USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 458 SER OG : rot -135:sc= 2.1 USER MOD Set 1.2: A 494 SER OG : rot -51:sc= 0.724 USER MOD Set 1.3: A 498 GLN : amide:sc= -0.123 K(o=2.7,f=-5.1!) USER MOD Set 2.1: A 476 ASN : amide:sc= -10.4! C(o=-15!,f=-21!) USER MOD Set 2.2: A 480 GLN : amide:sc= -4.82! C(o=-15!,f=-15!) USER MOD Set 3.1: A 401 HIS : no HD1:sc= -10.3! C(o=-11!,f=-14!) USER MOD Set 3.2: A 426 THR OG1 : rot -169:sc= -1.08 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 23:sc= 0.388 USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD Single : A 392 GLN : amide:sc= -0.0595 X(o=-0.059,f=-0.044) USER MOD Single : A 393 LYS NZ :NH3+ -137:sc= -1.74! (180deg=-3.98!) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -6.03! C(o=-6!,f=-9.6!) USER MOD Single : A 407 HIS : no HD1:sc= -0.699 X(o=-0.7,f=-0.47) USER MOD Single : A 415 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 428 CYS SG : rot 180:sc= -4.54! USER MOD Single : A 432 GLN : amide:sc= 0 X(o=0,f=0.075) USER MOD Single : A 434 HIS : no HD1:sc= -6.12! C(o=-6.1!,f=-5.5!) USER MOD Single : A 440 SER OG : rot 140:sc= -0.855 USER MOD Single : A 441 CYS SG : rot 180:sc= -0.471 USER MOD Single : A 443 GLN : amide:sc= -0.462 X(o=-0.46,f=-0.016) USER MOD Single : A 448 HIS : no HD1:sc= -0.757 K(o=-0.76,f=-2.1!) USER MOD Single : A 449 SER OG : rot -56:sc= 0.668 USER MOD Single : A 457 THR OG1 : rot 174:sc= 0.97 USER MOD Single : A 459 ASN : amide:sc= -0.213 K(o=-0.21,f=-0.74) USER MOD Single : A 462 CYS SG : rot -40:sc= -4.42! USER MOD Single : A 465 SER OG : rot -64:sc= -2.4 USER MOD Single : A 467 HIS : no HD1:sc= -2.92! C(o=-2.9!,f=-3.8!) USER MOD Single : A 468 GLN : amide:sc= -1.52 K(o=-1.5,f=-0.31) USER MOD Single : A 470 ASN : amide:sc= -4.45! K(o=-4.5!,f=-2.2) USER MOD Single : A 471 GLN : amide:sc= -2.04 K(o=-2,f=-0.14) USER MOD Single : A 473 MET CE :methyl -150:sc= -10! (180deg=-10.6!) USER MOD Single : A 474 MET CE :methyl 150:sc= -3.08! (180deg=-5.89!) USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 478 THR OG1 : rot -24:sc= 0.852 USER MOD Single : A 482 SER OG : rot 6:sc= 0.395 USER MOD Single : A 485 CYS SG : rot -107:sc= 0.0246 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot 180:sc= 0 USER MOD Single : A 503 THR OG1 : rot 100:sc= 0.251 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 180:sc= 0 USER MOD Single : A 516 HIS : no HD1:sc= -2.6 K(o=-2.6,f=-5.4!) USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 518 GLN : amide:sc= -0.0108 X(o=-0.011,f=-0.014) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.65! C(o=-3.6!,f=-4.7!) USER MOD Single : A 527 THR OG1 : rot 130:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -3.97 K(o=-4,f=-5.9!) USER MOD Single : A 534 GLN : amide:sc= -3.59! K(o=-3.6!,f=-1.5) USER MOD Single : A 537 LYS NZ :NH3+ 162:sc= -0.285 (180deg=-1.07) USER MOD Single : A 539 MET CE :methyl -161:sc= -3.95 (180deg=-5.05!) USER MOD Single : A 542 LYS NZ :NH3+ 162:sc= 0.998 (180deg=0.763) USER MOD Single : A 544 GLN : amide:sc=-0.00852 X(o=-0.0085,f=-0.0063) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 17.473 0.085 14.802 1.00 43.12 N ATOM 2 CA MET A 386 16.343 -0.612 14.211 1.00 22.21 C ATOM 3 C MET A 386 15.534 0.323 13.310 1.00 14.44 C ATOM 4 O MET A 386 14.768 -0.135 12.463 1.00 40.20 O ATOM 5 CB MET A 386 15.443 -1.158 15.322 1.00 30.01 C ATOM 6 CG MET A 386 14.727 -2.432 14.871 1.00 14.20 C ATOM 7 SD MET A 386 13.270 -2.012 13.928 1.00 43.42 S ATOM 8 CE MET A 386 12.083 -1.850 15.251 1.00 52.24 C ATOM 0 HA MET A 386 16.723 -1.433 13.603 1.00 22.21 H new ATOM 0 HB2 MET A 386 16.041 -1.367 16.209 1.00 30.01 H new ATOM 0 HB3 MET A 386 14.708 -0.404 15.603 1.00 30.01 H new ATOM 0 HG2 MET A 386 15.398 -3.042 14.266 1.00 14.20 H new ATOM 0 HG3 MET A 386 14.449 -3.029 15.739 1.00 14.20 H new ATOM 0 HE1 MET A 386 11.110 -1.588 14.836 1.00 52.24 H new ATOM 0 HE2 MET A 386 12.006 -2.795 15.788 1.00 52.24 H new ATOM 0 HE3 MET A 386 12.408 -1.068 15.937 1.00 52.24 H new ATOM 16 N GLU A 387 15.729 1.616 13.524 1.00 64.23 N ATOM 17 CA GLU A 387 15.026 2.619 12.743 1.00 21.52 C ATOM 18 C GLU A 387 15.873 3.044 11.542 1.00 13.14 C ATOM 19 O GLU A 387 17.065 2.747 11.481 1.00 21.05 O ATOM 20 CB GLU A 387 14.654 3.825 13.606 1.00 40.33 C ATOM 21 CG GLU A 387 13.943 3.384 14.888 1.00 13.24 C ATOM 22 CD GLU A 387 14.953 2.976 15.963 1.00 61.44 C ATOM 23 OE1 GLU A 387 16.165 2.977 15.705 1.00 64.40 O ATOM 24 OE2 GLU A 387 14.437 2.652 17.099 1.00 33.33 O ATOM 0 H GLU A 387 16.364 1.992 14.228 1.00 64.23 H new ATOM 0 HA GLU A 387 14.099 2.180 12.373 1.00 21.52 H new ATOM 0 HB2 GLU A 387 15.553 4.387 13.859 1.00 40.33 H new ATOM 0 HB3 GLU A 387 14.008 4.496 13.040 1.00 40.33 H new ATOM 0 HG2 GLU A 387 13.319 4.197 15.260 1.00 13.24 H new ATOM 0 HG3 GLU A 387 13.280 2.547 14.671 1.00 13.24 H new ATOM 30 N SER A 388 15.223 3.733 10.615 1.00 53.34 N ATOM 31 CA SER A 388 15.901 4.204 9.419 1.00 40.32 C ATOM 32 C SER A 388 15.623 5.694 9.211 1.00 63.21 C ATOM 33 O SER A 388 14.730 6.063 8.452 1.00 12.13 O ATOM 34 CB SER A 388 15.465 3.405 8.189 1.00 54.25 C ATOM 35 OG SER A 388 16.500 3.316 7.215 1.00 63.34 O ATOM 0 H SER A 388 14.234 3.976 10.668 1.00 53.34 H new ATOM 0 HA SER A 388 16.973 4.057 9.553 1.00 40.32 H new ATOM 0 HB2 SER A 388 15.168 2.402 8.495 1.00 54.25 H new ATOM 0 HB3 SER A 388 14.588 3.875 7.744 1.00 54.25 H new ATOM 0 HG SER A 388 16.182 2.797 6.447 1.00 63.34 H new ATOM 40 N SER A 389 16.408 6.510 9.900 1.00 15.43 N ATOM 41 CA SER A 389 16.257 7.953 9.801 1.00 21.43 C ATOM 42 C SER A 389 14.774 8.328 9.833 1.00 71.44 C ATOM 43 O SER A 389 14.281 9.003 8.931 1.00 43.45 O ATOM 44 CB SER A 389 16.912 8.487 8.525 1.00 52.41 C ATOM 45 OG SER A 389 16.476 7.783 7.366 1.00 74.11 O ATOM 0 H SER A 389 17.150 6.200 10.528 1.00 15.43 H new ATOM 0 HA SER A 389 16.758 8.409 10.654 1.00 21.43 H new ATOM 0 HB2 SER A 389 16.680 9.546 8.414 1.00 52.41 H new ATOM 0 HB3 SER A 389 17.995 8.406 8.612 1.00 52.41 H new ATOM 0 HG SER A 389 15.604 7.372 7.542 1.00 74.11 H new ATOM 50 N SER A 390 14.104 7.873 10.882 1.00 22.31 N ATOM 51 CA SER A 390 12.688 8.152 11.045 1.00 34.43 C ATOM 52 C SER A 390 12.448 9.663 11.041 1.00 64.24 C ATOM 53 O SER A 390 12.531 10.311 12.083 1.00 14.21 O ATOM 54 CB SER A 390 12.149 7.533 12.335 1.00 23.31 C ATOM 55 OG SER A 390 11.772 6.170 12.156 1.00 2.30 O ATOM 0 H SER A 390 14.517 7.313 11.628 1.00 22.31 H new ATOM 0 HA SER A 390 12.153 7.703 10.208 1.00 34.43 H new ATOM 0 HB2 SER A 390 12.908 7.600 13.114 1.00 23.31 H new ATOM 0 HB3 SER A 390 11.288 8.105 12.679 1.00 23.31 H new ATOM 0 HG SER A 390 11.435 5.810 13.003 1.00 2.30 H new ATOM 60 N GLU A 391 12.157 10.181 9.857 1.00 73.22 N ATOM 61 CA GLU A 391 11.906 11.604 9.703 1.00 41.51 C ATOM 62 C GLU A 391 10.418 11.904 9.896 1.00 52.42 C ATOM 63 O GLU A 391 9.645 11.018 10.259 1.00 51.25 O ATOM 64 CB GLU A 391 12.395 12.103 8.343 1.00 53.24 C ATOM 65 CG GLU A 391 11.504 11.580 7.214 1.00 61.50 C ATOM 66 CD GLU A 391 12.303 11.405 5.922 1.00 75.40 C ATOM 67 OE1 GLU A 391 12.015 10.492 5.133 1.00 53.52 O ATOM 68 OE2 GLU A 391 13.256 12.257 5.749 1.00 54.34 O ATOM 0 H GLU A 391 12.089 9.640 8.995 1.00 73.22 H new ATOM 0 HA GLU A 391 12.466 12.137 10.471 1.00 41.51 H new ATOM 0 HB2 GLU A 391 12.400 13.193 8.332 1.00 53.24 H new ATOM 0 HB3 GLU A 391 13.423 11.778 8.180 1.00 53.24 H new ATOM 0 HG2 GLU A 391 11.064 10.626 7.505 1.00 61.50 H new ATOM 0 HG3 GLU A 391 10.680 12.273 7.045 1.00 61.50 H new ATOM 74 N GLN A 392 10.062 13.155 9.643 1.00 5.44 N ATOM 75 CA GLN A 392 8.680 13.583 9.784 1.00 24.31 C ATOM 76 C GLN A 392 7.732 12.489 9.286 1.00 31.30 C ATOM 77 O GLN A 392 7.820 12.065 8.135 1.00 54.22 O ATOM 78 CB GLN A 392 8.435 14.898 9.044 1.00 42.13 C ATOM 79 CG GLN A 392 8.791 16.097 9.926 1.00 24.33 C ATOM 80 CD GLN A 392 10.280 16.435 9.818 1.00 44.13 C ATOM 81 OE1 GLN A 392 11.062 16.200 10.724 1.00 52.41 O ATOM 82 NE2 GLN A 392 10.625 16.995 8.663 1.00 72.23 N ATOM 0 H GLN A 392 10.706 13.886 9.341 1.00 5.44 H new ATOM 0 HA GLN A 392 8.480 13.757 10.841 1.00 24.31 H new ATOM 0 HB2 GLN A 392 9.031 14.923 8.132 1.00 42.13 H new ATOM 0 HB3 GLN A 392 7.389 14.961 8.743 1.00 42.13 H new ATOM 0 HG2 GLN A 392 8.196 16.961 9.629 1.00 24.33 H new ATOM 0 HG3 GLN A 392 8.539 15.877 10.963 1.00 24.33 H new ATOM 0 HE21 GLN A 392 9.919 17.164 7.947 1.00 72.23 H new ATOM 0 HE22 GLN A 392 11.596 17.256 8.493 1.00 72.23 H new ATOM 89 N LYS A 393 6.850 12.063 10.178 1.00 32.22 N ATOM 90 CA LYS A 393 5.888 11.027 9.842 1.00 50.54 C ATOM 91 C LYS A 393 5.336 11.285 8.439 1.00 1.15 C ATOM 92 O LYS A 393 5.005 12.417 8.096 1.00 41.22 O ATOM 93 CB LYS A 393 4.807 10.932 10.921 1.00 13.41 C ATOM 94 CG LYS A 393 4.240 9.514 11.005 1.00 50.24 C ATOM 95 CD LYS A 393 3.293 9.231 9.839 1.00 10.42 C ATOM 96 CE LYS A 393 3.556 7.847 9.241 1.00 21.04 C ATOM 97 NZ LYS A 393 2.515 7.505 8.247 1.00 11.14 N ATOM 0 H LYS A 393 6.781 12.416 11.132 1.00 32.22 H new ATOM 0 HA LYS A 393 6.371 10.050 9.819 1.00 50.54 H new ATOM 0 HB2 LYS A 393 5.225 11.218 11.886 1.00 13.41 H new ATOM 0 HB3 LYS A 393 4.005 11.636 10.700 1.00 13.41 H new ATOM 0 HG2 LYS A 393 5.056 8.792 10.998 1.00 50.24 H new ATOM 0 HG3 LYS A 393 3.709 9.386 11.948 1.00 50.24 H new ATOM 0 HD2 LYS A 393 2.260 9.292 10.182 1.00 10.42 H new ATOM 0 HD3 LYS A 393 3.420 9.993 9.070 1.00 10.42 H new ATOM 0 HE2 LYS A 393 4.538 7.829 8.768 1.00 21.04 H new ATOM 0 HE3 LYS A 393 3.570 7.099 10.033 1.00 21.04 H new ATOM 0 HZ1 LYS A 393 2.222 6.516 8.378 1.00 11.14 H new ATOM 0 HZ2 LYS A 393 1.693 8.130 8.376 1.00 11.14 H new ATOM 0 HZ3 LYS A 393 2.897 7.629 7.288 1.00 11.14 H new ATOM 106 N PHE A 394 5.256 10.213 7.665 1.00 14.44 N ATOM 107 CA PHE A 394 4.749 10.308 6.304 1.00 62.40 C ATOM 108 C PHE A 394 4.280 8.943 5.798 1.00 34.13 C ATOM 109 O PHE A 394 4.463 7.931 6.471 1.00 4.14 O ATOM 110 CB PHE A 394 5.907 10.793 5.430 1.00 25.10 C ATOM 111 CG PHE A 394 5.986 12.314 5.290 1.00 13.42 C ATOM 112 CD1 PHE A 394 4.852 13.039 5.089 1.00 23.25 C ATOM 113 CD2 PHE A 394 7.189 12.944 5.365 1.00 3.43 C ATOM 114 CE1 PHE A 394 4.924 14.450 4.959 1.00 42.03 C ATOM 115 CE2 PHE A 394 7.262 14.356 5.235 1.00 21.35 C ATOM 116 CZ PHE A 394 6.128 15.079 5.034 1.00 52.03 C ATOM 0 H PHE A 394 5.533 9.274 7.953 1.00 14.44 H new ATOM 0 HA PHE A 394 3.899 10.990 6.269 1.00 62.40 H new ATOM 0 HB2 PHE A 394 6.844 10.428 5.851 1.00 25.10 H new ATOM 0 HB3 PHE A 394 5.810 10.352 4.438 1.00 25.10 H new ATOM 0 HD1 PHE A 394 3.896 12.540 5.028 1.00 23.25 H new ATOM 0 HD2 PHE A 394 8.090 12.370 5.524 1.00 3.43 H new ATOM 0 HE1 PHE A 394 4.023 15.025 4.801 1.00 42.03 H new ATOM 0 HE2 PHE A 394 8.218 14.856 5.296 1.00 21.35 H new ATOM 0 HZ PHE A 394 6.183 16.153 4.934 1.00 52.03 H new ATOM 125 N TYR A 395 3.683 8.961 4.615 1.00 51.20 N ATOM 126 CA TYR A 395 3.186 7.736 4.009 1.00 44.30 C ATOM 127 C TYR A 395 3.917 7.437 2.700 1.00 10.43 C ATOM 128 O TYR A 395 4.015 8.298 1.828 1.00 63.35 O ATOM 129 CB TYR A 395 1.707 7.985 3.709 1.00 32.22 C ATOM 130 CG TYR A 395 0.894 8.444 4.921 1.00 23.32 C ATOM 131 CD1 TYR A 395 0.847 7.660 6.057 1.00 14.51 C ATOM 132 CD2 TYR A 395 0.207 9.640 4.881 1.00 74.42 C ATOM 133 CE1 TYR A 395 0.081 8.092 7.199 1.00 33.20 C ATOM 134 CE2 TYR A 395 -0.557 10.071 6.021 1.00 73.03 C ATOM 135 CZ TYR A 395 -0.582 9.276 7.123 1.00 43.43 C ATOM 136 OH TYR A 395 -1.305 9.683 8.202 1.00 34.32 O ATOM 0 H TYR A 395 3.532 9.803 4.060 1.00 51.20 H new ATOM 0 HA TYR A 395 3.340 6.887 4.675 1.00 44.30 H new ATOM 0 HB2 TYR A 395 1.628 8.738 2.925 1.00 32.22 H new ATOM 0 HB3 TYR A 395 1.267 7.068 3.316 1.00 32.22 H new ATOM 0 HD1 TYR A 395 1.384 6.724 6.090 1.00 14.51 H new ATOM 0 HD2 TYR A 395 0.243 10.253 3.993 1.00 74.42 H new ATOM 0 HE1 TYR A 395 0.035 7.489 8.094 1.00 33.20 H new ATOM 0 HE2 TYR A 395 -1.099 11.005 6.002 1.00 73.03 H new ATOM 0 HH TYR A 395 -1.725 10.547 8.007 1.00 34.32 H new ATOM 145 N ASN A 396 4.410 6.211 2.601 1.00 3.32 N ATOM 146 CA ASN A 396 5.130 5.786 1.412 1.00 44.13 C ATOM 147 C ASN A 396 4.321 4.705 0.692 1.00 41.24 C ATOM 148 O ASN A 396 4.656 4.315 -0.425 1.00 61.52 O ATOM 149 CB ASN A 396 6.493 5.194 1.775 1.00 43.21 C ATOM 150 CG ASN A 396 7.499 6.297 2.108 1.00 73.10 C ATOM 151 OD1 ASN A 396 8.180 6.832 1.247 1.00 62.21 O ATOM 152 ND2 ASN A 396 7.554 6.609 3.400 1.00 33.21 N ATOM 0 H ASN A 396 4.325 5.498 3.325 1.00 3.32 H new ATOM 0 HA ASN A 396 5.275 6.659 0.775 1.00 44.13 H new ATOM 0 HB2 ASN A 396 6.387 4.524 2.628 1.00 43.21 H new ATOM 0 HB3 ASN A 396 6.866 4.595 0.944 1.00 43.21 H new ATOM 0 HD21 ASN A 396 8.194 7.335 3.723 1.00 33.21 H new ATOM 0 HD22 ASN A 396 6.956 6.122 4.068 1.00 33.21 H new ATOM 158 N PHE A 397 3.271 4.251 1.362 1.00 71.42 N ATOM 159 CA PHE A 397 2.413 3.222 0.799 1.00 71.31 C ATOM 160 C PHE A 397 1.257 2.894 1.746 1.00 62.40 C ATOM 161 O PHE A 397 1.476 2.618 2.925 1.00 11.22 O ATOM 162 CB PHE A 397 3.275 1.973 0.613 1.00 75.11 C ATOM 163 CG PHE A 397 3.941 1.478 1.898 1.00 61.34 C ATOM 164 CD1 PHE A 397 5.061 2.095 2.364 1.00 22.14 C ATOM 165 CD2 PHE A 397 3.414 0.425 2.576 1.00 32.33 C ATOM 166 CE1 PHE A 397 5.679 1.638 3.558 1.00 22.43 C ATOM 167 CE2 PHE A 397 4.033 -0.034 3.770 1.00 14.32 C ATOM 168 CZ PHE A 397 5.151 0.583 4.236 1.00 32.40 C ATOM 0 H PHE A 397 2.995 4.577 2.289 1.00 71.42 H new ATOM 0 HA PHE A 397 1.988 3.566 -0.144 1.00 71.31 H new ATOM 0 HB2 PHE A 397 2.655 1.174 0.206 1.00 75.11 H new ATOM 0 HB3 PHE A 397 4.048 2.184 -0.126 1.00 75.11 H new ATOM 0 HD1 PHE A 397 5.480 2.932 1.826 1.00 22.14 H new ATOM 0 HD2 PHE A 397 2.524 -0.063 2.207 1.00 32.33 H new ATOM 0 HE1 PHE A 397 6.568 2.128 3.928 1.00 22.43 H new ATOM 0 HE2 PHE A 397 3.615 -0.873 4.307 1.00 14.32 H new ATOM 0 HZ PHE A 397 5.620 0.236 5.145 1.00 32.40 H new ATOM 177 N VAL A 398 0.053 2.937 1.196 1.00 44.10 N ATOM 178 CA VAL A 398 -1.137 2.646 1.978 1.00 52.33 C ATOM 179 C VAL A 398 -1.422 1.144 1.929 1.00 71.53 C ATOM 180 O VAL A 398 -1.728 0.601 0.867 1.00 43.33 O ATOM 181 CB VAL A 398 -2.310 3.495 1.480 1.00 33.15 C ATOM 182 CG1 VAL A 398 -3.108 2.748 0.407 1.00 45.15 C ATOM 183 CG2 VAL A 398 -3.212 3.920 2.639 1.00 31.23 C ATOM 0 H VAL A 398 -0.125 3.169 0.219 1.00 44.10 H new ATOM 0 HA VAL A 398 -0.981 2.911 3.024 1.00 52.33 H new ATOM 0 HB VAL A 398 -1.902 4.399 1.027 1.00 33.15 H new ATOM 0 HG11 VAL A 398 -3.936 3.372 0.069 1.00 45.15 H new ATOM 0 HG12 VAL A 398 -2.457 2.520 -0.437 1.00 45.15 H new ATOM 0 HG13 VAL A 398 -3.499 1.820 0.825 1.00 45.15 H new ATOM 0 HG21 VAL A 398 -4.037 4.522 2.257 1.00 31.23 H new ATOM 0 HG22 VAL A 398 -3.609 3.034 3.135 1.00 31.23 H new ATOM 0 HG23 VAL A 398 -2.635 4.508 3.353 1.00 31.23 H new ATOM 193 N ILE A 399 -1.310 0.515 3.089 1.00 5.41 N ATOM 194 CA ILE A 399 -1.551 -0.914 3.191 1.00 13.33 C ATOM 195 C ILE A 399 -3.051 -1.162 3.375 1.00 63.54 C ATOM 196 O ILE A 399 -3.543 -1.204 4.502 1.00 32.33 O ATOM 197 CB ILE A 399 -0.687 -1.525 4.296 1.00 64.10 C ATOM 198 CG1 ILE A 399 0.802 -1.349 3.988 1.00 5.31 C ATOM 199 CG2 ILE A 399 -1.054 -2.993 4.530 1.00 14.11 C ATOM 200 CD1 ILE A 399 1.665 -2.063 5.030 1.00 51.12 C ATOM 0 H ILE A 399 -1.056 0.969 3.966 1.00 5.41 H new ATOM 0 HA ILE A 399 -1.254 -1.417 2.271 1.00 13.33 H new ATOM 0 HB ILE A 399 -0.890 -0.990 5.224 1.00 64.10 H new ATOM 0 HG12 ILE A 399 1.021 -1.745 2.996 1.00 5.31 H new ATOM 0 HG13 ILE A 399 1.050 -0.288 3.970 1.00 5.31 H new ATOM 0 HG21 ILE A 399 -0.425 -3.404 5.320 1.00 14.11 H new ATOM 0 HG22 ILE A 399 -2.101 -3.064 4.825 1.00 14.11 H new ATOM 0 HG23 ILE A 399 -0.897 -3.558 3.611 1.00 14.11 H new ATOM 0 HD11 ILE A 399 2.718 -1.922 4.788 1.00 51.12 H new ATOM 0 HD12 ILE A 399 1.461 -1.648 6.017 1.00 51.12 H new ATOM 0 HD13 ILE A 399 1.431 -3.128 5.028 1.00 51.12 H new ATOM 211 N LEU A 400 -3.733 -1.319 2.252 1.00 52.20 N ATOM 212 CA LEU A 400 -5.166 -1.561 2.274 1.00 21.14 C ATOM 213 C LEU A 400 -5.443 -2.892 2.977 1.00 22.41 C ATOM 214 O LEU A 400 -5.346 -3.954 2.364 1.00 12.12 O ATOM 215 CB LEU A 400 -5.746 -1.482 0.860 1.00 64.34 C ATOM 216 CG LEU A 400 -7.076 -0.738 0.723 1.00 55.32 C ATOM 217 CD1 LEU A 400 -8.130 -1.322 1.664 1.00 0.30 C ATOM 218 CD2 LEU A 400 -6.888 0.765 0.933 1.00 11.21 C ATOM 0 H LEU A 400 -3.321 -1.284 1.320 1.00 52.20 H new ATOM 0 HA LEU A 400 -5.674 -0.784 2.846 1.00 21.14 H new ATOM 0 HB2 LEU A 400 -5.013 -0.998 0.214 1.00 64.34 H new ATOM 0 HB3 LEU A 400 -5.880 -2.497 0.486 1.00 64.34 H new ATOM 0 HG LEU A 400 -7.442 -0.876 -0.294 1.00 55.32 H new ATOM 0 HD11 LEU A 400 -9.066 -0.775 1.547 1.00 0.30 H new ATOM 0 HD12 LEU A 400 -8.291 -2.373 1.423 1.00 0.30 H new ATOM 0 HD13 LEU A 400 -7.786 -1.235 2.695 1.00 0.30 H new ATOM 0 HD21 LEU A 400 -7.849 1.270 0.830 1.00 11.21 H new ATOM 0 HD22 LEU A 400 -6.488 0.946 1.931 1.00 11.21 H new ATOM 0 HD23 LEU A 400 -6.193 1.152 0.188 1.00 11.21 H new ATOM 229 N HIS A 401 -5.780 -2.791 4.254 1.00 61.35 N ATOM 230 CA HIS A 401 -6.070 -3.973 5.048 1.00 52.44 C ATOM 231 C HIS A 401 -7.398 -3.782 5.784 1.00 3.35 C ATOM 232 O HIS A 401 -8.054 -2.754 5.632 1.00 13.31 O ATOM 233 CB HIS A 401 -4.910 -4.292 5.992 1.00 12.34 C ATOM 234 CG HIS A 401 -4.984 -3.577 7.320 1.00 63.14 C ATOM 235 ND1 HIS A 401 -5.360 -4.207 8.493 1.00 54.01 N ATOM 236 CD2 HIS A 401 -4.725 -2.277 7.648 1.00 32.14 C ATOM 237 CE1 HIS A 401 -5.327 -3.319 9.475 1.00 63.32 C ATOM 238 NE2 HIS A 401 -4.932 -2.123 8.949 1.00 3.13 N ATOM 0 H HIS A 401 -5.859 -1.908 4.759 1.00 61.35 H new ATOM 0 HA HIS A 401 -6.177 -4.838 4.394 1.00 52.44 H new ATOM 0 HB2 HIS A 401 -4.886 -5.367 6.171 1.00 12.34 H new ATOM 0 HB3 HIS A 401 -3.973 -4.029 5.501 1.00 12.34 H new ATOM 0 HD2 HIS A 401 -4.406 -1.505 6.964 1.00 32.14 H new ATOM 0 HE1 HIS A 401 -5.570 -3.508 10.510 1.00 63.32 H new ATOM 0 HE2 HIS A 401 -4.815 -1.254 9.470 1.00 3.13 H new ATOM 246 N ALA A 402 -7.755 -4.792 6.565 1.00 13.43 N ATOM 247 CA ALA A 402 -8.994 -4.749 7.324 1.00 71.30 C ATOM 248 C ALA A 402 -8.675 -4.460 8.792 1.00 51.34 C ATOM 249 O ALA A 402 -7.566 -4.721 9.254 1.00 14.51 O ATOM 250 CB ALA A 402 -9.751 -6.066 7.140 1.00 64.12 C ATOM 0 H ALA A 402 -7.208 -5.644 6.688 1.00 13.43 H new ATOM 0 HA ALA A 402 -9.640 -3.949 6.962 1.00 71.30 H new ATOM 0 HB1 ALA A 402 -10.680 -6.034 7.709 1.00 64.12 H new ATOM 0 HB2 ALA A 402 -9.977 -6.211 6.084 1.00 64.12 H new ATOM 0 HB3 ALA A 402 -9.136 -6.892 7.496 1.00 64.12 H new ATOM 256 N ARG A 403 -9.671 -3.924 9.485 1.00 62.11 N ATOM 257 CA ARG A 403 -9.511 -3.597 10.892 1.00 73.35 C ATOM 258 C ARG A 403 -9.199 -4.858 11.698 1.00 70.20 C ATOM 259 O ARG A 403 -8.816 -4.774 12.865 1.00 34.21 O ATOM 260 CB ARG A 403 -10.776 -2.940 11.450 1.00 24.12 C ATOM 261 CG ARG A 403 -11.702 -3.984 12.079 1.00 2.55 C ATOM 262 CD ARG A 403 -12.167 -5.003 11.036 1.00 33.23 C ATOM 263 NE ARG A 403 -12.479 -6.291 11.692 1.00 14.53 N ATOM 264 CZ ARG A 403 -13.214 -7.272 11.123 1.00 51.44 C ATOM 265 NH1 ARG A 403 -13.717 -7.117 9.880 1.00 32.11 N ATOM 266 NH2 ARG A 403 -13.432 -8.383 11.801 1.00 12.52 N ATOM 0 H ARG A 403 -10.590 -3.709 9.098 1.00 62.11 H new ATOM 0 HA ARG A 403 -8.682 -2.895 10.978 1.00 73.35 H new ATOM 0 HB2 ARG A 403 -10.504 -2.193 12.196 1.00 24.12 H new ATOM 0 HB3 ARG A 403 -11.301 -2.416 10.651 1.00 24.12 H new ATOM 0 HG2 ARG A 403 -11.181 -4.497 12.887 1.00 2.55 H new ATOM 0 HG3 ARG A 403 -12.567 -3.489 12.520 1.00 2.55 H new ATOM 0 HD2 ARG A 403 -13.048 -4.627 10.516 1.00 33.23 H new ATOM 0 HD3 ARG A 403 -11.391 -5.147 10.285 1.00 33.23 H new ATOM 0 HE ARG A 403 -12.117 -6.449 12.632 1.00 14.53 H new ATOM 0 HH11 ARG A 403 -13.543 -6.255 9.363 1.00 32.11 H new ATOM 0 HH12 ARG A 403 -14.271 -7.862 9.457 1.00 32.11 H new ATOM 0 HH21 ARG A 403 -13.048 -8.491 12.740 1.00 12.52 H new ATOM 0 HH22 ARG A 403 -13.985 -9.133 11.386 1.00 12.52 H new ATOM 276 N ALA A 404 -9.374 -5.998 11.046 1.00 42.20 N ATOM 277 CA ALA A 404 -9.117 -7.275 11.690 1.00 75.43 C ATOM 278 C ALA A 404 -7.826 -7.873 11.125 1.00 71.31 C ATOM 279 O ALA A 404 -7.583 -9.071 11.259 1.00 44.31 O ATOM 280 CB ALA A 404 -10.321 -8.197 11.494 1.00 4.05 C ATOM 0 H ALA A 404 -9.691 -6.064 10.079 1.00 42.20 H new ATOM 0 HA ALA A 404 -8.979 -7.144 12.763 1.00 75.43 H new ATOM 0 HB1 ALA A 404 -10.128 -9.155 11.977 1.00 4.05 H new ATOM 0 HB2 ALA A 404 -11.206 -7.739 11.936 1.00 4.05 H new ATOM 0 HB3 ALA A 404 -10.489 -8.355 10.429 1.00 4.05 H new ATOM 286 N ASP A 405 -7.034 -7.012 10.504 1.00 33.12 N ATOM 287 CA ASP A 405 -5.776 -7.440 9.918 1.00 31.14 C ATOM 288 C ASP A 405 -4.675 -6.448 10.300 1.00 5.24 C ATOM 289 O ASP A 405 -3.678 -6.318 9.592 1.00 52.11 O ATOM 290 CB ASP A 405 -5.865 -7.483 8.392 1.00 32.32 C ATOM 291 CG ASP A 405 -6.026 -8.881 7.791 1.00 25.40 C ATOM 292 OD1 ASP A 405 -5.487 -9.180 6.715 1.00 61.45 O ATOM 293 OD2 ASP A 405 -6.749 -9.692 8.485 1.00 71.34 O ATOM 0 H ASP A 405 -7.240 -6.019 10.394 1.00 33.12 H new ATOM 0 HA ASP A 405 -5.552 -8.438 10.294 1.00 31.14 H new ATOM 0 HB2 ASP A 405 -6.708 -6.869 8.075 1.00 32.32 H new ATOM 0 HB3 ASP A 405 -4.965 -7.028 7.978 1.00 32.32 H new ATOM 298 N GLU A 406 -4.895 -5.774 11.420 1.00 74.54 N ATOM 299 CA GLU A 406 -3.934 -4.797 11.904 1.00 14.44 C ATOM 300 C GLU A 406 -2.600 -5.476 12.221 1.00 52.13 C ATOM 301 O GLU A 406 -1.637 -5.341 11.467 1.00 41.33 O ATOM 302 CB GLU A 406 -4.476 -4.056 13.128 1.00 12.45 C ATOM 303 CG GLU A 406 -3.419 -3.117 13.714 1.00 73.13 C ATOM 304 CD GLU A 406 -4.058 -2.089 14.651 1.00 32.15 C ATOM 305 OE1 GLU A 406 -4.945 -1.332 14.228 1.00 5.50 O ATOM 306 OE2 GLU A 406 -3.603 -2.095 15.859 1.00 34.44 O ATOM 0 H GLU A 406 -5.723 -5.885 12.005 1.00 74.54 H new ATOM 0 HA GLU A 406 -3.767 -4.061 11.118 1.00 14.44 H new ATOM 0 HB2 GLU A 406 -5.361 -3.484 12.849 1.00 12.45 H new ATOM 0 HB3 GLU A 406 -4.788 -4.776 13.885 1.00 12.45 H new ATOM 0 HG2 GLU A 406 -2.674 -3.697 14.258 1.00 73.13 H new ATOM 0 HG3 GLU A 406 -2.896 -2.603 12.907 1.00 73.13 H new ATOM 312 N HIS A 407 -2.586 -6.189 13.336 1.00 1.14 N ATOM 313 CA HIS A 407 -1.385 -6.890 13.761 1.00 23.32 C ATOM 314 C HIS A 407 -0.649 -7.436 12.536 1.00 42.21 C ATOM 315 O HIS A 407 0.580 -7.498 12.522 1.00 73.00 O ATOM 316 CB HIS A 407 -1.724 -7.978 14.783 1.00 34.41 C ATOM 317 CG HIS A 407 -2.560 -9.104 14.226 1.00 41.34 C ATOM 318 ND1 HIS A 407 -3.872 -8.933 13.818 1.00 64.51 N ATOM 319 CD2 HIS A 407 -2.259 -10.417 14.013 1.00 21.15 C ATOM 320 CE1 HIS A 407 -4.330 -10.098 13.382 1.00 3.12 C ATOM 321 NE2 HIS A 407 -3.329 -11.017 13.504 1.00 73.13 N ATOM 0 H HIS A 407 -3.386 -6.297 13.959 1.00 1.14 H new ATOM 0 HA HIS A 407 -0.713 -6.195 14.266 1.00 23.32 H new ATOM 0 HB2 HIS A 407 -0.797 -8.390 15.181 1.00 34.41 H new ATOM 0 HB3 HIS A 407 -2.256 -7.524 15.619 1.00 34.41 H new ATOM 0 HD2 HIS A 407 -1.311 -10.889 14.223 1.00 21.15 H new ATOM 0 HE1 HIS A 407 -5.322 -10.287 12.998 1.00 3.12 H new ATOM 0 HE2 HIS A 407 -3.392 -12.002 13.247 1.00 73.13 H new ATOM 328 N ILE A 408 -1.430 -7.819 11.538 1.00 13.03 N ATOM 329 CA ILE A 408 -0.869 -8.357 10.310 1.00 64.23 C ATOM 330 C ILE A 408 -0.064 -7.266 9.600 1.00 43.11 C ATOM 331 O ILE A 408 1.138 -7.413 9.391 1.00 35.25 O ATOM 332 CB ILE A 408 -1.968 -8.974 9.443 1.00 33.13 C ATOM 333 CG1 ILE A 408 -2.811 -9.964 10.249 1.00 21.35 C ATOM 334 CG2 ILE A 408 -1.378 -9.615 8.185 1.00 31.53 C ATOM 335 CD1 ILE A 408 -3.881 -10.616 9.370 1.00 1.31 C ATOM 0 H ILE A 408 -2.449 -7.768 11.554 1.00 13.03 H new ATOM 0 HA ILE A 408 -0.177 -9.170 10.532 1.00 64.23 H new ATOM 0 HB ILE A 408 -2.634 -8.176 9.116 1.00 33.13 H new ATOM 0 HG12 ILE A 408 -2.167 -10.733 10.675 1.00 21.35 H new ATOM 0 HG13 ILE A 408 -3.286 -9.448 11.083 1.00 21.35 H new ATOM 0 HG21 ILE A 408 -2.180 -10.046 7.586 1.00 31.53 H new ATOM 0 HG22 ILE A 408 -0.856 -8.857 7.601 1.00 31.53 H new ATOM 0 HG23 ILE A 408 -0.677 -10.399 8.471 1.00 31.53 H new ATOM 0 HD11 ILE A 408 -4.466 -11.315 9.967 1.00 1.31 H new ATOM 0 HD12 ILE A 408 -4.538 -9.846 8.965 1.00 1.31 H new ATOM 0 HD13 ILE A 408 -3.402 -11.152 8.550 1.00 1.31 H new ATOM 346 N ALA A 409 -0.762 -6.195 9.250 1.00 42.30 N ATOM 347 CA ALA A 409 -0.129 -5.079 8.569 1.00 21.40 C ATOM 348 C ALA A 409 1.019 -4.547 9.429 1.00 63.41 C ATOM 349 O ALA A 409 2.144 -4.409 8.952 1.00 64.34 O ATOM 350 CB ALA A 409 -1.175 -4.006 8.265 1.00 32.20 C ATOM 0 H ALA A 409 -1.760 -6.077 9.426 1.00 42.30 H new ATOM 0 HA ALA A 409 0.294 -5.401 7.617 1.00 21.40 H new ATOM 0 HB1 ALA A 409 -0.700 -3.169 7.754 1.00 32.20 H new ATOM 0 HB2 ALA A 409 -1.953 -4.426 7.627 1.00 32.20 H new ATOM 0 HB3 ALA A 409 -1.620 -3.657 9.197 1.00 32.20 H new ATOM 356 N LEU A 410 0.695 -4.262 10.682 1.00 32.22 N ATOM 357 CA LEU A 410 1.685 -3.748 11.613 1.00 24.14 C ATOM 358 C LEU A 410 2.949 -4.606 11.531 1.00 74.52 C ATOM 359 O LEU A 410 4.043 -4.140 11.850 1.00 13.12 O ATOM 360 CB LEU A 410 1.096 -3.654 13.022 1.00 72.30 C ATOM 361 CG LEU A 410 -0.138 -2.765 13.174 1.00 3.22 C ATOM 362 CD1 LEU A 410 -0.122 -2.029 14.516 1.00 2.24 C ATOM 363 CD2 LEU A 410 -0.269 -1.801 11.994 1.00 45.34 C ATOM 0 H LEU A 410 -0.240 -4.377 11.074 1.00 32.22 H new ATOM 0 HA LEU A 410 1.971 -2.731 11.343 1.00 24.14 H new ATOM 0 HB2 LEU A 410 0.838 -4.660 13.354 1.00 72.30 H new ATOM 0 HB3 LEU A 410 1.870 -3.285 13.694 1.00 72.30 H new ATOM 0 HG LEU A 410 -1.021 -3.404 13.167 1.00 3.22 H new ATOM 0 HD11 LEU A 410 -1.011 -1.404 14.599 1.00 2.24 H new ATOM 0 HD12 LEU A 410 -0.112 -2.755 15.329 1.00 2.24 H new ATOM 0 HD13 LEU A 410 0.769 -1.404 14.577 1.00 2.24 H new ATOM 0 HD21 LEU A 410 -1.155 -1.181 12.128 1.00 45.34 H new ATOM 0 HD22 LEU A 410 0.615 -1.165 11.944 1.00 45.34 H new ATOM 0 HD23 LEU A 410 -0.360 -2.369 11.068 1.00 45.34 H new ATOM 374 N ARG A 411 2.760 -5.845 11.100 1.00 41.42 N ATOM 375 CA ARG A 411 3.871 -6.772 10.972 1.00 51.30 C ATOM 376 C ARG A 411 4.652 -6.490 9.687 1.00 54.13 C ATOM 377 O ARG A 411 5.875 -6.608 9.661 1.00 61.11 O ATOM 378 CB ARG A 411 3.382 -8.221 10.957 1.00 50.51 C ATOM 379 CG ARG A 411 4.511 -9.185 11.323 1.00 44.24 C ATOM 380 CD ARG A 411 3.960 -10.446 11.994 1.00 51.45 C ATOM 381 NE ARG A 411 3.152 -11.221 11.025 1.00 45.43 N ATOM 382 CZ ARG A 411 2.690 -12.470 11.253 1.00 71.54 C ATOM 383 NH1 ARG A 411 2.955 -13.095 12.419 1.00 22.21 N ATOM 384 NH2 ARG A 411 1.978 -13.069 10.317 1.00 40.13 N ATOM 0 H ARG A 411 1.853 -6.228 10.835 1.00 41.42 H new ATOM 0 HA ARG A 411 4.522 -6.630 11.835 1.00 51.30 H new ATOM 0 HB2 ARG A 411 2.557 -8.337 11.660 1.00 50.51 H new ATOM 0 HB3 ARG A 411 2.995 -8.468 9.968 1.00 50.51 H new ATOM 0 HG2 ARG A 411 5.065 -9.459 10.425 1.00 44.24 H new ATOM 0 HG3 ARG A 411 5.214 -8.690 11.993 1.00 44.24 H new ATOM 0 HD2 ARG A 411 4.781 -11.058 12.368 1.00 51.45 H new ATOM 0 HD3 ARG A 411 3.349 -10.173 12.854 1.00 51.45 H new ATOM 0 HE ARG A 411 2.930 -10.785 10.130 1.00 45.43 H new ATOM 0 HH11 ARG A 411 3.508 -12.625 13.136 1.00 22.21 H new ATOM 0 HH12 ARG A 411 2.603 -14.038 12.584 1.00 22.21 H new ATOM 0 HH21 ARG A 411 1.784 -12.589 9.438 1.00 40.13 H new ATOM 0 HH22 ARG A 411 1.621 -14.012 10.473 1.00 40.13 H new ATOM 394 N VAL A 412 3.911 -6.123 8.651 1.00 2.45 N ATOM 395 CA VAL A 412 4.517 -5.824 7.365 1.00 33.33 C ATOM 396 C VAL A 412 5.292 -4.509 7.466 1.00 22.12 C ATOM 397 O VAL A 412 6.473 -4.453 7.128 1.00 65.53 O ATOM 398 CB VAL A 412 3.447 -5.806 6.273 1.00 50.23 C ATOM 399 CG1 VAL A 412 3.897 -4.964 5.078 1.00 71.12 C ATOM 400 CG2 VAL A 412 3.084 -7.227 5.837 1.00 4.11 C ATOM 0 H VAL A 412 2.896 -6.026 8.677 1.00 2.45 H new ATOM 0 HA VAL A 412 5.230 -6.601 7.088 1.00 33.33 H new ATOM 0 HB VAL A 412 2.552 -5.345 6.689 1.00 50.23 H new ATOM 0 HG11 VAL A 412 3.118 -4.968 4.316 1.00 71.12 H new ATOM 0 HG12 VAL A 412 4.081 -3.940 5.403 1.00 71.12 H new ATOM 0 HG13 VAL A 412 4.813 -5.383 4.662 1.00 71.12 H new ATOM 0 HG21 VAL A 412 2.321 -7.185 5.060 1.00 4.11 H new ATOM 0 HG22 VAL A 412 3.971 -7.726 5.448 1.00 4.11 H new ATOM 0 HG23 VAL A 412 2.701 -7.783 6.692 1.00 4.11 H new ATOM 410 N ARG A 413 4.594 -3.483 7.931 1.00 54.21 N ATOM 411 CA ARG A 413 5.202 -2.171 8.079 1.00 71.44 C ATOM 412 C ARG A 413 6.653 -2.308 8.545 1.00 23.52 C ATOM 413 O ARG A 413 7.556 -1.709 7.961 1.00 3.51 O ATOM 414 CB ARG A 413 4.429 -1.317 9.085 1.00 2.14 C ATOM 415 CG ARG A 413 2.921 -1.417 8.845 1.00 44.44 C ATOM 416 CD ARG A 413 2.225 -0.095 9.178 1.00 22.14 C ATOM 417 NE ARG A 413 2.796 0.479 10.416 1.00 74.12 N ATOM 418 CZ ARG A 413 2.122 1.294 11.255 1.00 50.33 C ATOM 419 NH1 ARG A 413 0.843 1.637 10.995 1.00 13.44 N ATOM 420 NH2 ARG A 413 2.732 1.751 12.333 1.00 35.50 N ATOM 0 H ARG A 413 3.614 -3.533 8.210 1.00 54.21 H new ATOM 0 HA ARG A 413 5.174 -1.681 7.106 1.00 71.44 H new ATOM 0 HB2 ARG A 413 4.662 -1.643 10.099 1.00 2.14 H new ATOM 0 HB3 ARG A 413 4.746 -0.277 9.004 1.00 2.14 H new ATOM 0 HG2 ARG A 413 2.731 -1.680 7.804 1.00 44.44 H new ATOM 0 HG3 ARG A 413 2.504 -2.216 9.457 1.00 44.44 H new ATOM 0 HD2 ARG A 413 2.345 0.607 8.353 1.00 22.14 H new ATOM 0 HD3 ARG A 413 1.155 -0.259 9.303 1.00 22.14 H new ATOM 0 HE ARG A 413 3.760 0.244 10.651 1.00 74.12 H new ATOM 0 HH11 ARG A 413 0.379 1.280 10.160 1.00 13.44 H new ATOM 0 HH12 ARG A 413 0.340 2.253 11.634 1.00 13.44 H new ATOM 0 HH21 ARG A 413 3.699 1.487 12.522 1.00 35.50 H new ATOM 0 HH22 ARG A 413 2.236 2.368 12.977 1.00 35.50 H new ATOM 430 N GLU A 414 6.833 -3.100 9.593 1.00 51.23 N ATOM 431 CA GLU A 414 8.158 -3.323 10.143 1.00 63.12 C ATOM 432 C GLU A 414 9.006 -4.145 9.170 1.00 61.44 C ATOM 433 O GLU A 414 10.124 -3.756 8.834 1.00 71.11 O ATOM 434 CB GLU A 414 8.077 -4.004 11.510 1.00 42.23 C ATOM 435 CG GLU A 414 7.403 -3.093 12.538 1.00 12.13 C ATOM 436 CD GLU A 414 7.495 -3.691 13.944 1.00 55.23 C ATOM 437 OE1 GLU A 414 6.624 -4.479 14.340 1.00 1.22 O ATOM 438 OE2 GLU A 414 8.517 -3.310 14.634 1.00 53.31 O ATOM 0 H GLU A 414 6.082 -3.595 10.075 1.00 51.23 H new ATOM 0 HA GLU A 414 8.639 -2.355 10.284 1.00 63.12 H new ATOM 0 HB2 GLU A 414 7.518 -4.936 11.423 1.00 42.23 H new ATOM 0 HB3 GLU A 414 9.079 -4.264 11.851 1.00 42.23 H new ATOM 0 HG2 GLU A 414 7.876 -2.111 12.525 1.00 12.13 H new ATOM 0 HG3 GLU A 414 6.357 -2.946 12.269 1.00 12.13 H new ATOM 444 N LYS A 415 8.442 -5.266 8.746 1.00 62.13 N ATOM 445 CA LYS A 415 9.133 -6.145 7.818 1.00 1.23 C ATOM 446 C LYS A 415 9.652 -5.327 6.636 1.00 34.12 C ATOM 447 O LYS A 415 10.628 -5.709 5.992 1.00 63.43 O ATOM 448 CB LYS A 415 8.228 -7.310 7.410 1.00 23.22 C ATOM 449 CG LYS A 415 8.622 -8.595 8.143 1.00 71.02 C ATOM 450 CD LYS A 415 10.037 -9.032 7.759 1.00 51.11 C ATOM 451 CE LYS A 415 10.252 -8.930 6.247 1.00 21.02 C ATOM 452 NZ LYS A 415 11.296 -9.882 5.807 1.00 12.21 N ATOM 0 H LYS A 415 7.515 -5.586 9.028 1.00 62.13 H new ATOM 0 HA LYS A 415 10.001 -6.598 8.297 1.00 1.23 H new ATOM 0 HB2 LYS A 415 7.190 -7.064 7.633 1.00 23.22 H new ATOM 0 HB3 LYS A 415 8.294 -7.467 6.333 1.00 23.22 H new ATOM 0 HG2 LYS A 415 8.566 -8.436 9.220 1.00 71.02 H new ATOM 0 HG3 LYS A 415 7.914 -9.388 7.901 1.00 71.02 H new ATOM 0 HD2 LYS A 415 10.767 -8.409 8.276 1.00 51.11 H new ATOM 0 HD3 LYS A 415 10.206 -10.058 8.085 1.00 51.11 H new ATOM 0 HE2 LYS A 415 9.318 -9.139 5.726 1.00 21.02 H new ATOM 0 HE3 LYS A 415 10.544 -7.914 5.983 1.00 21.02 H new ATOM 0 HZ1 LYS A 415 11.430 -9.800 4.779 1.00 12.21 H new ATOM 0 HZ2 LYS A 415 12.191 -9.664 6.291 1.00 12.21 H new ATOM 0 HZ3 LYS A 415 11.003 -10.852 6.042 1.00 12.21 H new ATOM 461 N LEU A 416 8.976 -4.215 6.384 1.00 41.21 N ATOM 462 CA LEU A 416 9.358 -3.339 5.289 1.00 24.01 C ATOM 463 C LEU A 416 10.588 -2.526 5.698 1.00 33.12 C ATOM 464 O LEU A 416 11.454 -2.247 4.871 1.00 72.41 O ATOM 465 CB LEU A 416 8.169 -2.479 4.853 1.00 72.21 C ATOM 466 CG LEU A 416 6.974 -3.235 4.270 1.00 1.13 C ATOM 467 CD1 LEU A 416 5.745 -2.328 4.177 1.00 3.31 C ATOM 468 CD2 LEU A 416 7.327 -3.861 2.920 1.00 1.54 C ATOM 0 H LEU A 416 8.166 -3.901 6.919 1.00 41.21 H new ATOM 0 HA LEU A 416 9.639 -3.923 4.413 1.00 24.01 H new ATOM 0 HB2 LEU A 416 7.826 -1.905 5.714 1.00 72.21 H new ATOM 0 HB3 LEU A 416 8.518 -1.762 4.110 1.00 72.21 H new ATOM 0 HG LEU A 416 6.722 -4.051 4.947 1.00 1.13 H new ATOM 0 HD11 LEU A 416 4.909 -2.889 3.759 1.00 3.31 H new ATOM 0 HD12 LEU A 416 5.481 -1.970 5.172 1.00 3.31 H new ATOM 0 HD13 LEU A 416 5.968 -1.477 3.533 1.00 3.31 H new ATOM 0 HD21 LEU A 416 6.460 -4.392 2.528 1.00 1.54 H new ATOM 0 HD22 LEU A 416 7.619 -3.077 2.221 1.00 1.54 H new ATOM 0 HD23 LEU A 416 8.154 -4.560 3.048 1.00 1.54 H new ATOM 479 N GLU A 417 10.624 -2.167 6.973 1.00 2.54 N ATOM 480 CA GLU A 417 11.733 -1.392 7.501 1.00 31.11 C ATOM 481 C GLU A 417 12.976 -2.273 7.647 1.00 52.21 C ATOM 482 O GLU A 417 14.064 -1.776 7.931 1.00 64.03 O ATOM 483 CB GLU A 417 11.362 -0.742 8.836 1.00 41.03 C ATOM 484 CG GLU A 417 9.993 -0.063 8.754 1.00 21.04 C ATOM 485 CD GLU A 417 9.942 1.176 9.648 1.00 54.03 C ATOM 486 OE1 GLU A 417 10.097 1.066 10.873 1.00 2.13 O ATOM 487 OE2 GLU A 417 9.733 2.288 9.027 1.00 12.54 O ATOM 0 H GLU A 417 9.902 -2.399 7.656 1.00 2.54 H new ATOM 0 HA GLU A 417 11.959 -0.593 6.795 1.00 31.11 H new ATOM 0 HB2 GLU A 417 11.351 -1.498 9.622 1.00 41.03 H new ATOM 0 HB3 GLU A 417 12.120 -0.008 9.110 1.00 41.03 H new ATOM 0 HG2 GLU A 417 9.785 0.220 7.722 1.00 21.04 H new ATOM 0 HG3 GLU A 417 9.216 -0.766 9.055 1.00 21.04 H new ATOM 493 N ALA A 418 12.770 -3.566 7.446 1.00 32.53 N ATOM 494 CA ALA A 418 13.862 -4.522 7.551 1.00 51.54 C ATOM 495 C ALA A 418 14.535 -4.674 6.186 1.00 43.24 C ATOM 496 O ALA A 418 15.578 -5.313 6.072 1.00 23.40 O ATOM 497 CB ALA A 418 13.325 -5.851 8.088 1.00 41.13 C ATOM 0 H ALA A 418 11.865 -3.975 7.211 1.00 32.53 H new ATOM 0 HA ALA A 418 14.617 -4.167 8.252 1.00 51.54 H new ATOM 0 HB1 ALA A 418 14.142 -6.568 8.167 1.00 41.13 H new ATOM 0 HB2 ALA A 418 12.883 -5.694 9.072 1.00 41.13 H new ATOM 0 HB3 ALA A 418 12.567 -6.239 7.408 1.00 41.13 H new ATOM 503 N LEU A 419 13.909 -4.074 5.183 1.00 2.22 N ATOM 504 CA LEU A 419 14.435 -4.134 3.831 1.00 14.12 C ATOM 505 C LEU A 419 14.794 -2.722 3.364 1.00 51.21 C ATOM 506 O LEU A 419 15.858 -2.507 2.786 1.00 71.11 O ATOM 507 CB LEU A 419 13.453 -4.856 2.906 1.00 5.53 C ATOM 508 CG LEU A 419 12.743 -6.073 3.501 1.00 10.44 C ATOM 509 CD1 LEU A 419 11.349 -6.245 2.896 1.00 11.35 C ATOM 510 CD2 LEU A 419 13.595 -7.335 3.344 1.00 44.44 C ATOM 0 H LEU A 419 13.043 -3.544 5.281 1.00 2.22 H new ATOM 0 HA LEU A 419 15.353 -4.721 3.805 1.00 14.12 H new ATOM 0 HB2 LEU A 419 12.697 -4.141 2.583 1.00 5.53 H new ATOM 0 HB3 LEU A 419 13.992 -5.175 2.014 1.00 5.53 H new ATOM 0 HG LEU A 419 12.611 -5.903 4.570 1.00 10.44 H new ATOM 0 HD11 LEU A 419 10.866 -7.117 3.336 1.00 11.35 H new ATOM 0 HD12 LEU A 419 10.751 -5.357 3.101 1.00 11.35 H new ATOM 0 HD13 LEU A 419 11.435 -6.383 1.818 1.00 11.35 H new ATOM 0 HD21 LEU A 419 13.068 -8.186 3.775 1.00 44.44 H new ATOM 0 HD22 LEU A 419 13.779 -7.520 2.286 1.00 44.44 H new ATOM 0 HD23 LEU A 419 14.546 -7.199 3.859 1.00 44.44 H new ATOM 521 N GLY A 420 13.885 -1.795 3.634 1.00 24.40 N ATOM 522 CA GLY A 420 14.094 -0.409 3.249 1.00 14.12 C ATOM 523 C GLY A 420 12.859 0.438 3.563 1.00 22.41 C ATOM 524 O GLY A 420 12.878 1.250 4.487 1.00 35.22 O ATOM 0 H GLY A 420 13.004 -1.977 4.114 1.00 24.40 H new ATOM 0 HA2 GLY A 420 14.959 -0.007 3.777 1.00 14.12 H new ATOM 0 HA3 GLY A 420 14.317 -0.353 2.183 1.00 14.12 H new ATOM 528 N VAL A 421 11.815 0.219 2.777 1.00 31.10 N ATOM 529 CA VAL A 421 10.573 0.952 2.960 1.00 63.22 C ATOM 530 C VAL A 421 10.238 1.015 4.451 1.00 61.41 C ATOM 531 O VAL A 421 10.406 0.032 5.171 1.00 11.32 O ATOM 532 CB VAL A 421 9.463 0.316 2.123 1.00 42.44 C ATOM 533 CG1 VAL A 421 9.605 -1.208 2.090 1.00 52.32 C ATOM 534 CG2 VAL A 421 8.083 0.726 2.642 1.00 22.11 C ATOM 0 H VAL A 421 11.803 -0.456 2.012 1.00 31.10 H new ATOM 0 HA VAL A 421 10.679 1.978 2.608 1.00 63.22 H new ATOM 0 HB VAL A 421 9.561 0.684 1.102 1.00 42.44 H new ATOM 0 HG11 VAL A 421 8.803 -1.635 1.488 1.00 52.32 H new ATOM 0 HG12 VAL A 421 10.568 -1.474 1.654 1.00 52.32 H new ATOM 0 HG13 VAL A 421 9.546 -1.601 3.105 1.00 52.32 H new ATOM 0 HG21 VAL A 421 7.311 0.260 2.030 1.00 22.11 H new ATOM 0 HG22 VAL A 421 7.972 0.400 3.676 1.00 22.11 H new ATOM 0 HG23 VAL A 421 7.982 1.810 2.590 1.00 22.11 H new ATOM 544 N PRO A 422 9.759 2.213 4.883 1.00 75.23 N ATOM 545 CA PRO A 422 9.398 2.417 6.275 1.00 62.40 C ATOM 546 C PRO A 422 8.074 1.727 6.605 1.00 1.30 C ATOM 547 O PRO A 422 7.603 0.882 5.846 1.00 74.13 O ATOM 548 CB PRO A 422 9.345 3.925 6.450 1.00 41.34 C ATOM 549 CG PRO A 422 9.218 4.503 5.050 1.00 61.24 C ATOM 550 CD PRO A 422 9.549 3.400 4.059 1.00 52.51 C ATOM 0 HA PRO A 422 10.116 1.975 6.966 1.00 62.40 H new ATOM 0 HB2 PRO A 422 8.498 4.217 7.071 1.00 41.34 H new ATOM 0 HB3 PRO A 422 10.244 4.293 6.944 1.00 41.34 H new ATOM 0 HG2 PRO A 422 8.208 4.877 4.882 1.00 61.24 H new ATOM 0 HG3 PRO A 422 9.896 5.347 4.922 1.00 61.24 H new ATOM 0 HD2 PRO A 422 8.737 3.250 3.348 1.00 52.51 H new ATOM 0 HD3 PRO A 422 10.440 3.642 3.479 1.00 52.51 H new ATOM 555 N ASP A 423 7.508 2.115 7.740 1.00 74.54 N ATOM 556 CA ASP A 423 6.246 1.546 8.179 1.00 22.20 C ATOM 557 C ASP A 423 5.168 1.840 7.136 1.00 41.43 C ATOM 558 O ASP A 423 4.372 0.965 6.795 1.00 54.02 O ATOM 559 CB ASP A 423 5.799 2.159 9.509 1.00 0.14 C ATOM 560 CG ASP A 423 6.933 2.510 10.473 1.00 23.15 C ATOM 561 OD1 ASP A 423 7.451 1.642 11.191 1.00 63.05 O ATOM 562 OD2 ASP A 423 7.288 3.750 10.469 1.00 33.32 O ATOM 0 H ASP A 423 7.901 2.816 8.368 1.00 74.54 H new ATOM 0 HA ASP A 423 6.386 0.472 8.306 1.00 22.20 H new ATOM 0 HB2 ASP A 423 5.227 3.063 9.301 1.00 0.14 H new ATOM 0 HB3 ASP A 423 5.124 1.461 10.005 1.00 0.14 H new ATOM 567 N GLY A 424 5.174 3.076 6.658 1.00 14.23 N ATOM 568 CA GLY A 424 4.205 3.497 5.659 1.00 64.44 C ATOM 569 C GLY A 424 2.848 3.793 6.302 1.00 64.14 C ATOM 570 O GLY A 424 2.607 4.906 6.767 1.00 14.10 O ATOM 0 H GLY A 424 5.834 3.799 6.944 1.00 14.23 H new ATOM 0 HA2 GLY A 424 4.570 4.386 5.145 1.00 64.44 H new ATOM 0 HA3 GLY A 424 4.092 2.718 4.905 1.00 64.44 H new ATOM 574 N ALA A 425 1.998 2.777 6.308 1.00 23.32 N ATOM 575 CA ALA A 425 0.673 2.913 6.887 1.00 71.33 C ATOM 576 C ALA A 425 -0.222 1.782 6.376 1.00 74.40 C ATOM 577 O ALA A 425 0.212 0.960 5.569 1.00 24.41 O ATOM 578 CB ALA A 425 0.110 4.297 6.553 1.00 31.12 C ATOM 0 H ALA A 425 2.202 1.856 5.921 1.00 23.32 H new ATOM 0 HA ALA A 425 0.719 2.832 7.973 1.00 71.33 H new ATOM 0 HB1 ALA A 425 -0.884 4.400 6.987 1.00 31.12 H new ATOM 0 HB2 ALA A 425 0.766 5.065 6.963 1.00 31.12 H new ATOM 0 HB3 ALA A 425 0.047 4.413 5.471 1.00 31.12 H new ATOM 584 N THR A 426 -1.453 1.778 6.864 1.00 33.44 N ATOM 585 CA THR A 426 -2.412 0.760 6.466 1.00 45.32 C ATOM 586 C THR A 426 -3.839 1.301 6.577 1.00 72.44 C ATOM 587 O THR A 426 -4.163 2.020 7.521 1.00 32.33 O ATOM 588 CB THR A 426 -2.165 -0.483 7.323 1.00 10.24 C ATOM 589 OG1 THR A 426 -2.952 -0.262 8.489 1.00 43.31 O ATOM 590 CG2 THR A 426 -0.731 -0.557 7.850 1.00 73.35 C ATOM 0 H THR A 426 -1.809 2.463 7.531 1.00 33.44 H new ATOM 0 HA THR A 426 -2.283 0.482 5.420 1.00 45.32 H new ATOM 0 HB THR A 426 -2.382 -1.376 6.737 1.00 10.24 H new ATOM 0 HG1 THR A 426 -2.721 -0.927 9.171 1.00 43.31 H new ATOM 0 HG21 THR A 426 -0.610 -1.458 8.452 1.00 73.35 H new ATOM 0 HG22 THR A 426 -0.036 -0.585 7.011 1.00 73.35 H new ATOM 0 HG23 THR A 426 -0.523 0.320 8.464 1.00 73.35 H new ATOM 598 N PHE A 427 -4.654 0.934 5.598 1.00 64.33 N ATOM 599 CA PHE A 427 -6.038 1.373 5.573 1.00 43.34 C ATOM 600 C PHE A 427 -6.927 0.434 6.393 1.00 32.24 C ATOM 601 O PHE A 427 -6.829 -0.786 6.265 1.00 12.22 O ATOM 602 CB PHE A 427 -6.492 1.340 4.114 1.00 0.13 C ATOM 603 CG PHE A 427 -7.528 2.408 3.759 1.00 52.44 C ATOM 604 CD1 PHE A 427 -8.716 2.449 4.420 1.00 32.31 C ATOM 605 CD2 PHE A 427 -7.263 3.318 2.784 1.00 62.45 C ATOM 606 CE1 PHE A 427 -9.679 3.441 4.091 1.00 62.44 C ATOM 607 CE2 PHE A 427 -8.224 4.310 2.455 1.00 74.40 C ATOM 608 CZ PHE A 427 -9.412 4.350 3.116 1.00 34.24 C ATOM 0 H PHE A 427 -4.382 0.338 4.817 1.00 64.33 H new ATOM 0 HA PHE A 427 -6.118 2.372 6.001 1.00 43.34 H new ATOM 0 HB2 PHE A 427 -5.621 1.466 3.471 1.00 0.13 H new ATOM 0 HB3 PHE A 427 -6.910 0.357 3.897 1.00 0.13 H new ATOM 0 HD1 PHE A 427 -8.928 1.727 5.195 1.00 32.31 H new ATOM 0 HD2 PHE A 427 -6.320 3.286 2.259 1.00 62.45 H new ATOM 0 HE1 PHE A 427 -10.623 3.473 4.615 1.00 62.44 H new ATOM 0 HE2 PHE A 427 -8.012 5.032 1.681 1.00 74.40 H new ATOM 0 HZ PHE A 427 -10.144 5.104 2.866 1.00 34.24 H new ATOM 617 N CYS A 428 -7.771 1.037 7.215 1.00 44.43 N ATOM 618 CA CYS A 428 -8.675 0.270 8.056 1.00 15.20 C ATOM 619 C CYS A 428 -10.093 0.809 7.853 1.00 62.25 C ATOM 620 O CYS A 428 -10.498 1.762 8.516 1.00 44.13 O ATOM 621 CB CYS A 428 -8.254 0.309 9.525 1.00 71.02 C ATOM 622 SG CYS A 428 -9.609 -0.320 10.583 1.00 61.20 S ATOM 0 H CYS A 428 -7.849 2.049 7.317 1.00 44.43 H new ATOM 0 HA CYS A 428 -8.641 -0.780 7.766 1.00 15.20 H new ATOM 0 HB2 CYS A 428 -7.358 -0.294 9.671 1.00 71.02 H new ATOM 0 HB3 CYS A 428 -8.001 1.330 9.812 1.00 71.02 H new ATOM 0 HG CYS A 428 -9.239 -0.284 11.829 1.00 61.20 H new ATOM 627 N GLU A 429 -10.807 0.176 6.935 1.00 14.31 N ATOM 628 CA GLU A 429 -12.171 0.582 6.637 1.00 3.13 C ATOM 629 C GLU A 429 -13.147 -0.092 7.604 1.00 33.11 C ATOM 630 O GLU A 429 -12.836 -1.133 8.180 1.00 52.14 O ATOM 631 CB GLU A 429 -12.532 0.266 5.184 1.00 4.33 C ATOM 632 CG GLU A 429 -12.909 -1.208 5.021 1.00 75.15 C ATOM 633 CD GLU A 429 -12.580 -1.704 3.612 1.00 42.42 C ATOM 634 OE1 GLU A 429 -13.415 -1.588 2.702 1.00 51.21 O ATOM 635 OE2 GLU A 429 -11.409 -2.227 3.478 1.00 34.54 O ATOM 0 H GLU A 429 -10.468 -0.615 6.387 1.00 14.31 H new ATOM 0 HA GLU A 429 -12.246 1.661 6.768 1.00 3.13 H new ATOM 0 HB2 GLU A 429 -13.364 0.895 4.867 1.00 4.33 H new ATOM 0 HB3 GLU A 429 -11.688 0.503 4.536 1.00 4.33 H new ATOM 0 HG2 GLU A 429 -12.373 -1.808 5.756 1.00 75.15 H new ATOM 0 HG3 GLU A 429 -13.973 -1.339 5.218 1.00 75.15 H new ATOM 641 N ASP A 430 -14.308 0.530 7.751 1.00 3.31 N ATOM 642 CA ASP A 430 -15.331 0.004 8.637 1.00 1.52 C ATOM 643 C ASP A 430 -16.613 0.824 8.475 1.00 32.24 C ATOM 644 O ASP A 430 -16.565 1.980 8.060 1.00 73.15 O ATOM 645 CB ASP A 430 -14.894 0.096 10.100 1.00 60.12 C ATOM 646 CG ASP A 430 -15.535 -0.933 11.034 1.00 23.55 C ATOM 647 OD1 ASP A 430 -16.711 -1.292 10.877 1.00 51.34 O ATOM 648 OD2 ASP A 430 -14.763 -1.378 11.967 1.00 2.15 O ATOM 0 H ASP A 430 -14.562 1.393 7.271 1.00 3.31 H new ATOM 0 HA ASP A 430 -15.497 -1.041 8.375 1.00 1.52 H new ATOM 0 HB2 ASP A 430 -13.811 -0.018 10.148 1.00 60.12 H new ATOM 0 HB3 ASP A 430 -15.126 1.094 10.470 1.00 60.12 H new ATOM 653 N PHE A 431 -17.728 0.193 8.810 1.00 1.23 N ATOM 654 CA PHE A 431 -19.021 0.850 8.706 1.00 32.40 C ATOM 655 C PHE A 431 -19.248 1.803 9.883 1.00 33.45 C ATOM 656 O PHE A 431 -20.048 2.732 9.787 1.00 4.23 O ATOM 657 CB PHE A 431 -20.086 -0.247 8.741 1.00 23.50 C ATOM 658 CG PHE A 431 -20.269 -0.892 10.116 1.00 60.40 C ATOM 659 CD1 PHE A 431 -20.866 -0.196 11.119 1.00 44.53 C ATOM 660 CD2 PHE A 431 -19.834 -2.163 10.336 1.00 40.23 C ATOM 661 CE1 PHE A 431 -21.036 -0.795 12.397 1.00 54.33 C ATOM 662 CE2 PHE A 431 -20.004 -2.761 11.611 1.00 62.14 C ATOM 663 CZ PHE A 431 -20.602 -2.064 12.616 1.00 34.14 C ATOM 0 H PHE A 431 -17.764 -0.767 9.154 1.00 1.23 H new ATOM 0 HA PHE A 431 -19.069 1.433 7.786 1.00 32.40 H new ATOM 0 HB2 PHE A 431 -21.038 0.175 8.419 1.00 23.50 H new ATOM 0 HB3 PHE A 431 -19.820 -1.021 8.021 1.00 23.50 H new ATOM 0 HD1 PHE A 431 -21.211 0.812 10.945 1.00 44.53 H new ATOM 0 HD2 PHE A 431 -19.359 -2.716 9.539 1.00 40.23 H new ATOM 0 HE1 PHE A 431 -21.510 -0.241 13.194 1.00 54.33 H new ATOM 0 HE2 PHE A 431 -19.659 -3.770 11.785 1.00 62.14 H new ATOM 0 HZ PHE A 431 -20.731 -2.519 13.587 1.00 34.14 H new ATOM 672 N GLN A 432 -18.528 1.538 10.963 1.00 53.30 N ATOM 673 CA GLN A 432 -18.641 2.360 12.156 1.00 63.45 C ATOM 674 C GLN A 432 -18.473 3.839 11.800 1.00 51.32 C ATOM 675 O GLN A 432 -19.111 4.702 12.400 1.00 3.23 O ATOM 676 CB GLN A 432 -17.624 1.932 13.215 1.00 2.22 C ATOM 677 CG GLN A 432 -17.828 0.469 13.613 1.00 13.31 C ATOM 678 CD GLN A 432 -16.942 0.096 14.802 1.00 24.14 C ATOM 679 OE1 GLN A 432 -15.756 -0.159 14.671 1.00 13.53 O ATOM 680 NE2 GLN A 432 -17.582 0.076 15.968 1.00 1.12 N ATOM 0 H GLN A 432 -17.865 0.767 11.037 1.00 53.30 H new ATOM 0 HA GLN A 432 -19.636 2.219 12.578 1.00 63.45 H new ATOM 0 HB2 GLN A 432 -16.614 2.070 12.830 1.00 2.22 H new ATOM 0 HB3 GLN A 432 -17.720 2.568 14.095 1.00 2.22 H new ATOM 0 HG2 GLN A 432 -18.874 0.300 13.868 1.00 13.31 H new ATOM 0 HG3 GLN A 432 -17.598 -0.178 12.766 1.00 13.31 H new ATOM 0 HE21 GLN A 432 -18.576 0.300 16.008 1.00 1.12 H new ATOM 0 HE22 GLN A 432 -17.078 -0.163 16.822 1.00 1.12 H new ATOM 687 N VAL A 433 -17.612 4.085 10.825 1.00 72.32 N ATOM 688 CA VAL A 433 -17.352 5.444 10.381 1.00 55.14 C ATOM 689 C VAL A 433 -18.420 5.859 9.367 1.00 34.01 C ATOM 690 O VAL A 433 -19.380 5.125 9.137 1.00 14.25 O ATOM 691 CB VAL A 433 -15.929 5.552 9.828 1.00 0.43 C ATOM 692 CG1 VAL A 433 -14.898 5.491 10.956 1.00 73.54 C ATOM 693 CG2 VAL A 433 -15.664 4.466 8.783 1.00 31.51 C ATOM 0 H VAL A 433 -17.085 3.366 10.329 1.00 72.32 H new ATOM 0 HA VAL A 433 -17.414 6.137 11.220 1.00 55.14 H new ATOM 0 HB VAL A 433 -15.832 6.520 9.337 1.00 0.43 H new ATOM 0 HG11 VAL A 433 -13.895 5.570 10.537 1.00 73.54 H new ATOM 0 HG12 VAL A 433 -15.068 6.315 11.649 1.00 73.54 H new ATOM 0 HG13 VAL A 433 -14.996 4.544 11.487 1.00 73.54 H new ATOM 0 HG21 VAL A 433 -14.646 4.565 8.406 1.00 31.51 H new ATOM 0 HG22 VAL A 433 -15.788 3.484 9.239 1.00 31.51 H new ATOM 0 HG23 VAL A 433 -16.369 4.575 7.959 1.00 31.51 H new ATOM 703 N HIS A 434 -18.217 7.032 8.788 1.00 70.15 N ATOM 704 CA HIS A 434 -19.151 7.553 7.803 1.00 74.52 C ATOM 705 C HIS A 434 -18.631 7.257 6.395 1.00 60.13 C ATOM 706 O HIS A 434 -19.408 6.945 5.495 1.00 55.23 O ATOM 707 CB HIS A 434 -19.413 9.043 8.036 1.00 23.45 C ATOM 708 CG HIS A 434 -18.227 9.794 8.595 1.00 50.22 C ATOM 709 ND1 HIS A 434 -17.321 10.466 7.794 1.00 73.34 N ATOM 710 CD2 HIS A 434 -17.811 9.972 9.882 1.00 75.43 C ATOM 711 CE1 HIS A 434 -16.405 11.020 8.574 1.00 75.44 C ATOM 712 NE2 HIS A 434 -16.708 10.713 9.867 1.00 14.41 N ATOM 0 H HIS A 434 -17.419 7.638 8.981 1.00 70.15 H new ATOM 0 HA HIS A 434 -20.113 7.053 7.911 1.00 74.52 H new ATOM 0 HB2 HIS A 434 -19.709 9.502 7.092 1.00 23.45 H new ATOM 0 HB3 HIS A 434 -20.254 9.151 8.721 1.00 23.45 H new ATOM 0 HD2 HIS A 434 -18.296 9.578 10.763 1.00 75.43 H new ATOM 0 HE1 HIS A 434 -15.564 11.612 8.243 1.00 75.44 H new ATOM 0 HE2 HIS A 434 -16.176 11.004 10.687 1.00 14.41 H new ATOM 719 N GLY A 435 -17.318 7.363 6.250 1.00 74.55 N ATOM 720 CA GLY A 435 -16.685 7.111 4.966 1.00 0.02 C ATOM 721 C GLY A 435 -15.309 7.777 4.893 1.00 41.32 C ATOM 722 O GLY A 435 -14.362 7.198 4.364 1.00 30.21 O ATOM 0 H GLY A 435 -16.676 7.620 7.000 1.00 74.55 H new ATOM 0 HA2 GLY A 435 -16.582 6.037 4.812 1.00 0.02 H new ATOM 0 HA3 GLY A 435 -17.319 7.489 4.164 1.00 0.02 H new ATOM 726 N ARG A 436 -15.244 8.987 5.431 1.00 30.35 N ATOM 727 CA ARG A 436 -14.000 9.738 5.434 1.00 33.33 C ATOM 728 C ARG A 436 -13.644 10.169 6.858 1.00 52.13 C ATOM 729 O ARG A 436 -12.914 11.141 7.051 1.00 12.21 O ATOM 730 CB ARG A 436 -14.103 10.977 4.543 1.00 33.41 C ATOM 731 CG ARG A 436 -14.901 10.673 3.272 1.00 73.04 C ATOM 732 CD ARG A 436 -14.095 9.789 2.318 1.00 50.33 C ATOM 733 NE ARG A 436 -14.896 9.491 1.109 1.00 30.00 N ATOM 734 CZ ARG A 436 -14.968 10.299 0.029 1.00 65.02 C ATOM 735 NH1 ARG A 436 -14.288 11.465 0.000 1.00 4.34 N ATOM 736 NH2 ARG A 436 -15.714 9.932 -0.996 1.00 43.13 N ATOM 0 H ARG A 436 -16.032 9.465 5.867 1.00 30.35 H new ATOM 0 HA ARG A 436 -13.218 9.087 5.042 1.00 33.33 H new ATOM 0 HB2 ARG A 436 -14.583 11.786 5.093 1.00 33.41 H new ATOM 0 HB3 ARG A 436 -13.104 11.322 4.276 1.00 33.41 H new ATOM 0 HG2 ARG A 436 -15.834 10.175 3.534 1.00 73.04 H new ATOM 0 HG3 ARG A 436 -15.167 11.605 2.773 1.00 73.04 H new ATOM 0 HD2 ARG A 436 -13.170 10.292 2.037 1.00 50.33 H new ATOM 0 HD3 ARG A 436 -13.815 8.861 2.817 1.00 50.33 H new ATOM 0 HE ARG A 436 -15.427 8.620 1.090 1.00 30.00 H new ATOM 0 HH11 ARG A 436 -13.715 11.741 0.797 1.00 4.34 H new ATOM 0 HH12 ARG A 436 -14.347 12.070 -0.819 1.00 4.34 H new ATOM 0 HH21 ARG A 436 -16.225 9.050 -0.965 1.00 43.13 H new ATOM 0 HH22 ARG A 436 -15.779 10.530 -1.819 1.00 43.13 H new ATOM 746 N GLY A 437 -14.174 9.428 7.817 1.00 12.55 N ATOM 747 CA GLY A 437 -13.921 9.723 9.219 1.00 55.43 C ATOM 748 C GLY A 437 -12.679 8.983 9.718 1.00 42.42 C ATOM 749 O GLY A 437 -12.463 8.871 10.924 1.00 52.22 O ATOM 0 H GLY A 437 -14.778 8.623 7.653 1.00 12.55 H new ATOM 0 HA2 GLY A 437 -13.786 10.797 9.350 1.00 55.43 H new ATOM 0 HA3 GLY A 437 -14.786 9.435 9.817 1.00 55.43 H new ATOM 753 N GLU A 438 -11.896 8.498 8.767 1.00 73.42 N ATOM 754 CA GLU A 438 -10.681 7.772 9.096 1.00 70.43 C ATOM 755 C GLU A 438 -9.475 8.417 8.408 1.00 73.15 C ATOM 756 O GLU A 438 -8.677 9.096 9.053 1.00 5.32 O ATOM 757 CB GLU A 438 -10.804 6.296 8.716 1.00 13.12 C ATOM 758 CG GLU A 438 -12.219 5.970 8.234 1.00 25.21 C ATOM 759 CD GLU A 438 -12.433 6.451 6.797 1.00 44.55 C ATOM 760 OE1 GLU A 438 -13.146 7.441 6.576 1.00 13.12 O ATOM 761 OE2 GLU A 438 -11.827 5.757 5.894 1.00 14.11 O ATOM 0 H GLU A 438 -12.079 8.593 7.768 1.00 73.42 H new ATOM 0 HA GLU A 438 -10.531 7.824 10.174 1.00 70.43 H new ATOM 0 HB2 GLU A 438 -10.085 6.057 7.932 1.00 13.12 H new ATOM 0 HB3 GLU A 438 -10.556 5.674 9.576 1.00 13.12 H new ATOM 0 HG2 GLU A 438 -12.387 4.895 8.290 1.00 25.21 H new ATOM 0 HG3 GLU A 438 -12.949 6.442 8.892 1.00 25.21 H new ATOM 767 N LEU A 439 -9.381 8.183 7.108 1.00 63.40 N ATOM 768 CA LEU A 439 -8.286 8.732 6.326 1.00 40.25 C ATOM 769 C LEU A 439 -8.854 9.500 5.131 1.00 10.23 C ATOM 770 O LEU A 439 -9.945 9.193 4.652 1.00 23.40 O ATOM 771 CB LEU A 439 -7.300 7.629 5.935 1.00 64.11 C ATOM 772 CG LEU A 439 -7.689 6.779 4.725 1.00 10.14 C ATOM 773 CD1 LEU A 439 -7.405 7.522 3.418 1.00 64.23 C ATOM 774 CD2 LEU A 439 -6.999 5.413 4.769 1.00 41.24 C ATOM 0 H LEU A 439 -10.045 7.621 6.576 1.00 63.40 H new ATOM 0 HA LEU A 439 -7.713 9.444 6.921 1.00 40.25 H new ATOM 0 HB2 LEU A 439 -6.332 8.089 5.735 1.00 64.11 H new ATOM 0 HB3 LEU A 439 -7.168 6.967 6.791 1.00 64.11 H new ATOM 0 HG LEU A 439 -8.763 6.599 4.766 1.00 10.14 H new ATOM 0 HD11 LEU A 439 -7.691 6.895 2.573 1.00 64.23 H new ATOM 0 HD12 LEU A 439 -7.980 8.448 3.393 1.00 64.23 H new ATOM 0 HD13 LEU A 439 -6.342 7.753 3.355 1.00 64.23 H new ATOM 0 HD21 LEU A 439 -7.293 4.829 3.897 1.00 41.24 H new ATOM 0 HD22 LEU A 439 -5.918 5.551 4.765 1.00 41.24 H new ATOM 0 HD23 LEU A 439 -7.294 4.885 5.676 1.00 41.24 H new ATOM 785 N SER A 440 -8.088 10.484 4.682 1.00 11.51 N ATOM 786 CA SER A 440 -8.502 11.298 3.552 1.00 72.34 C ATOM 787 C SER A 440 -9.172 10.420 2.492 1.00 64.53 C ATOM 788 O SER A 440 -10.387 10.486 2.306 1.00 24.24 O ATOM 789 CB SER A 440 -7.310 12.045 2.947 1.00 0.23 C ATOM 790 OG SER A 440 -7.493 12.303 1.557 1.00 51.40 O ATOM 0 H SER A 440 -7.183 10.736 5.080 1.00 11.51 H new ATOM 0 HA SER A 440 -9.219 12.038 3.907 1.00 72.34 H new ATOM 0 HB2 SER A 440 -7.167 12.988 3.475 1.00 0.23 H new ATOM 0 HB3 SER A 440 -6.403 11.458 3.091 1.00 0.23 H new ATOM 0 HG SER A 440 -7.164 13.202 1.345 1.00 51.40 H new ATOM 795 N CYS A 441 -8.352 9.621 1.826 1.00 74.13 N ATOM 796 CA CYS A 441 -8.849 8.733 0.790 1.00 14.31 C ATOM 797 C CYS A 441 -7.669 7.936 0.233 1.00 2.13 C ATOM 798 O CYS A 441 -6.540 8.421 0.215 1.00 43.35 O ATOM 799 CB CYS A 441 -9.588 9.502 -0.308 1.00 60.01 C ATOM 800 SG CYS A 441 -10.222 8.337 -1.568 1.00 14.11 S ATOM 0 H CYS A 441 -7.346 9.570 1.984 1.00 74.13 H new ATOM 0 HA CYS A 441 -9.580 8.046 1.217 1.00 14.31 H new ATOM 0 HB2 CYS A 441 -10.413 10.067 0.125 1.00 60.01 H new ATOM 0 HB3 CYS A 441 -8.917 10.224 -0.773 1.00 60.01 H new ATOM 0 HG CYS A 441 -10.850 8.999 -2.494 1.00 14.11 H new ATOM 805 N LEU A 442 -7.972 6.723 -0.209 1.00 21.40 N ATOM 806 CA LEU A 442 -6.950 5.853 -0.765 1.00 34.12 C ATOM 807 C LEU A 442 -6.217 6.587 -1.889 1.00 34.00 C ATOM 808 O LEU A 442 -4.989 6.584 -1.940 1.00 70.33 O ATOM 809 CB LEU A 442 -7.560 4.518 -1.197 1.00 13.51 C ATOM 810 CG LEU A 442 -6.864 3.807 -2.360 1.00 23.53 C ATOM 811 CD1 LEU A 442 -7.303 2.345 -2.451 1.00 2.05 C ATOM 812 CD2 LEU A 442 -7.089 4.556 -3.674 1.00 20.25 C ATOM 0 H LEU A 442 -8.910 6.323 -0.193 1.00 21.40 H new ATOM 0 HA LEU A 442 -6.206 5.607 -0.007 1.00 34.12 H new ATOM 0 HB2 LEU A 442 -7.564 3.848 -0.337 1.00 13.51 H new ATOM 0 HB3 LEU A 442 -8.601 4.689 -1.472 1.00 13.51 H new ATOM 0 HG LEU A 442 -5.791 3.809 -2.168 1.00 23.53 H new ATOM 0 HD11 LEU A 442 -6.794 1.863 -3.286 1.00 2.05 H new ATOM 0 HD12 LEU A 442 -7.048 1.830 -1.525 1.00 2.05 H new ATOM 0 HD13 LEU A 442 -8.381 2.298 -2.608 1.00 2.05 H new ATOM 0 HD21 LEU A 442 -6.584 4.030 -4.484 1.00 20.25 H new ATOM 0 HD22 LEU A 442 -8.157 4.607 -3.885 1.00 20.25 H new ATOM 0 HD23 LEU A 442 -6.687 5.566 -3.591 1.00 20.25 H new ATOM 823 N GLN A 443 -7.003 7.199 -2.764 1.00 42.52 N ATOM 824 CA GLN A 443 -6.445 7.936 -3.883 1.00 35.45 C ATOM 825 C GLN A 443 -5.457 8.993 -3.386 1.00 1.34 C ATOM 826 O GLN A 443 -4.626 9.480 -4.150 1.00 45.15 O ATOM 827 CB GLN A 443 -7.552 8.574 -4.727 1.00 24.44 C ATOM 828 CG GLN A 443 -8.553 7.521 -5.205 1.00 62.33 C ATOM 829 CD GLN A 443 -9.600 8.142 -6.131 1.00 51.41 C ATOM 830 OE1 GLN A 443 -10.798 8.013 -5.931 1.00 32.50 O ATOM 831 NE2 GLN A 443 -9.086 8.819 -7.152 1.00 54.01 N ATOM 0 H GLN A 443 -8.022 7.199 -2.719 1.00 42.52 H new ATOM 0 HA GLN A 443 -5.905 7.235 -4.520 1.00 35.45 H new ATOM 0 HB2 GLN A 443 -8.070 9.333 -4.140 1.00 24.44 H new ATOM 0 HB3 GLN A 443 -7.113 9.080 -5.587 1.00 24.44 H new ATOM 0 HG2 GLN A 443 -8.026 6.724 -5.729 1.00 62.33 H new ATOM 0 HG3 GLN A 443 -9.046 7.066 -4.346 1.00 62.33 H new ATOM 0 HE21 GLN A 443 -8.074 8.888 -7.261 1.00 54.01 H new ATOM 0 HE22 GLN A 443 -9.703 9.270 -7.827 1.00 54.01 H new ATOM 838 N ASP A 444 -5.581 9.316 -2.107 1.00 11.31 N ATOM 839 CA ASP A 444 -4.709 10.305 -1.497 1.00 4.43 C ATOM 840 C ASP A 444 -3.294 9.735 -1.390 1.00 51.23 C ATOM 841 O ASP A 444 -2.317 10.440 -1.642 1.00 35.43 O ATOM 842 CB ASP A 444 -5.182 10.662 -0.086 1.00 14.51 C ATOM 843 CG ASP A 444 -4.780 12.055 0.399 1.00 54.54 C ATOM 844 OD1 ASP A 444 -4.986 12.409 1.569 1.00 1.04 O ATOM 845 OD2 ASP A 444 -4.225 12.804 -0.495 1.00 42.41 O ATOM 0 H ASP A 444 -6.272 8.910 -1.476 1.00 11.31 H new ATOM 0 HA ASP A 444 -4.726 11.199 -2.120 1.00 4.43 H new ATOM 0 HB2 ASP A 444 -6.269 10.582 -0.053 1.00 14.51 H new ATOM 0 HB3 ASP A 444 -4.786 9.923 0.611 1.00 14.51 H new ATOM 850 N ALA A 445 -3.227 8.466 -1.018 1.00 44.10 N ATOM 851 CA ALA A 445 -1.948 7.793 -0.876 1.00 43.54 C ATOM 852 C ALA A 445 -1.344 7.556 -2.260 1.00 34.22 C ATOM 853 O ALA A 445 -0.126 7.464 -2.404 1.00 5.41 O ATOM 854 CB ALA A 445 -2.137 6.493 -0.092 1.00 2.41 C ATOM 0 H ALA A 445 -4.039 7.885 -0.810 1.00 44.10 H new ATOM 0 HA ALA A 445 -1.250 8.413 -0.314 1.00 43.54 H new ATOM 0 HB1 ALA A 445 -1.176 5.989 0.014 1.00 2.41 H new ATOM 0 HB2 ALA A 445 -2.539 6.719 0.896 1.00 2.41 H new ATOM 0 HB3 ALA A 445 -2.831 5.844 -0.626 1.00 2.41 H new ATOM 860 N ILE A 446 -2.225 7.464 -3.246 1.00 73.35 N ATOM 861 CA ILE A 446 -1.794 7.240 -4.615 1.00 34.24 C ATOM 862 C ILE A 446 -0.841 8.362 -5.038 1.00 12.55 C ATOM 863 O ILE A 446 0.008 8.166 -5.905 1.00 33.30 O ATOM 864 CB ILE A 446 -3.004 7.080 -5.539 1.00 41.23 C ATOM 865 CG1 ILE A 446 -3.506 5.635 -5.540 1.00 1.14 C ATOM 866 CG2 ILE A 446 -2.686 7.578 -6.950 1.00 31.21 C ATOM 867 CD1 ILE A 446 -4.706 5.473 -6.474 1.00 30.42 C ATOM 0 H ILE A 446 -3.235 7.541 -3.124 1.00 73.35 H new ATOM 0 HA ILE A 446 -1.238 6.305 -4.690 1.00 34.24 H new ATOM 0 HB ILE A 446 -3.813 7.701 -5.154 1.00 41.23 H new ATOM 0 HG12 ILE A 446 -2.703 4.968 -5.854 1.00 1.14 H new ATOM 0 HG13 ILE A 446 -3.786 5.343 -4.528 1.00 1.14 H new ATOM 0 HG21 ILE A 446 -3.562 7.453 -7.586 1.00 31.21 H new ATOM 0 HG22 ILE A 446 -2.414 8.633 -6.911 1.00 31.21 H new ATOM 0 HG23 ILE A 446 -1.855 7.004 -7.360 1.00 31.21 H new ATOM 0 HD11 ILE A 446 -5.043 4.437 -6.456 1.00 30.42 H new ATOM 0 HD12 ILE A 446 -5.515 6.124 -6.143 1.00 30.42 H new ATOM 0 HD13 ILE A 446 -4.416 5.743 -7.489 1.00 30.42 H new ATOM 878 N ASP A 447 -1.018 9.512 -4.404 1.00 3.14 N ATOM 879 CA ASP A 447 -0.185 10.665 -4.704 1.00 52.54 C ATOM 880 C ASP A 447 0.843 10.850 -3.584 1.00 74.03 C ATOM 881 O ASP A 447 2.046 10.858 -3.839 1.00 3.21 O ATOM 882 CB ASP A 447 -1.024 11.941 -4.790 1.00 73.14 C ATOM 883 CG ASP A 447 -2.217 11.999 -3.833 1.00 4.14 C ATOM 884 OD1 ASP A 447 -3.303 11.482 -4.134 1.00 72.41 O ATOM 885 OD2 ASP A 447 -1.993 12.614 -2.721 1.00 61.20 O ATOM 0 H ASP A 447 -1.724 9.670 -3.685 1.00 3.14 H new ATOM 0 HA ASP A 447 0.304 10.489 -5.662 1.00 52.54 H new ATOM 0 HB2 ASP A 447 -0.378 12.796 -4.593 1.00 73.14 H new ATOM 0 HB3 ASP A 447 -1.391 12.048 -5.811 1.00 73.14 H new ATOM 890 N HIS A 448 0.330 10.994 -2.371 1.00 64.43 N ATOM 891 CA HIS A 448 1.188 11.177 -1.214 1.00 61.22 C ATOM 892 C HIS A 448 2.122 9.974 -1.071 1.00 63.44 C ATOM 893 O HIS A 448 3.343 10.130 -1.059 1.00 3.14 O ATOM 894 CB HIS A 448 0.357 11.435 0.044 1.00 11.42 C ATOM 895 CG HIS A 448 -0.402 12.741 0.023 1.00 64.33 C ATOM 896 ND1 HIS A 448 -0.249 13.680 -0.983 1.00 31.45 N ATOM 897 CD2 HIS A 448 -1.318 13.255 0.893 1.00 25.52 C ATOM 898 CE1 HIS A 448 -1.042 14.708 -0.719 1.00 0.21 C ATOM 899 NE2 HIS A 448 -1.702 14.443 0.445 1.00 14.53 N ATOM 0 H HIS A 448 -0.669 10.988 -2.165 1.00 64.43 H new ATOM 0 HA HIS A 448 1.810 12.061 -1.355 1.00 61.22 H new ATOM 0 HB2 HIS A 448 -0.352 10.617 0.173 1.00 11.42 H new ATOM 0 HB3 HIS A 448 1.017 11.424 0.911 1.00 11.42 H new ATOM 0 HD2 HIS A 448 -1.671 12.776 1.794 1.00 25.52 H new ATOM 0 HE1 HIS A 448 -1.147 15.599 -1.320 1.00 0.21 H new ATOM 0 HE2 HIS A 448 -2.379 15.057 0.897 1.00 14.53 H new ATOM 906 N SER A 449 1.515 8.802 -0.966 1.00 4.54 N ATOM 907 CA SER A 449 2.276 7.573 -0.824 1.00 62.21 C ATOM 908 C SER A 449 2.930 7.207 -2.158 1.00 23.02 C ATOM 909 O SER A 449 2.466 7.626 -3.217 1.00 2.45 O ATOM 910 CB SER A 449 1.387 6.428 -0.337 1.00 0.33 C ATOM 911 OG SER A 449 1.004 5.559 -1.399 1.00 72.40 O ATOM 0 H SER A 449 0.503 8.677 -0.976 1.00 4.54 H new ATOM 0 HA SER A 449 3.053 7.736 -0.077 1.00 62.21 H new ATOM 0 HB2 SER A 449 1.917 5.857 0.425 1.00 0.33 H new ATOM 0 HB3 SER A 449 0.494 6.838 0.135 1.00 0.33 H new ATOM 0 HG SER A 449 0.558 6.077 -2.101 1.00 72.40 H new ATOM 916 N ALA A 450 3.998 6.429 -2.062 1.00 31.23 N ATOM 917 CA ALA A 450 4.722 6.001 -3.247 1.00 41.11 C ATOM 918 C ALA A 450 3.875 4.985 -4.017 1.00 65.53 C ATOM 919 O ALA A 450 3.257 5.324 -5.024 1.00 1.13 O ATOM 920 CB ALA A 450 6.084 5.437 -2.839 1.00 54.02 C ATOM 0 H ALA A 450 4.380 6.084 -1.181 1.00 31.23 H new ATOM 0 HA ALA A 450 4.907 6.846 -3.910 1.00 41.11 H new ATOM 0 HB1 ALA A 450 6.626 5.116 -3.728 1.00 54.02 H new ATOM 0 HB2 ALA A 450 6.657 6.207 -2.323 1.00 54.02 H new ATOM 0 HB3 ALA A 450 5.941 4.585 -2.175 1.00 54.02 H new ATOM 926 N PHE A 451 3.877 3.760 -3.513 1.00 44.42 N ATOM 927 CA PHE A 451 3.117 2.692 -4.139 1.00 13.12 C ATOM 928 C PHE A 451 2.052 2.144 -3.187 1.00 4.01 C ATOM 929 O PHE A 451 2.357 1.786 -2.050 1.00 44.40 O ATOM 930 CB PHE A 451 4.107 1.576 -4.475 1.00 31.52 C ATOM 931 CG PHE A 451 5.353 2.053 -5.224 1.00 23.12 C ATOM 932 CD1 PHE A 451 6.290 2.800 -4.580 1.00 72.21 C ATOM 933 CD2 PHE A 451 5.524 1.731 -6.534 1.00 34.30 C ATOM 934 CE1 PHE A 451 7.446 3.243 -5.274 1.00 13.23 C ATOM 935 CE2 PHE A 451 6.680 2.175 -7.230 1.00 5.24 C ATOM 936 CZ PHE A 451 7.617 2.922 -6.585 1.00 10.01 C ATOM 0 H PHE A 451 4.393 3.483 -2.678 1.00 44.42 H new ATOM 0 HA PHE A 451 2.611 3.068 -5.028 1.00 13.12 H new ATOM 0 HB2 PHE A 451 4.416 1.088 -3.551 1.00 31.52 H new ATOM 0 HB3 PHE A 451 3.599 0.823 -5.078 1.00 31.52 H new ATOM 0 HD1 PHE A 451 6.154 3.056 -3.540 1.00 72.21 H new ATOM 0 HD2 PHE A 451 4.781 1.137 -7.045 1.00 34.30 H new ATOM 0 HE1 PHE A 451 8.190 3.835 -4.761 1.00 13.23 H new ATOM 0 HE2 PHE A 451 6.815 1.920 -8.271 1.00 5.24 H new ATOM 0 HZ PHE A 451 8.496 3.260 -7.114 1.00 10.01 H new ATOM 945 N ILE A 452 0.826 2.095 -3.686 1.00 2.22 N ATOM 946 CA ILE A 452 -0.285 1.597 -2.894 1.00 42.12 C ATOM 947 C ILE A 452 -0.120 0.091 -2.681 1.00 31.35 C ATOM 948 O ILE A 452 0.057 -0.659 -3.640 1.00 75.12 O ATOM 949 CB ILE A 452 -1.618 1.985 -3.537 1.00 25.14 C ATOM 950 CG1 ILE A 452 -1.703 3.496 -3.756 1.00 63.23 C ATOM 951 CG2 ILE A 452 -2.797 1.457 -2.715 1.00 15.01 C ATOM 952 CD1 ILE A 452 -1.663 4.246 -2.423 1.00 64.31 C ATOM 0 H ILE A 452 0.578 2.392 -4.630 1.00 2.22 H new ATOM 0 HA ILE A 452 -0.287 2.060 -1.907 1.00 42.12 H new ATOM 0 HB ILE A 452 -1.673 1.515 -4.519 1.00 25.14 H new ATOM 0 HG12 ILE A 452 -0.876 3.823 -4.386 1.00 63.23 H new ATOM 0 HG13 ILE A 452 -2.624 3.739 -4.287 1.00 63.23 H new ATOM 0 HG21 ILE A 452 -3.733 1.746 -3.193 1.00 15.01 H new ATOM 0 HG22 ILE A 452 -2.741 0.370 -2.655 1.00 15.01 H new ATOM 0 HG23 ILE A 452 -2.758 1.878 -1.710 1.00 15.01 H new ATOM 0 HD11 ILE A 452 -1.725 5.319 -2.607 1.00 64.31 H new ATOM 0 HD12 ILE A 452 -2.505 3.935 -1.805 1.00 64.31 H new ATOM 0 HD13 ILE A 452 -0.730 4.020 -1.906 1.00 64.31 H new ATOM 963 N ILE A 453 -0.182 -0.308 -1.419 1.00 41.04 N ATOM 964 CA ILE A 453 -0.042 -1.710 -1.069 1.00 24.13 C ATOM 965 C ILE A 453 -1.418 -2.287 -0.729 1.00 23.33 C ATOM 966 O ILE A 453 -2.021 -1.910 0.275 1.00 22.31 O ATOM 967 CB ILE A 453 0.992 -1.883 0.046 1.00 50.52 C ATOM 968 CG1 ILE A 453 2.407 -1.973 -0.527 1.00 61.24 C ATOM 969 CG2 ILE A 453 0.651 -3.088 0.926 1.00 65.12 C ATOM 970 CD1 ILE A 453 3.453 -1.660 0.546 1.00 54.23 C ATOM 0 H ILE A 453 -0.328 0.317 -0.626 1.00 41.04 H new ATOM 0 HA ILE A 453 0.340 -2.278 -1.917 1.00 24.13 H new ATOM 0 HB ILE A 453 0.960 -0.999 0.683 1.00 50.52 H new ATOM 0 HG12 ILE A 453 2.579 -2.972 -0.927 1.00 61.24 H new ATOM 0 HG13 ILE A 453 2.512 -1.275 -1.357 1.00 61.24 H new ATOM 0 HG21 ILE A 453 1.401 -3.189 1.711 1.00 65.12 H new ATOM 0 HG22 ILE A 453 -0.330 -2.942 1.378 1.00 65.12 H new ATOM 0 HG23 ILE A 453 0.639 -3.992 0.317 1.00 65.12 H new ATOM 0 HD11 ILE A 453 4.451 -1.731 0.113 1.00 54.23 H new ATOM 0 HD12 ILE A 453 3.293 -0.651 0.926 1.00 54.23 H new ATOM 0 HD13 ILE A 453 3.361 -2.375 1.364 1.00 54.23 H new ATOM 981 N LEU A 454 -1.872 -3.192 -1.583 1.00 5.21 N ATOM 982 CA LEU A 454 -3.166 -3.825 -1.385 1.00 41.04 C ATOM 983 C LEU A 454 -2.978 -5.122 -0.596 1.00 31.35 C ATOM 984 O LEU A 454 -2.639 -6.157 -1.169 1.00 75.04 O ATOM 985 CB LEU A 454 -3.878 -4.015 -2.724 1.00 12.25 C ATOM 986 CG LEU A 454 -4.146 -2.742 -3.529 1.00 52.04 C ATOM 987 CD1 LEU A 454 -4.615 -1.606 -2.620 1.00 2.13 C ATOM 988 CD2 LEU A 454 -2.918 -2.347 -4.351 1.00 35.22 C ATOM 0 H LEU A 454 -1.368 -3.502 -2.414 1.00 5.21 H new ATOM 0 HA LEU A 454 -3.819 -3.184 -0.792 1.00 41.04 H new ATOM 0 HB2 LEU A 454 -3.281 -4.690 -3.337 1.00 12.25 H new ATOM 0 HB3 LEU A 454 -4.831 -4.511 -2.539 1.00 12.25 H new ATOM 0 HG LEU A 454 -4.954 -2.946 -4.231 1.00 52.04 H new ATOM 0 HD11 LEU A 454 -4.798 -0.713 -3.218 1.00 2.13 H new ATOM 0 HD12 LEU A 454 -5.535 -1.900 -2.116 1.00 2.13 H new ATOM 0 HD13 LEU A 454 -3.846 -1.393 -1.877 1.00 2.13 H new ATOM 0 HD21 LEU A 454 -3.134 -1.439 -4.914 1.00 35.22 H new ATOM 0 HD22 LEU A 454 -2.075 -2.168 -3.683 1.00 35.22 H new ATOM 0 HD23 LEU A 454 -2.668 -3.152 -5.042 1.00 35.22 H new ATOM 999 N LEU A 455 -3.208 -5.026 0.704 1.00 52.12 N ATOM 1000 CA LEU A 455 -3.069 -6.180 1.577 1.00 33.34 C ATOM 1001 C LEU A 455 -4.131 -7.220 1.213 1.00 13.44 C ATOM 1002 O LEU A 455 -5.163 -7.315 1.875 1.00 50.34 O ATOM 1003 CB LEU A 455 -3.106 -5.750 3.045 1.00 31.54 C ATOM 1004 CG LEU A 455 -2.435 -6.699 4.038 1.00 25.15 C ATOM 1005 CD1 LEU A 455 -1.105 -7.220 3.489 1.00 10.50 C ATOM 1006 CD2 LEU A 455 -2.268 -6.034 5.407 1.00 31.40 C ATOM 0 H LEU A 455 -3.490 -4.167 1.175 1.00 52.12 H new ATOM 0 HA LEU A 455 -2.097 -6.652 1.433 1.00 33.34 H new ATOM 0 HB2 LEU A 455 -2.631 -4.773 3.129 1.00 31.54 H new ATOM 0 HB3 LEU A 455 -4.148 -5.624 3.340 1.00 31.54 H new ATOM 0 HG LEU A 455 -3.086 -7.562 4.176 1.00 25.15 H new ATOM 0 HD11 LEU A 455 -0.650 -7.893 4.216 1.00 10.50 H new ATOM 0 HD12 LEU A 455 -1.282 -7.758 2.558 1.00 10.50 H new ATOM 0 HD13 LEU A 455 -0.435 -6.381 3.302 1.00 10.50 H new ATOM 0 HD21 LEU A 455 -1.788 -6.731 6.094 1.00 31.40 H new ATOM 0 HD22 LEU A 455 -1.650 -5.142 5.305 1.00 31.40 H new ATOM 0 HD23 LEU A 455 -3.247 -5.755 5.798 1.00 31.40 H new ATOM 1017 N LEU A 456 -3.841 -7.972 0.162 1.00 0.32 N ATOM 1018 CA LEU A 456 -4.759 -9.001 -0.298 1.00 64.52 C ATOM 1019 C LEU A 456 -4.815 -10.127 0.738 1.00 1.12 C ATOM 1020 O LEU A 456 -3.944 -10.995 0.765 1.00 65.00 O ATOM 1021 CB LEU A 456 -4.373 -9.475 -1.700 1.00 32.04 C ATOM 1022 CG LEU A 456 -4.052 -8.376 -2.714 1.00 33.40 C ATOM 1023 CD1 LEU A 456 -3.921 -8.952 -4.125 1.00 2.44 C ATOM 1024 CD2 LEU A 456 -5.085 -7.250 -2.648 1.00 53.13 C ATOM 0 H LEU A 456 -2.984 -7.890 -0.384 1.00 0.32 H new ATOM 0 HA LEU A 456 -5.768 -8.599 -0.389 1.00 64.52 H new ATOM 0 HB2 LEU A 456 -3.505 -10.128 -1.615 1.00 32.04 H new ATOM 0 HB3 LEU A 456 -5.189 -10.080 -2.095 1.00 32.04 H new ATOM 0 HG LEU A 456 -3.087 -7.943 -2.453 1.00 33.40 H new ATOM 0 HD11 LEU A 456 -3.693 -8.149 -4.826 1.00 2.44 H new ATOM 0 HD12 LEU A 456 -3.119 -9.689 -4.144 1.00 2.44 H new ATOM 0 HD13 LEU A 456 -4.858 -9.428 -4.412 1.00 2.44 H new ATOM 0 HD21 LEU A 456 -4.833 -6.482 -3.379 1.00 53.13 H new ATOM 0 HD22 LEU A 456 -6.074 -7.651 -2.869 1.00 53.13 H new ATOM 0 HD23 LEU A 456 -5.085 -6.814 -1.649 1.00 53.13 H new ATOM 1035 N THR A 457 -5.850 -10.076 1.563 1.00 23.20 N ATOM 1036 CA THR A 457 -6.032 -11.081 2.598 1.00 13.41 C ATOM 1037 C THR A 457 -7.476 -11.588 2.601 1.00 71.54 C ATOM 1038 O THR A 457 -8.373 -10.921 2.088 1.00 51.33 O ATOM 1039 CB THR A 457 -5.600 -10.469 3.932 1.00 40.33 C ATOM 1040 OG1 THR A 457 -6.684 -9.618 4.290 1.00 53.55 O ATOM 1041 CG2 THR A 457 -4.413 -9.516 3.783 1.00 22.35 C ATOM 0 H THR A 457 -6.571 -9.355 1.536 1.00 23.20 H new ATOM 0 HA THR A 457 -5.413 -11.958 2.411 1.00 13.41 H new ATOM 0 HB THR A 457 -5.340 -11.266 4.629 1.00 40.33 H new ATOM 0 HG1 THR A 457 -6.533 -9.256 5.188 1.00 53.55 H new ATOM 0 HG21 THR A 457 -4.148 -9.110 4.759 1.00 22.35 H new ATOM 0 HG22 THR A 457 -3.561 -10.057 3.371 1.00 22.35 H new ATOM 0 HG23 THR A 457 -4.683 -8.700 3.112 1.00 22.35 H new ATOM 1049 N SER A 458 -7.655 -12.764 3.184 1.00 14.13 N ATOM 1050 CA SER A 458 -8.974 -13.368 3.260 1.00 52.12 C ATOM 1051 C SER A 458 -9.929 -12.445 4.020 1.00 42.20 C ATOM 1052 O SER A 458 -11.145 -12.622 3.962 1.00 42.35 O ATOM 1053 CB SER A 458 -8.913 -14.740 3.933 1.00 42.31 C ATOM 1054 OG SER A 458 -7.985 -14.763 5.016 1.00 3.54 O ATOM 0 H SER A 458 -6.909 -13.315 3.608 1.00 14.13 H new ATOM 0 HA SER A 458 -9.346 -13.508 2.245 1.00 52.12 H new ATOM 0 HB2 SER A 458 -9.904 -15.009 4.299 1.00 42.31 H new ATOM 0 HB3 SER A 458 -8.630 -15.493 3.197 1.00 42.31 H new ATOM 0 HG SER A 458 -7.439 -15.575 4.962 1.00 3.54 H new ATOM 1059 N ASN A 459 -9.342 -11.482 4.715 1.00 51.32 N ATOM 1060 CA ASN A 459 -10.125 -10.532 5.486 1.00 14.45 C ATOM 1061 C ASN A 459 -10.238 -9.221 4.706 1.00 41.15 C ATOM 1062 O ASN A 459 -10.528 -8.173 5.284 1.00 31.22 O ATOM 1063 CB ASN A 459 -9.458 -10.228 6.827 1.00 44.51 C ATOM 1064 CG ASN A 459 -9.738 -11.338 7.842 1.00 62.12 C ATOM 1065 OD1 ASN A 459 -9.753 -12.516 7.525 1.00 71.24 O ATOM 1066 ND2 ASN A 459 -9.959 -10.898 9.079 1.00 12.02 N ATOM 0 H ASN A 459 -8.333 -11.339 4.760 1.00 51.32 H new ATOM 0 HA ASN A 459 -11.107 -10.970 5.664 1.00 14.45 H new ATOM 0 HB2 ASN A 459 -8.382 -10.122 6.686 1.00 44.51 H new ATOM 0 HB3 ASN A 459 -9.825 -9.277 7.212 1.00 44.51 H new ATOM 0 HD21 ASN A 459 -10.155 -11.561 9.829 1.00 12.02 H new ATOM 0 HD22 ASN A 459 -9.932 -9.898 9.277 1.00 12.02 H new ATOM 1072 N PHE A 460 -10.005 -9.319 3.406 1.00 73.40 N ATOM 1073 CA PHE A 460 -10.077 -8.154 2.540 1.00 63.32 C ATOM 1074 C PHE A 460 -10.404 -8.557 1.101 1.00 4.44 C ATOM 1075 O PHE A 460 -10.316 -9.732 0.748 1.00 55.34 O ATOM 1076 CB PHE A 460 -8.699 -7.490 2.570 1.00 74.15 C ATOM 1077 CG PHE A 460 -8.606 -6.210 1.736 1.00 54.14 C ATOM 1078 CD1 PHE A 460 -9.495 -5.201 1.938 1.00 63.21 C ATOM 1079 CD2 PHE A 460 -7.635 -6.082 0.793 1.00 0.31 C ATOM 1080 CE1 PHE A 460 -9.409 -4.013 1.164 1.00 30.45 C ATOM 1081 CE2 PHE A 460 -7.550 -4.895 0.018 1.00 52.13 C ATOM 1082 CZ PHE A 460 -8.439 -3.885 0.220 1.00 64.20 C ATOM 0 H PHE A 460 -9.766 -10.189 2.930 1.00 73.40 H new ATOM 0 HA PHE A 460 -10.862 -7.482 2.887 1.00 63.32 H new ATOM 0 HB2 PHE A 460 -8.442 -7.258 3.603 1.00 74.15 H new ATOM 0 HB3 PHE A 460 -7.956 -8.201 2.209 1.00 74.15 H new ATOM 0 HD1 PHE A 460 -10.266 -5.303 2.687 1.00 63.21 H new ATOM 0 HD2 PHE A 460 -6.928 -6.883 0.633 1.00 0.31 H new ATOM 0 HE1 PHE A 460 -10.114 -3.211 1.325 1.00 30.45 H new ATOM 0 HE2 PHE A 460 -6.779 -4.794 -0.732 1.00 52.13 H new ATOM 0 HZ PHE A 460 -8.374 -2.982 -0.369 1.00 64.20 H new ATOM 1091 N ASP A 461 -10.777 -7.561 0.313 1.00 15.14 N ATOM 1092 CA ASP A 461 -11.119 -7.798 -1.081 1.00 64.51 C ATOM 1093 C ASP A 461 -10.030 -7.206 -1.976 1.00 62.13 C ATOM 1094 O ASP A 461 -9.488 -6.141 -1.681 1.00 14.13 O ATOM 1095 CB ASP A 461 -12.446 -7.128 -1.443 1.00 63.25 C ATOM 1096 CG ASP A 461 -12.731 -5.818 -0.706 1.00 73.43 C ATOM 1097 OD1 ASP A 461 -11.830 -4.992 -0.499 1.00 75.34 O ATOM 1098 OD2 ASP A 461 -13.956 -5.656 -0.333 1.00 24.50 O ATOM 0 H ASP A 461 -10.850 -6.588 0.611 1.00 15.14 H new ATOM 0 HA ASP A 461 -11.206 -8.874 -1.229 1.00 64.51 H new ATOM 0 HB2 ASP A 461 -12.457 -6.934 -2.516 1.00 63.25 H new ATOM 0 HB3 ASP A 461 -13.257 -7.827 -1.237 1.00 63.25 H new ATOM 1103 N CYS A 462 -9.740 -7.921 -3.053 1.00 53.34 N ATOM 1104 CA CYS A 462 -8.726 -7.479 -3.994 1.00 73.40 C ATOM 1105 C CYS A 462 -9.415 -6.694 -5.112 1.00 32.13 C ATOM 1106 O CYS A 462 -9.111 -5.522 -5.333 1.00 24.32 O ATOM 1107 CB CYS A 462 -7.911 -8.654 -4.541 1.00 54.14 C ATOM 1108 SG CYS A 462 -7.583 -9.861 -3.207 1.00 40.52 S ATOM 0 H CYS A 462 -10.190 -8.804 -3.295 1.00 53.34 H new ATOM 0 HA CYS A 462 -8.012 -6.832 -3.484 1.00 73.40 H new ATOM 0 HB2 CYS A 462 -8.453 -9.136 -5.354 1.00 54.14 H new ATOM 0 HB3 CYS A 462 -6.970 -8.293 -4.956 1.00 54.14 H new ATOM 0 HG CYS A 462 -7.307 -9.227 -2.106 1.00 40.52 H new ATOM 1113 N ARG A 463 -10.331 -7.371 -5.789 1.00 72.45 N ATOM 1114 CA ARG A 463 -11.067 -6.752 -6.878 1.00 70.42 C ATOM 1115 C ARG A 463 -11.391 -5.295 -6.539 1.00 34.31 C ATOM 1116 O ARG A 463 -11.471 -4.451 -7.430 1.00 73.34 O ATOM 1117 CB ARG A 463 -12.368 -7.504 -7.162 1.00 1.30 C ATOM 1118 CG ARG A 463 -12.127 -8.678 -8.113 1.00 1.14 C ATOM 1119 CD ARG A 463 -13.415 -9.471 -8.344 1.00 70.21 C ATOM 1120 NE ARG A 463 -14.177 -8.881 -9.467 1.00 73.35 N ATOM 1121 CZ ARG A 463 -15.387 -9.318 -9.873 1.00 1.24 C ATOM 1122 NH1 ARG A 463 -15.985 -10.356 -9.250 1.00 22.15 N ATOM 1123 NH2 ARG A 463 -15.978 -8.718 -10.888 1.00 14.45 N ATOM 0 H ARG A 463 -10.580 -8.343 -5.604 1.00 72.45 H new ATOM 0 HA ARG A 463 -10.438 -6.791 -7.767 1.00 70.42 H new ATOM 0 HB2 ARG A 463 -12.792 -7.870 -6.227 1.00 1.30 H new ATOM 0 HB3 ARG A 463 -13.098 -6.822 -7.598 1.00 1.30 H new ATOM 0 HG2 ARG A 463 -11.749 -8.307 -9.066 1.00 1.14 H new ATOM 0 HG3 ARG A 463 -11.361 -9.334 -7.699 1.00 1.14 H new ATOM 0 HD2 ARG A 463 -13.177 -10.512 -8.562 1.00 70.21 H new ATOM 0 HD3 ARG A 463 -14.022 -9.466 -7.439 1.00 70.21 H new ATOM 0 HE ARG A 463 -13.761 -8.094 -9.966 1.00 73.35 H new ATOM 0 HH11 ARG A 463 -15.522 -10.816 -8.466 1.00 22.15 H new ATOM 0 HH12 ARG A 463 -16.900 -10.680 -9.563 1.00 22.15 H new ATOM 0 HH21 ARG A 463 -15.520 -7.935 -11.354 1.00 14.45 H new ATOM 0 HH22 ARG A 463 -16.893 -9.037 -11.207 1.00 14.45 H new ATOM 1133 N LEU A 464 -11.569 -5.047 -5.250 1.00 2.44 N ATOM 1134 CA LEU A 464 -11.883 -3.708 -4.783 1.00 41.12 C ATOM 1135 C LEU A 464 -10.589 -2.904 -4.648 1.00 63.44 C ATOM 1136 O LEU A 464 -10.405 -1.896 -5.329 1.00 25.33 O ATOM 1137 CB LEU A 464 -12.708 -3.768 -3.495 1.00 20.14 C ATOM 1138 CG LEU A 464 -12.901 -2.442 -2.759 1.00 71.15 C ATOM 1139 CD1 LEU A 464 -11.651 -2.072 -1.959 1.00 43.42 C ATOM 1140 CD2 LEU A 464 -13.310 -1.331 -3.728 1.00 51.03 C ATOM 0 H LEU A 464 -11.502 -5.751 -4.515 1.00 2.44 H new ATOM 0 HA LEU A 464 -12.508 -3.188 -5.509 1.00 41.12 H new ATOM 0 HB2 LEU A 464 -13.691 -4.173 -3.735 1.00 20.14 H new ATOM 0 HB3 LEU A 464 -12.230 -4.472 -2.814 1.00 20.14 H new ATOM 0 HG LEU A 464 -13.716 -2.563 -2.046 1.00 71.15 H new ATOM 0 HD11 LEU A 464 -11.815 -1.125 -1.445 1.00 43.42 H new ATOM 0 HD12 LEU A 464 -11.444 -2.852 -1.226 1.00 43.42 H new ATOM 0 HD13 LEU A 464 -10.802 -1.976 -2.635 1.00 43.42 H new ATOM 0 HD21 LEU A 464 -13.441 -0.399 -3.178 1.00 51.03 H new ATOM 0 HD22 LEU A 464 -12.534 -1.202 -4.482 1.00 51.03 H new ATOM 0 HD23 LEU A 464 -14.248 -1.600 -4.215 1.00 51.03 H new ATOM 1151 N SER A 465 -9.725 -3.378 -3.762 1.00 5.54 N ATOM 1152 CA SER A 465 -8.453 -2.715 -3.528 1.00 21.23 C ATOM 1153 C SER A 465 -7.881 -2.201 -4.849 1.00 73.21 C ATOM 1154 O SER A 465 -7.365 -1.086 -4.914 1.00 64.22 O ATOM 1155 CB SER A 465 -7.458 -3.659 -2.849 1.00 22.21 C ATOM 1156 OG SER A 465 -6.627 -4.328 -3.795 1.00 41.03 O ATOM 0 H SER A 465 -9.881 -4.213 -3.198 1.00 5.54 H new ATOM 0 HA SER A 465 -8.624 -1.870 -2.861 1.00 21.23 H new ATOM 0 HB2 SER A 465 -6.836 -3.093 -2.156 1.00 22.21 H new ATOM 0 HB3 SER A 465 -8.002 -4.396 -2.259 1.00 22.21 H new ATOM 0 HG SER A 465 -7.178 -4.903 -4.366 1.00 41.03 H new ATOM 1161 N LEU A 466 -7.990 -3.037 -5.870 1.00 22.42 N ATOM 1162 CA LEU A 466 -7.488 -2.680 -7.186 1.00 34.30 C ATOM 1163 C LEU A 466 -8.367 -1.578 -7.781 1.00 42.43 C ATOM 1164 O LEU A 466 -7.877 -0.501 -8.117 1.00 63.34 O ATOM 1165 CB LEU A 466 -7.378 -3.923 -8.072 1.00 53.23 C ATOM 1166 CG LEU A 466 -6.557 -3.762 -9.354 1.00 73.32 C ATOM 1167 CD1 LEU A 466 -5.836 -5.063 -9.710 1.00 2.23 C ATOM 1168 CD2 LEU A 466 -7.427 -3.255 -10.504 1.00 1.34 C ATOM 0 H LEU A 466 -8.419 -3.961 -5.813 1.00 22.42 H new ATOM 0 HA LEU A 466 -6.478 -2.278 -7.112 1.00 34.30 H new ATOM 0 HB2 LEU A 466 -6.940 -4.728 -7.482 1.00 53.23 H new ATOM 0 HB3 LEU A 466 -8.384 -4.240 -8.346 1.00 53.23 H new ATOM 0 HG LEU A 466 -5.791 -3.008 -9.176 1.00 73.32 H new ATOM 0 HD11 LEU A 466 -5.260 -4.921 -10.625 1.00 2.23 H new ATOM 0 HD12 LEU A 466 -5.164 -5.341 -8.898 1.00 2.23 H new ATOM 0 HD13 LEU A 466 -6.569 -5.855 -9.862 1.00 2.23 H new ATOM 0 HD21 LEU A 466 -6.818 -3.150 -11.402 1.00 1.34 H new ATOM 0 HD22 LEU A 466 -8.232 -3.966 -10.692 1.00 1.34 H new ATOM 0 HD23 LEU A 466 -7.853 -2.287 -10.239 1.00 1.34 H new ATOM 1179 N HIS A 467 -9.652 -1.883 -7.892 1.00 22.52 N ATOM 1180 CA HIS A 467 -10.603 -0.932 -8.438 1.00 1.11 C ATOM 1181 C HIS A 467 -10.324 0.458 -7.868 1.00 54.10 C ATOM 1182 O HIS A 467 -10.059 1.400 -8.615 1.00 4.51 O ATOM 1183 CB HIS A 467 -12.041 -1.398 -8.192 1.00 22.42 C ATOM 1184 CG HIS A 467 -13.089 -0.376 -8.562 1.00 33.24 C ATOM 1185 ND1 HIS A 467 -12.890 0.581 -9.542 1.00 63.42 N ATOM 1186 CD2 HIS A 467 -14.347 -0.175 -8.078 1.00 44.32 C ATOM 1187 CE1 HIS A 467 -13.985 1.321 -9.633 1.00 70.32 C ATOM 1188 NE2 HIS A 467 -14.887 0.852 -8.724 1.00 25.03 N ATOM 0 H HIS A 467 -10.056 -2.777 -7.612 1.00 22.52 H new ATOM 0 HA HIS A 467 -10.483 -0.873 -9.520 1.00 1.11 H new ATOM 0 HB2 HIS A 467 -12.219 -2.309 -8.763 1.00 22.42 H new ATOM 0 HB3 HIS A 467 -12.154 -1.654 -7.139 1.00 22.42 H new ATOM 0 HD2 HIS A 467 -14.824 -0.753 -7.301 1.00 44.32 H new ATOM 0 HE1 HIS A 467 -14.137 2.150 -10.308 1.00 70.32 H new ATOM 0 HE2 HIS A 467 -15.822 1.228 -8.566 1.00 25.03 H new ATOM 1195 N GLN A 468 -10.393 0.546 -6.547 1.00 73.24 N ATOM 1196 CA GLN A 468 -10.150 1.807 -5.867 1.00 53.33 C ATOM 1197 C GLN A 468 -8.895 2.480 -6.426 1.00 1.35 C ATOM 1198 O GLN A 468 -8.823 3.705 -6.498 1.00 14.42 O ATOM 1199 CB GLN A 468 -10.035 1.600 -4.355 1.00 30.01 C ATOM 1200 CG GLN A 468 -11.322 1.000 -3.784 1.00 22.52 C ATOM 1201 CD GLN A 468 -11.544 1.455 -2.340 1.00 54.43 C ATOM 1202 OE1 GLN A 468 -12.634 1.837 -1.944 1.00 12.41 O ATOM 1203 NE2 GLN A 468 -10.456 1.393 -1.579 1.00 71.25 N ATOM 0 H GLN A 468 -10.614 -0.236 -5.930 1.00 73.24 H new ATOM 0 HA GLN A 468 -11.000 2.465 -6.048 1.00 53.33 H new ATOM 0 HB2 GLN A 468 -9.195 0.941 -4.137 1.00 30.01 H new ATOM 0 HB3 GLN A 468 -9.827 2.553 -3.869 1.00 30.01 H new ATOM 0 HG2 GLN A 468 -12.171 1.299 -4.398 1.00 22.52 H new ATOM 0 HG3 GLN A 468 -11.269 -0.088 -3.822 1.00 22.52 H new ATOM 0 HE21 GLN A 468 -9.575 1.064 -1.974 1.00 71.25 H new ATOM 0 HE22 GLN A 468 -10.502 1.675 -0.600 1.00 71.25 H new ATOM 1210 N VAL A 469 -7.937 1.648 -6.807 1.00 45.51 N ATOM 1211 CA VAL A 469 -6.688 2.147 -7.357 1.00 24.32 C ATOM 1212 C VAL A 469 -6.906 2.557 -8.814 1.00 33.24 C ATOM 1213 O VAL A 469 -6.838 3.739 -9.148 1.00 1.51 O ATOM 1214 CB VAL A 469 -5.586 1.098 -7.189 1.00 54.23 C ATOM 1215 CG1 VAL A 469 -4.233 1.647 -7.643 1.00 44.20 C ATOM 1216 CG2 VAL A 469 -5.521 0.599 -5.744 1.00 63.53 C ATOM 0 H VAL A 469 -8.000 0.632 -6.746 1.00 45.51 H new ATOM 0 HA VAL A 469 -6.359 3.034 -6.815 1.00 24.32 H new ATOM 0 HB VAL A 469 -5.831 0.248 -7.825 1.00 54.23 H new ATOM 0 HG11 VAL A 469 -3.468 0.882 -7.513 1.00 44.20 H new ATOM 0 HG12 VAL A 469 -4.289 1.929 -8.694 1.00 44.20 H new ATOM 0 HG13 VAL A 469 -3.976 2.522 -7.046 1.00 44.20 H new ATOM 0 HG21 VAL A 469 -4.730 -0.145 -5.651 1.00 63.53 H new ATOM 0 HG22 VAL A 469 -5.311 1.437 -5.079 1.00 63.53 H new ATOM 0 HG23 VAL A 469 -6.476 0.150 -5.471 1.00 63.53 H new ATOM 1226 N ASN A 470 -7.163 1.556 -9.645 1.00 44.12 N ATOM 1227 CA ASN A 470 -7.391 1.799 -11.060 1.00 43.04 C ATOM 1228 C ASN A 470 -8.297 3.020 -11.224 1.00 60.33 C ATOM 1229 O ASN A 470 -7.862 4.057 -11.722 1.00 44.33 O ATOM 1230 CB ASN A 470 -8.084 0.605 -11.717 1.00 10.15 C ATOM 1231 CG ASN A 470 -7.062 -0.348 -12.342 1.00 75.04 C ATOM 1232 OD1 ASN A 470 -6.979 -0.504 -13.550 1.00 73.24 O ATOM 1233 ND2 ASN A 470 -6.291 -0.971 -11.457 1.00 55.33 N ATOM 0 H ASN A 470 -7.218 0.577 -9.366 1.00 44.12 H new ATOM 0 HA ASN A 470 -6.424 1.962 -11.535 1.00 43.04 H new ATOM 0 HB2 ASN A 470 -8.678 0.071 -10.975 1.00 10.15 H new ATOM 0 HB3 ASN A 470 -8.774 0.957 -12.484 1.00 10.15 H new ATOM 0 HD21 ASN A 470 -5.577 -1.626 -11.775 1.00 55.33 H new ATOM 0 HD22 ASN A 470 -6.414 -0.794 -10.460 1.00 55.33 H new ATOM 1239 N GLN A 471 -9.541 2.857 -10.797 1.00 25.21 N ATOM 1240 CA GLN A 471 -10.512 3.933 -10.890 1.00 55.24 C ATOM 1241 C GLN A 471 -9.847 5.277 -10.585 1.00 61.34 C ATOM 1242 O GLN A 471 -10.254 6.311 -11.114 1.00 22.04 O ATOM 1243 CB GLN A 471 -11.698 3.685 -9.957 1.00 14.13 C ATOM 1244 CG GLN A 471 -11.291 3.864 -8.492 1.00 34.54 C ATOM 1245 CD GLN A 471 -12.015 5.056 -7.864 1.00 53.53 C ATOM 1246 OE1 GLN A 471 -12.422 5.032 -6.714 1.00 75.13 O ATOM 1247 NE2 GLN A 471 -12.151 6.097 -8.681 1.00 3.41 N ATOM 0 H GLN A 471 -9.898 1.995 -10.385 1.00 25.21 H new ATOM 0 HA GLN A 471 -10.895 3.962 -11.910 1.00 55.24 H new ATOM 0 HB2 GLN A 471 -12.507 4.374 -10.200 1.00 14.13 H new ATOM 0 HB3 GLN A 471 -12.082 2.676 -10.111 1.00 14.13 H new ATOM 0 HG2 GLN A 471 -11.523 2.957 -7.933 1.00 34.54 H new ATOM 0 HG3 GLN A 471 -10.213 4.012 -8.426 1.00 34.54 H new ATOM 0 HE21 GLN A 471 -11.786 6.050 -9.632 1.00 3.41 H new ATOM 0 HE22 GLN A 471 -12.620 6.943 -8.356 1.00 3.41 H new ATOM 1254 N ALA A 472 -8.833 5.219 -9.733 1.00 61.32 N ATOM 1255 CA ALA A 472 -8.107 6.419 -9.351 1.00 4.25 C ATOM 1256 C ALA A 472 -7.115 6.782 -10.455 1.00 35.52 C ATOM 1257 O ALA A 472 -7.110 7.911 -10.945 1.00 20.43 O ATOM 1258 CB ALA A 472 -7.422 6.193 -8.001 1.00 4.32 C ATOM 0 H ALA A 472 -8.497 4.360 -9.297 1.00 61.32 H new ATOM 0 HA ALA A 472 -8.790 7.260 -9.233 1.00 4.25 H new ATOM 0 HB1 ALA A 472 -6.877 7.093 -7.714 1.00 4.32 H new ATOM 0 HB2 ALA A 472 -8.174 5.967 -7.245 1.00 4.32 H new ATOM 0 HB3 ALA A 472 -6.726 5.358 -8.081 1.00 4.32 H new ATOM 1264 N MET A 473 -6.296 5.804 -10.817 1.00 54.42 N ATOM 1265 CA MET A 473 -5.301 6.007 -11.856 1.00 62.30 C ATOM 1266 C MET A 473 -5.918 6.678 -13.084 1.00 3.12 C ATOM 1267 O MET A 473 -5.488 7.757 -13.488 1.00 74.00 O ATOM 1268 CB MET A 473 -4.700 4.658 -12.258 1.00 54.41 C ATOM 1269 CG MET A 473 -3.584 4.246 -11.295 1.00 10.12 C ATOM 1270 SD MET A 473 -3.537 2.469 -11.142 1.00 32.20 S ATOM 1271 CE MET A 473 -2.198 2.293 -9.975 1.00 15.10 C ATOM 0 H MET A 473 -6.302 4.869 -10.409 1.00 54.42 H new ATOM 0 HA MET A 473 -4.521 6.660 -11.463 1.00 62.30 H new ATOM 0 HB2 MET A 473 -5.479 3.896 -12.264 1.00 54.41 H new ATOM 0 HB3 MET A 473 -4.306 4.719 -13.272 1.00 54.41 H new ATOM 0 HG2 MET A 473 -2.624 4.614 -11.658 1.00 10.12 H new ATOM 0 HG3 MET A 473 -3.750 4.699 -10.318 1.00 10.12 H new ATOM 0 HE1 MET A 473 -1.684 1.348 -10.151 1.00 15.10 H new ATOM 0 HE2 MET A 473 -1.496 3.117 -10.100 1.00 15.10 H new ATOM 0 HE3 MET A 473 -2.596 2.306 -8.960 1.00 15.10 H new ATOM 1279 N MET A 474 -6.916 6.011 -13.643 1.00 12.10 N ATOM 1280 CA MET A 474 -7.598 6.529 -14.818 1.00 2.12 C ATOM 1281 C MET A 474 -8.197 7.910 -14.540 1.00 11.12 C ATOM 1282 O MET A 474 -8.562 8.629 -15.467 1.00 74.23 O ATOM 1283 CB MET A 474 -8.711 5.564 -15.231 1.00 23.50 C ATOM 1284 CG MET A 474 -9.508 5.092 -14.012 1.00 32.33 C ATOM 1285 SD MET A 474 -11.244 5.002 -14.415 1.00 74.14 S ATOM 1286 CE MET A 474 -11.899 6.157 -13.223 1.00 54.44 C ATOM 0 H MET A 474 -7.270 5.116 -13.305 1.00 12.10 H new ATOM 0 HA MET A 474 -6.870 6.624 -15.624 1.00 2.12 H new ATOM 0 HB2 MET A 474 -9.379 6.055 -15.939 1.00 23.50 H new ATOM 0 HB3 MET A 474 -8.280 4.704 -15.743 1.00 23.50 H new ATOM 0 HG2 MET A 474 -9.150 4.114 -13.690 1.00 32.33 H new ATOM 0 HG3 MET A 474 -9.355 5.778 -13.179 1.00 32.33 H new ATOM 0 HE1 MET A 474 -12.795 6.628 -13.627 1.00 54.44 H new ATOM 0 HE2 MET A 474 -12.150 5.628 -12.304 1.00 54.44 H new ATOM 0 HE3 MET A 474 -11.152 6.922 -13.009 1.00 54.44 H new ATOM 1294 N SER A 475 -8.278 8.237 -13.259 1.00 20.51 N ATOM 1295 CA SER A 475 -8.826 9.518 -12.847 1.00 71.04 C ATOM 1296 C SER A 475 -7.707 10.556 -12.743 1.00 63.05 C ATOM 1297 O SER A 475 -7.964 11.759 -12.790 1.00 31.15 O ATOM 1298 CB SER A 475 -9.564 9.398 -11.513 1.00 42.30 C ATOM 1299 OG SER A 475 -10.438 10.499 -11.285 1.00 70.15 O ATOM 0 H SER A 475 -7.973 7.637 -12.492 1.00 20.51 H new ATOM 0 HA SER A 475 -9.544 9.841 -13.601 1.00 71.04 H new ATOM 0 HB2 SER A 475 -10.137 8.471 -11.498 1.00 42.30 H new ATOM 0 HB3 SER A 475 -8.839 9.337 -10.702 1.00 42.30 H new ATOM 0 HG SER A 475 -10.891 10.384 -10.424 1.00 70.15 H new ATOM 1304 N ASN A 476 -6.489 10.054 -12.602 1.00 21.20 N ATOM 1305 CA ASN A 476 -5.330 10.924 -12.491 1.00 24.34 C ATOM 1306 C ASN A 476 -4.158 10.303 -13.253 1.00 63.22 C ATOM 1307 O ASN A 476 -3.345 9.584 -12.672 1.00 14.20 O ATOM 1308 CB ASN A 476 -4.907 11.093 -11.030 1.00 22.20 C ATOM 1309 CG ASN A 476 -3.710 12.040 -10.911 1.00 0.41 C ATOM 1310 OD1 ASN A 476 -3.514 12.937 -11.716 1.00 43.03 O ATOM 1311 ND2 ASN A 476 -2.925 11.791 -9.868 1.00 3.01 N ATOM 0 H ASN A 476 -6.279 9.057 -12.562 1.00 21.20 H new ATOM 0 HA ASN A 476 -5.597 11.897 -12.905 1.00 24.34 H new ATOM 0 HB2 ASN A 476 -5.743 11.483 -10.449 1.00 22.20 H new ATOM 0 HB3 ASN A 476 -4.650 10.122 -10.607 1.00 22.20 H new ATOM 0 HD21 ASN A 476 -2.100 12.367 -9.702 1.00 3.01 H new ATOM 0 HD22 ASN A 476 -3.148 11.024 -9.234 1.00 3.01 H new ATOM 1317 N LEU A 477 -4.106 10.605 -14.543 1.00 63.14 N ATOM 1318 CA LEU A 477 -3.046 10.087 -15.391 1.00 24.23 C ATOM 1319 C LEU A 477 -2.118 11.232 -15.797 1.00 30.53 C ATOM 1320 O LEU A 477 -0.971 11.002 -16.180 1.00 21.43 O ATOM 1321 CB LEU A 477 -3.636 9.322 -16.577 1.00 33.23 C ATOM 1322 CG LEU A 477 -4.723 8.298 -16.242 1.00 74.31 C ATOM 1323 CD1 LEU A 477 -5.617 8.031 -17.455 1.00 62.34 C ATOM 1324 CD2 LEU A 477 -4.111 7.010 -15.686 1.00 74.13 C ATOM 0 H LEU A 477 -4.781 11.202 -15.021 1.00 63.14 H new ATOM 0 HA LEU A 477 -2.439 9.364 -14.845 1.00 24.23 H new ATOM 0 HB2 LEU A 477 -4.050 10.045 -17.280 1.00 33.23 H new ATOM 0 HB3 LEU A 477 -2.825 8.806 -17.091 1.00 33.23 H new ATOM 0 HG LEU A 477 -5.357 8.716 -15.460 1.00 74.31 H new ATOM 0 HD11 LEU A 477 -6.381 7.300 -17.190 1.00 62.34 H new ATOM 0 HD12 LEU A 477 -6.096 8.960 -17.766 1.00 62.34 H new ATOM 0 HD13 LEU A 477 -5.012 7.643 -18.274 1.00 62.34 H new ATOM 0 HD21 LEU A 477 -4.905 6.300 -15.456 1.00 74.13 H new ATOM 0 HD22 LEU A 477 -3.440 6.577 -16.427 1.00 74.13 H new ATOM 0 HD23 LEU A 477 -3.552 7.235 -14.778 1.00 74.13 H new ATOM 1335 N THR A 478 -2.647 12.443 -15.702 1.00 70.33 N ATOM 1336 CA THR A 478 -1.880 13.625 -16.055 1.00 60.05 C ATOM 1337 C THR A 478 -0.874 13.958 -14.951 1.00 31.25 C ATOM 1338 O THR A 478 -0.127 14.929 -15.059 1.00 31.44 O ATOM 1339 CB THR A 478 -2.864 14.759 -16.341 1.00 53.24 C ATOM 1340 OG1 THR A 478 -2.031 15.873 -16.649 1.00 62.34 O ATOM 1341 CG2 THR A 478 -3.629 15.201 -15.092 1.00 4.33 C ATOM 0 H THR A 478 -3.598 12.631 -15.385 1.00 70.33 H new ATOM 0 HA THR A 478 -1.286 13.457 -16.953 1.00 60.05 H new ATOM 0 HB THR A 478 -3.572 14.439 -17.106 1.00 53.24 H new ATOM 0 HG1 THR A 478 -1.150 15.745 -16.240 1.00 62.34 H new ATOM 0 HG21 THR A 478 -4.314 16.008 -15.351 1.00 4.33 H new ATOM 0 HG22 THR A 478 -4.195 14.358 -14.695 1.00 4.33 H new ATOM 0 HG23 THR A 478 -2.924 15.552 -14.338 1.00 4.33 H new ATOM 1349 N ARG A 479 -0.886 13.132 -13.915 1.00 33.20 N ATOM 1350 CA ARG A 479 0.016 13.326 -12.793 1.00 30.40 C ATOM 1351 C ARG A 479 1.172 12.326 -12.861 1.00 31.12 C ATOM 1352 O ARG A 479 2.298 12.694 -13.193 1.00 50.55 O ATOM 1353 CB ARG A 479 -0.718 13.157 -11.462 1.00 63.32 C ATOM 1354 CG ARG A 479 -1.481 14.429 -11.090 1.00 52.35 C ATOM 1355 CD ARG A 479 -0.520 15.594 -10.845 1.00 70.22 C ATOM 1356 NE ARG A 479 -1.183 16.635 -10.030 1.00 32.00 N ATOM 1357 CZ ARG A 479 -1.459 16.505 -8.714 1.00 13.21 C ATOM 1358 NH1 ARG A 479 -1.130 15.374 -8.054 1.00 2.23 N ATOM 1359 NH2 ARG A 479 -2.055 17.499 -8.083 1.00 13.00 N ATOM 0 H ARG A 479 -1.506 12.327 -13.829 1.00 33.20 H new ATOM 0 HA ARG A 479 0.407 14.342 -12.854 1.00 30.40 H new ATOM 0 HB2 ARG A 479 -1.412 12.319 -11.529 1.00 63.32 H new ATOM 0 HB3 ARG A 479 -0.002 12.915 -10.676 1.00 63.32 H new ATOM 0 HG2 ARG A 479 -2.175 14.688 -11.890 1.00 52.35 H new ATOM 0 HG3 ARG A 479 -2.077 14.251 -10.195 1.00 52.35 H new ATOM 0 HD2 ARG A 479 0.375 15.237 -10.335 1.00 70.22 H new ATOM 0 HD3 ARG A 479 -0.198 16.016 -11.797 1.00 70.22 H new ATOM 0 HE ARG A 479 -1.448 17.506 -10.490 1.00 32.00 H new ATOM 0 HH11 ARG A 479 -0.670 14.610 -8.549 1.00 2.23 H new ATOM 0 HH12 ARG A 479 -1.342 15.283 -7.060 1.00 2.23 H new ATOM 0 HH21 ARG A 479 -2.301 18.350 -8.589 1.00 13.00 H new ATOM 0 HH22 ARG A 479 -2.270 17.416 -7.089 1.00 13.00 H new ATOM 1369 N GLN A 480 0.854 11.080 -12.543 1.00 31.14 N ATOM 1370 CA GLN A 480 1.851 10.024 -12.565 1.00 61.02 C ATOM 1371 C GLN A 480 1.480 8.963 -13.603 1.00 61.31 C ATOM 1372 O GLN A 480 2.353 8.405 -14.264 1.00 73.41 O ATOM 1373 CB GLN A 480 2.018 9.398 -11.178 1.00 75.10 C ATOM 1374 CG GLN A 480 0.670 9.279 -10.465 1.00 10.22 C ATOM 1375 CD GLN A 480 0.376 10.530 -9.635 1.00 61.31 C ATOM 1376 OE1 GLN A 480 1.178 11.443 -9.537 1.00 70.22 O ATOM 1377 NE2 GLN A 480 -0.815 10.519 -9.043 1.00 31.42 N ATOM 0 H GLN A 480 -0.081 10.778 -12.269 1.00 31.14 H new ATOM 0 HA GLN A 480 2.808 10.462 -12.848 1.00 61.02 H new ATOM 0 HB2 GLN A 480 2.472 8.412 -11.272 1.00 75.10 H new ATOM 0 HB3 GLN A 480 2.697 10.006 -10.580 1.00 75.10 H new ATOM 0 HG2 GLN A 480 -0.122 9.131 -11.199 1.00 10.22 H new ATOM 0 HG3 GLN A 480 0.673 8.402 -9.818 1.00 10.22 H new ATOM 0 HE21 GLN A 480 -1.439 9.722 -9.167 1.00 31.42 H new ATOM 0 HE22 GLN A 480 -1.105 11.308 -8.465 1.00 31.42 H new ATOM 1384 N GLY A 481 0.183 8.718 -13.714 1.00 42.11 N ATOM 1385 CA GLY A 481 -0.315 7.735 -14.661 1.00 3.43 C ATOM 1386 C GLY A 481 0.519 6.453 -14.609 1.00 4.31 C ATOM 1387 O GLY A 481 0.824 5.863 -15.645 1.00 51.23 O ATOM 0 H GLY A 481 -0.539 9.183 -13.164 1.00 42.11 H new ATOM 0 HA2 GLY A 481 -1.357 7.505 -14.438 1.00 3.43 H new ATOM 0 HA3 GLY A 481 -0.289 8.150 -15.669 1.00 3.43 H new ATOM 1391 N SER A 482 0.865 6.059 -13.392 1.00 1.33 N ATOM 1392 CA SER A 482 1.657 4.857 -13.193 1.00 42.45 C ATOM 1393 C SER A 482 0.808 3.777 -12.520 1.00 33.12 C ATOM 1394 O SER A 482 0.642 3.780 -11.302 1.00 22.23 O ATOM 1395 CB SER A 482 2.901 5.153 -12.352 1.00 33.53 C ATOM 1396 OG SER A 482 3.508 6.390 -12.713 1.00 42.12 O ATOM 0 H SER A 482 0.612 6.550 -12.535 1.00 1.33 H new ATOM 0 HA SER A 482 1.986 4.497 -14.168 1.00 42.45 H new ATOM 0 HB2 SER A 482 2.628 5.178 -11.297 1.00 33.53 H new ATOM 0 HB3 SER A 482 3.623 4.345 -12.476 1.00 33.53 H new ATOM 0 HG SER A 482 2.949 6.848 -13.375 1.00 42.12 H new ATOM 1401 N PRO A 483 0.279 2.853 -13.367 1.00 13.21 N ATOM 1402 CA PRO A 483 -0.549 1.768 -12.869 1.00 15.30 C ATOM 1403 C PRO A 483 0.303 0.699 -12.182 1.00 3.42 C ATOM 1404 O PRO A 483 -0.223 -0.305 -11.702 1.00 24.42 O ATOM 1405 CB PRO A 483 -1.288 1.245 -14.090 1.00 1.14 C ATOM 1406 CG PRO A 483 -0.507 1.740 -15.295 1.00 41.25 C ATOM 1407 CD PRO A 483 0.453 2.817 -14.816 1.00 72.45 C ATOM 0 HA PRO A 483 -1.253 2.093 -12.103 1.00 15.30 H new ATOM 0 HB2 PRO A 483 -1.339 0.156 -14.079 1.00 1.14 H new ATOM 0 HB3 PRO A 483 -2.314 1.612 -14.112 1.00 1.14 H new ATOM 0 HG2 PRO A 483 0.040 0.919 -15.759 1.00 41.25 H new ATOM 0 HG3 PRO A 483 -1.183 2.140 -16.051 1.00 41.25 H new ATOM 0 HD2 PRO A 483 1.482 2.578 -15.085 1.00 72.45 H new ATOM 0 HD3 PRO A 483 0.222 3.782 -15.266 1.00 72.45 H new ATOM 1412 N ASP A 484 1.603 0.952 -12.154 1.00 13.30 N ATOM 1413 CA ASP A 484 2.533 0.024 -11.532 1.00 50.10 C ATOM 1414 C ASP A 484 2.779 0.449 -10.084 1.00 21.21 C ATOM 1415 O ASP A 484 3.744 0.010 -9.460 1.00 1.21 O ATOM 1416 CB ASP A 484 3.879 0.024 -12.260 1.00 50.32 C ATOM 1417 CG ASP A 484 4.572 1.385 -12.337 1.00 23.53 C ATOM 1418 OD1 ASP A 484 4.148 2.356 -11.694 1.00 1.53 O ATOM 1419 OD2 ASP A 484 5.607 1.426 -13.108 1.00 40.04 O ATOM 0 H ASP A 484 2.035 1.786 -12.552 1.00 13.30 H new ATOM 0 HA ASP A 484 2.097 -0.974 -11.579 1.00 50.10 H new ATOM 0 HB2 ASP A 484 4.546 -0.679 -11.760 1.00 50.32 H new ATOM 0 HB3 ASP A 484 3.727 -0.347 -13.273 1.00 50.32 H new ATOM 1424 N CYS A 485 1.888 1.298 -9.590 1.00 32.42 N ATOM 1425 CA CYS A 485 1.997 1.787 -8.226 1.00 21.14 C ATOM 1426 C CYS A 485 1.176 0.868 -7.320 1.00 73.44 C ATOM 1427 O CYS A 485 0.840 1.238 -6.196 1.00 74.12 O ATOM 1428 CB CYS A 485 1.554 3.248 -8.112 1.00 23.13 C ATOM 1429 SG CYS A 485 2.975 4.359 -8.417 1.00 62.22 S ATOM 0 H CYS A 485 1.088 1.659 -10.110 1.00 32.42 H new ATOM 0 HA CYS A 485 3.040 1.767 -7.911 1.00 21.14 H new ATOM 0 HB2 CYS A 485 0.761 3.453 -8.831 1.00 23.13 H new ATOM 0 HB3 CYS A 485 1.142 3.435 -7.120 1.00 23.13 H new ATOM 0 HG CYS A 485 3.358 4.892 -7.295 1.00 62.22 H new ATOM 1434 N VAL A 486 0.877 -0.312 -7.843 1.00 20.24 N ATOM 1435 CA VAL A 486 0.102 -1.287 -7.095 1.00 51.42 C ATOM 1436 C VAL A 486 1.032 -2.392 -6.587 1.00 1.32 C ATOM 1437 O VAL A 486 1.815 -2.948 -7.355 1.00 21.32 O ATOM 1438 CB VAL A 486 -1.043 -1.820 -7.958 1.00 73.12 C ATOM 1439 CG1 VAL A 486 -1.836 -2.897 -7.214 1.00 74.42 C ATOM 1440 CG2 VAL A 486 -1.960 -0.681 -8.415 1.00 25.55 C ATOM 0 H VAL A 486 1.157 -0.615 -8.776 1.00 20.24 H new ATOM 0 HA VAL A 486 -0.356 -0.821 -6.223 1.00 51.42 H new ATOM 0 HB VAL A 486 -0.608 -2.278 -8.846 1.00 73.12 H new ATOM 0 HG11 VAL A 486 -2.644 -3.259 -7.850 1.00 74.42 H new ATOM 0 HG12 VAL A 486 -1.175 -3.726 -6.961 1.00 74.42 H new ATOM 0 HG13 VAL A 486 -2.255 -2.475 -6.301 1.00 74.42 H new ATOM 0 HG21 VAL A 486 -2.766 -1.086 -9.027 1.00 25.55 H new ATOM 0 HG22 VAL A 486 -2.382 -0.182 -7.543 1.00 25.55 H new ATOM 0 HG23 VAL A 486 -1.385 0.036 -9.001 1.00 25.55 H new ATOM 1450 N ILE A 487 0.914 -2.676 -5.298 1.00 55.44 N ATOM 1451 CA ILE A 487 1.733 -3.704 -4.681 1.00 41.13 C ATOM 1452 C ILE A 487 0.848 -4.606 -3.818 1.00 50.52 C ATOM 1453 O ILE A 487 0.628 -4.325 -2.642 1.00 64.32 O ATOM 1454 CB ILE A 487 2.897 -3.073 -3.915 1.00 60.35 C ATOM 1455 CG1 ILE A 487 3.359 -1.778 -4.590 1.00 2.14 C ATOM 1456 CG2 ILE A 487 4.045 -4.069 -3.742 1.00 31.01 C ATOM 1457 CD1 ILE A 487 3.865 -2.049 -6.007 1.00 25.41 C ATOM 0 H ILE A 487 0.263 -2.212 -4.664 1.00 55.44 H new ATOM 0 HA ILE A 487 2.187 -4.337 -5.443 1.00 41.13 H new ATOM 0 HB ILE A 487 2.546 -2.810 -2.917 1.00 60.35 H new ATOM 0 HG12 ILE A 487 2.533 -1.067 -4.625 1.00 2.14 H new ATOM 0 HG13 ILE A 487 4.151 -1.318 -3.999 1.00 2.14 H new ATOM 0 HG21 ILE A 487 4.859 -3.594 -3.194 1.00 31.01 H new ATOM 0 HG22 ILE A 487 3.692 -4.938 -3.187 1.00 31.01 H new ATOM 0 HG23 ILE A 487 4.403 -4.385 -4.722 1.00 31.01 H new ATOM 0 HD11 ILE A 487 4.187 -1.113 -6.464 1.00 25.41 H new ATOM 0 HD12 ILE A 487 4.706 -2.741 -5.967 1.00 25.41 H new ATOM 0 HD13 ILE A 487 3.063 -2.486 -6.602 1.00 25.41 H new ATOM 1468 N PRO A 488 0.350 -5.699 -4.454 1.00 22.14 N ATOM 1469 CA PRO A 488 -0.506 -6.645 -3.758 1.00 53.31 C ATOM 1470 C PRO A 488 0.307 -7.526 -2.808 1.00 62.35 C ATOM 1471 O PRO A 488 1.104 -8.350 -3.251 1.00 72.31 O ATOM 1472 CB PRO A 488 -1.196 -7.435 -4.858 1.00 21.35 C ATOM 1473 CG PRO A 488 -0.358 -7.226 -6.110 1.00 12.02 C ATOM 1474 CD PRO A 488 0.587 -6.065 -5.849 1.00 44.13 C ATOM 0 HA PRO A 488 -1.240 -6.155 -3.118 1.00 53.31 H new ATOM 0 HB2 PRO A 488 -1.256 -8.492 -4.600 1.00 21.35 H new ATOM 0 HB3 PRO A 488 -2.217 -7.085 -5.009 1.00 21.35 H new ATOM 0 HG2 PRO A 488 0.204 -8.129 -6.349 1.00 12.02 H new ATOM 0 HG3 PRO A 488 -0.998 -7.013 -6.966 1.00 12.02 H new ATOM 0 HD2 PRO A 488 1.625 -6.355 -6.011 1.00 44.13 H new ATOM 0 HD3 PRO A 488 0.382 -5.229 -6.518 1.00 44.13 H new ATOM 1479 N PHE A 489 0.077 -7.320 -1.519 1.00 71.01 N ATOM 1480 CA PHE A 489 0.779 -8.085 -0.503 1.00 64.24 C ATOM 1481 C PHE A 489 0.000 -9.349 -0.134 1.00 23.35 C ATOM 1482 O PHE A 489 -1.157 -9.503 -0.516 1.00 15.13 O ATOM 1483 CB PHE A 489 0.891 -7.189 0.733 1.00 33.34 C ATOM 1484 CG PHE A 489 2.112 -7.484 1.606 1.00 23.52 C ATOM 1485 CD1 PHE A 489 2.032 -8.412 2.598 1.00 32.34 C ATOM 1486 CD2 PHE A 489 3.279 -6.819 1.390 1.00 42.11 C ATOM 1487 CE1 PHE A 489 3.166 -8.686 3.408 1.00 13.02 C ATOM 1488 CE2 PHE A 489 4.413 -7.092 2.201 1.00 41.44 C ATOM 1489 CZ PHE A 489 4.331 -8.020 3.192 1.00 73.52 C ATOM 0 H PHE A 489 -0.585 -6.635 -1.156 1.00 71.01 H new ATOM 0 HA PHE A 489 1.757 -8.389 -0.875 1.00 64.24 H new ATOM 0 HB2 PHE A 489 0.929 -6.148 0.412 1.00 33.34 H new ATOM 0 HB3 PHE A 489 -0.010 -7.304 1.335 1.00 33.34 H new ATOM 0 HD1 PHE A 489 1.106 -8.940 2.769 1.00 32.34 H new ATOM 0 HD2 PHE A 489 3.343 -6.083 0.602 1.00 42.11 H new ATOM 0 HE1 PHE A 489 3.103 -9.423 4.195 1.00 13.02 H new ATOM 0 HE2 PHE A 489 5.339 -6.563 2.031 1.00 41.44 H new ATOM 0 HZ PHE A 489 5.193 -8.228 3.808 1.00 73.52 H new ATOM 1498 N LEU A 490 0.668 -10.221 0.609 1.00 34.53 N ATOM 1499 CA LEU A 490 0.054 -11.467 1.034 1.00 13.33 C ATOM 1500 C LEU A 490 0.701 -11.929 2.341 1.00 53.24 C ATOM 1501 O LEU A 490 1.775 -12.526 2.329 1.00 32.35 O ATOM 1502 CB LEU A 490 0.119 -12.507 -0.086 1.00 63.33 C ATOM 1503 CG LEU A 490 -0.733 -13.763 0.114 1.00 54.44 C ATOM 1504 CD1 LEU A 490 0.116 -14.925 0.630 1.00 2.24 C ATOM 1505 CD2 LEU A 490 -1.928 -13.475 1.026 1.00 62.32 C ATOM 0 H LEU A 490 1.628 -10.088 0.927 1.00 34.53 H new ATOM 0 HA LEU A 490 -1.007 -11.319 1.237 1.00 13.33 H new ATOM 0 HB2 LEU A 490 -0.187 -12.029 -1.017 1.00 63.33 H new ATOM 0 HB3 LEU A 490 1.158 -12.813 -0.211 1.00 63.33 H new ATOM 0 HG LEU A 490 -1.133 -14.063 -0.855 1.00 54.44 H new ATOM 0 HD11 LEU A 490 -0.514 -15.805 0.763 1.00 2.24 H new ATOM 0 HD12 LEU A 490 0.903 -15.148 -0.090 1.00 2.24 H new ATOM 0 HD13 LEU A 490 0.565 -14.652 1.585 1.00 2.24 H new ATOM 0 HD21 LEU A 490 -2.517 -14.384 1.152 1.00 62.32 H new ATOM 0 HD22 LEU A 490 -1.570 -13.137 1.999 1.00 62.32 H new ATOM 0 HD23 LEU A 490 -2.549 -12.699 0.578 1.00 62.32 H new ATOM 1516 N PRO A 491 -0.001 -11.626 3.467 1.00 21.44 N ATOM 1517 CA PRO A 491 0.495 -12.005 4.780 1.00 51.23 C ATOM 1518 C PRO A 491 0.309 -13.503 5.026 1.00 2.50 C ATOM 1519 O PRO A 491 -0.417 -14.172 4.290 1.00 42.02 O ATOM 1520 CB PRO A 491 -0.287 -11.141 5.758 1.00 20.42 C ATOM 1521 CG PRO A 491 -1.509 -10.652 4.998 1.00 44.20 C ATOM 1522 CD PRO A 491 -1.277 -10.919 3.520 1.00 21.31 C ATOM 0 HA PRO A 491 1.567 -11.839 4.889 1.00 51.23 H new ATOM 0 HB2 PRO A 491 -0.578 -11.714 6.639 1.00 20.42 H new ATOM 0 HB3 PRO A 491 0.316 -10.303 6.108 1.00 20.42 H new ATOM 0 HG2 PRO A 491 -2.405 -11.168 5.343 1.00 44.20 H new ATOM 0 HG3 PRO A 491 -1.667 -9.588 5.173 1.00 44.20 H new ATOM 0 HD2 PRO A 491 -2.081 -11.520 3.095 1.00 21.31 H new ATOM 0 HD3 PRO A 491 -1.239 -9.990 2.951 1.00 21.31 H new ATOM 1527 N LEU A 492 0.977 -13.988 6.063 1.00 35.30 N ATOM 1528 CA LEU A 492 0.895 -15.394 6.414 1.00 4.23 C ATOM 1529 C LEU A 492 -0.502 -15.699 6.956 1.00 12.15 C ATOM 1530 O LEU A 492 -1.036 -16.784 6.731 1.00 1.43 O ATOM 1531 CB LEU A 492 2.024 -15.774 7.375 1.00 51.14 C ATOM 1532 CG LEU A 492 3.443 -15.688 6.809 1.00 25.15 C ATOM 1533 CD1 LEU A 492 3.741 -14.283 6.286 1.00 21.32 C ATOM 1534 CD2 LEU A 492 4.475 -16.146 7.843 1.00 13.14 C ATOM 0 H LEU A 492 1.577 -13.431 6.671 1.00 35.30 H new ATOM 0 HA LEU A 492 1.038 -16.016 5.530 1.00 4.23 H new ATOM 0 HB2 LEU A 492 1.963 -15.127 8.250 1.00 51.14 H new ATOM 0 HB3 LEU A 492 1.853 -16.794 7.720 1.00 51.14 H new ATOM 0 HG LEU A 492 3.513 -16.368 5.960 1.00 25.15 H new ATOM 0 HD11 LEU A 492 4.756 -14.250 5.890 1.00 21.32 H new ATOM 0 HD12 LEU A 492 3.034 -14.032 5.495 1.00 21.32 H new ATOM 0 HD13 LEU A 492 3.646 -13.564 7.100 1.00 21.32 H new ATOM 0 HD21 LEU A 492 5.475 -16.075 7.415 1.00 13.14 H new ATOM 0 HD22 LEU A 492 4.412 -15.510 8.726 1.00 13.14 H new ATOM 0 HD23 LEU A 492 4.274 -17.179 8.125 1.00 13.14 H new ATOM 1545 N GLU A 493 -1.055 -14.724 7.661 1.00 50.23 N ATOM 1546 CA GLU A 493 -2.380 -14.874 8.238 1.00 64.44 C ATOM 1547 C GLU A 493 -3.389 -15.264 7.155 1.00 60.13 C ATOM 1548 O GLU A 493 -4.316 -16.028 7.413 1.00 21.55 O ATOM 1549 CB GLU A 493 -2.814 -13.595 8.958 1.00 12.22 C ATOM 1550 CG GLU A 493 -2.390 -13.622 10.427 1.00 62.34 C ATOM 1551 CD GLU A 493 -3.082 -14.762 11.177 1.00 0.43 C ATOM 1552 OE1 GLU A 493 -2.405 -15.607 11.782 1.00 32.11 O ATOM 1553 OE2 GLU A 493 -4.371 -14.750 11.117 1.00 70.33 O ATOM 0 H GLU A 493 -0.609 -13.826 7.846 1.00 50.23 H new ATOM 0 HA GLU A 493 -2.344 -15.673 8.979 1.00 64.44 H new ATOM 0 HB2 GLU A 493 -2.374 -12.728 8.465 1.00 12.22 H new ATOM 0 HB3 GLU A 493 -3.896 -13.485 8.890 1.00 12.22 H new ATOM 0 HG2 GLU A 493 -1.309 -13.741 10.495 1.00 62.34 H new ATOM 0 HG3 GLU A 493 -2.636 -12.670 10.898 1.00 62.34 H new ATOM 1559 N SER A 494 -3.173 -14.719 5.967 1.00 53.01 N ATOM 1560 CA SER A 494 -4.052 -14.999 4.845 1.00 14.22 C ATOM 1561 C SER A 494 -3.262 -15.664 3.716 1.00 21.54 C ATOM 1562 O SER A 494 -2.056 -15.875 3.837 1.00 50.00 O ATOM 1563 CB SER A 494 -4.725 -13.723 4.340 1.00 31.12 C ATOM 1564 OG SER A 494 -5.822 -13.335 5.164 1.00 22.41 O ATOM 0 H SER A 494 -2.402 -14.085 5.757 1.00 53.01 H new ATOM 0 HA SER A 494 -4.833 -15.679 5.184 1.00 14.22 H new ATOM 0 HB2 SER A 494 -3.993 -12.916 4.307 1.00 31.12 H new ATOM 0 HB3 SER A 494 -5.075 -13.877 3.319 1.00 31.12 H new ATOM 0 HG SER A 494 -6.420 -14.101 5.295 1.00 22.41 H new ATOM 1569 N SER A 495 -3.973 -15.978 2.643 1.00 15.43 N ATOM 1570 CA SER A 495 -3.354 -16.614 1.493 1.00 61.13 C ATOM 1571 C SER A 495 -4.041 -16.153 0.206 1.00 52.52 C ATOM 1572 O SER A 495 -5.124 -15.570 0.251 1.00 71.33 O ATOM 1573 CB SER A 495 -3.414 -18.138 1.609 1.00 20.04 C ATOM 1574 OG SER A 495 -2.168 -18.692 2.025 1.00 40.13 O ATOM 0 H SER A 495 -4.973 -15.803 2.546 1.00 15.43 H new ATOM 0 HA SER A 495 -2.305 -16.319 1.463 1.00 61.13 H new ATOM 0 HB2 SER A 495 -4.190 -18.417 2.321 1.00 20.04 H new ATOM 0 HB3 SER A 495 -3.697 -18.564 0.646 1.00 20.04 H new ATOM 0 HG SER A 495 -2.248 -19.667 2.089 1.00 40.13 H new ATOM 1579 N PRO A 496 -3.367 -16.439 -0.940 1.00 53.01 N ATOM 1580 CA PRO A 496 -3.900 -16.060 -2.237 1.00 50.10 C ATOM 1581 C PRO A 496 -5.054 -16.978 -2.645 1.00 35.42 C ATOM 1582 O PRO A 496 -6.011 -16.535 -3.278 1.00 13.13 O ATOM 1583 CB PRO A 496 -2.717 -16.134 -3.186 1.00 23.43 C ATOM 1584 CG PRO A 496 -1.676 -16.997 -2.489 1.00 4.31 C ATOM 1585 CD PRO A 496 -2.083 -17.129 -1.030 1.00 61.21 C ATOM 0 HA PRO A 496 -4.331 -15.059 -2.238 1.00 50.10 H new ATOM 0 HB2 PRO A 496 -3.009 -16.570 -4.141 1.00 23.43 H new ATOM 0 HB3 PRO A 496 -2.323 -15.140 -3.397 1.00 23.43 H new ATOM 0 HG2 PRO A 496 -1.617 -17.979 -2.959 1.00 4.31 H new ATOM 0 HG3 PRO A 496 -0.688 -16.544 -2.570 1.00 4.31 H new ATOM 0 HD2 PRO A 496 -2.174 -18.175 -0.737 1.00 61.21 H new ATOM 0 HD3 PRO A 496 -1.343 -16.677 -0.370 1.00 61.21 H new ATOM 1590 N ALA A 497 -4.924 -18.241 -2.266 1.00 55.40 N ATOM 1591 CA ALA A 497 -5.945 -19.226 -2.585 1.00 31.20 C ATOM 1592 C ALA A 497 -7.280 -18.785 -1.983 1.00 51.24 C ATOM 1593 O ALA A 497 -8.336 -19.018 -2.568 1.00 24.12 O ATOM 1594 CB ALA A 497 -5.503 -20.601 -2.079 1.00 42.31 C ATOM 0 H ALA A 497 -4.128 -18.605 -1.742 1.00 55.40 H new ATOM 0 HA ALA A 497 -6.080 -19.303 -3.664 1.00 31.20 H new ATOM 0 HB1 ALA A 497 -6.268 -21.340 -2.318 1.00 42.31 H new ATOM 0 HB2 ALA A 497 -4.565 -20.881 -2.559 1.00 42.31 H new ATOM 0 HB3 ALA A 497 -5.360 -20.563 -0.999 1.00 42.31 H new ATOM 1600 N GLN A 498 -7.189 -18.154 -0.822 1.00 41.22 N ATOM 1601 CA GLN A 498 -8.376 -17.677 -0.134 1.00 50.50 C ATOM 1602 C GLN A 498 -9.126 -16.667 -1.006 1.00 43.12 C ATOM 1603 O GLN A 498 -10.282 -16.346 -0.737 1.00 41.30 O ATOM 1604 CB GLN A 498 -8.018 -17.069 1.223 1.00 4.51 C ATOM 1605 CG GLN A 498 -6.927 -17.886 1.919 1.00 2.21 C ATOM 1606 CD GLN A 498 -7.077 -17.817 3.440 1.00 24.42 C ATOM 1607 OE1 GLN A 498 -6.940 -16.774 4.057 1.00 70.14 O ATOM 1608 NE2 GLN A 498 -7.364 -18.985 4.009 1.00 0.23 N ATOM 0 H GLN A 498 -6.311 -17.962 -0.340 1.00 41.22 H new ATOM 0 HA GLN A 498 -9.032 -18.528 0.048 1.00 50.50 H new ATOM 0 HB2 GLN A 498 -7.678 -16.042 1.087 1.00 4.51 H new ATOM 0 HB3 GLN A 498 -8.906 -17.030 1.854 1.00 4.51 H new ATOM 0 HG2 GLN A 498 -6.980 -18.924 1.591 1.00 2.21 H new ATOM 0 HG3 GLN A 498 -5.946 -17.510 1.629 1.00 2.21 H new ATOM 0 HE21 GLN A 498 -7.465 -19.821 3.434 1.00 0.23 H new ATOM 0 HE22 GLN A 498 -7.483 -19.044 5.020 1.00 0.23 H new ATOM 1615 N LEU A 499 -8.436 -16.194 -2.033 1.00 71.13 N ATOM 1616 CA LEU A 499 -9.021 -15.228 -2.948 1.00 44.43 C ATOM 1617 C LEU A 499 -9.462 -15.942 -4.225 1.00 1.33 C ATOM 1618 O LEU A 499 -9.149 -17.115 -4.426 1.00 41.35 O ATOM 1619 CB LEU A 499 -8.053 -14.069 -3.192 1.00 33.43 C ATOM 1620 CG LEU A 499 -7.085 -13.750 -2.052 1.00 51.54 C ATOM 1621 CD1 LEU A 499 -5.938 -12.860 -2.538 1.00 22.35 C ATOM 1622 CD2 LEU A 499 -7.824 -13.131 -0.864 1.00 60.14 C ATOM 0 H LEU A 499 -7.476 -16.462 -2.252 1.00 71.13 H new ATOM 0 HA LEU A 499 -9.914 -14.781 -2.511 1.00 44.43 H new ATOM 0 HB2 LEU A 499 -7.470 -14.292 -4.085 1.00 33.43 H new ATOM 0 HB3 LEU A 499 -8.637 -13.174 -3.407 1.00 33.43 H new ATOM 0 HG LEU A 499 -6.644 -14.685 -1.707 1.00 51.54 H new ATOM 0 HD11 LEU A 499 -5.265 -12.648 -1.707 1.00 22.35 H new ATOM 0 HD12 LEU A 499 -5.390 -13.372 -3.328 1.00 22.35 H new ATOM 0 HD13 LEU A 499 -6.342 -11.924 -2.925 1.00 22.35 H new ATOM 0 HD21 LEU A 499 -7.113 -12.913 -0.067 1.00 60.14 H new ATOM 0 HD22 LEU A 499 -8.310 -12.208 -1.179 1.00 60.14 H new ATOM 0 HD23 LEU A 499 -8.576 -13.830 -0.499 1.00 60.14 H new ATOM 1633 N SER A 500 -10.186 -15.206 -5.058 1.00 64.13 N ATOM 1634 CA SER A 500 -10.674 -15.755 -6.310 1.00 32.33 C ATOM 1635 C SER A 500 -9.495 -16.104 -7.223 1.00 44.21 C ATOM 1636 O SER A 500 -8.420 -15.520 -7.106 1.00 43.05 O ATOM 1637 CB SER A 500 -11.616 -14.774 -7.011 1.00 32.13 C ATOM 1638 OG SER A 500 -12.607 -14.262 -6.126 1.00 13.05 O ATOM 0 H SER A 500 -10.445 -14.234 -4.889 1.00 64.13 H new ATOM 0 HA SER A 500 -11.236 -16.663 -6.090 1.00 32.33 H new ATOM 0 HB2 SER A 500 -11.037 -13.948 -7.424 1.00 32.13 H new ATOM 0 HB3 SER A 500 -12.102 -15.274 -7.849 1.00 32.13 H new ATOM 0 HG SER A 500 -13.187 -13.638 -6.610 1.00 13.05 H new ATOM 1643 N SER A 501 -9.740 -17.055 -8.112 1.00 34.13 N ATOM 1644 CA SER A 501 -8.713 -17.489 -9.045 1.00 10.20 C ATOM 1645 C SER A 501 -8.399 -16.367 -10.037 1.00 31.24 C ATOM 1646 O SER A 501 -7.442 -16.462 -10.804 1.00 74.03 O ATOM 1647 CB SER A 501 -9.145 -18.753 -9.791 1.00 75.32 C ATOM 1648 OG SER A 501 -9.038 -19.916 -8.976 1.00 3.01 O ATOM 0 H SER A 501 -10.634 -17.537 -8.206 1.00 34.13 H new ATOM 0 HA SER A 501 -7.813 -17.725 -8.477 1.00 10.20 H new ATOM 0 HB2 SER A 501 -10.175 -18.640 -10.129 1.00 75.32 H new ATOM 0 HB3 SER A 501 -8.529 -18.877 -10.682 1.00 75.32 H new ATOM 0 HG SER A 501 -9.324 -20.701 -9.487 1.00 3.01 H new ATOM 1653 N ASP A 502 -9.223 -15.331 -9.989 1.00 41.21 N ATOM 1654 CA ASP A 502 -9.045 -14.192 -10.874 1.00 5.53 C ATOM 1655 C ASP A 502 -7.971 -13.268 -10.299 1.00 13.24 C ATOM 1656 O ASP A 502 -7.203 -12.662 -11.046 1.00 63.41 O ATOM 1657 CB ASP A 502 -10.341 -13.389 -11.004 1.00 73.54 C ATOM 1658 CG ASP A 502 -11.508 -14.143 -11.645 1.00 72.32 C ATOM 1659 OD1 ASP A 502 -11.617 -15.372 -11.524 1.00 30.30 O ATOM 1660 OD2 ASP A 502 -12.339 -13.406 -12.300 1.00 71.13 O ATOM 0 H ASP A 502 -10.016 -15.256 -9.351 1.00 41.21 H new ATOM 0 HA ASP A 502 -8.754 -14.568 -11.855 1.00 5.53 H new ATOM 0 HB2 ASP A 502 -10.645 -13.055 -10.012 1.00 73.54 H new ATOM 0 HB3 ASP A 502 -10.139 -12.494 -11.593 1.00 73.54 H new ATOM 1665 N THR A 503 -7.952 -13.186 -8.977 1.00 44.51 N ATOM 1666 CA THR A 503 -6.984 -12.345 -8.293 1.00 42.30 C ATOM 1667 C THR A 503 -5.600 -12.498 -8.929 1.00 40.31 C ATOM 1668 O THR A 503 -4.950 -11.505 -9.253 1.00 21.34 O ATOM 1669 CB THR A 503 -7.012 -12.704 -6.806 1.00 4.24 C ATOM 1670 OG1 THR A 503 -8.391 -12.621 -6.455 1.00 71.25 O ATOM 1671 CG2 THR A 503 -6.340 -11.643 -5.933 1.00 11.45 C ATOM 0 H THR A 503 -8.591 -13.688 -8.361 1.00 44.51 H new ATOM 0 HA THR A 503 -7.238 -11.290 -8.392 1.00 42.30 H new ATOM 0 HB THR A 503 -6.516 -13.663 -6.655 1.00 4.24 H new ATOM 0 HG1 THR A 503 -8.778 -13.521 -6.433 1.00 71.25 H new ATOM 0 HG21 THR A 503 -6.388 -11.948 -4.888 1.00 11.45 H new ATOM 0 HG22 THR A 503 -5.297 -11.533 -6.231 1.00 11.45 H new ATOM 0 HG23 THR A 503 -6.855 -10.690 -6.057 1.00 11.45 H new ATOM 1679 N ALA A 504 -5.193 -13.749 -9.089 1.00 21.31 N ATOM 1680 CA ALA A 504 -3.899 -14.044 -9.679 1.00 32.33 C ATOM 1681 C ALA A 504 -3.760 -13.282 -10.999 1.00 54.42 C ATOM 1682 O ALA A 504 -2.681 -12.789 -11.326 1.00 45.32 O ATOM 1683 CB ALA A 504 -3.754 -15.556 -9.862 1.00 43.02 C ATOM 0 H ALA A 504 -5.737 -14.569 -8.820 1.00 21.31 H new ATOM 0 HA ALA A 504 -3.094 -13.716 -9.022 1.00 32.33 H new ATOM 0 HB1 ALA A 504 -2.783 -15.777 -10.305 1.00 43.02 H new ATOM 0 HB2 ALA A 504 -3.832 -16.049 -8.893 1.00 43.02 H new ATOM 0 HB3 ALA A 504 -4.544 -15.920 -10.519 1.00 43.02 H new ATOM 1689 N SER A 505 -4.868 -13.208 -11.722 1.00 74.32 N ATOM 1690 CA SER A 505 -4.883 -12.514 -12.999 1.00 75.25 C ATOM 1691 C SER A 505 -5.036 -11.008 -12.774 1.00 53.31 C ATOM 1692 O SER A 505 -4.652 -10.207 -13.625 1.00 64.41 O ATOM 1693 CB SER A 505 -6.007 -13.034 -13.895 1.00 11.45 C ATOM 1694 OG SER A 505 -5.723 -12.839 -15.278 1.00 64.41 O ATOM 0 H SER A 505 -5.761 -13.617 -11.448 1.00 74.32 H new ATOM 0 HA SER A 505 -3.936 -12.705 -13.504 1.00 75.25 H new ATOM 0 HB2 SER A 505 -6.161 -14.096 -13.703 1.00 11.45 H new ATOM 0 HB3 SER A 505 -6.937 -12.526 -13.641 1.00 11.45 H new ATOM 0 HG SER A 505 -6.465 -13.186 -15.816 1.00 64.41 H new ATOM 1699 N LEU A 506 -5.600 -10.668 -11.624 1.00 11.20 N ATOM 1700 CA LEU A 506 -5.810 -9.273 -11.276 1.00 31.33 C ATOM 1701 C LEU A 506 -4.455 -8.598 -11.057 1.00 74.13 C ATOM 1702 O LEU A 506 -4.259 -7.449 -11.452 1.00 52.40 O ATOM 1703 CB LEU A 506 -6.757 -9.156 -10.080 1.00 72.24 C ATOM 1704 CG LEU A 506 -8.177 -9.684 -10.294 1.00 24.31 C ATOM 1705 CD1 LEU A 506 -8.959 -9.701 -8.979 1.00 71.43 C ATOM 1706 CD2 LEU A 506 -8.901 -8.889 -11.381 1.00 31.13 C ATOM 0 H LEU A 506 -5.918 -11.335 -10.921 1.00 11.20 H new ATOM 0 HA LEU A 506 -6.301 -8.745 -12.094 1.00 31.33 H new ATOM 0 HB2 LEU A 506 -6.315 -9.690 -9.239 1.00 72.24 H new ATOM 0 HB3 LEU A 506 -6.820 -8.106 -9.794 1.00 72.24 H new ATOM 0 HG LEU A 506 -8.109 -10.715 -10.642 1.00 24.31 H new ATOM 0 HD11 LEU A 506 -9.965 -10.080 -9.159 1.00 71.43 H new ATOM 0 HD12 LEU A 506 -8.451 -10.346 -8.262 1.00 71.43 H new ATOM 0 HD13 LEU A 506 -9.019 -8.689 -8.578 1.00 71.43 H new ATOM 0 HD21 LEU A 506 -9.908 -9.286 -11.512 1.00 31.13 H new ATOM 0 HD22 LEU A 506 -8.959 -7.841 -11.087 1.00 31.13 H new ATOM 0 HD23 LEU A 506 -8.353 -8.973 -12.319 1.00 31.13 H new ATOM 1717 N LEU A 507 -3.555 -9.339 -10.429 1.00 43.24 N ATOM 1718 CA LEU A 507 -2.224 -8.826 -10.153 1.00 22.31 C ATOM 1719 C LEU A 507 -1.184 -9.739 -10.806 1.00 35.14 C ATOM 1720 O LEU A 507 -0.040 -9.802 -10.361 1.00 72.35 O ATOM 1721 CB LEU A 507 -2.022 -8.643 -8.647 1.00 11.15 C ATOM 1722 CG LEU A 507 -2.295 -9.873 -7.779 1.00 20.11 C ATOM 1723 CD1 LEU A 507 -3.786 -10.001 -7.463 1.00 1.32 C ATOM 1724 CD2 LEU A 507 -1.738 -11.140 -8.432 1.00 71.33 C ATOM 0 H LEU A 507 -3.721 -10.291 -10.103 1.00 43.24 H new ATOM 0 HA LEU A 507 -2.099 -7.836 -10.591 1.00 22.31 H new ATOM 0 HB2 LEU A 507 -0.995 -8.322 -8.475 1.00 11.15 H new ATOM 0 HB3 LEU A 507 -2.669 -7.834 -8.309 1.00 11.15 H new ATOM 0 HG LEU A 507 -1.774 -9.743 -6.830 1.00 20.11 H new ATOM 0 HD11 LEU A 507 -3.953 -10.883 -6.845 1.00 1.32 H new ATOM 0 HD12 LEU A 507 -4.122 -9.114 -6.927 1.00 1.32 H new ATOM 0 HD13 LEU A 507 -4.348 -10.098 -8.392 1.00 1.32 H new ATOM 0 HD21 LEU A 507 -1.946 -11.999 -7.794 1.00 71.33 H new ATOM 0 HD22 LEU A 507 -2.210 -11.286 -9.403 1.00 71.33 H new ATOM 0 HD23 LEU A 507 -0.661 -11.038 -8.564 1.00 71.33 H new ATOM 1735 N SER A 508 -1.620 -10.424 -11.853 1.00 5.15 N ATOM 1736 CA SER A 508 -0.742 -11.332 -12.572 1.00 55.12 C ATOM 1737 C SER A 508 0.444 -10.560 -13.154 1.00 22.11 C ATOM 1738 O SER A 508 1.543 -11.100 -13.272 1.00 34.21 O ATOM 1739 CB SER A 508 -1.496 -12.062 -13.684 1.00 31.42 C ATOM 1740 OG SER A 508 -0.702 -12.215 -14.857 1.00 34.50 O ATOM 0 H SER A 508 -2.570 -10.369 -12.221 1.00 5.15 H new ATOM 0 HA SER A 508 -0.373 -12.079 -11.869 1.00 55.12 H new ATOM 0 HB2 SER A 508 -1.807 -13.044 -13.327 1.00 31.42 H new ATOM 0 HB3 SER A 508 -2.403 -11.510 -13.930 1.00 31.42 H new ATOM 0 HG SER A 508 -1.219 -12.687 -15.543 1.00 34.50 H new ATOM 1745 N GLY A 509 0.182 -9.307 -13.500 1.00 31.32 N ATOM 1746 CA GLY A 509 1.214 -8.456 -14.066 1.00 24.31 C ATOM 1747 C GLY A 509 1.953 -7.686 -12.969 1.00 32.10 C ATOM 1748 O GLY A 509 3.078 -7.235 -13.173 1.00 11.24 O ATOM 0 H GLY A 509 -0.730 -8.862 -13.399 1.00 31.32 H new ATOM 0 HA2 GLY A 509 1.923 -9.063 -14.629 1.00 24.31 H new ATOM 0 HA3 GLY A 509 0.766 -7.754 -14.769 1.00 24.31 H new ATOM 1752 N LEU A 510 1.289 -7.561 -11.830 1.00 52.14 N ATOM 1753 CA LEU A 510 1.869 -6.854 -10.700 1.00 43.54 C ATOM 1754 C LEU A 510 2.834 -7.785 -9.962 1.00 50.14 C ATOM 1755 O LEU A 510 3.130 -8.880 -10.437 1.00 41.21 O ATOM 1756 CB LEU A 510 0.769 -6.277 -9.807 1.00 3.32 C ATOM 1757 CG LEU A 510 -0.448 -5.697 -10.532 1.00 64.24 C ATOM 1758 CD1 LEU A 510 -1.567 -5.363 -9.544 1.00 4.30 C ATOM 1759 CD2 LEU A 510 -0.053 -4.488 -11.383 1.00 13.41 C ATOM 0 H LEU A 510 0.355 -7.937 -11.665 1.00 52.14 H new ATOM 0 HA LEU A 510 2.450 -5.999 -11.044 1.00 43.54 H new ATOM 0 HB2 LEU A 510 0.426 -7.062 -9.134 1.00 3.32 H new ATOM 0 HB3 LEU A 510 1.205 -5.494 -9.187 1.00 3.32 H new ATOM 0 HG LEU A 510 -0.836 -6.456 -11.211 1.00 64.24 H new ATOM 0 HD11 LEU A 510 -2.420 -4.953 -10.085 1.00 4.30 H new ATOM 0 HD12 LEU A 510 -1.872 -6.269 -9.020 1.00 4.30 H new ATOM 0 HD13 LEU A 510 -1.208 -4.629 -8.822 1.00 4.30 H new ATOM 0 HD21 LEU A 510 -0.935 -4.094 -11.888 1.00 13.41 H new ATOM 0 HD22 LEU A 510 0.373 -3.716 -10.743 1.00 13.41 H new ATOM 0 HD23 LEU A 510 0.685 -4.791 -12.126 1.00 13.41 H new ATOM 1770 N VAL A 511 3.298 -7.314 -8.813 1.00 15.22 N ATOM 1771 CA VAL A 511 4.224 -8.091 -8.007 1.00 42.33 C ATOM 1772 C VAL A 511 3.568 -8.422 -6.664 1.00 54.10 C ATOM 1773 O VAL A 511 3.471 -7.564 -5.788 1.00 22.20 O ATOM 1774 CB VAL A 511 5.546 -7.336 -7.855 1.00 75.24 C ATOM 1775 CG1 VAL A 511 6.443 -8.005 -6.812 1.00 5.45 C ATOM 1776 CG2 VAL A 511 6.265 -7.216 -9.200 1.00 52.40 C ATOM 0 H VAL A 511 3.050 -6.405 -8.422 1.00 15.22 H new ATOM 0 HA VAL A 511 4.459 -9.036 -8.498 1.00 42.33 H new ATOM 0 HB VAL A 511 5.319 -6.329 -7.505 1.00 75.24 H new ATOM 0 HG11 VAL A 511 7.376 -7.448 -6.724 1.00 5.45 H new ATOM 0 HG12 VAL A 511 5.934 -8.016 -5.848 1.00 5.45 H new ATOM 0 HG13 VAL A 511 6.659 -9.028 -7.120 1.00 5.45 H new ATOM 0 HG21 VAL A 511 7.202 -6.675 -9.065 1.00 52.40 H new ATOM 0 HG22 VAL A 511 6.474 -8.212 -9.591 1.00 52.40 H new ATOM 0 HG23 VAL A 511 5.632 -6.675 -9.904 1.00 52.40 H new ATOM 1786 N ARG A 512 3.136 -9.669 -6.545 1.00 62.01 N ATOM 1787 CA ARG A 512 2.492 -10.124 -5.324 1.00 25.43 C ATOM 1788 C ARG A 512 3.519 -10.249 -4.197 1.00 33.22 C ATOM 1789 O ARG A 512 4.259 -11.230 -4.132 1.00 73.41 O ATOM 1790 CB ARG A 512 1.809 -11.477 -5.535 1.00 45.43 C ATOM 1791 CG ARG A 512 0.889 -11.815 -4.358 1.00 71.43 C ATOM 1792 CD ARG A 512 0.002 -13.018 -4.684 1.00 70.14 C ATOM 1793 NE ARG A 512 0.795 -14.265 -4.611 1.00 33.03 N ATOM 1794 CZ ARG A 512 1.485 -14.786 -5.649 1.00 52.15 C ATOM 1795 NH1 ARG A 512 1.485 -14.168 -6.849 1.00 61.44 N ATOM 1796 NH2 ARG A 512 2.160 -15.906 -5.472 1.00 50.53 N ATOM 0 H ARG A 512 3.219 -10.378 -7.273 1.00 62.01 H new ATOM 0 HA ARG A 512 1.737 -9.386 -5.051 1.00 25.43 H new ATOM 0 HB2 ARG A 512 1.231 -11.457 -6.459 1.00 45.43 H new ATOM 0 HB3 ARG A 512 2.563 -12.256 -5.647 1.00 45.43 H new ATOM 0 HG2 ARG A 512 1.488 -12.030 -3.473 1.00 71.43 H new ATOM 0 HG3 ARG A 512 0.266 -10.953 -4.120 1.00 71.43 H new ATOM 0 HD2 ARG A 512 -0.832 -13.066 -3.984 1.00 70.14 H new ATOM 0 HD3 ARG A 512 -0.425 -12.906 -5.681 1.00 70.14 H new ATOM 0 HE ARG A 512 0.822 -14.763 -3.721 1.00 33.03 H new ATOM 0 HH11 ARG A 512 0.962 -13.302 -6.977 1.00 61.44 H new ATOM 0 HH12 ARG A 512 2.008 -14.567 -7.628 1.00 61.44 H new ATOM 0 HH21 ARG A 512 2.156 -16.366 -4.561 1.00 50.53 H new ATOM 0 HH22 ARG A 512 2.686 -16.312 -6.246 1.00 50.53 H new ATOM 1806 N LEU A 513 3.534 -9.242 -3.338 1.00 10.31 N ATOM 1807 CA LEU A 513 4.457 -9.227 -2.217 1.00 53.03 C ATOM 1808 C LEU A 513 4.015 -10.264 -1.182 1.00 32.10 C ATOM 1809 O LEU A 513 2.828 -10.383 -0.885 1.00 62.21 O ATOM 1810 CB LEU A 513 4.590 -7.811 -1.649 1.00 15.15 C ATOM 1811 CG LEU A 513 5.834 -7.031 -2.078 1.00 22.24 C ATOM 1812 CD1 LEU A 513 6.102 -7.204 -3.574 1.00 34.20 C ATOM 1813 CD2 LEU A 513 5.721 -5.557 -1.682 1.00 33.43 C ATOM 0 H LEU A 513 2.921 -8.429 -3.396 1.00 10.31 H new ATOM 0 HA LEU A 513 5.457 -9.510 -2.546 1.00 53.03 H new ATOM 0 HB2 LEU A 513 3.709 -7.240 -1.940 1.00 15.15 H new ATOM 0 HB3 LEU A 513 4.583 -7.875 -0.561 1.00 15.15 H new ATOM 0 HG LEU A 513 6.694 -7.442 -1.548 1.00 22.24 H new ATOM 0 HD11 LEU A 513 6.992 -6.639 -3.852 1.00 34.20 H new ATOM 0 HD12 LEU A 513 6.258 -8.260 -3.796 1.00 34.20 H new ATOM 0 HD13 LEU A 513 5.247 -6.837 -4.142 1.00 34.20 H new ATOM 0 HD21 LEU A 513 6.618 -5.025 -1.999 1.00 33.43 H new ATOM 0 HD22 LEU A 513 4.849 -5.116 -2.165 1.00 33.43 H new ATOM 0 HD23 LEU A 513 5.615 -5.478 -0.600 1.00 33.43 H new ATOM 1824 N ASP A 514 4.994 -10.989 -0.663 1.00 30.42 N ATOM 1825 CA ASP A 514 4.722 -12.012 0.331 1.00 13.51 C ATOM 1826 C ASP A 514 5.528 -11.716 1.597 1.00 62.40 C ATOM 1827 O ASP A 514 6.426 -10.875 1.582 1.00 22.44 O ATOM 1828 CB ASP A 514 5.130 -13.397 -0.176 1.00 4.23 C ATOM 1829 CG ASP A 514 4.011 -14.195 -0.849 1.00 2.01 C ATOM 1830 OD1 ASP A 514 3.007 -13.628 -1.302 1.00 12.14 O ATOM 1831 OD2 ASP A 514 4.205 -15.470 -0.898 1.00 75.14 O ATOM 0 H ASP A 514 5.978 -10.888 -0.913 1.00 30.42 H new ATOM 0 HA ASP A 514 3.652 -12.004 0.536 1.00 13.51 H new ATOM 0 HB2 ASP A 514 5.950 -13.281 -0.885 1.00 4.23 H new ATOM 0 HB3 ASP A 514 5.514 -13.976 0.664 1.00 4.23 H new ATOM 1836 N GLU A 515 5.180 -12.423 2.662 1.00 34.43 N ATOM 1837 CA GLU A 515 5.862 -12.247 3.934 1.00 14.53 C ATOM 1838 C GLU A 515 6.434 -13.580 4.419 1.00 42.41 C ATOM 1839 O GLU A 515 6.955 -13.668 5.530 1.00 30.41 O ATOM 1840 CB GLU A 515 4.923 -11.640 4.979 1.00 14.31 C ATOM 1841 CG GLU A 515 5.604 -11.558 6.345 1.00 21.12 C ATOM 1842 CD GLU A 515 5.025 -10.413 7.179 1.00 54.31 C ATOM 1843 OE1 GLU A 515 4.203 -10.654 8.076 1.00 53.13 O ATOM 1844 OE2 GLU A 515 5.458 -9.238 6.867 1.00 44.42 O ATOM 0 H GLU A 515 4.435 -13.119 2.671 1.00 34.43 H new ATOM 0 HA GLU A 515 6.689 -11.552 3.788 1.00 14.53 H new ATOM 0 HB2 GLU A 515 4.615 -10.644 4.662 1.00 14.31 H new ATOM 0 HB3 GLU A 515 4.019 -12.244 5.055 1.00 14.31 H new ATOM 0 HG2 GLU A 515 5.475 -12.501 6.877 1.00 21.12 H new ATOM 0 HG3 GLU A 515 6.676 -11.410 6.213 1.00 21.12 H new ATOM 1850 N HIS A 516 6.317 -14.585 3.562 1.00 65.44 N ATOM 1851 CA HIS A 516 6.816 -15.909 3.891 1.00 60.20 C ATOM 1852 C HIS A 516 7.823 -16.355 2.828 1.00 62.13 C ATOM 1853 O HIS A 516 8.376 -17.451 2.913 1.00 54.24 O ATOM 1854 CB HIS A 516 5.662 -16.896 4.065 1.00 22.34 C ATOM 1855 CG HIS A 516 4.548 -16.723 3.061 1.00 31.45 C ATOM 1856 ND1 HIS A 516 3.234 -17.063 3.332 1.00 22.22 N ATOM 1857 CD2 HIS A 516 4.565 -16.242 1.785 1.00 35.21 C ATOM 1858 CE1 HIS A 516 2.502 -16.795 2.260 1.00 22.35 C ATOM 1859 NE2 HIS A 516 3.330 -16.287 1.302 1.00 72.15 N ATOM 0 H HIS A 516 5.884 -14.508 2.642 1.00 65.44 H new ATOM 0 HA HIS A 516 7.338 -15.879 4.847 1.00 60.20 H new ATOM 0 HB2 HIS A 516 6.051 -17.911 3.989 1.00 22.34 H new ATOM 0 HB3 HIS A 516 5.252 -16.786 5.069 1.00 22.34 H new ATOM 0 HD2 HIS A 516 5.437 -15.885 1.257 1.00 35.21 H new ATOM 0 HE1 HIS A 516 1.438 -16.951 2.162 1.00 22.35 H new ATOM 0 HE2 HIS A 516 3.046 -15.991 0.368 1.00 72.15 H new ATOM 1866 N SER A 517 8.030 -15.483 1.853 1.00 34.42 N ATOM 1867 CA SER A 517 8.961 -15.773 0.775 1.00 70.21 C ATOM 1868 C SER A 517 10.352 -15.243 1.127 1.00 25.25 C ATOM 1869 O SER A 517 10.496 -14.417 2.028 1.00 10.24 O ATOM 1870 CB SER A 517 8.482 -15.167 -0.545 1.00 2.42 C ATOM 1871 OG SER A 517 8.353 -16.149 -1.569 1.00 34.22 O ATOM 0 H SER A 517 7.569 -14.575 1.786 1.00 34.42 H new ATOM 0 HA SER A 517 9.012 -16.855 0.650 1.00 70.21 H new ATOM 0 HB2 SER A 517 7.521 -14.676 -0.391 1.00 2.42 H new ATOM 0 HB3 SER A 517 9.185 -14.398 -0.867 1.00 2.42 H new ATOM 0 HG SER A 517 8.043 -15.722 -2.395 1.00 34.22 H new ATOM 1876 N GLN A 518 11.341 -15.741 0.401 1.00 24.35 N ATOM 1877 CA GLN A 518 12.717 -15.329 0.627 1.00 13.11 C ATOM 1878 C GLN A 518 13.181 -14.396 -0.494 1.00 53.12 C ATOM 1879 O GLN A 518 14.317 -13.926 -0.484 1.00 62.45 O ATOM 1880 CB GLN A 518 13.642 -16.542 0.746 1.00 54.32 C ATOM 1881 CG GLN A 518 13.731 -17.296 -0.581 1.00 63.01 C ATOM 1882 CD GLN A 518 15.087 -17.994 -0.724 1.00 53.32 C ATOM 1883 OE1 GLN A 518 15.592 -18.621 0.192 1.00 12.43 O ATOM 1884 NE2 GLN A 518 15.645 -17.849 -1.923 1.00 53.04 N ATOM 0 H GLN A 518 11.218 -16.426 -0.345 1.00 24.35 H new ATOM 0 HA GLN A 518 12.762 -14.786 1.571 1.00 13.11 H new ATOM 0 HB2 GLN A 518 14.637 -16.217 1.051 1.00 54.32 H new ATOM 0 HB3 GLN A 518 13.273 -17.210 1.524 1.00 54.32 H new ATOM 0 HG2 GLN A 518 12.930 -18.033 -0.639 1.00 63.01 H new ATOM 0 HG3 GLN A 518 13.586 -16.602 -1.409 1.00 63.01 H new ATOM 0 HE21 GLN A 518 15.168 -17.311 -2.646 1.00 53.04 H new ATOM 0 HE22 GLN A 518 16.550 -18.276 -2.119 1.00 53.04 H new ATOM 1891 N ILE A 519 12.279 -14.156 -1.433 1.00 54.33 N ATOM 1892 CA ILE A 519 12.581 -13.286 -2.558 1.00 14.43 C ATOM 1893 C ILE A 519 11.808 -11.975 -2.407 1.00 45.10 C ATOM 1894 O ILE A 519 12.228 -10.940 -2.921 1.00 10.12 O ATOM 1895 CB ILE A 519 12.313 -14.009 -3.880 1.00 21.23 C ATOM 1896 CG1 ILE A 519 11.630 -13.079 -4.884 1.00 13.12 C ATOM 1897 CG2 ILE A 519 11.513 -15.293 -3.652 1.00 64.50 C ATOM 1898 CD1 ILE A 519 12.598 -12.005 -5.383 1.00 31.41 C ATOM 0 H ILE A 519 11.338 -14.549 -1.439 1.00 54.33 H new ATOM 0 HA ILE A 519 13.641 -13.031 -2.568 1.00 14.43 H new ATOM 0 HB ILE A 519 13.271 -14.300 -4.310 1.00 21.23 H new ATOM 0 HG12 ILE A 519 11.259 -13.660 -5.728 1.00 13.12 H new ATOM 0 HG13 ILE A 519 10.766 -12.606 -4.418 1.00 13.12 H new ATOM 0 HG21 ILE A 519 11.337 -15.786 -4.608 1.00 64.50 H new ATOM 0 HG22 ILE A 519 12.074 -15.960 -2.997 1.00 64.50 H new ATOM 0 HG23 ILE A 519 10.557 -15.049 -3.188 1.00 64.50 H new ATOM 0 HD11 ILE A 519 12.087 -11.357 -6.095 1.00 31.41 H new ATOM 0 HD12 ILE A 519 12.949 -11.411 -4.539 1.00 31.41 H new ATOM 0 HD13 ILE A 519 13.449 -12.480 -5.870 1.00 31.41 H new ATOM 1909 N PHE A 520 10.692 -12.062 -1.698 1.00 72.40 N ATOM 1910 CA PHE A 520 9.856 -10.894 -1.472 1.00 34.42 C ATOM 1911 C PHE A 520 10.708 -9.653 -1.201 1.00 71.40 C ATOM 1912 O PHE A 520 10.350 -8.549 -1.607 1.00 42.13 O ATOM 1913 CB PHE A 520 8.999 -11.190 -0.239 1.00 22.40 C ATOM 1914 CG PHE A 520 8.615 -9.945 0.564 1.00 40.30 C ATOM 1915 CD1 PHE A 520 7.677 -9.087 0.079 1.00 25.40 C ATOM 1916 CD2 PHE A 520 9.210 -9.698 1.761 1.00 41.42 C ATOM 1917 CE1 PHE A 520 7.320 -7.932 0.824 1.00 62.42 C ATOM 1918 CE2 PHE A 520 8.853 -8.543 2.506 1.00 52.44 C ATOM 1919 CZ PHE A 520 7.915 -7.684 2.021 1.00 63.24 C ATOM 0 H PHE A 520 10.347 -12.922 -1.273 1.00 72.40 H new ATOM 0 HA PHE A 520 9.246 -10.697 -2.354 1.00 34.42 H new ATOM 0 HB2 PHE A 520 8.090 -11.701 -0.555 1.00 22.40 H new ATOM 0 HB3 PHE A 520 9.541 -11.877 0.411 1.00 22.40 H new ATOM 0 HD1 PHE A 520 7.204 -9.284 -0.872 1.00 25.40 H new ATOM 0 HD2 PHE A 520 9.954 -10.380 2.145 1.00 41.42 H new ATOM 0 HE1 PHE A 520 6.576 -7.250 0.440 1.00 62.42 H new ATOM 0 HE2 PHE A 520 9.325 -8.346 3.457 1.00 52.44 H new ATOM 0 HZ PHE A 520 7.643 -6.805 2.587 1.00 63.24 H new ATOM 1928 N ALA A 521 11.822 -9.878 -0.517 1.00 1.32 N ATOM 1929 CA ALA A 521 12.729 -8.792 -0.187 1.00 11.21 C ATOM 1930 C ALA A 521 13.132 -8.062 -1.470 1.00 30.44 C ATOM 1931 O ALA A 521 13.100 -6.834 -1.527 1.00 21.22 O ATOM 1932 CB ALA A 521 13.934 -9.347 0.574 1.00 62.44 C ATOM 0 H ALA A 521 12.116 -10.796 -0.183 1.00 1.32 H new ATOM 0 HA ALA A 521 12.240 -8.067 0.463 1.00 11.21 H new ATOM 0 HB1 ALA A 521 14.615 -8.532 0.822 1.00 62.44 H new ATOM 0 HB2 ALA A 521 13.595 -9.828 1.491 1.00 62.44 H new ATOM 0 HB3 ALA A 521 14.453 -10.077 -0.048 1.00 62.44 H new ATOM 1938 N ARG A 522 13.505 -8.851 -2.468 1.00 64.43 N ATOM 1939 CA ARG A 522 13.915 -8.296 -3.746 1.00 55.11 C ATOM 1940 C ARG A 522 12.698 -7.778 -4.516 1.00 75.31 C ATOM 1941 O ARG A 522 12.833 -6.945 -5.410 1.00 71.31 O ATOM 1942 CB ARG A 522 14.639 -9.344 -4.595 1.00 41.22 C ATOM 1943 CG ARG A 522 16.021 -9.656 -4.019 1.00 44.52 C ATOM 1944 CD ARG A 522 15.912 -10.566 -2.794 1.00 3.31 C ATOM 1945 NE ARG A 522 17.261 -11.001 -2.364 1.00 42.42 N ATOM 1946 CZ ARG A 522 18.004 -11.915 -3.022 1.00 62.43 C ATOM 1947 NH1 ARG A 522 17.539 -12.500 -4.146 1.00 5.44 N ATOM 1948 NH2 ARG A 522 19.197 -12.229 -2.548 1.00 41.30 N ATOM 0 H ARG A 522 13.532 -9.869 -2.417 1.00 64.43 H new ATOM 0 HA ARG A 522 14.599 -7.472 -3.545 1.00 55.11 H new ATOM 0 HB2 ARG A 522 14.044 -10.257 -4.638 1.00 41.22 H new ATOM 0 HB3 ARG A 522 14.741 -8.982 -5.618 1.00 41.22 H new ATOM 0 HG2 ARG A 522 16.636 -10.137 -4.780 1.00 44.52 H new ATOM 0 HG3 ARG A 522 16.522 -8.728 -3.744 1.00 44.52 H new ATOM 0 HD2 ARG A 522 15.415 -10.037 -1.981 1.00 3.31 H new ATOM 0 HD3 ARG A 522 15.299 -11.436 -3.030 1.00 3.31 H new ATOM 0 HE ARG A 522 17.652 -10.584 -1.519 1.00 42.42 H new ATOM 0 HH11 ARG A 522 16.617 -12.252 -4.506 1.00 5.44 H new ATOM 0 HH12 ARG A 522 18.109 -13.190 -4.635 1.00 5.44 H new ATOM 0 HH21 ARG A 522 19.542 -11.783 -1.698 1.00 41.30 H new ATOM 0 HH22 ARG A 522 19.773 -12.918 -3.032 1.00 41.30 H new ATOM 1958 N LYS A 523 11.538 -8.295 -4.139 1.00 13.21 N ATOM 1959 CA LYS A 523 10.297 -7.895 -4.783 1.00 14.32 C ATOM 1960 C LYS A 523 9.913 -6.490 -4.312 1.00 11.31 C ATOM 1961 O LYS A 523 9.463 -5.668 -5.108 1.00 40.11 O ATOM 1962 CB LYS A 523 9.208 -8.943 -4.545 1.00 32.41 C ATOM 1963 CG LYS A 523 9.708 -10.344 -4.907 1.00 50.32 C ATOM 1964 CD LYS A 523 10.265 -10.376 -6.332 1.00 42.15 C ATOM 1965 CE LYS A 523 9.207 -9.935 -7.345 1.00 31.33 C ATOM 1966 NZ LYS A 523 9.388 -10.651 -8.626 1.00 35.23 N ATOM 0 H LYS A 523 11.431 -8.986 -3.397 1.00 13.21 H new ATOM 0 HA LYS A 523 10.427 -7.845 -5.864 1.00 14.32 H new ATOM 0 HB2 LYS A 523 8.900 -8.922 -3.500 1.00 32.41 H new ATOM 0 HB3 LYS A 523 8.329 -8.701 -5.142 1.00 32.41 H new ATOM 0 HG2 LYS A 523 10.482 -10.651 -4.203 1.00 50.32 H new ATOM 0 HG3 LYS A 523 8.892 -11.060 -4.816 1.00 50.32 H new ATOM 0 HD2 LYS A 523 11.134 -9.722 -6.401 1.00 42.15 H new ATOM 0 HD3 LYS A 523 10.604 -11.384 -6.571 1.00 42.15 H new ATOM 0 HE2 LYS A 523 8.211 -10.132 -6.949 1.00 31.33 H new ATOM 0 HE3 LYS A 523 9.278 -8.860 -7.509 1.00 31.33 H new ATOM 0 HZ1 LYS A 523 8.662 -10.340 -9.303 1.00 35.23 H new ATOM 0 HZ2 LYS A 523 10.332 -10.442 -9.010 1.00 35.23 H new ATOM 0 HZ3 LYS A 523 9.298 -11.675 -8.467 1.00 35.23 H new ATOM 1975 N VAL A 524 10.105 -6.260 -3.021 1.00 31.33 N ATOM 1976 CA VAL A 524 9.783 -4.971 -2.436 1.00 72.22 C ATOM 1977 C VAL A 524 10.905 -3.979 -2.750 1.00 20.14 C ATOM 1978 O VAL A 524 10.643 -2.845 -3.149 1.00 61.32 O ATOM 1979 CB VAL A 524 9.527 -5.127 -0.936 1.00 74.43 C ATOM 1980 CG1 VAL A 524 10.835 -5.054 -0.146 1.00 45.20 C ATOM 1981 CG2 VAL A 524 8.527 -4.081 -0.439 1.00 51.14 C ATOM 0 H VAL A 524 10.479 -6.945 -2.365 1.00 31.33 H new ATOM 0 HA VAL A 524 8.866 -4.573 -2.870 1.00 72.22 H new ATOM 0 HB VAL A 524 9.091 -6.112 -0.771 1.00 74.43 H new ATOM 0 HG11 VAL A 524 10.625 -5.168 0.917 1.00 45.20 H new ATOM 0 HG12 VAL A 524 11.502 -5.853 -0.471 1.00 45.20 H new ATOM 0 HG13 VAL A 524 11.312 -4.090 -0.320 1.00 45.20 H new ATOM 0 HG21 VAL A 524 8.363 -4.214 0.630 1.00 51.14 H new ATOM 0 HG22 VAL A 524 8.923 -3.082 -0.624 1.00 51.14 H new ATOM 0 HG23 VAL A 524 7.582 -4.200 -0.969 1.00 51.14 H new ATOM 1991 N ALA A 525 12.132 -4.443 -2.561 1.00 72.13 N ATOM 1992 CA ALA A 525 13.294 -3.610 -2.819 1.00 24.45 C ATOM 1993 C ALA A 525 13.366 -3.292 -4.314 1.00 62.12 C ATOM 1994 O ALA A 525 14.149 -2.442 -4.734 1.00 52.13 O ATOM 1995 CB ALA A 525 14.553 -4.319 -2.313 1.00 53.51 C ATOM 0 H ALA A 525 12.346 -5.385 -2.232 1.00 72.13 H new ATOM 0 HA ALA A 525 13.215 -2.664 -2.284 1.00 24.45 H new ATOM 0 HB1 ALA A 525 15.425 -3.694 -2.506 1.00 53.51 H new ATOM 0 HB2 ALA A 525 14.465 -4.497 -1.241 1.00 53.51 H new ATOM 0 HB3 ALA A 525 14.667 -5.271 -2.831 1.00 53.51 H new ATOM 2001 N ASN A 526 12.539 -3.993 -5.076 1.00 71.41 N ATOM 2002 CA ASN A 526 12.499 -3.795 -6.515 1.00 4.04 C ATOM 2003 C ASN A 526 11.539 -2.650 -6.842 1.00 24.34 C ATOM 2004 O ASN A 526 11.912 -1.700 -7.528 1.00 32.44 O ATOM 2005 CB ASN A 526 11.996 -5.052 -7.229 1.00 21.34 C ATOM 2006 CG ASN A 526 13.164 -5.880 -7.770 1.00 15.42 C ATOM 2007 OD1 ASN A 526 14.238 -5.375 -8.055 1.00 10.44 O ATOM 2008 ND2 ASN A 526 12.895 -7.177 -7.894 1.00 42.24 N ATOM 0 H ASN A 526 11.892 -4.698 -4.724 1.00 71.41 H new ATOM 0 HA ASN A 526 13.510 -3.568 -6.853 1.00 4.04 H new ATOM 0 HB2 ASN A 526 11.407 -5.656 -6.539 1.00 21.34 H new ATOM 0 HB3 ASN A 526 11.336 -4.769 -8.049 1.00 21.34 H new ATOM 0 HD21 ASN A 526 13.609 -7.815 -8.246 1.00 42.24 H new ATOM 0 HD22 ASN A 526 11.975 -7.534 -7.637 1.00 42.24 H new ATOM 2014 N THR A 527 10.322 -2.777 -6.335 1.00 22.14 N ATOM 2015 CA THR A 527 9.307 -1.763 -6.563 1.00 22.02 C ATOM 2016 C THR A 527 9.548 -0.552 -5.662 1.00 62.24 C ATOM 2017 O THR A 527 9.660 0.574 -6.146 1.00 51.41 O ATOM 2018 CB THR A 527 7.937 -2.412 -6.355 1.00 13.23 C ATOM 2019 OG1 THR A 527 7.013 -1.353 -6.585 1.00 12.22 O ATOM 2020 CG2 THR A 527 7.692 -2.809 -4.897 1.00 73.42 C ATOM 0 H THR A 527 10.016 -3.567 -5.767 1.00 22.14 H new ATOM 0 HA THR A 527 9.352 -1.382 -7.583 1.00 22.02 H new ATOM 0 HB THR A 527 7.853 -3.294 -6.991 1.00 13.23 H new ATOM 0 HG1 THR A 527 6.326 -1.650 -7.218 1.00 12.22 H new ATOM 0 HG21 THR A 527 6.706 -3.265 -4.805 1.00 73.42 H new ATOM 0 HG22 THR A 527 8.453 -3.523 -4.582 1.00 73.42 H new ATOM 0 HG23 THR A 527 7.742 -1.922 -4.265 1.00 73.42 H new ATOM 2028 N PHE A 528 9.624 -0.823 -4.367 1.00 13.22 N ATOM 2029 CA PHE A 528 9.851 0.231 -3.393 1.00 75.41 C ATOM 2030 C PHE A 528 11.342 0.559 -3.278 1.00 11.13 C ATOM 2031 O PHE A 528 11.912 0.497 -2.189 1.00 41.42 O ATOM 2032 CB PHE A 528 9.349 -0.290 -2.045 1.00 73.11 C ATOM 2033 CG PHE A 528 7.833 -0.192 -1.865 1.00 35.42 C ATOM 2034 CD1 PHE A 528 7.230 1.027 -1.836 1.00 2.42 C ATOM 2035 CD2 PHE A 528 7.089 -1.322 -1.736 1.00 3.13 C ATOM 2036 CE1 PHE A 528 5.822 1.118 -1.669 1.00 24.31 C ATOM 2037 CE2 PHE A 528 5.682 -1.231 -1.569 1.00 34.52 C ATOM 2038 CZ PHE A 528 5.079 -0.013 -1.539 1.00 3.32 C ATOM 0 H PHE A 528 9.532 -1.758 -3.970 1.00 13.22 H new ATOM 0 HA PHE A 528 9.329 1.138 -3.698 1.00 75.41 H new ATOM 0 HB2 PHE A 528 9.651 -1.331 -1.934 1.00 73.11 H new ATOM 0 HB3 PHE A 528 9.836 0.270 -1.247 1.00 73.11 H new ATOM 0 HD1 PHE A 528 7.821 1.925 -1.940 1.00 2.42 H new ATOM 0 HD2 PHE A 528 7.568 -2.290 -1.761 1.00 3.13 H new ATOM 0 HE1 PHE A 528 5.342 2.085 -1.645 1.00 24.31 H new ATOM 0 HE2 PHE A 528 5.091 -2.129 -1.466 1.00 34.52 H new ATOM 0 HZ PHE A 528 4.009 0.056 -1.412 1.00 3.32 H new ATOM 2047 N LYS A 529 11.930 0.900 -4.414 1.00 31.02 N ATOM 2048 CA LYS A 529 13.343 1.237 -4.454 1.00 71.53 C ATOM 2049 C LYS A 529 13.582 2.507 -3.637 1.00 52.04 C ATOM 2050 O LYS A 529 12.650 3.265 -3.371 1.00 35.01 O ATOM 2051 CB LYS A 529 13.829 1.336 -5.902 1.00 52.04 C ATOM 2052 CG LYS A 529 14.141 -0.049 -6.472 1.00 73.02 C ATOM 2053 CD LYS A 529 14.221 -0.008 -7.999 1.00 3.45 C ATOM 2054 CE LYS A 529 14.621 -1.374 -8.564 1.00 45.44 C ATOM 2055 NZ LYS A 529 14.475 -1.388 -10.036 1.00 44.20 N ATOM 0 H LYS A 529 11.454 0.950 -5.315 1.00 31.02 H new ATOM 0 HA LYS A 529 13.937 0.446 -3.996 1.00 71.53 H new ATOM 0 HB2 LYS A 529 13.067 1.821 -6.512 1.00 52.04 H new ATOM 0 HB3 LYS A 529 14.721 1.961 -5.948 1.00 52.04 H new ATOM 0 HG2 LYS A 529 15.085 -0.410 -6.064 1.00 73.02 H new ATOM 0 HG3 LYS A 529 13.370 -0.755 -6.163 1.00 73.02 H new ATOM 0 HD2 LYS A 529 13.257 0.291 -8.409 1.00 3.45 H new ATOM 0 HD3 LYS A 529 14.946 0.744 -8.309 1.00 3.45 H new ATOM 0 HE2 LYS A 529 15.653 -1.599 -8.293 1.00 45.44 H new ATOM 0 HE3 LYS A 529 13.999 -2.153 -8.123 1.00 45.44 H new ATOM 0 HZ1 LYS A 529 14.750 -2.321 -10.403 1.00 44.20 H new ATOM 0 HZ2 LYS A 529 13.485 -1.195 -10.288 1.00 44.20 H new ATOM 0 HZ3 LYS A 529 15.087 -0.658 -10.453 1.00 44.20 H new ATOM 2064 N PRO A 530 14.871 2.708 -3.250 1.00 32.32 N ATOM 2065 CA PRO A 530 15.245 3.874 -2.469 1.00 4.30 C ATOM 2066 C PRO A 530 15.274 5.132 -3.338 1.00 35.53 C ATOM 2067 O PRO A 530 15.199 6.248 -2.826 1.00 25.21 O ATOM 2068 CB PRO A 530 16.602 3.531 -1.875 1.00 14.02 C ATOM 2069 CG PRO A 530 17.147 2.386 -2.714 1.00 11.41 C ATOM 2070 CD PRO A 530 16.002 1.833 -3.547 1.00 12.54 C ATOM 0 HA PRO A 530 14.526 4.100 -1.682 1.00 4.30 H new ATOM 0 HB2 PRO A 530 17.271 4.391 -1.907 1.00 14.02 H new ATOM 0 HB3 PRO A 530 16.508 3.239 -0.829 1.00 14.02 H new ATOM 0 HG2 PRO A 530 17.954 2.735 -3.358 1.00 11.41 H new ATOM 0 HG3 PRO A 530 17.564 1.608 -2.074 1.00 11.41 H new ATOM 0 HD2 PRO A 530 16.244 1.845 -4.610 1.00 12.54 H new ATOM 0 HD3 PRO A 530 15.783 0.799 -3.282 1.00 12.54 H new ATOM 2075 N HIS A 531 15.383 4.909 -4.641 1.00 61.22 N ATOM 2076 CA HIS A 531 15.423 6.012 -5.587 1.00 0.00 C ATOM 2077 C HIS A 531 14.002 6.349 -6.041 1.00 42.11 C ATOM 2078 O HIS A 531 13.776 7.383 -6.669 1.00 11.12 O ATOM 2079 CB HIS A 531 16.359 5.690 -6.755 1.00 53.54 C ATOM 2080 CG HIS A 531 15.678 5.006 -7.916 1.00 1.10 C ATOM 2081 ND1 HIS A 531 15.472 3.638 -7.962 1.00 11.33 N ATOM 2082 CD2 HIS A 531 15.159 5.513 -9.071 1.00 13.32 C ATOM 2083 CE1 HIS A 531 14.855 3.347 -9.100 1.00 64.32 C ATOM 2084 NE2 HIS A 531 14.664 4.510 -9.785 1.00 11.42 N ATOM 0 H HIS A 531 15.445 3.982 -5.063 1.00 61.22 H new ATOM 0 HA HIS A 531 15.832 6.899 -5.103 1.00 0.00 H new ATOM 0 HB2 HIS A 531 16.815 6.615 -7.108 1.00 53.54 H new ATOM 0 HB3 HIS A 531 17.167 5.054 -6.395 1.00 53.54 H new ATOM 0 HD2 HIS A 531 15.152 6.555 -9.356 1.00 13.32 H new ATOM 0 HE1 HIS A 531 14.556 2.362 -9.426 1.00 64.32 H new ATOM 0 HE2 HIS A 531 14.214 4.595 -10.697 1.00 11.42 H new ATOM 2091 N ARG A 532 13.080 5.459 -5.705 1.00 41.14 N ATOM 2092 CA ARG A 532 11.686 5.650 -6.070 1.00 63.34 C ATOM 2093 C ARG A 532 10.886 6.149 -4.865 1.00 53.44 C ATOM 2094 O ARG A 532 9.714 6.500 -4.996 1.00 70.24 O ATOM 2095 CB ARG A 532 11.068 4.348 -6.579 1.00 14.22 C ATOM 2096 CG ARG A 532 11.917 3.737 -7.697 1.00 71.01 C ATOM 2097 CD ARG A 532 11.883 4.614 -8.951 1.00 10.10 C ATOM 2098 NE ARG A 532 10.481 4.893 -9.336 1.00 33.23 N ATOM 2099 CZ ARG A 532 10.118 5.792 -10.276 1.00 64.24 C ATOM 2100 NH1 ARG A 532 11.054 6.509 -10.933 1.00 75.43 N ATOM 2101 NH2 ARG A 532 8.837 5.959 -10.541 1.00 41.51 N ATOM 0 H ARG A 532 13.271 4.603 -5.184 1.00 41.14 H new ATOM 0 HA ARG A 532 11.650 6.392 -6.867 1.00 63.34 H new ATOM 0 HB2 ARG A 532 10.978 3.638 -5.757 1.00 14.22 H new ATOM 0 HB3 ARG A 532 10.060 4.539 -6.946 1.00 14.22 H new ATOM 0 HG2 ARG A 532 12.946 3.623 -7.356 1.00 71.01 H new ATOM 0 HG3 ARG A 532 11.548 2.740 -7.936 1.00 71.01 H new ATOM 0 HD2 ARG A 532 12.411 5.549 -8.765 1.00 10.10 H new ATOM 0 HD3 ARG A 532 12.401 4.113 -9.769 1.00 10.10 H new ATOM 0 HE ARG A 532 9.743 4.373 -8.861 1.00 33.23 H new ATOM 0 HH11 ARG A 532 12.042 6.373 -10.721 1.00 75.43 H new ATOM 0 HH12 ARG A 532 10.773 7.186 -11.642 1.00 75.43 H new ATOM 0 HH21 ARG A 532 8.137 5.413 -10.039 1.00 41.51 H new ATOM 0 HH22 ARG A 532 8.546 6.634 -11.248 1.00 41.51 H new ATOM 2111 N LEU A 533 11.550 6.165 -3.718 1.00 20.23 N ATOM 2112 CA LEU A 533 10.914 6.615 -2.493 1.00 44.25 C ATOM 2113 C LEU A 533 11.094 8.128 -2.355 1.00 71.41 C ATOM 2114 O LEU A 533 10.204 8.822 -1.869 1.00 24.14 O ATOM 2115 CB LEU A 533 11.441 5.823 -1.294 1.00 72.22 C ATOM 2116 CG LEU A 533 10.618 4.598 -0.886 1.00 71.41 C ATOM 2117 CD1 LEU A 533 9.294 5.016 -0.244 1.00 41.13 C ATOM 2118 CD2 LEU A 533 10.408 3.660 -2.075 1.00 31.25 C ATOM 0 H LEU A 533 12.522 5.873 -3.612 1.00 20.23 H new ATOM 0 HA LEU A 533 9.842 6.423 -2.528 1.00 44.25 H new ATOM 0 HB2 LEU A 533 12.456 5.496 -1.518 1.00 72.22 H new ATOM 0 HB3 LEU A 533 11.504 6.496 -0.438 1.00 72.22 H new ATOM 0 HG LEU A 533 11.179 4.044 -0.133 1.00 71.41 H new ATOM 0 HD11 LEU A 533 8.729 4.127 0.036 1.00 41.13 H new ATOM 0 HD12 LEU A 533 9.494 5.614 0.645 1.00 41.13 H new ATOM 0 HD13 LEU A 533 8.715 5.605 -0.955 1.00 41.13 H new ATOM 0 HD21 LEU A 533 9.821 2.798 -1.759 1.00 31.25 H new ATOM 0 HD22 LEU A 533 9.878 4.189 -2.867 1.00 31.25 H new ATOM 0 HD23 LEU A 533 11.375 3.323 -2.448 1.00 31.25 H new ATOM 2129 N GLN A 534 12.255 8.596 -2.795 1.00 45.42 N ATOM 2130 CA GLN A 534 12.564 10.014 -2.727 1.00 50.44 C ATOM 2131 C GLN A 534 11.932 10.751 -3.910 1.00 43.34 C ATOM 2132 O GLN A 534 11.380 11.838 -3.744 1.00 13.30 O ATOM 2133 CB GLN A 534 14.076 10.245 -2.682 1.00 4.41 C ATOM 2134 CG GLN A 534 14.742 9.313 -1.667 1.00 2.51 C ATOM 2135 CD GLN A 534 16.160 8.949 -2.106 1.00 14.34 C ATOM 2136 OE1 GLN A 534 17.124 9.096 -1.372 1.00 3.51 O ATOM 2137 NE2 GLN A 534 16.235 8.465 -3.343 1.00 62.31 N ATOM 0 H GLN A 534 12.992 8.018 -3.199 1.00 45.42 H new ATOM 0 HA GLN A 534 12.141 10.414 -1.805 1.00 50.44 H new ATOM 0 HB2 GLN A 534 14.503 10.077 -3.671 1.00 4.41 H new ATOM 0 HB3 GLN A 534 14.282 11.282 -2.418 1.00 4.41 H new ATOM 0 HG2 GLN A 534 14.772 9.796 -0.690 1.00 2.51 H new ATOM 0 HG3 GLN A 534 14.148 8.406 -1.556 1.00 2.51 H new ATOM 0 HE21 GLN A 534 15.389 8.368 -3.905 1.00 62.31 H new ATOM 0 HE22 GLN A 534 17.138 8.191 -3.730 1.00 62.31 H new ATOM 2144 N ALA A 535 12.036 10.132 -5.075 1.00 54.12 N ATOM 2145 CA ALA A 535 11.481 10.715 -6.286 1.00 45.13 C ATOM 2146 C ALA A 535 10.021 11.102 -6.038 1.00 10.20 C ATOM 2147 O ALA A 535 9.476 11.958 -6.733 1.00 34.00 O ATOM 2148 CB ALA A 535 11.633 9.730 -7.445 1.00 23.35 C ATOM 0 H ALA A 535 12.497 9.232 -5.208 1.00 54.12 H new ATOM 0 HA ALA A 535 12.022 11.622 -6.557 1.00 45.13 H new ATOM 0 HB1 ALA A 535 11.217 10.168 -8.352 1.00 23.35 H new ATOM 0 HB2 ALA A 535 12.689 9.511 -7.600 1.00 23.35 H new ATOM 0 HB3 ALA A 535 11.102 8.808 -7.211 1.00 23.35 H new ATOM 2154 N ARG A 536 9.431 10.454 -5.044 1.00 70.33 N ATOM 2155 CA ARG A 536 8.046 10.720 -4.696 1.00 23.10 C ATOM 2156 C ARG A 536 7.881 12.171 -4.243 1.00 54.50 C ATOM 2157 O ARG A 536 6.933 12.846 -4.644 1.00 63.11 O ATOM 2158 CB ARG A 536 7.571 9.787 -3.581 1.00 52.04 C ATOM 2159 CG ARG A 536 6.766 8.615 -4.150 1.00 71.35 C ATOM 2160 CD ARG A 536 7.498 7.969 -5.327 1.00 61.21 C ATOM 2161 NE ARG A 536 6.813 8.302 -6.595 1.00 51.55 N ATOM 2162 CZ ARG A 536 7.300 8.009 -7.818 1.00 72.15 C ATOM 2163 NH1 ARG A 536 8.483 7.373 -7.951 1.00 65.31 N ATOM 2164 NH2 ARG A 536 6.602 8.354 -8.885 1.00 74.40 N ATOM 0 H ARG A 536 9.887 9.746 -4.469 1.00 70.33 H new ATOM 0 HA ARG A 536 7.441 10.544 -5.585 1.00 23.10 H new ATOM 0 HB2 ARG A 536 8.431 9.408 -3.029 1.00 52.04 H new ATOM 0 HB3 ARG A 536 6.958 10.344 -2.873 1.00 52.04 H new ATOM 0 HG2 ARG A 536 6.597 7.872 -3.370 1.00 71.35 H new ATOM 0 HG3 ARG A 536 5.786 8.965 -4.474 1.00 71.35 H new ATOM 0 HD2 ARG A 536 8.530 8.318 -5.359 1.00 61.21 H new ATOM 0 HD3 ARG A 536 7.531 6.887 -5.196 1.00 61.21 H new ATOM 0 HE ARG A 536 5.916 8.784 -6.541 1.00 51.55 H new ATOM 0 HH11 ARG A 536 9.017 7.110 -7.122 1.00 65.31 H new ATOM 0 HH12 ARG A 536 8.843 7.155 -8.880 1.00 65.31 H new ATOM 0 HH21 ARG A 536 5.709 8.835 -8.777 1.00 74.40 H new ATOM 0 HH22 ARG A 536 6.956 8.140 -9.817 1.00 74.40 H new ATOM 2174 N LYS A 537 8.818 12.610 -3.416 1.00 65.11 N ATOM 2175 CA LYS A 537 8.789 13.969 -2.904 1.00 72.30 C ATOM 2176 C LYS A 537 8.940 14.951 -4.068 1.00 13.35 C ATOM 2177 O LYS A 537 8.410 16.060 -4.022 1.00 63.03 O ATOM 2178 CB LYS A 537 9.839 14.151 -1.806 1.00 12.12 C ATOM 2179 CG LYS A 537 9.228 13.931 -0.421 1.00 53.32 C ATOM 2180 CD LYS A 537 9.347 12.465 0.003 1.00 73.13 C ATOM 2181 CE LYS A 537 10.805 12.089 0.270 1.00 21.11 C ATOM 2182 NZ LYS A 537 11.510 13.196 0.955 1.00 15.12 N ATOM 0 H LYS A 537 9.603 12.048 -3.087 1.00 65.11 H new ATOM 0 HA LYS A 537 7.829 14.178 -2.432 1.00 72.30 H new ATOM 0 HB2 LYS A 537 10.658 13.449 -1.962 1.00 12.12 H new ATOM 0 HB3 LYS A 537 10.262 15.154 -1.865 1.00 12.12 H new ATOM 0 HG2 LYS A 537 9.731 14.566 0.308 1.00 53.32 H new ATOM 0 HG3 LYS A 537 8.179 14.227 -0.431 1.00 53.32 H new ATOM 0 HD2 LYS A 537 8.753 12.293 0.901 1.00 73.13 H new ATOM 0 HD3 LYS A 537 8.939 11.823 -0.777 1.00 73.13 H new ATOM 0 HE2 LYS A 537 10.848 11.189 0.883 1.00 21.11 H new ATOM 0 HE3 LYS A 537 11.305 11.859 -0.671 1.00 21.11 H new ATOM 0 HZ1 LYS A 537 12.379 12.834 1.396 1.00 15.12 H new ATOM 0 HZ2 LYS A 537 11.754 13.933 0.263 1.00 15.12 H new ATOM 0 HZ3 LYS A 537 10.892 13.600 1.688 1.00 15.12 H new ATOM 2191 N ALA A 538 9.663 14.507 -5.085 1.00 15.24 N ATOM 2192 CA ALA A 538 9.889 15.332 -6.260 1.00 43.02 C ATOM 2193 C ALA A 538 8.546 15.655 -6.918 1.00 0.14 C ATOM 2194 O ALA A 538 8.460 16.553 -7.752 1.00 53.35 O ATOM 2195 CB ALA A 538 10.847 14.612 -7.212 1.00 65.54 C ATOM 0 H ALA A 538 10.100 13.586 -5.120 1.00 15.24 H new ATOM 0 HA ALA A 538 10.355 16.277 -5.982 1.00 43.02 H new ATOM 0 HB1 ALA A 538 11.017 15.230 -8.094 1.00 65.54 H new ATOM 0 HB2 ALA A 538 11.796 14.432 -6.706 1.00 65.54 H new ATOM 0 HB3 ALA A 538 10.411 13.660 -7.515 1.00 65.54 H new ATOM 2201 N MET A 539 7.532 14.903 -6.515 1.00 13.35 N ATOM 2202 CA MET A 539 6.196 15.098 -7.056 1.00 41.53 C ATOM 2203 C MET A 539 5.363 16.003 -6.147 1.00 43.50 C ATOM 2204 O MET A 539 4.383 16.600 -6.588 1.00 52.40 O ATOM 2205 CB MET A 539 5.503 13.743 -7.203 1.00 13.33 C ATOM 2206 CG MET A 539 6.469 12.687 -7.740 1.00 73.21 C ATOM 2207 SD MET A 539 5.645 11.108 -7.860 1.00 3.42 S ATOM 2208 CE MET A 539 4.875 11.038 -6.251 1.00 10.03 C ATOM 0 H MET A 539 7.608 14.159 -5.822 1.00 13.35 H new ATOM 0 HA MET A 539 6.285 15.578 -8.031 1.00 41.53 H new ATOM 0 HB2 MET A 539 5.111 13.425 -6.237 1.00 13.33 H new ATOM 0 HB3 MET A 539 4.651 13.838 -7.877 1.00 13.33 H new ATOM 0 HG2 MET A 539 6.841 12.987 -8.720 1.00 73.21 H new ATOM 0 HG3 MET A 539 7.334 12.606 -7.082 1.00 73.21 H new ATOM 0 HE1 MET A 539 4.608 10.007 -6.020 1.00 10.03 H new ATOM 0 HE2 MET A 539 5.570 11.410 -5.498 1.00 10.03 H new ATOM 0 HE3 MET A 539 3.976 11.654 -6.251 1.00 10.03 H new ATOM 2216 N TRP A 540 5.784 16.076 -4.892 1.00 53.41 N ATOM 2217 CA TRP A 540 5.089 16.898 -3.916 1.00 10.20 C ATOM 2218 C TRP A 540 5.476 18.358 -4.166 1.00 12.12 C ATOM 2219 O TRP A 540 4.709 19.268 -3.855 1.00 14.12 O ATOM 2220 CB TRP A 540 5.395 16.434 -2.490 1.00 72.51 C ATOM 2221 CG TRP A 540 4.376 16.901 -1.451 1.00 71.21 C ATOM 2222 CD1 TRP A 540 3.091 16.537 -1.333 1.00 42.13 C ATOM 2223 CD2 TRP A 540 4.608 17.841 -0.380 1.00 64.10 C ATOM 2224 NE1 TRP A 540 2.481 17.170 -0.270 1.00 11.50 N ATOM 2225 CE2 TRP A 540 3.433 17.988 0.329 1.00 55.25 C ATOM 2226 CE3 TRP A 540 5.773 18.543 -0.023 1.00 11.43 C ATOM 2227 CZ2 TRP A 540 3.309 18.832 1.438 1.00 10.52 C ATOM 2228 CZ3 TRP A 540 5.630 19.382 1.089 1.00 65.05 C ATOM 2229 CH2 TRP A 540 4.455 19.542 1.814 1.00 15.03 C ATOM 0 H TRP A 540 6.598 15.579 -4.529 1.00 53.41 H new ATOM 0 HA TRP A 540 4.009 16.800 -4.028 1.00 10.20 H new ATOM 0 HB2 TRP A 540 5.440 15.345 -2.475 1.00 72.51 H new ATOM 0 HB3 TRP A 540 6.382 16.798 -2.205 1.00 72.51 H new ATOM 0 HD1 TRP A 540 2.596 15.836 -1.988 1.00 42.13 H new ATOM 0 HE1 TRP A 540 1.510 17.059 0.023 1.00 11.50 H new ATOM 0 HE3 TRP A 540 6.703 18.443 -0.563 1.00 11.43 H new ATOM 0 HZ2 TRP A 540 2.378 18.930 1.976 1.00 10.52 H new ATOM 0 HZ3 TRP A 540 6.495 19.945 1.406 1.00 65.05 H new ATOM 0 HH2 TRP A 540 4.427 20.210 2.662 1.00 15.03 H new ATOM 2239 N ARG A 541 6.663 18.535 -4.724 1.00 20.23 N ATOM 2240 CA ARG A 541 7.162 19.868 -5.018 1.00 3.10 C ATOM 2241 C ARG A 541 6.478 20.424 -6.269 1.00 43.13 C ATOM 2242 O ARG A 541 6.400 21.639 -6.449 1.00 32.41 O ATOM 2243 CB ARG A 541 8.675 19.854 -5.236 1.00 63.33 C ATOM 2244 CG ARG A 541 9.047 19.014 -6.459 1.00 0.04 C ATOM 2245 CD ARG A 541 10.399 19.445 -7.032 1.00 30.43 C ATOM 2246 NE ARG A 541 11.481 19.110 -6.079 1.00 74.30 N ATOM 2247 CZ ARG A 541 12.796 19.250 -6.349 1.00 31.22 C ATOM 2248 NH1 ARG A 541 13.204 19.719 -7.547 1.00 12.33 N ATOM 2249 NH2 ARG A 541 13.678 18.921 -5.423 1.00 14.54 N ATOM 0 H ARG A 541 7.295 17.777 -4.981 1.00 20.23 H new ATOM 0 HA ARG A 541 6.937 20.504 -4.162 1.00 3.10 H new ATOM 0 HB2 ARG A 541 9.036 20.874 -5.368 1.00 63.33 H new ATOM 0 HB3 ARG A 541 9.169 19.453 -4.351 1.00 63.33 H new ATOM 0 HG2 ARG A 541 9.085 17.960 -6.183 1.00 0.04 H new ATOM 0 HG3 ARG A 541 8.276 19.116 -7.222 1.00 0.04 H new ATOM 0 HD2 ARG A 541 10.575 18.947 -7.985 1.00 30.43 H new ATOM 0 HD3 ARG A 541 10.395 20.517 -7.229 1.00 30.43 H new ATOM 0 HE ARG A 541 11.216 18.751 -5.162 1.00 74.30 H new ATOM 0 HH11 ARG A 541 12.516 19.971 -8.257 1.00 12.33 H new ATOM 0 HH12 ARG A 541 14.200 19.822 -7.742 1.00 12.33 H new ATOM 0 HH21 ARG A 541 13.362 18.567 -4.520 1.00 14.54 H new ATOM 0 HH22 ARG A 541 14.676 19.021 -5.611 1.00 14.54 H new ATOM 2259 N LYS A 542 6.000 19.511 -7.100 1.00 24.55 N ATOM 2260 CA LYS A 542 5.326 19.895 -8.330 1.00 4.40 C ATOM 2261 C LYS A 542 3.982 20.540 -7.986 1.00 33.03 C ATOM 2262 O LYS A 542 3.586 21.525 -8.608 1.00 0.32 O ATOM 2263 CB LYS A 542 5.212 18.698 -9.274 1.00 33.14 C ATOM 2264 CG LYS A 542 6.570 18.024 -9.474 1.00 63.43 C ATOM 2265 CD LYS A 542 7.313 18.630 -10.665 1.00 34.42 C ATOM 2266 CE LYS A 542 8.828 18.571 -10.456 1.00 34.34 C ATOM 2267 NZ LYS A 542 9.290 17.165 -10.413 1.00 43.22 N ATOM 0 H LYS A 542 6.066 18.505 -6.947 1.00 24.55 H new ATOM 0 HA LYS A 542 5.910 20.641 -8.870 1.00 4.40 H new ATOM 0 HB2 LYS A 542 4.501 17.978 -8.869 1.00 33.14 H new ATOM 0 HB3 LYS A 542 4.820 19.026 -10.237 1.00 33.14 H new ATOM 0 HG2 LYS A 542 7.171 18.134 -8.571 1.00 63.43 H new ATOM 0 HG3 LYS A 542 6.429 16.955 -9.634 1.00 63.43 H new ATOM 0 HD2 LYS A 542 7.047 18.093 -11.575 1.00 34.42 H new ATOM 0 HD3 LYS A 542 7.002 19.665 -10.803 1.00 34.42 H new ATOM 0 HE2 LYS A 542 9.333 19.102 -11.263 1.00 34.34 H new ATOM 0 HE3 LYS A 542 9.093 19.076 -9.527 1.00 34.34 H new ATOM 0 HZ1 LYS A 542 10.316 17.132 -10.577 1.00 43.22 H new ATOM 0 HZ2 LYS A 542 9.075 16.757 -9.481 1.00 43.22 H new ATOM 0 HZ3 LYS A 542 8.803 16.617 -11.151 1.00 43.22 H new ATOM 2276 N GLU A 543 3.316 19.957 -7.000 1.00 63.42 N ATOM 2277 CA GLU A 543 2.025 20.464 -6.567 1.00 70.32 C ATOM 2278 C GLU A 543 2.074 21.985 -6.417 1.00 55.32 C ATOM 2279 O GLU A 543 1.063 22.662 -6.593 1.00 52.21 O ATOM 2280 CB GLU A 543 1.584 19.798 -5.263 1.00 73.31 C ATOM 2281 CG GLU A 543 0.781 18.525 -5.540 1.00 52.14 C ATOM 2282 CD GLU A 543 -0.247 18.274 -4.437 1.00 44.30 C ATOM 2283 OE1 GLU A 543 -1.460 18.345 -4.691 1.00 22.03 O ATOM 2284 OE2 GLU A 543 0.250 17.997 -3.279 1.00 33.20 O ATOM 0 H GLU A 543 3.646 19.138 -6.489 1.00 63.42 H new ATOM 0 HA GLU A 543 1.286 20.218 -7.330 1.00 70.32 H new ATOM 0 HB2 GLU A 543 2.459 19.556 -4.660 1.00 73.31 H new ATOM 0 HB3 GLU A 543 0.979 20.494 -4.682 1.00 73.31 H new ATOM 0 HG2 GLU A 543 0.274 18.613 -6.501 1.00 52.14 H new ATOM 0 HG3 GLU A 543 1.457 17.673 -5.613 1.00 52.14 H new ATOM 2290 N GLN A 544 3.260 22.478 -6.093 1.00 62.24 N ATOM 2291 CA GLN A 544 3.454 23.908 -5.918 1.00 0.50 C ATOM 2292 C GLN A 544 3.584 24.597 -7.276 1.00 55.51 C ATOM 2293 O GLN A 544 2.899 25.582 -7.545 1.00 75.44 O ATOM 2294 CB GLN A 544 4.674 24.192 -5.040 1.00 21.43 C ATOM 2295 CG GLN A 544 4.638 23.352 -3.761 1.00 11.21 C ATOM 2296 CD GLN A 544 3.581 23.879 -2.789 1.00 30.02 C ATOM 2297 OE1 GLN A 544 3.745 24.906 -2.151 1.00 52.10 O ATOM 2298 NE2 GLN A 544 2.491 23.121 -2.711 1.00 21.12 N ATOM 0 H GLN A 544 4.097 21.913 -5.947 1.00 62.24 H new ATOM 0 HA GLN A 544 2.579 24.314 -5.410 1.00 0.50 H new ATOM 0 HB2 GLN A 544 5.585 23.974 -5.597 1.00 21.43 H new ATOM 0 HB3 GLN A 544 4.703 25.251 -4.783 1.00 21.43 H new ATOM 0 HG2 GLN A 544 4.422 22.313 -4.010 1.00 11.21 H new ATOM 0 HG3 GLN A 544 5.617 23.369 -3.283 1.00 11.21 H new ATOM 0 HE21 GLN A 544 2.418 22.273 -3.273 1.00 21.12 H new ATOM 0 HE22 GLN A 544 1.728 23.388 -2.089 1.00 21.12 H new ATOM 2305 N ASP A 545 4.469 24.052 -8.099 1.00 34.42 N ATOM 2306 CA ASP A 545 4.698 24.602 -9.424 1.00 21.10 C ATOM 2307 C ASP A 545 3.352 24.845 -10.110 1.00 23.35 C ATOM 2308 O ASP A 545 3.247 25.691 -10.997 1.00 12.23 O ATOM 2309 CB ASP A 545 5.502 23.633 -10.292 1.00 1.03 C ATOM 2310 CG ASP A 545 6.073 24.236 -11.576 1.00 32.11 C ATOM 2311 OD1 ASP A 545 7.098 24.933 -11.556 1.00 5.31 O ATOM 2312 OD2 ASP A 545 5.410 23.961 -12.649 1.00 22.32 O ATOM 0 H ASP A 545 5.036 23.235 -7.873 1.00 34.42 H new ATOM 0 HA ASP A 545 5.255 25.532 -9.311 1.00 21.10 H new ATOM 0 HB2 ASP A 545 6.325 23.235 -9.699 1.00 1.03 H new ATOM 0 HB3 ASP A 545 4.863 22.791 -10.557 1.00 1.03 H new TER 2317 ASP A 545