 -3.887 -12.740 -11.625 1.00 43.21 O ATOM 1683 CB ALA A 504 -5.076 -15.581 -10.352 1.00 63.25 C ATOM 0 H ALA A 504 -6.704 -14.529 -8.845 1.00 71.51 H new ATOM 0 HA ALA A 504 -4.072 -13.945 -9.435 1.00 4.40 H new ATOM 0 HB1 ALA A 504 -4.216 -15.850 -10.966 1.00 63.25 H new ATOM 0 HB2 ALA A 504 -5.073 -16.180 -9.442 1.00 63.25 H new ATOM 0 HB3 ALA A 504 -5.993 -15.772 -10.909 1.00 63.25 H new ATOM 1689 N SER A 505 -6.132 -12.963 -11.787 1.00 45.30 N ATOM 1690 CA SER A 505 -6.242 -12.122 -12.967 1.00 2.34 C ATOM 1691 C SER A 505 -6.159 -10.648 -12.568 1.00 52.23 C ATOM 1692 O SER A 505 -5.738 -9.808 -13.364 1.00 21.25 O ATOM 1693 CB SER A 505 -7.545 -12.398 -13.718 1.00 54.43 C ATOM 1694 OG SER A 505 -8.020 -11.241 -14.404 1.00 31.14 O ATOM 0 H SER A 505 -7.017 -13.343 -11.450 1.00 45.30 H new ATOM 0 HA SER A 505 -5.413 -12.357 -13.635 1.00 2.34 H new ATOM 0 HB2 SER A 505 -7.387 -13.205 -14.434 1.00 54.43 H new ATOM 0 HB3 SER A 505 -8.304 -12.740 -13.014 1.00 54.43 H new ATOM 0 HG SER A 505 -8.853 -11.458 -14.873 1.00 31.14 H new ATOM 1699 N LEU A 506 -6.568 -10.376 -11.338 1.00 1.24 N ATOM 1700 CA LEU A 506 -6.546 -9.016 -10.825 1.00 73.23 C ATOM 1701 C LEU A 506 -5.095 -8.554 -10.679 1.00 70.13 C ATOM 1702 O LEU A 506 -4.802 -7.365 -10.797 1.00 3.33 O ATOM 1703 CB LEU A 506 -7.355 -8.919 -9.531 1.00 4.32 C ATOM 1704 CG LEU A 506 -8.826 -9.330 -9.626 1.00 23.23 C ATOM 1705 CD1 LEU A 506 -9.460 -9.427 -8.237 1.00 40.34 C ATOM 1706 CD2 LEU A 506 -9.601 -8.385 -10.545 1.00 41.32 C ATOM 0 H LEU A 506 -6.917 -11.074 -10.681 1.00 1.24 H new ATOM 0 HA LEU A 506 -7.028 -8.336 -11.527 1.00 73.23 H new ATOM 0 HB2 LEU A 506 -6.873 -9.541 -8.777 1.00 4.32 H new ATOM 0 HB3 LEU A 506 -7.308 -7.891 -9.173 1.00 4.32 H new ATOM 0 HG LEU A 506 -8.874 -10.324 -10.071 1.00 23.23 H new ATOM 0 HD11 LEU A 506 -10.505 -9.721 -8.334 1.00 40.34 H new ATOM 0 HD12 LEU A 506 -8.927 -10.171 -7.645 1.00 40.34 H new ATOM 0 HD13 LEU A 506 -9.400 -8.458 -7.741 1.00 40.34 H new ATOM 0 HD21 LEU A 506 -10.643 -8.700 -10.595 1.00 41.32 H new ATOM 0 HD22 LEU A 506 -9.547 -7.370 -10.152 1.00 41.32 H new ATOM 0 HD23 LEU A 506 -9.166 -8.411 -11.544 1.00 41.32 H new ATOM 1717 N LEU A 507 -4.223 -9.520 -10.424 1.00 55.21 N ATOM 1718 CA LEU A 507 -2.808 -9.227 -10.261 1.00 53.52 C ATOM 1719 C LEU A 507 -2.001 -10.067 -11.251 1.00 13.42 C ATOM 1720 O LEU A 507 -0.838 -10.380 -11.001 1.00 32.03 O ATOM 1721 CB LEU A 507 -2.386 -9.419 -8.803 1.00 10.43 C ATOM 1722 CG LEU A 507 -2.938 -10.664 -8.104 1.00 13.44 C ATOM 1723 CD1 LEU A 507 -1.924 -11.225 -7.106 1.00 23.34 C ATOM 1724 CD2 LEU A 507 -4.288 -10.372 -7.447 1.00 11.20 C ATOM 0 H LEU A 507 -4.469 -10.505 -10.326 1.00 55.21 H new ATOM 0 HA LEU A 507 -2.606 -8.181 -10.492 1.00 53.52 H new ATOM 0 HB2 LEU A 507 -1.297 -9.456 -8.762 1.00 10.43 H new ATOM 0 HB3 LEU A 507 -2.696 -8.541 -8.237 1.00 10.43 H new ATOM 0 HG LEU A 507 -3.108 -11.432 -8.858 1.00 13.44 H new ATOM 0 HD11 LEU A 507 -2.340 -12.109 -6.623 1.00 23.34 H new ATOM 0 HD12 LEU A 507 -1.008 -11.496 -7.631 1.00 23.34 H new ATOM 0 HD13 LEU A 507 -1.700 -10.471 -6.352 1.00 23.34 H new ATOM 0 HD21 LEU A 507 -4.657 -11.273 -6.958 1.00 11.20 H new ATOM 0 HD22 LEU A 507 -4.169 -9.580 -6.707 1.00 11.20 H new ATOM 0 HD23 LEU A 507 -5.001 -10.054 -8.207 1.00 11.20 H new ATOM 1735 N SER A 508 -2.649 -10.409 -12.355 1.00 50.34 N ATOM 1736 CA SER A 508 -2.006 -11.206 -13.385 1.00 71.12 C ATOM 1737 C SER A 508 -1.025 -10.341 -14.180 1.00 31.45 C ATOM 1738 O SER A 508 -1.183 -10.169 -15.387 1.00 74.32 O ATOM 1739 CB SER A 508 -3.039 -11.835 -14.322 1.00 20.10 C ATOM 1740 OG SER A 508 -3.365 -13.169 -13.939 1.00 51.24 O ATOM 0 H SER A 508 -3.614 -10.148 -12.558 1.00 50.34 H new ATOM 0 HA SER A 508 -1.458 -12.013 -12.899 1.00 71.12 H new ATOM 0 HB2 SER A 508 -3.944 -11.227 -14.325 1.00 20.10 H new ATOM 0 HB3 SER A 508 -2.652 -11.835 -15.341 1.00 20.10 H new ATOM 0 HG SER A 508 -3.161 -13.296 -12.989 1.00 51.24 H new ATOM 1745 N GLY A 509 -0.034 -9.823 -13.471 1.00 63.42 N ATOM 1746 CA GLY A 509 0.973 -8.981 -14.095 1.00 23.01 C ATOM 1747 C GLY A 509 1.740 -8.175 -13.046 1.00 54.44 C ATOM 1748 O GLY A 509 2.913 -7.857 -13.238 1.00 1.10 O ATOM 0 H GLY A 509 0.094 -9.970 -12.470 1.00 63.42 H new ATOM 0 HA2 GLY A 509 1.668 -9.599 -14.663 1.00 23.01 H new ATOM 0 HA3 GLY A 509 0.497 -8.303 -14.803 1.00 23.01 H new ATOM 1752 N LEU A 510 1.048 -7.867 -11.959 1.00 53.32 N ATOM 1753 CA LEU A 510 1.650 -7.103 -10.880 1.00 33.41 C ATOM 1754 C LEU A 510 2.638 -7.992 -10.121 1.00 33.03 C ATOM 1755 O LEU A 510 2.911 -9.116 -10.537 1.00 63.20 O ATOM 1756 CB LEU A 510 0.567 -6.489 -9.989 1.00 31.42 C ATOM 1757 CG LEU A 510 -0.042 -5.177 -10.485 1.00 15.44 C ATOM 1758 CD1 LEU A 510 -1.055 -4.626 -9.478 1.00 62.32 C ATOM 1759 CD2 LEU A 510 1.047 -4.156 -10.820 1.00 74.02 C ATOM 0 H LEU A 510 0.076 -8.133 -11.802 1.00 53.32 H new ATOM 0 HA LEU A 510 2.217 -6.262 -11.279 1.00 33.41 H new ATOM 0 HB2 LEU A 510 -0.235 -7.218 -9.871 1.00 31.42 H new ATOM 0 HB3 LEU A 510 0.991 -6.319 -8.999 1.00 31.42 H new ATOM 0 HG LEU A 510 -0.584 -5.382 -11.408 1.00 15.44 H new ATOM 0 HD11 LEU A 510 -1.473 -3.693 -9.856 1.00 62.32 H new ATOM 0 HD12 LEU A 510 -1.857 -5.351 -9.335 1.00 62.32 H new ATOM 0 HD13 LEU A 510 -0.558 -4.442 -8.526 1.00 62.32 H new ATOM 0 HD21 LEU A 510 0.585 -3.233 -11.170 1.00 74.02 H new ATOM 0 HD22 LEU A 510 1.639 -3.950 -9.928 1.00 74.02 H new ATOM 0 HD23 LEU A 510 1.694 -4.557 -11.601 1.00 74.02 H new ATOM 1770 N VAL A 511 3.146 -7.454 -9.023 1.00 40.10 N ATOM 1771 CA VAL A 511 4.098 -8.183 -8.203 1.00 24.23 C ATOM 1772 C VAL A 511 3.507 -8.393 -6.807 1.00 72.24 C ATOM 1773 O VAL A 511 3.549 -7.492 -5.970 1.00 64.23 O ATOM 1774 CB VAL A 511 5.440 -7.449 -8.180 1.00 22.35 C ATOM 1775 CG1 VAL A 511 6.235 -7.801 -6.922 1.00 63.22 C ATOM 1776 CG2 VAL A 511 6.251 -7.751 -9.442 1.00 73.25 C ATOM 0 H VAL A 511 2.916 -6.521 -8.681 1.00 40.10 H new ATOM 0 HA VAL A 511 4.290 -9.169 -8.626 1.00 24.23 H new ATOM 0 HB VAL A 511 5.236 -6.378 -8.160 1.00 22.35 H new ATOM 0 HG11 VAL A 511 7.185 -7.266 -6.930 1.00 63.22 H new ATOM 0 HG12 VAL A 511 5.664 -7.514 -6.039 1.00 63.22 H new ATOM 0 HG13 VAL A 511 6.423 -8.874 -6.899 1.00 63.22 H new ATOM 0 HG21 VAL A 511 7.200 -7.217 -9.401 1.00 73.25 H new ATOM 0 HG22 VAL A 511 6.440 -8.823 -9.505 1.00 73.25 H new ATOM 0 HG23 VAL A 511 5.691 -7.429 -10.320 1.00 73.25 H new ATOM 1786 N ARG A 512 2.970 -9.585 -6.599 1.00 30.15 N ATOM 1787 CA ARG A 512 2.372 -9.924 -5.319 1.00 55.32 C ATOM 1788 C ARG A 512 3.447 -10.003 -4.234 1.00 41.20 C ATOM 1789 O ARG A 512 4.385 -10.791 -4.340 1.00 22.33 O ATOM 1790 CB ARG A 512 1.633 -11.262 -5.392 1.00 53.22 C ATOM 1791 CG ARG A 512 0.511 -11.326 -4.355 1.00 4.32 C ATOM 1792 CD ARG A 512 -0.183 -12.691 -4.382 1.00 44.03 C ATOM 1793 NE ARG A 512 0.827 -13.771 -4.428 1.00 53.11 N ATOM 1794 CZ ARG A 512 1.348 -14.270 -5.571 1.00 40.04 C ATOM 1795 NH1 ARG A 512 0.957 -13.788 -6.769 1.00 72.32 N ATOM 1796 NH2 ARG A 512 2.246 -15.235 -5.495 1.00 55.30 N ATOM 0 H ARG A 512 2.936 -10.329 -7.296 1.00 30.15 H new ATOM 0 HA ARG A 512 1.657 -9.140 -5.071 1.00 55.32 H new ATOM 0 HB2 ARG A 512 1.218 -11.398 -6.391 1.00 53.22 H new ATOM 0 HB3 ARG A 512 2.335 -12.079 -5.224 1.00 53.22 H new ATOM 0 HG2 ARG A 512 0.918 -11.141 -3.361 1.00 4.32 H new ATOM 0 HG3 ARG A 512 -0.217 -10.540 -4.553 1.00 4.32 H new ATOM 0 HD2 ARG A 512 -0.811 -12.806 -3.499 1.00 44.03 H new ATOM 0 HD3 ARG A 512 -0.839 -12.758 -5.250 1.00 44.03 H new ATOM 0 HE ARG A 512 1.150 -14.163 -3.543 1.00 53.11 H new ATOM 0 HH11 ARG A 512 0.263 -13.042 -6.817 1.00 72.32 H new ATOM 0 HH12 ARG A 512 1.355 -14.170 -7.627 1.00 72.32 H new ATOM 0 HH21 ARG A 512 2.536 -15.592 -4.584 1.00 55.30 H new ATOM 0 HH22 ARG A 512 2.650 -15.624 -6.347 1.00 55.30 H new ATOM 1806 N LEU A 513 3.276 -9.174 -3.214 1.00 3.13 N ATOM 1807 CA LEU A 513 4.221 -9.141 -2.111 1.00 43.21 C ATOM 1808 C LEU A 513 3.840 -10.212 -1.086 1.00 35.24 C ATOM 1809 O LEU A 513 2.682 -10.305 -0.680 1.00 34.21 O ATOM 1810 CB LEU A 513 4.307 -7.731 -1.523 1.00 64.34 C ATOM 1811 CG LEU A 513 5.591 -6.955 -1.828 1.00 55.31 C ATOM 1812 CD1 LEU A 513 5.947 -7.048 -3.312 1.00 14.54 C ATOM 1813 CD2 LEU A 513 5.479 -5.504 -1.355 1.00 53.31 C ATOM 0 H LEU A 513 2.497 -8.521 -3.129 1.00 3.13 H new ATOM 0 HA LEU A 513 5.225 -9.378 -2.462 1.00 43.21 H new ATOM 0 HB2 LEU A 513 3.460 -7.153 -1.892 1.00 64.34 H new ATOM 0 HB3 LEU A 513 4.197 -7.803 -0.441 1.00 64.34 H new ATOM 0 HG LEU A 513 6.409 -7.413 -1.271 1.00 55.31 H new ATOM 0 HD11 LEU A 513 6.863 -6.488 -3.502 1.00 14.54 H new ATOM 0 HD12 LEU A 513 6.096 -8.092 -3.586 1.00 14.54 H new ATOM 0 HD13 LEU A 513 5.136 -6.629 -3.908 1.00 14.54 H new ATOM 0 HD21 LEU A 513 6.404 -4.974 -1.583 1.00 53.31 H new ATOM 0 HD22 LEU A 513 4.647 -5.018 -1.865 1.00 53.31 H new ATOM 0 HD23 LEU A 513 5.306 -5.484 -0.279 1.00 53.31 H new ATOM 1824 N ASP A 514 4.836 -10.993 -0.696 1.00 73.22 N ATOM 1825 CA ASP A 514 4.621 -12.053 0.273 1.00 1.13 C ATOM 1826 C ASP A 514 5.664 -11.940 1.386 1.00 4.42 C ATOM 1827 O ASP A 514 6.834 -11.670 1.121 1.00 23.32 O ATOM 1828 CB ASP A 514 4.771 -13.432 -0.375 1.00 71.13 C ATOM 1829 CG ASP A 514 4.728 -13.434 -1.905 1.00 5.21 C ATOM 1830 OD1 ASP A 514 5.565 -14.064 -2.566 1.00 73.40 O ATOM 1831 OD2 ASP A 514 3.770 -12.744 -2.424 1.00 4.02 O ATOM 0 H ASP A 514 5.795 -10.913 -1.034 1.00 73.22 H new ATOM 0 HA ASP A 514 3.611 -11.948 0.668 1.00 1.13 H new ATOM 0 HB2 ASP A 514 5.716 -13.868 -0.052 1.00 71.13 H new ATOM 0 HB3 ASP A 514 3.978 -14.080 -0.003 1.00 71.13 H new ATOM 1836 N GLU A 515 5.201 -12.152 2.611 1.00 32.01 N ATOM 1837 CA GLU A 515 6.078 -12.077 3.766 1.00 33.33 C ATOM 1838 C GLU A 515 6.788 -13.416 3.982 1.00 74.00 C ATOM 1839 O GLU A 515 7.833 -13.471 4.627 1.00 4.14 O ATOM 1840 CB GLU A 515 5.305 -11.658 5.016 1.00 3.32 C ATOM 1841 CG GLU A 515 6.153 -11.845 6.275 1.00 24.41 C ATOM 1842 CD GLU A 515 7.302 -10.837 6.317 1.00 33.32 C ATOM 1843 OE1 GLU A 515 7.062 -9.628 6.452 1.00 31.24 O ATOM 1844 OE2 GLU A 515 8.482 -11.349 6.204 1.00 73.03 O ATOM 0 H GLU A 515 4.230 -12.376 2.827 1.00 32.01 H new ATOM 0 HA GLU A 515 6.833 -11.315 3.575 1.00 33.33 H new ATOM 0 HB2 GLU A 515 5.004 -10.614 4.928 1.00 3.32 H new ATOM 0 HB3 GLU A 515 4.392 -12.248 5.098 1.00 3.32 H new ATOM 0 HG2 GLU A 515 5.528 -11.726 7.160 1.00 24.41 H new ATOM 0 HG3 GLU A 515 6.553 -12.859 6.301 1.00 24.41 H new ATOM 1850 N HIS A 516 6.190 -14.461 3.430 1.00 51.41 N ATOM 1851 CA HIS A 516 6.752 -15.795 3.554 1.00 3.31 C ATOM 1852 C HIS A 516 7.560 -16.131 2.300 1.00 23.55 C ATOM 1853 O HIS A 516 7.930 -17.285 2.085 1.00 70.32 O ATOM 1854 CB HIS A 516 5.654 -16.822 3.843 1.00 52.14 C ATOM 1855 CG HIS A 516 4.403 -16.633 3.019 1.00 54.54 C ATOM 1856 ND1 HIS A 516 3.154 -17.053 3.444 1.00 54.12 N ATOM 1857 CD2 HIS A 516 4.220 -16.062 1.793 1.00 64.42 C ATOM 1858 CE1 HIS A 516 2.269 -16.746 2.507 1.00 11.25 C ATOM 1859 NE2 HIS A 516 2.932 -16.132 1.485 1.00 13.10 N ATOM 0 H HIS A 516 5.322 -14.411 2.896 1.00 51.41 H new ATOM 0 HA HIS A 516 7.434 -15.828 4.403 1.00 3.31 H new ATOM 0 HB2 HIS A 516 6.049 -17.822 3.661 1.00 52.14 H new ATOM 0 HB3 HIS A 516 5.392 -16.770 4.900 1.00 52.14 H new ATOM 0 HD2 HIS A 516 4.993 -15.627 1.178 1.00 64.42 H new ATOM 0 HE1 HIS A 516 1.209 -16.947 2.546 1.00 11.25 H new ATOM 0 HE2 HIS A 516 2.507 -15.784 0.625 1.00 13.10 H new ATOM 1866 N SER A 517 7.811 -15.102 1.504 1.00 5.14 N ATOM 1867 CA SER A 517 8.570 -15.273 0.276 1.00 62.22 C ATOM 1868 C SER A 517 10.035 -14.895 0.509 1.00 31.03 C ATOM 1869 O SER A 517 10.325 -13.914 1.191 1.00 13.31 O ATOM 1870 CB SER A 517 7.979 -14.434 -0.857 1.00 54.33 C ATOM 1871 OG SER A 517 8.924 -14.203 -1.900 1.00 42.33 O ATOM 0 H SER A 517 7.502 -14.147 1.685 1.00 5.14 H new ATOM 0 HA SER A 517 8.515 -16.321 -0.018 1.00 62.22 H new ATOM 0 HB2 SER A 517 7.105 -14.941 -1.266 1.00 54.33 H new ATOM 0 HB3 SER A 517 7.637 -13.478 -0.460 1.00 54.33 H new ATOM 0 HG SER A 517 8.546 -13.575 -2.550 1.00 42.33 H new ATOM 1876 N GLN A 518 10.918 -15.695 -0.071 1.00 24.00 N ATOM 1877 CA GLN A 518 12.344 -15.457 0.066 1.00 60.01 C ATOM 1878 C GLN A 518 12.829 -14.496 -1.023 1.00 45.03 C ATOM 1879 O GLN A 518 13.988 -14.085 -1.023 1.00 61.41 O ATOM 1880 CB GLN A 518 13.127 -16.771 0.024 1.00 32.04 C ATOM 1881 CG GLN A 518 13.310 -17.253 -1.417 1.00 31.45 C ATOM 1882 CD GLN A 518 14.611 -16.714 -2.015 1.00 51.53 C ATOM 1883 OE1 GLN A 518 15.706 -17.105 -1.640 1.00 11.42 O ATOM 1884 NE2 GLN A 518 14.432 -15.798 -2.962 1.00 34.42 N ATOM 0 H GLN A 518 10.673 -16.508 -0.636 1.00 24.00 H new ATOM 0 HA GLN A 518 12.523 -14.996 1.037 1.00 60.01 H new ATOM 0 HB2 GLN A 518 14.102 -16.633 0.492 1.00 32.04 H new ATOM 0 HB3 GLN A 518 12.601 -17.531 0.602 1.00 32.04 H new ATOM 0 HG2 GLN A 518 13.319 -18.343 -1.441 1.00 31.45 H new ATOM 0 HG3 GLN A 518 12.465 -16.927 -2.023 1.00 31.45 H new ATOM 0 HE21 GLN A 518 13.488 -15.517 -3.227 1.00 34.42 H new ATOM 0 HE22 GLN A 518 15.238 -15.377 -3.423 1.00 34.42 H new ATOM 1891 N ILE A 519 11.916 -14.165 -1.924 1.00 12.34 N ATOM 1892 CA ILE A 519 12.234 -13.260 -3.015 1.00 20.51 C ATOM 1893 C ILE A 519 11.534 -11.920 -2.782 1.00 12.40 C ATOM 1894 O ILE A 519 11.993 -10.884 -3.262 1.00 2.32 O ATOM 1895 CB ILE A 519 11.898 -13.904 -4.362 1.00 24.15 C ATOM 1896 CG1 ILE A 519 11.227 -12.898 -5.298 1.00 33.31 C ATOM 1897 CG2 ILE A 519 11.048 -15.162 -4.170 1.00 21.32 C ATOM 1898 CD1 ILE A 519 12.229 -11.847 -5.782 1.00 42.24 C ATOM 0 H ILE A 519 10.955 -14.508 -1.921 1.00 12.34 H new ATOM 0 HA ILE A 519 13.305 -13.059 -3.043 1.00 20.51 H new ATOM 0 HB ILE A 519 12.830 -14.213 -4.835 1.00 24.15 H new ATOM 0 HG12 ILE A 519 10.801 -13.421 -6.154 1.00 33.31 H new ATOM 0 HG13 ILE A 519 10.402 -12.408 -4.780 1.00 33.31 H new ATOM 0 HG21 ILE A 519 10.823 -15.601 -5.142 1.00 21.32 H new ATOM 0 HG22 ILE A 519 11.597 -15.883 -3.565 1.00 21.32 H new ATOM 0 HG23 ILE A 519 10.118 -14.899 -3.666 1.00 21.32 H new ATOM 0 HD11 ILE A 519 11.726 -11.144 -6.446 1.00 42.24 H new ATOM 0 HD12 ILE A 519 12.635 -11.310 -4.925 1.00 42.24 H new ATOM 0 HD13 ILE A 519 13.040 -12.338 -6.320 1.00 42.24 H new ATOM 1909 N PHE A 520 10.434 -11.984 -2.046 1.00 15.44 N ATOM 1910 CA PHE A 520 9.665 -10.788 -1.744 1.00 61.43 C ATOM 1911 C PHE A 520 10.587 -9.603 -1.451 1.00 23.45 C ATOM 1912 O PHE A 520 10.279 -8.468 -1.809 1.00 21.21 O ATOM 1913 CB PHE A 520 8.835 -11.094 -0.497 1.00 3.33 C ATOM 1914 CG PHE A 520 8.563 -9.874 0.386 1.00 23.31 C ATOM 1915 CD1 PHE A 520 8.130 -8.714 -0.175 1.00 44.41 C ATOM 1916 CD2 PHE A 520 8.757 -9.950 1.729 1.00 4.13 C ATOM 1917 CE1 PHE A 520 7.879 -7.580 0.644 1.00 0.45 C ATOM 1918 CE2 PHE A 520 8.506 -8.818 2.548 1.00 40.12 C ATOM 1919 CZ PHE A 520 8.072 -7.657 1.988 1.00 61.24 C ATOM 0 H PHE A 520 10.057 -12.845 -1.650 1.00 15.44 H new ATOM 0 HA PHE A 520 9.038 -10.524 -2.595 1.00 61.43 H new ATOM 0 HB2 PHE A 520 7.883 -11.527 -0.804 1.00 3.33 H new ATOM 0 HB3 PHE A 520 9.352 -11.849 0.095 1.00 3.33 H new ATOM 0 HD1 PHE A 520 7.977 -8.654 -1.242 1.00 44.41 H new ATOM 0 HD2 PHE A 520 9.102 -10.872 2.173 1.00 4.13 H new ATOM 0 HE1 PHE A 520 7.535 -6.658 0.199 1.00 0.45 H new ATOM 0 HE2 PHE A 520 8.660 -8.879 3.615 1.00 40.12 H new ATOM 0 HZ PHE A 520 7.881 -6.796 2.611 1.00 61.24 H new ATOM 1928 N ALA A 521 11.701 -9.909 -0.800 1.00 34.02 N ATOM 1929 CA ALA A 521 12.670 -8.883 -0.455 1.00 64.21 C ATOM 1930 C ALA A 521 13.069 -8.116 -1.717 1.00 32.30 C ATOM 1931 O ALA A 521 13.091 -6.887 -1.720 1.00 22.32 O ATOM 1932 CB ALA A 521 13.872 -9.530 0.239 1.00 42.24 C ATOM 0 H ALA A 521 11.953 -10.852 -0.503 1.00 34.02 H new ATOM 0 HA ALA A 521 12.237 -8.165 0.242 1.00 64.21 H new ATOM 0 HB1 ALA A 521 14.600 -8.761 0.498 1.00 42.24 H new ATOM 0 HB2 ALA A 521 13.540 -10.036 1.146 1.00 42.24 H new ATOM 0 HB3 ALA A 521 14.333 -10.254 -0.432 1.00 42.24 H new ATOM 1938 N ARG A 522 13.372 -8.875 -2.760 1.00 34.35 N ATOM 1939 CA ARG A 522 13.768 -8.283 -4.026 1.00 15.35 C ATOM 1940 C ARG A 522 12.552 -7.684 -4.735 1.00 12.55 C ATOM 1941 O ARG A 522 12.697 -6.848 -5.626 1.00 2.23 O ATOM 1942 CB ARG A 522 14.423 -9.321 -4.940 1.00 2.23 C ATOM 1943 CG ARG A 522 15.801 -9.725 -4.410 1.00 35.30 C ATOM 1944 CD ARG A 522 15.674 -10.688 -3.229 1.00 24.05 C ATOM 1945 NE ARG A 522 17.005 -11.222 -2.865 1.00 11.30 N ATOM 1946 CZ ARG A 522 17.847 -10.626 -1.993 1.00 23.53 C ATOM 1947 NH1 ARG A 522 17.501 -9.471 -1.388 1.00 63.34 N ATOM 1948 NH2 ARG A 522 19.013 -11.192 -1.742 1.00 72.34 N ATOM 0 H ARG A 522 13.351 -9.895 -2.754 1.00 34.35 H new ATOM 0 HA ARG A 522 14.492 -7.497 -3.812 1.00 15.35 H new ATOM 0 HB2 ARG A 522 13.785 -10.202 -5.013 1.00 2.23 H new ATOM 0 HB3 ARG A 522 14.521 -8.914 -5.947 1.00 2.23 H new ATOM 0 HG2 ARG A 522 16.377 -10.195 -5.207 1.00 35.30 H new ATOM 0 HG3 ARG A 522 16.351 -8.836 -4.101 1.00 35.30 H new ATOM 0 HD2 ARG A 522 15.234 -10.173 -2.375 1.00 24.05 H new ATOM 0 HD3 ARG A 522 15.003 -11.507 -3.488 1.00 24.05 H new ATOM 0 HE ARG A 522 17.305 -12.095 -3.300 1.00 11.30 H new ATOM 0 HH11 ARG A 522 16.598 -9.041 -1.588 1.00 63.34 H new ATOM 0 HH12 ARG A 522 18.143 -9.027 -0.731 1.00 63.34 H new ATOM 0 HH21 ARG A 522 19.266 -12.066 -2.204 1.00 72.34 H new ATOM 0 HH22 ARG A 522 19.661 -10.756 -1.086 1.00 72.34 H new ATOM 1958 N LYS A 523 11.379 -8.136 -4.315 1.00 12.03 N ATOM 1959 CA LYS A 523 10.138 -7.657 -4.900 1.00 73.53 C ATOM 1960 C LYS A 523 9.830 -6.261 -4.356 1.00 23.03 C ATOM 1961 O LYS A 523 9.401 -5.381 -5.101 1.00 5.54 O ATOM 1962 CB LYS A 523 9.013 -8.669 -4.673 1.00 60.54 C ATOM 1963 CG LYS A 523 9.436 -10.069 -5.121 1.00 34.02 C ATOM 1964 CD LYS A 523 9.947 -10.052 -6.564 1.00 11.50 C ATOM 1965 CE LYS A 523 8.906 -9.446 -7.507 1.00 1.42 C ATOM 1966 NZ LYS A 523 8.970 -10.094 -8.836 1.00 63.11 N ATOM 0 H LYS A 523 11.262 -8.829 -3.576 1.00 12.03 H new ATOM 0 HA LYS A 523 10.237 -7.564 -5.982 1.00 73.53 H new ATOM 0 HB2 LYS A 523 8.743 -8.687 -3.617 1.00 60.54 H new ATOM 0 HB3 LYS A 523 8.125 -8.360 -5.224 1.00 60.54 H new ATOM 0 HG2 LYS A 523 10.216 -10.446 -4.460 1.00 34.02 H new ATOM 0 HG3 LYS A 523 8.591 -10.752 -5.039 1.00 34.02 H new ATOM 0 HD2 LYS A 523 10.871 -9.477 -6.619 1.00 11.50 H new ATOM 0 HD3 LYS A 523 10.183 -11.067 -6.882 1.00 11.50 H new ATOM 0 HE2 LYS A 523 7.909 -9.568 -7.084 1.00 1.42 H new ATOM 0 HE3 LYS A 523 9.080 -8.375 -7.610 1.00 1.42 H new ATOM 0 HZ1 LYS A 523 8.510 -9.485 -9.542 1.00 63.11 H new ATOM 0 HZ2 LYS A 523 9.964 -10.242 -9.102 1.00 63.11 H new ATOM 0 HZ3 LYS A 523 8.481 -11.011 -8.799 1.00 63.11 H new ATOM 1975 N VAL A 524 10.060 -6.102 -3.061 1.00 64.40 N ATOM 1976 CA VAL A 524 9.813 -4.827 -2.409 1.00 45.44 C ATOM 1977 C VAL A 524 10.947 -3.857 -2.743 1.00 71.41 C ATOM 1978 O VAL A 524 10.709 -2.671 -2.969 1.00 21.24 O ATOM 1979 CB VAL A 524 9.630 -5.038 -0.903 1.00 50.24 C ATOM 1980 CG1 VAL A 524 10.980 -5.026 -0.181 1.00 31.13 C ATOM 1981 CG2 VAL A 524 8.685 -3.988 -0.313 1.00 31.24 C ATOM 0 H VAL A 524 10.415 -6.834 -2.446 1.00 64.40 H new ATOM 0 HA VAL A 524 8.889 -4.383 -2.778 1.00 45.44 H new ATOM 0 HB VAL A 524 9.177 -6.018 -0.754 1.00 50.24 H new ATOM 0 HG11 VAL A 524 10.823 -5.178 0.887 1.00 31.13 H new ATOM 0 HG12 VAL A 524 11.609 -5.825 -0.572 1.00 31.13 H new ATOM 0 HG13 VAL A 524 11.471 -4.066 -0.343 1.00 31.13 H new ATOM 0 HG21 VAL A 524 8.572 -4.160 0.757 1.00 31.24 H new ATOM 0 HG22 VAL A 524 9.098 -2.993 -0.479 1.00 31.24 H new ATOM 0 HG23 VAL A 524 7.711 -4.062 -0.797 1.00 31.24 H new ATOM 1991 N ALA A 525 12.157 -4.398 -2.766 1.00 44.24 N ATOM 1992 CA ALA A 525 13.330 -3.595 -3.071 1.00 1.53 C ATOM 1993 C ALA A 525 13.365 -3.301 -4.572 1.00 22.03 C ATOM 1994 O ALA A 525 14.244 -2.584 -5.047 1.00 31.10 O ATOM 1995 CB ALA A 525 14.585 -4.323 -2.589 1.00 62.32 C ATOM 0 H ALA A 525 12.350 -5.382 -2.579 1.00 44.24 H new ATOM 0 HA ALA A 525 13.288 -2.639 -2.550 1.00 1.53 H new ATOM 0 HB1 ALA A 525 15.465 -3.722 -2.817 1.00 62.32 H new ATOM 0 HB2 ALA A 525 14.523 -4.481 -1.512 1.00 62.32 H new ATOM 0 HB3 ALA A 525 14.663 -5.286 -3.093 1.00 62.32 H new ATOM 2001 N ASN A 526 12.399 -3.872 -5.278 1.00 61.24 N ATOM 2002 CA ASN A 526 12.309 -3.680 -6.715 1.00 44.34 C ATOM 2003 C ASN A 526 11.302 -2.568 -7.015 1.00 12.24 C ATOM 2004 O ASN A 526 11.504 -1.772 -7.930 1.00 65.34 O ATOM 2005 CB ASN A 526 11.828 -4.954 -7.411 1.00 12.12 C ATOM 2006 CG ASN A 526 13.008 -5.755 -7.966 1.00 70.20 C ATOM 2007 OD1 ASN A 526 14.091 -5.239 -8.193 1.00 52.51 O ATOM 2008 ND2 ASN A 526 12.741 -7.041 -8.169 1.00 33.23 N ATOM 0 H ASN A 526 11.672 -4.468 -4.881 1.00 61.24 H new ATOM 0 HA ASN A 526 13.301 -3.420 -7.083 1.00 44.34 H new ATOM 0 HB2 ASN A 526 11.267 -5.568 -6.706 1.00 12.12 H new ATOM 0 HB3 ASN A 526 11.147 -4.695 -8.221 1.00 12.12 H new ATOM 0 HD21 ASN A 526 13.464 -7.660 -8.536 1.00 33.23 H new ATOM 0 HD22 ASN A 526 11.813 -7.409 -7.958 1.00 33.23 H new ATOM 2014 N THR A 527 10.237 -2.550 -6.226 1.00 2.34 N ATOM 2015 CA THR A 527 9.197 -1.550 -6.395 1.00 14.42 C ATOM 2016 C THR A 527 9.452 -0.354 -5.475 1.00 74.21 C ATOM 2017 O THR A 527 9.501 0.787 -5.932 1.00 53.11 O ATOM 2018 CB THR A 527 7.846 -2.225 -6.152 1.00 21.33 C ATOM 2019 OG1 THR A 527 6.894 -1.188 -6.367 1.00 71.44 O ATOM 2020 CG2 THR A 527 7.644 -2.620 -4.688 1.00 3.33 C ATOM 0 H THR A 527 10.072 -3.212 -5.468 1.00 2.34 H new ATOM 0 HA THR A 527 9.198 -1.148 -7.408 1.00 14.42 H new ATOM 0 HB THR A 527 7.766 -3.111 -6.781 1.00 21.33 H new ATOM 0 HG1 THR A 527 7.333 -0.426 -6.800 1.00 71.44 H new ATOM 0 HG21 THR A 527 6.670 -3.095 -4.570 1.00 3.33 H new ATOM 0 HG22 THR A 527 8.426 -3.317 -4.388 1.00 3.33 H new ATOM 0 HG23 THR A 527 7.692 -1.730 -4.061 1.00 3.33 H new ATOM 2028 N PHE A 528 9.609 -0.656 -4.195 1.00 20.11 N ATOM 2029 CA PHE A 528 9.859 0.379 -3.208 1.00 44.54 C ATOM 2030 C PHE A 528 11.355 0.669 -3.083 1.00 70.44 C ATOM 2031 O PHE A 528 11.902 0.673 -1.982 1.00 42.10 O ATOM 2032 CB PHE A 528 9.340 -0.147 -1.867 1.00 63.20 C ATOM 2033 CG PHE A 528 7.819 -0.077 -1.717 1.00 24.33 C ATOM 2034 CD1 PHE A 528 7.186 1.124 -1.767 1.00 61.22 C ATOM 2035 CD2 PHE A 528 7.102 -1.217 -1.532 1.00 31.53 C ATOM 2036 CE1 PHE A 528 5.774 1.190 -1.627 1.00 61.12 C ATOM 2037 CE2 PHE A 528 5.690 -1.153 -1.392 1.00 20.33 C ATOM 2038 CZ PHE A 528 5.056 0.049 -1.442 1.00 73.22 C ATOM 0 H PHE A 528 9.568 -1.603 -3.819 1.00 20.11 H new ATOM 0 HA PHE A 528 9.361 1.302 -3.504 1.00 44.54 H new ATOM 0 HB2 PHE A 528 9.659 -1.182 -1.746 1.00 63.20 H new ATOM 0 HB3 PHE A 528 9.801 0.425 -1.061 1.00 63.20 H new ATOM 0 HD1 PHE A 528 7.757 2.029 -1.913 1.00 61.22 H new ATOM 0 HD2 PHE A 528 7.606 -2.171 -1.491 1.00 31.53 H new ATOM 0 HE1 PHE A 528 5.271 2.145 -1.667 1.00 61.12 H new ATOM 0 HE2 PHE A 528 5.120 -2.059 -1.246 1.00 20.33 H new ATOM 0 HZ PHE A 528 3.982 0.098 -1.335 1.00 73.22 H new ATOM 2047 N LYS A 529 11.976 0.908 -4.229 1.00 11.22 N ATOM 2048 CA LYS A 529 13.399 1.200 -4.263 1.00 34.11 C ATOM 2049 C LYS A 529 13.667 2.502 -3.507 1.00 51.21 C ATOM 2050 O LYS A 529 12.782 3.349 -3.389 1.00 34.32 O ATOM 2051 CB LYS A 529 13.909 1.211 -5.705 1.00 34.23 C ATOM 2052 CG LYS A 529 14.068 -0.215 -6.241 1.00 42.13 C ATOM 2053 CD LYS A 529 14.134 -0.222 -7.770 1.00 54.23 C ATOM 2054 CE LYS A 529 14.941 -1.418 -8.278 1.00 10.42 C ATOM 2055 NZ LYS A 529 15.606 -1.088 -9.559 1.00 3.51 N ATOM 0 H LYS A 529 11.519 0.905 -5.141 1.00 11.22 H new ATOM 0 HA LYS A 529 13.961 0.415 -3.756 1.00 34.11 H new ATOM 0 HB2 LYS A 529 13.214 1.765 -6.336 1.00 34.23 H new ATOM 0 HB3 LYS A 529 14.866 1.730 -5.752 1.00 34.23 H new ATOM 0 HG2 LYS A 529 14.974 -0.662 -5.832 1.00 42.13 H new ATOM 0 HG3 LYS A 529 13.231 -0.828 -5.907 1.00 42.13 H new ATOM 0 HD2 LYS A 529 13.125 -0.258 -8.181 1.00 54.23 H new ATOM 0 HD3 LYS A 529 14.588 0.704 -8.122 1.00 54.23 H new ATOM 0 HE2 LYS A 529 15.688 -1.702 -7.536 1.00 10.42 H new ATOM 0 HE3 LYS A 529 14.284 -2.277 -8.413 1.00 10.42 H new ATOM 0 HZ1 LYS A 529 16.150 -1.911 -9.890 1.00 3.51 H new ATOM 0 HZ2 LYS A 529 14.888 -0.839 -10.269 1.00 3.51 H new ATOM 0 HZ3 LYS A 529 16.248 -0.282 -9.419 1.00 3.51 H new ATOM 2064 N PRO A 530 14.922 2.626 -3.001 1.00 31.54 N ATOM 2065 CA PRO A 530 15.318 3.811 -2.259 1.00 33.02 C ATOM 2066 C PRO A 530 15.543 4.997 -3.200 1.00 62.21 C ATOM 2067 O PRO A 530 15.296 6.144 -2.828 1.00 33.43 O ATOM 2068 CB PRO A 530 16.574 3.403 -1.507 1.00 51.15 C ATOM 2069 CG PRO A 530 17.097 2.162 -2.210 1.00 22.04 C ATOM 2070 CD PRO A 530 15.997 1.644 -3.121 1.00 51.14 C ATOM 0 HA PRO A 530 14.548 4.151 -1.566 1.00 33.02 H new ATOM 0 HB2 PRO A 530 17.315 4.202 -1.523 1.00 51.15 H new ATOM 0 HB3 PRO A 530 16.352 3.194 -0.460 1.00 51.15 H new ATOM 0 HG2 PRO A 530 17.991 2.398 -2.787 1.00 22.04 H new ATOM 0 HG3 PRO A 530 17.380 1.401 -1.482 1.00 22.04 H new ATOM 0 HD2 PRO A 530 16.343 1.560 -4.151 1.00 51.14 H new ATOM 0 HD3 PRO A 530 15.663 0.653 -2.815 1.00 51.14 H new ATOM 2075 N HIS A 531 16.008 4.680 -4.399 1.00 33.14 N ATOM 2076 CA HIS A 531 16.269 5.704 -5.396 1.00 60.12 C ATOM 2077 C HIS A 531 14.943 6.224 -5.957 1.00 21.21 C ATOM 2078 O HIS A 531 14.925 7.184 -6.725 1.00 51.14 O ATOM 2079 CB HIS A 531 17.208 5.178 -6.483 1.00 4.22 C ATOM 2080 CG HIS A 531 16.496 4.541 -7.653 1.00 64.23 C ATOM 2081 ND1 HIS A 531 16.451 3.172 -7.848 1.00 42.20 N ATOM 2082 CD2 HIS A 531 15.802 5.100 -8.686 1.00 24.23 C ATOM 2083 CE1 HIS A 531 15.759 2.929 -8.952 1.00 72.25 C ATOM 2084 NE2 HIS A 531 15.358 4.125 -9.470 1.00 63.14 N ATOM 0 H HIS A 531 16.211 3.728 -4.703 1.00 33.14 H new ATOM 0 HA HIS A 531 16.782 6.546 -4.932 1.00 60.12 H new ATOM 0 HB2 HIS A 531 17.822 6.001 -6.849 1.00 4.22 H new ATOM 0 HB3 HIS A 531 17.886 4.447 -6.041 1.00 4.22 H new ATOM 0 HD1 HIS A 531 16.878 2.469 -7.245 1.00 42.20 H new ATOM 0 HD2 HIS A 531 15.641 6.157 -8.840 1.00 24.23 H new ATOM 0 HE1 HIS A 531 15.549 1.955 -9.368 1.00 72.25 H new ATOM 2091 N ARG A 532 13.868 5.564 -5.552 1.00 51.03 N ATOM 2092 CA ARG A 532 12.541 5.948 -6.004 1.00 23.03 C ATOM 2093 C ARG A 532 11.833 6.777 -4.930 1.00 20.21 C ATOM 2094 O ARG A 532 11.177 7.771 -5.239 1.00 35.45 O ATOM 2095 CB ARG A 532 11.694 4.717 -6.330 1.00 34.23 C ATOM 2096 CG ARG A 532 12.388 3.833 -7.369 1.00 63.22 C ATOM 2097 CD ARG A 532 12.408 4.510 -8.740 1.00 60.40 C ATOM 2098 NE ARG A 532 11.040 4.556 -9.302 1.00 70.52 N ATOM 2099 CZ ARG A 532 10.491 3.567 -10.040 1.00 21.21 C ATOM 2100 NH1 ARG A 532 11.191 2.446 -10.311 1.00 0.12 N ATOM 2101 NH2 ARG A 532 9.259 3.714 -10.492 1.00 72.42 N ATOM 0 H ARG A 532 13.888 4.766 -4.916 1.00 51.03 H new ATOM 0 HA ARG A 532 12.658 6.545 -6.909 1.00 23.03 H new ATOM 0 HB2 ARG A 532 11.515 4.143 -5.421 1.00 34.23 H new ATOM 0 HB3 ARG A 532 10.720 5.030 -6.706 1.00 34.23 H new ATOM 0 HG2 ARG A 532 13.408 3.622 -7.049 1.00 63.22 H new ATOM 0 HG3 ARG A 532 11.872 2.876 -7.440 1.00 63.22 H new ATOM 0 HD2 ARG A 532 12.807 5.520 -8.650 1.00 60.40 H new ATOM 0 HD3 ARG A 532 13.069 3.965 -9.414 1.00 60.40 H new ATOM 0 HE ARG A 532 10.476 5.387 -9.121 1.00 70.52 H new ATOM 0 HH11 ARG A 532 12.142 2.341 -9.958 1.00 0.12 H new ATOM 0 HH12 ARG A 532 10.769 1.704 -10.869 1.00 0.12 H new ATOM 0 HH21 ARG A 532 8.737 4.565 -10.282 1.00 72.42 H new ATOM 0 HH22 ARG A 532 8.829 2.977 -11.051 1.00 72.42 H new ATOM 2111 N LEU A 533 11.988 6.337 -3.691 1.00 24.43 N ATOM 2112 CA LEU A 533 11.371 7.025 -2.570 1.00 63.33 C ATOM 2113 C LEU A 533 12.024 8.398 -2.399 1.00 60.22 C ATOM 2114 O LEU A 533 11.340 9.420 -2.408 1.00 45.54 O ATOM 2115 CB LEU A 533 11.428 6.156 -1.311 1.00 3.10 C ATOM 2116 CG LEU A 533 10.810 4.762 -1.431 1.00 62.14 C ATOM 2117 CD1 LEU A 533 10.154 4.338 -0.115 1.00 45.45 C ATOM 2118 CD2 LEU A 533 9.834 4.693 -2.606 1.00 42.31 C ATOM 0 H LEU A 533 12.532 5.512 -3.438 1.00 24.43 H new ATOM 0 HA LEU A 533 10.312 7.196 -2.764 1.00 63.33 H new ATOM 0 HB2 LEU A 533 12.472 6.045 -1.017 1.00 3.10 H new ATOM 0 HB3 LEU A 533 10.924 6.687 -0.504 1.00 3.10 H new ATOM 0 HG LEU A 533 11.610 4.051 -1.636 1.00 62.14 H new ATOM 0 HD11 LEU A 533 9.722 3.343 -0.227 1.00 45.45 H new ATOM 0 HD12 LEU A 533 10.904 4.321 0.676 1.00 45.45 H new ATOM 0 HD13 LEU A 533 9.368 5.047 0.145 1.00 45.45 H new ATOM 0 HD21 LEU A 533 9.409 3.691 -2.668 1.00 42.31 H new ATOM 0 HD22 LEU A 533 9.034 5.418 -2.457 1.00 42.31 H new ATOM 0 HD23 LEU A 533 10.362 4.921 -3.532 1.00 42.31 H new ATOM 2129 N GLN A 534 13.340 8.378 -2.246 1.00 1.22 N ATOM 2130 CA GLN A 534 14.092 9.610 -2.074 1.00 1.53 C ATOM 2131 C GLN A 534 13.812 10.570 -3.231 1.00 10.41 C ATOM 2132 O GLN A 534 13.672 11.774 -3.022 1.00 33.31 O ATOM 2133 CB GLN A 534 15.589 9.323 -1.948 1.00 62.41 C ATOM 2134 CG GLN A 534 16.252 9.258 -3.326 1.00 10.04 C ATOM 2135 CD GLN A 534 17.686 8.735 -3.221 1.00 21.54 C ATOM 2136 OE1 GLN A 534 18.653 9.473 -3.317 1.00 61.00 O ATOM 2137 NE2 GLN A 534 17.770 7.422 -3.017 1.00 53.32 N ATOM 0 H GLN A 534 13.905 7.529 -2.238 1.00 1.22 H new ATOM 0 HA GLN A 534 13.767 10.086 -1.149 1.00 1.53 H new ATOM 0 HB2 GLN A 534 16.063 10.100 -1.349 1.00 62.41 H new ATOM 0 HB3 GLN A 534 15.739 8.380 -1.423 1.00 62.41 H new ATOM 0 HG2 GLN A 534 15.672 8.609 -3.982 1.00 10.04 H new ATOM 0 HG3 GLN A 534 16.255 10.249 -3.779 1.00 10.04 H new ATOM 0 HE21 GLN A 534 16.921 6.862 -2.946 1.00 53.32 H new ATOM 0 HE22 GLN A 534 18.684 6.977 -2.931 1.00 53.32 H new ATOM 2144 N ALA A 535 13.738 10.001 -4.425 1.00 61.41 N ATOM 2145 CA ALA A 535 13.477 10.791 -5.616 1.00 65.44 C ATOM 2146 C ALA A 535 12.004 11.203 -5.637 1.00 32.22 C ATOM 2147 O ALA A 535 11.648 12.217 -6.235 1.00 41.12 O ATOM 2148 CB ALA A 535 13.877 9.992 -6.857 1.00 32.14 C ATOM 0 H ALA A 535 13.854 9.002 -4.593 1.00 61.41 H new ATOM 0 HA ALA A 535 14.074 11.703 -5.610 1.00 65.44 H new ATOM 0 HB1 ALA A 535 13.681 10.585 -7.750 1.00 32.14 H new ATOM 0 HB2 ALA A 535 14.939 9.750 -6.808 1.00 32.14 H new ATOM 0 HB3 ALA A 535 13.297 9.070 -6.899 1.00 32.14 H new ATOM 2154 N ARG A 536 11.189 10.396 -4.975 1.00 0.14 N ATOM 2155 CA ARG A 536 9.761 10.663 -4.910 1.00 33.25 C ATOM 2156 C ARG A 536 9.487 11.867 -4.006 1.00 75.51 C ATOM 2157 O ARG A 536 8.647 12.707 -4.323 1.00 43.25 O ATOM 2158 CB ARG A 536 8.997 9.450 -4.378 1.00 21.15 C ATOM 2159 CG ARG A 536 8.542 8.542 -5.523 1.00 25.24 C ATOM 2160 CD ARG A 536 7.179 8.980 -6.062 1.00 44.32 C ATOM 2161 NE ARG A 536 6.212 9.111 -4.948 1.00 25.42 N ATOM 2162 CZ ARG A 536 5.116 9.896 -4.985 1.00 14.22 C ATOM 2163 NH1 ARG A 536 4.836 10.630 -6.084 1.00 63.44 N ATOM 2164 NH2 ARG A 536 4.321 9.937 -3.933 1.00 70.13 N ATOM 0 H ARG A 536 11.489 9.557 -4.479 1.00 0.14 H new ATOM 0 HA ARG A 536 9.418 10.878 -5.922 1.00 33.25 H new ATOM 0 HB2 ARG A 536 9.632 8.887 -3.694 1.00 21.15 H new ATOM 0 HB3 ARG A 536 8.130 9.783 -3.807 1.00 21.15 H new ATOM 0 HG2 ARG A 536 9.279 8.566 -6.326 1.00 25.24 H new ATOM 0 HG3 ARG A 536 8.485 7.511 -5.173 1.00 25.24 H new ATOM 0 HD2 ARG A 536 7.274 9.931 -6.585 1.00 44.32 H new ATOM 0 HD3 ARG A 536 6.815 8.252 -6.787 1.00 44.32 H new ATOM 0 HE ARG A 536 6.386 8.573 -4.099 1.00 25.42 H new ATOM 0 HH11 ARG A 536 5.455 10.593 -6.894 1.00 63.44 H new ATOM 0 HH12 ARG A 536 4.005 11.221 -6.104 1.00 63.44 H new ATOM 0 HH21 ARG A 536 4.539 9.380 -3.107 1.00 70.13 H new ATOM 0 HH22 ARG A 536 3.488 10.526 -3.946 1.00 70.13 H new ATOM 2174 N LYS A 537 10.214 11.912 -2.900 1.00 61.24 N ATOM 2175 CA LYS A 537 10.060 12.999 -1.948 1.00 70.02 C ATOM 2176 C LYS A 537 11.151 14.043 -2.192 1.00 55.14 C ATOM 2177 O LYS A 537 11.149 15.106 -1.571 1.00 34.31 O ATOM 2178 CB LYS A 537 10.035 12.459 -0.516 1.00 35.34 C ATOM 2179 CG LYS A 537 11.408 11.917 -0.112 1.00 72.05 C ATOM 2180 CD LYS A 537 11.294 10.975 1.089 1.00 73.24 C ATOM 2181 CE LYS A 537 12.396 9.914 1.061 1.00 73.34 C ATOM 2182 NZ LYS A 537 12.511 9.252 2.378 1.00 24.10 N ATOM 0 H LYS A 537 10.911 11.214 -2.642 1.00 61.24 H new ATOM 0 HA LYS A 537 9.102 13.498 -2.092 1.00 70.02 H new ATOM 0 HB2 LYS A 537 9.736 13.251 0.170 1.00 35.34 H new ATOM 0 HB3 LYS A 537 9.289 11.668 -0.434 1.00 35.34 H new ATOM 0 HG2 LYS A 537 11.856 11.387 -0.953 1.00 72.05 H new ATOM 0 HG3 LYS A 537 12.072 12.746 0.133 1.00 72.05 H new ATOM 0 HD2 LYS A 537 11.360 11.549 2.013 1.00 73.24 H new ATOM 0 HD3 LYS A 537 10.318 10.490 1.084 1.00 73.24 H new ATOM 0 HE2 LYS A 537 12.176 9.173 0.293 1.00 73.34 H new ATOM 0 HE3 LYS A 537 13.347 10.376 0.795 1.00 73.34 H new ATOM 0 HZ1 LYS A 537 13.263 8.535 2.342 1.00 24.10 H new ATOM 0 HZ2 LYS A 537 12.743 9.960 3.104 1.00 24.10 H new ATOM 0 HZ3 LYS A 537 11.608 8.795 2.617 1.00 24.10 H new ATOM 2191 N ALA A 538 12.057 13.705 -3.096 1.00 73.32 N ATOM 2192 CA ALA A 538 13.153 14.601 -3.431 1.00 23.12 C ATOM 2193 C ALA A 538 12.607 16.018 -3.617 1.00 44.14 C ATOM 2194 O ALA A 538 13.330 16.995 -3.424 1.00 43.32 O ATOM 2195 CB ALA A 538 13.871 14.085 -4.678 1.00 23.40 C ATOM 0 H ALA A 538 12.056 12.823 -3.608 1.00 73.32 H new ATOM 0 HA ALA A 538 13.885 14.632 -2.624 1.00 23.12 H new ATOM 0 HB1 ALA A 538 14.692 14.756 -4.929 1.00 23.40 H new ATOM 0 HB2 ALA A 538 14.264 13.087 -4.485 1.00 23.40 H new ATOM 0 HB3 ALA A 538 13.169 14.043 -5.511 1.00 23.40 H new ATOM 2201 N MET A 539 11.338 16.085 -3.989 1.00 14.10 N ATOM 2202 CA MET A 539 10.688 17.368 -4.202 1.00 1.05 C ATOM 2203 C MET A 539 10.601 18.162 -2.899 1.00 63.34 C ATOM 2204 O MET A 539 10.859 19.365 -2.881 1.00 11.24 O ATOM 2205 CB MET A 539 9.280 17.140 -4.757 1.00 10.24 C ATOM 2206 CG MET A 539 9.335 16.592 -6.185 1.00 42.21 C ATOM 2207 SD MET A 539 7.714 16.040 -6.689 1.00 65.22 S ATOM 2208 CE MET A 539 7.834 14.307 -6.278 1.00 43.42 C ATOM 0 H MET A 539 10.742 15.273 -4.149 1.00 14.10 H new ATOM 0 HA MET A 539 11.281 17.941 -4.915 1.00 1.05 H new ATOM 0 HB2 MET A 539 8.741 16.442 -4.116 1.00 10.24 H new ATOM 0 HB3 MET A 539 8.724 18.078 -4.745 1.00 10.24 H new ATOM 0 HG2 MET A 539 9.694 17.364 -6.866 1.00 42.21 H new ATOM 0 HG3 MET A 539 10.043 15.765 -6.239 1.00 42.21 H new ATOM 0 HE1 MET A 539 7.467 13.709 -7.112 1.00 43.42 H new ATOM 0 HE2 MET A 539 8.875 14.052 -6.078 1.00 43.42 H new ATOM 0 HE3 MET A 539 7.233 14.101 -5.392 1.00 43.42 H new ATOM 2216 N TRP A 540 10.238 17.459 -1.836 1.00 14.45 N ATOM 2217 CA TRP A 540 10.113 18.084 -0.530 1.00 33.13 C ATOM 2218 C TRP A 540 11.513 18.185 0.079 1.00 3.52 C ATOM 2219 O TRP A 540 11.742 18.985 0.985 1.00 41.31 O ATOM 2220 CB TRP A 540 9.129 17.315 0.353 1.00 41.51 C ATOM 2221 CG TRP A 540 8.745 18.049 1.641 1.00 40.04 C ATOM 2222 CD1 TRP A 540 8.141 19.239 1.762 1.00 44.21 C ATOM 2223 CD2 TRP A 540 8.965 17.590 2.991 1.00 31.24 C ATOM 2224 NE1 TRP A 540 7.956 19.579 3.088 1.00 31.11 N ATOM 2225 CE2 TRP A 540 8.474 18.544 3.858 1.00 10.23 C ATOM 2226 CE3 TRP A 540 9.561 16.406 3.463 1.00 41.54 C ATOM 2227 CZ2 TRP A 540 8.525 18.413 5.251 1.00 23.40 C ATOM 2228 CZ3 TRP A 540 9.605 16.292 4.858 1.00 24.33 C ATOM 2229 CH2 TRP A 540 9.115 17.243 5.745 1.00 12.43 C ATOM 0 H TRP A 540 10.026 16.461 -1.853 1.00 14.45 H new ATOM 0 HA TRP A 540 9.699 19.088 -0.619 1.00 33.13 H new ATOM 0 HB2 TRP A 540 8.225 17.111 -0.220 1.00 41.51 H new ATOM 0 HB3 TRP A 540 9.566 16.351 0.613 1.00 41.51 H new ATOM 0 HD1 TRP A 540 7.837 19.855 0.928 1.00 44.21 H new ATOM 0 HE1 TRP A 540 7.520 20.432 3.438 1.00 31.11 H new ATOM 0 HE3 TRP A 540 9.953 15.646 2.803 1.00 41.54 H new ATOM 0 HZ2 TRP A 540 8.131 19.173 5.909 1.00 23.40 H new ATOM 0 HZ3 TRP A 540 10.052 15.401 5.274 1.00 24.33 H new ATOM 0 HH2 TRP A 540 9.189 17.081 6.810 1.00 12.43 H new ATOM 2239 N ARG A 541 12.412 17.363 -0.441 1.00 1.33 N ATOM 2240 CA ARG A 541 13.782 17.349 0.042 1.00 40.12 C ATOM 2241 C ARG A 541 14.512 18.618 -0.401 1.00 31.03 C ATOM 2242 O ARG A 541 15.416 19.091 0.288 1.00 23.23 O ATOM 2243 CB ARG A 541 14.537 16.124 -0.479 1.00 42.01 C ATOM 2244 CG ARG A 541 13.865 14.829 -0.020 1.00 52.53 C ATOM 2245 CD ARG A 541 14.890 13.703 0.131 1.00 50.52 C ATOM 2246 NE ARG A 541 15.812 14.006 1.248 1.00 12.31 N ATOM 2247 CZ ARG A 541 15.583 13.661 2.533 1.00 21.53 C ATOM 2248 NH1 ARG A 541 14.459 12.997 2.874 1.00 4.32 N ATOM 2249 NH2 ARG A 541 16.477 13.981 3.450 1.00 42.12 N ATOM 0 H ARG A 541 12.218 16.701 -1.193 1.00 1.33 H new ATOM 0 HA ARG A 541 13.751 17.305 1.131 1.00 40.12 H new ATOM 0 HB2 ARG A 541 14.575 16.152 -1.568 1.00 42.01 H new ATOM 0 HB3 ARG A 541 15.567 16.149 -0.123 1.00 42.01 H new ATOM 0 HG2 ARG A 541 13.359 14.995 0.931 1.00 52.53 H new ATOM 0 HG3 ARG A 541 13.101 14.536 -0.741 1.00 52.53 H new ATOM 0 HD2 ARG A 541 14.380 12.758 0.316 1.00 50.52 H new ATOM 0 HD3 ARG A 541 15.453 13.586 -0.795 1.00 50.52 H new ATOM 0 HE ARG A 541 16.674 14.507 1.034 1.00 12.31 H new ATOM 0 HH11 ARG A 541 13.775 12.752 2.159 1.00 4.32 H new ATOM 0 HH12 ARG A 541 14.294 12.740 3.847 1.00 4.32 H new ATOM 0 HH21 ARG A 541 17.325 14.481 3.183 1.00 42.12 H new ATOM 0 HH22 ARG A 541 16.320 13.728 4.426 1.00 42.12 H new ATOM 2259 N LYS A 542 14.096 19.132 -1.548 1.00 40.13 N ATOM 2260 CA LYS A 542 14.700 20.337 -2.092 1.00 74.51 C ATOM 2261 C LYS A 542 14.959 21.329 -0.956 1.00 14.33 C ATOM 2262 O LYS A 542 15.894 22.126 -1.024 1.00 11.51 O ATOM 2263 CB LYS A 542 13.838 20.907 -3.222 1.00 21.21 C ATOM 2264 CG LYS A 542 13.964 20.055 -4.488 1.00 43.45 C ATOM 2265 CD LYS A 542 13.398 20.794 -5.702 1.00 71.42 C ATOM 2266 CE LYS A 542 12.768 19.815 -6.695 1.00 12.10 C ATOM 2267 NZ LYS A 542 13.706 19.527 -7.803 1.00 54.04 N ATOM 0 H LYS A 542 13.347 18.736 -2.117 1.00 40.13 H new ATOM 0 HA LYS A 542 15.665 20.109 -2.544 1.00 74.51 H new ATOM 0 HB2 LYS A 542 12.795 20.944 -2.906 1.00 21.21 H new ATOM 0 HB3 LYS A 542 14.143 21.931 -3.436 1.00 21.21 H new ATOM 0 HG2 LYS A 542 15.011 19.809 -4.663 1.00 43.45 H new ATOM 0 HG3 LYS A 542 13.434 19.113 -4.351 1.00 43.45 H new ATOM 0 HD2 LYS A 542 12.651 21.518 -5.376 1.00 71.42 H new ATOM 0 HD3 LYS A 542 14.193 21.355 -6.194 1.00 71.42 H new ATOM 0 HE2 LYS A 542 12.504 18.889 -6.184 1.00 12.10 H new ATOM 0 HE3 LYS A 542 11.844 20.235 -7.092 1.00 12.10 H new ATOM 0 HZ1 LYS A 542 13.264 18.861 -8.468 1.00 54.04 H new ATOM 0 HZ2 LYS A 542 13.938 20.411 -8.300 1.00 54.04 H new ATOM 0 HZ3 LYS A 542 14.577 19.107 -7.420 1.00 54.04 H new ATOM 2276 N GLU A 543 14.113 21.249 0.061 1.00 54.02 N ATOM 2277 CA GLU A 543 14.239 22.130 1.209 1.00 53.23 C ATOM 2278 C GLU A 543 15.633 22.003 1.826 1.00 31.42 C ATOM 2279 O GLU A 543 16.302 23.007 2.068 1.00 63.12 O ATOM 2280 CB GLU A 543 13.152 21.837 2.246 1.00 33.41 C ATOM 2281 CG GLU A 543 11.783 22.315 1.756 1.00 31.14 C ATOM 2282 CD GLU A 543 11.620 23.822 1.965 1.00 60.23 C ATOM 2283 OE1 GLU A 543 11.605 24.289 3.114 1.00 3.53 O ATOM 2284 OE2 GLU A 543 11.509 24.514 0.883 1.00 61.32 O ATOM 0 H GLU A 543 13.338 20.588 0.113 1.00 54.02 H new ATOM 0 HA GLU A 543 14.106 23.157 0.870 1.00 53.23 H new ATOM 0 HB2 GLU A 543 13.116 20.766 2.448 1.00 33.41 H new ATOM 0 HB3 GLU A 543 13.399 22.331 3.186 1.00 33.41 H new ATOM 0 HG2 GLU A 543 11.668 22.077 0.699 1.00 31.14 H new ATOM 0 HG3 GLU A 543 10.996 21.783 2.290 1.00 31.14 H new ATOM 2290 N GLN A 544 16.029 20.762 2.062 1.00 22.32 N ATOM 2291 CA GLN A 544 17.333 20.491 2.647 1.00 3.24 C ATOM 2292 C GLN A 544 18.413 20.501 1.562 1.00 3.45 C ATOM 2293 O GLN A 544 19.538 20.931 1.807 1.00 70.23 O ATOM 2294 CB GLN A 544 17.328 19.162 3.405 1.00 34.41 C ATOM 2295 CG GLN A 544 16.107 19.056 4.319 1.00 60.54 C ATOM 2296 CD GLN A 544 16.381 19.710 5.677 1.00 30.24 C ATOM 2297 OE1 GLN A 544 16.859 19.086 6.609 1.00 33.41 O ATOM 2298 NE2 GLN A 544 16.051 20.996 5.732 1.00 44.15 N ATOM 0 H GLN A 544 15.471 19.932 1.859 1.00 22.32 H new ATOM 0 HA GLN A 544 17.560 21.279 3.365 1.00 3.24 H new ATOM 0 HB2 GLN A 544 17.328 18.335 2.695 1.00 34.41 H new ATOM 0 HB3 GLN A 544 18.239 19.074 3.997 1.00 34.41 H new ATOM 0 HG2 GLN A 544 15.251 19.537 3.846 1.00 60.54 H new ATOM 0 HG3 GLN A 544 15.845 18.008 4.462 1.00 60.54 H new ATOM 0 HE21 GLN A 544 15.655 21.456 4.913 1.00 44.15 H new ATOM 0 HE22 GLN A 544 16.194 21.523 6.594 1.00 44.15 H new ATOM 2305 N ASP A 545 18.031 20.020 0.389 1.00 13.21 N ATOM 2306 CA ASP A 545 18.952 19.968 -0.734 1.00 32.53 C ATOM 2307 C ASP A 545 19.407 21.387 -1.082 1.00 24.00 C ATOM 2308 O ASP A 545 20.388 21.570 -1.802 1.00 25.52 O ATOM 2309 CB ASP A 545 18.280 19.370 -1.972 1.00 23.13 C ATOM 2310 CG ASP A 545 19.241 18.829 -3.032 1.00 63.42 C ATOM 2311 OD1 ASP A 545 19.638 19.546 -3.961 1.00 73.00 O ATOM 2312 OD2 ASP A 545 19.589 17.596 -2.874 1.00 22.32 O ATOM 0 H ASP A 545 17.096 19.663 0.191 1.00 13.21 H new ATOM 0 HA ASP A 545 19.798 19.344 -0.446 1.00 32.53 H new ATOM 0 HB2 ASP A 545 17.621 18.562 -1.654 1.00 23.13 H new ATOM 0 HB3 ASP A 545 17.651 20.133 -2.430 1.00 23.13 H new TER 2317 ASP A 545