USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 462 CYS SG : rot -130:sc= -1.05 USER MOD Set 1.2: A 503 THR OG1 : rot -86:sc= 1.17 USER MOD Set 2.1: A 476 ASN : amide:sc= -4.93! C(o=-7.7!,f=-20!) USER MOD Set 2.2: A 480 GLN : amide:sc= -2.72 K(o=-7.7,f=-9.6!) USER MOD Set 3.1: A 443 GLN : amide:sc= -2.44! K(o=-2.4!,f=-1.3) USER MOD Set 3.2: A 475 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 471 GLN : amide:sc= -0.376 X(o=-3,f=-3.2) USER MOD Set 4.2: A 474 MET CE :methyl 137:sc= -2.67! (180deg=-4.31!) USER MOD Set 5.1: A 458 SER OG : rot -133:sc= 0.812 USER MOD Set 5.2: A 494 SER OG : rot 70:sc= -1.39! USER MOD Set 5.3: A 498 GLN : amide:sc= -0.215 K(o=-0.8,f=-5!) USER MOD Set 6.1: A 401 HIS : no HD1:sc= -7.29! C(o=-6.6!,f=-9.1!) USER MOD Set 6.2: A 426 THR OG1 : rot -6:sc= 0.741! 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 -56:sc= 0.033 USER MOD Single : A 390 SER OG : rot 57:sc= 1.17 USER MOD Single : A 392 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 393 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0925) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -7.35! C(o=-7.3!,f=-10!) USER MOD Single : A 407 HIS : no HD1:sc= -1.45 K(o=-1.4,f=-0.93) USER MOD Single : A 415 LYS NZ :NH3+ 156:sc= -2.44! (180deg=-4.51!) USER MOD Single : A 428 CYS SG : rot 180:sc= 0.0711 USER MOD Single : A 432 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 434 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-0.28) USER MOD Single : A 440 SER OG : rot 180:sc= -0.0103 USER MOD Single : A 441 CYS SG : rot 180:sc= -0.04 USER MOD Single : A 448 HIS : no HD1:sc= -1.11 K(o=-1.1,f=-0.57) USER MOD Single : A 449 SER OG : rot -150:sc= -2.12! USER MOD Single : A 457 THR OG1 : rot 179:sc= -0.904 USER MOD Single : A 459 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 465 SER OG : rot -116:sc= -4.37! USER MOD Single : A 467 HIS : no HD1:sc= -0.262 X(o=-0.26,f=-0.43) USER MOD Single : A 468 GLN : amide:sc= -7.39! C(o=-7.4!,f=-11!) USER MOD Single : A 470 ASN : amide:sc= -1.12 K(o=-1.1,f=-0.16) USER MOD Single : A 473 MET CE :methyl -146:sc= -11.7! (180deg=-16.5!) USER MOD Single : A 478 THR OG1 : rot -30:sc= 0.917 USER MOD Single : A 482 SER OG : rot 58:sc= 0.00253 USER MOD Single : A 485 CYS SG : rot 99:sc= 0.0462 USER MOD Single : A 495 SER OG : rot 32:sc=0.000731 USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot -29:sc= 0.284 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= -6.76! C(o=-6.7!,f=-11!) USER MOD Single : A 517 SER OG : rot 180:sc= -1.37 USER MOD Single : A 518 GLN : amide:sc= -1.59 X(o=-1.6,f=-2.1) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.61! C(o=-3.6!,f=-4.5!) USER MOD Single : A 527 THR OG1 : rot -55:sc= -0.469 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -6.17! C(o=-6.2!,f=-8.1!) USER MOD Single : A 534 GLN : amide:sc= -0.911 X(o=-0.91,f=-0.48) USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 539 MET CE :methyl -155:sc= -3.07! (180deg=-3.86!) USER MOD Single : A 542 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 544 GLN : amide:sc= -0.0913 K(o=-0.091,f=-1.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 -3.312 30.947 3.353 1.00 62.25 N ATOM 2 CA MET A 386 -2.503 29.739 3.390 1.00 55.20 C ATOM 3 C MET A 386 -1.709 29.651 4.695 1.00 43.05 C ATOM 4 O MET A 386 -1.599 30.633 5.426 1.00 51.42 O ATOM 5 CB MET A 386 -1.538 29.735 2.202 1.00 4.45 C ATOM 6 CG MET A 386 -2.224 30.249 0.936 1.00 73.15 C ATOM 7 SD MET A 386 -1.345 29.680 -0.510 1.00 24.40 S ATOM 8 CE MET A 386 -2.717 29.413 -1.620 1.00 73.22 C ATOM 0 HA MET A 386 -3.167 28.876 3.333 1.00 55.20 H new ATOM 0 HB2 MET A 386 -0.673 30.358 2.430 1.00 4.45 H new ATOM 0 HB3 MET A 386 -1.167 28.724 2.034 1.00 4.45 H new ATOM 0 HG2 MET A 386 -3.256 29.900 0.905 1.00 73.15 H new ATOM 0 HG3 MET A 386 -2.256 31.338 0.947 1.00 73.15 H new ATOM 0 HE1 MET A 386 -2.344 29.053 -2.579 1.00 73.22 H new ATOM 0 HE2 MET A 386 -3.392 28.672 -1.192 1.00 73.22 H new ATOM 0 HE3 MET A 386 -3.253 30.350 -1.768 1.00 73.22 H new ATOM 16 N GLU A 387 -1.174 28.465 4.946 1.00 52.52 N ATOM 17 CA GLU A 387 -0.394 28.237 6.149 1.00 32.42 C ATOM 18 C GLU A 387 1.067 28.632 5.918 1.00 71.41 C ATOM 19 O GLU A 387 1.422 29.101 4.839 1.00 61.42 O ATOM 20 CB GLU A 387 -0.502 26.779 6.603 1.00 44.10 C ATOM 21 CG GLU A 387 -1.907 26.470 7.121 1.00 4.34 C ATOM 22 CD GLU A 387 -2.057 26.891 8.585 1.00 14.11 C ATOM 23 OE1 GLU A 387 -1.389 26.328 9.464 1.00 22.04 O ATOM 24 OE2 GLU A 387 -2.906 27.840 8.794 1.00 1.04 O ATOM 0 H GLU A 387 -1.266 27.652 4.336 1.00 52.52 H new ATOM 0 HA GLU A 387 -0.798 28.863 6.945 1.00 32.42 H new ATOM 0 HB2 GLU A 387 -0.263 26.117 5.771 1.00 44.10 H new ATOM 0 HB3 GLU A 387 0.230 26.583 7.387 1.00 44.10 H new ATOM 0 HG2 GLU A 387 -2.646 26.991 6.512 1.00 4.34 H new ATOM 0 HG3 GLU A 387 -2.108 25.403 7.023 1.00 4.34 H new ATOM 30 N SER A 388 1.873 28.427 6.949 1.00 3.43 N ATOM 31 CA SER A 388 3.286 28.755 6.872 1.00 71.44 C ATOM 32 C SER A 388 4.105 27.488 6.621 1.00 31.40 C ATOM 33 O SER A 388 4.941 27.112 7.441 1.00 74.52 O ATOM 34 CB SER A 388 3.760 29.450 8.149 1.00 32.23 C ATOM 35 OG SER A 388 3.102 30.698 8.356 1.00 12.24 O ATOM 0 H SER A 388 1.574 28.037 7.843 1.00 3.43 H new ATOM 0 HA SER A 388 3.432 29.444 6.040 1.00 71.44 H new ATOM 0 HB2 SER A 388 3.579 28.799 9.004 1.00 32.23 H new ATOM 0 HB3 SER A 388 4.836 29.613 8.095 1.00 32.23 H new ATOM 0 HG SER A 388 3.432 31.109 9.183 1.00 12.24 H new ATOM 40 N SER A 389 3.837 26.865 5.483 1.00 22.44 N ATOM 41 CA SER A 389 4.539 25.647 5.112 1.00 65.45 C ATOM 42 C SER A 389 4.373 24.593 6.210 1.00 15.04 C ATOM 43 O SER A 389 5.347 23.974 6.635 1.00 70.23 O ATOM 44 CB SER A 389 6.024 25.921 4.862 1.00 52.23 C ATOM 45 OG SER A 389 6.653 24.853 4.161 1.00 53.12 O ATOM 0 H SER A 389 3.143 27.181 4.805 1.00 22.44 H new ATOM 0 HA SER A 389 4.105 25.271 4.186 1.00 65.45 H new ATOM 0 HB2 SER A 389 6.131 26.843 4.290 1.00 52.23 H new ATOM 0 HB3 SER A 389 6.529 26.076 5.815 1.00 52.23 H new ATOM 0 HG SER A 389 6.524 24.017 4.655 1.00 53.12 H new ATOM 50 N SER A 390 3.130 24.421 6.637 1.00 75.12 N ATOM 51 CA SER A 390 2.822 23.453 7.675 1.00 4.01 C ATOM 52 C SER A 390 2.597 22.072 7.054 1.00 50.02 C ATOM 53 O SER A 390 1.460 21.683 6.795 1.00 12.03 O ATOM 54 CB SER A 390 1.593 23.880 8.479 1.00 21.34 C ATOM 55 OG SER A 390 0.379 23.609 7.785 1.00 15.12 O ATOM 0 H SER A 390 2.324 24.936 6.282 1.00 75.12 H new ATOM 0 HA SER A 390 3.670 23.403 8.358 1.00 4.01 H new ATOM 0 HB2 SER A 390 1.587 23.359 9.436 1.00 21.34 H new ATOM 0 HB3 SER A 390 1.655 24.946 8.697 1.00 21.34 H new ATOM 0 HG SER A 390 0.333 22.655 7.567 1.00 15.12 H new ATOM 60 N GLU A 391 3.699 21.372 6.831 1.00 24.21 N ATOM 61 CA GLU A 391 3.636 20.044 6.245 1.00 50.03 C ATOM 62 C GLU A 391 3.256 19.012 7.310 1.00 35.13 C ATOM 63 O GLU A 391 3.004 19.365 8.460 1.00 64.13 O ATOM 64 CB GLU A 391 4.961 19.676 5.575 1.00 70.44 C ATOM 65 CG GLU A 391 5.973 19.165 6.603 1.00 3.44 C ATOM 66 CD GLU A 391 7.400 19.245 6.056 1.00 14.55 C ATOM 67 OE1 GLU A 391 7.947 18.229 5.603 1.00 64.10 O ATOM 68 OE2 GLU A 391 7.939 20.415 6.112 1.00 53.12 O ATOM 0 H GLU A 391 4.641 21.699 7.046 1.00 24.21 H new ATOM 0 HA GLU A 391 2.865 20.045 5.474 1.00 50.03 H new ATOM 0 HB2 GLU A 391 4.789 18.911 4.817 1.00 70.44 H new ATOM 0 HB3 GLU A 391 5.367 20.548 5.062 1.00 70.44 H new ATOM 0 HG2 GLU A 391 5.897 19.754 7.517 1.00 3.44 H new ATOM 0 HG3 GLU A 391 5.739 18.134 6.868 1.00 3.44 H new ATOM 74 N GLN A 392 3.226 17.756 6.886 1.00 71.25 N ATOM 75 CA GLN A 392 2.880 16.671 7.788 1.00 33.44 C ATOM 76 C GLN A 392 3.536 15.368 7.325 1.00 44.52 C ATOM 77 O GLN A 392 3.788 15.184 6.136 1.00 10.32 O ATOM 78 CB GLN A 392 1.363 16.513 7.899 1.00 10.34 C ATOM 79 CG GLN A 392 0.998 15.176 8.548 1.00 54.54 C ATOM 80 CD GLN A 392 -0.466 15.166 8.997 1.00 41.15 C ATOM 81 OE1 GLN A 392 -1.386 15.075 8.201 1.00 2.13 O ATOM 82 NE2 GLN A 392 -0.628 15.265 10.314 1.00 75.03 N ATOM 0 H GLN A 392 3.436 17.467 5.931 1.00 71.25 H new ATOM 0 HA GLN A 392 3.259 16.913 8.781 1.00 33.44 H new ATOM 0 HB2 GLN A 392 0.950 17.332 8.488 1.00 10.34 H new ATOM 0 HB3 GLN A 392 0.914 16.575 6.908 1.00 10.34 H new ATOM 0 HG2 GLN A 392 1.171 14.365 7.841 1.00 54.54 H new ATOM 0 HG3 GLN A 392 1.646 14.995 9.405 1.00 54.54 H new ATOM 0 HE21 GLN A 392 0.186 15.338 10.924 1.00 75.03 H new ATOM 0 HE22 GLN A 392 -1.566 15.268 10.714 1.00 75.03 H new ATOM 89 N LYS A 393 3.794 14.498 8.291 1.00 31.52 N ATOM 90 CA LYS A 393 4.415 13.216 7.997 1.00 44.05 C ATOM 91 C LYS A 393 3.518 12.427 7.043 1.00 34.21 C ATOM 92 O LYS A 393 2.349 12.186 7.340 1.00 4.12 O ATOM 93 CB LYS A 393 4.743 12.472 9.293 1.00 1.23 C ATOM 94 CG LYS A 393 5.440 11.142 8.998 1.00 12.34 C ATOM 95 CD LYS A 393 4.419 10.013 8.834 1.00 21.12 C ATOM 96 CE LYS A 393 3.555 9.869 10.089 1.00 15.42 C ATOM 97 NZ LYS A 393 3.008 8.497 10.187 1.00 2.12 N ATOM 0 H LYS A 393 3.585 14.655 9.277 1.00 31.52 H new ATOM 0 HA LYS A 393 5.369 13.360 7.490 1.00 44.05 H new ATOM 0 HB2 LYS A 393 5.384 13.092 9.920 1.00 1.23 H new ATOM 0 HB3 LYS A 393 3.827 12.290 9.855 1.00 1.23 H new ATOM 0 HG2 LYS A 393 6.036 11.233 8.090 1.00 12.34 H new ATOM 0 HG3 LYS A 393 6.128 10.900 9.808 1.00 12.34 H new ATOM 0 HD2 LYS A 393 3.784 10.215 7.972 1.00 21.12 H new ATOM 0 HD3 LYS A 393 4.937 9.075 8.635 1.00 21.12 H new ATOM 0 HE2 LYS A 393 4.149 10.094 10.975 1.00 15.42 H new ATOM 0 HE3 LYS A 393 2.739 10.591 10.061 1.00 15.42 H new ATOM 0 HZ1 LYS A 393 2.282 8.465 10.931 1.00 2.12 H new ATOM 0 HZ2 LYS A 393 2.583 8.227 9.277 1.00 2.12 H new ATOM 0 HZ3 LYS A 393 3.774 7.834 10.422 1.00 2.12 H new ATOM 106 N PHE A 394 4.099 12.045 5.916 1.00 31.44 N ATOM 107 CA PHE A 394 3.367 11.285 4.915 1.00 60.14 C ATOM 108 C PHE A 394 3.796 9.817 4.919 1.00 74.45 C ATOM 109 O PHE A 394 4.762 9.451 5.587 1.00 4.35 O ATOM 110 CB PHE A 394 3.701 11.900 3.555 1.00 40.41 C ATOM 111 CG PHE A 394 3.921 13.414 3.593 1.00 15.20 C ATOM 112 CD1 PHE A 394 2.855 14.253 3.703 1.00 44.14 C ATOM 113 CD2 PHE A 394 5.180 13.920 3.516 1.00 41.54 C ATOM 114 CE1 PHE A 394 3.060 15.659 3.738 1.00 2.45 C ATOM 115 CE2 PHE A 394 5.384 15.326 3.552 1.00 33.14 C ATOM 116 CZ PHE A 394 4.319 16.165 3.662 1.00 73.31 C ATOM 0 H PHE A 394 5.069 12.247 5.673 1.00 31.44 H new ATOM 0 HA PHE A 394 2.298 11.323 5.126 1.00 60.14 H new ATOM 0 HB2 PHE A 394 4.599 11.423 3.163 1.00 40.41 H new ATOM 0 HB3 PHE A 394 2.892 11.678 2.859 1.00 40.41 H new ATOM 0 HD1 PHE A 394 1.854 13.851 3.764 1.00 44.14 H new ATOM 0 HD2 PHE A 394 6.025 13.254 3.427 1.00 41.54 H new ATOM 0 HE1 PHE A 394 2.215 16.326 3.825 1.00 2.45 H new ATOM 0 HE2 PHE A 394 6.384 15.728 3.492 1.00 33.14 H new ATOM 0 HZ PHE A 394 4.474 17.233 3.689 1.00 73.31 H new ATOM 125 N TYR A 395 3.058 9.017 4.163 1.00 60.44 N ATOM 126 CA TYR A 395 3.350 7.596 4.071 1.00 73.32 C ATOM 127 C TYR A 395 4.048 7.267 2.748 1.00 5.31 C ATOM 128 O TYR A 395 4.104 8.100 1.846 1.00 41.14 O ATOM 129 CB TYR A 395 1.998 6.885 4.111 1.00 33.15 C ATOM 130 CG TYR A 395 1.026 7.452 5.148 1.00 10.53 C ATOM 131 CD1 TYR A 395 1.500 7.904 6.362 1.00 21.12 C ATOM 132 CD2 TYR A 395 -0.324 7.512 4.867 1.00 64.00 C ATOM 133 CE1 TYR A 395 0.586 8.437 7.339 1.00 72.35 C ATOM 134 CE2 TYR A 395 -1.238 8.046 5.844 1.00 21.22 C ATOM 135 CZ TYR A 395 -0.738 8.482 7.030 1.00 44.43 C ATOM 136 OH TYR A 395 -1.602 8.987 7.953 1.00 23.44 O ATOM 0 H TYR A 395 2.259 9.325 3.609 1.00 60.44 H new ATOM 0 HA TYR A 395 4.009 7.285 4.881 1.00 73.32 H new ATOM 0 HB2 TYR A 395 1.538 6.947 3.125 1.00 33.15 H new ATOM 0 HB3 TYR A 395 2.161 5.828 4.321 1.00 33.15 H new ATOM 0 HD1 TYR A 395 2.557 7.858 6.580 1.00 21.12 H new ATOM 0 HD2 TYR A 395 -0.695 7.159 3.916 1.00 64.00 H new ATOM 0 HE1 TYR A 395 0.943 8.793 8.294 1.00 72.35 H new ATOM 0 HE2 TYR A 395 -2.297 8.099 5.639 1.00 21.22 H new ATOM 0 HH TYR A 395 -2.515 8.959 7.597 1.00 23.44 H new ATOM 145 N ASN A 396 4.562 6.047 2.677 1.00 60.41 N ATOM 146 CA ASN A 396 5.255 5.596 1.482 1.00 63.43 C ATOM 147 C ASN A 396 4.424 4.510 0.797 1.00 31.12 C ATOM 148 O ASN A 396 4.678 4.162 -0.356 1.00 51.21 O ATOM 149 CB ASN A 396 6.621 5.000 1.829 1.00 14.34 C ATOM 150 CG ASN A 396 7.682 6.095 1.953 1.00 3.21 C ATOM 151 OD1 ASN A 396 8.782 5.991 1.436 1.00 11.31 O ATOM 152 ND2 ASN A 396 7.291 7.148 2.665 1.00 64.25 N ATOM 0 H ASN A 396 4.512 5.358 3.427 1.00 60.41 H new ATOM 0 HA ASN A 396 5.394 6.456 0.827 1.00 63.43 H new ATOM 0 HB2 ASN A 396 6.553 4.447 2.766 1.00 14.34 H new ATOM 0 HB3 ASN A 396 6.917 4.288 1.059 1.00 14.34 H new ATOM 0 HD21 ASN A 396 7.927 7.933 2.806 1.00 64.25 H new ATOM 0 HD22 ASN A 396 6.355 7.171 3.070 1.00 64.25 H new ATOM 158 N PHE A 397 3.448 4.001 1.535 1.00 50.05 N ATOM 159 CA PHE A 397 2.579 2.962 1.013 1.00 21.44 C ATOM 160 C PHE A 397 1.415 2.688 1.969 1.00 13.12 C ATOM 161 O PHE A 397 1.628 2.385 3.141 1.00 45.30 O ATOM 162 CB PHE A 397 3.425 1.694 0.885 1.00 23.22 C ATOM 163 CG PHE A 397 4.064 1.237 2.197 1.00 72.44 C ATOM 164 CD1 PHE A 397 5.065 1.970 2.758 1.00 3.44 C ATOM 165 CD2 PHE A 397 3.635 0.098 2.804 1.00 33.24 C ATOM 166 CE1 PHE A 397 5.658 1.546 3.976 1.00 55.43 C ATOM 167 CE2 PHE A 397 4.229 -0.325 4.022 1.00 70.33 C ATOM 168 CZ PHE A 397 5.228 0.407 4.581 1.00 45.55 C ATOM 0 H PHE A 397 3.240 4.290 2.491 1.00 50.05 H new ATOM 0 HA PHE A 397 2.162 3.273 0.055 1.00 21.44 H new ATOM 0 HB2 PHE A 397 2.799 0.890 0.498 1.00 23.22 H new ATOM 0 HB3 PHE A 397 4.212 1.867 0.151 1.00 23.22 H new ATOM 0 HD1 PHE A 397 5.408 2.874 2.276 1.00 3.44 H new ATOM 0 HD2 PHE A 397 2.842 -0.485 2.359 1.00 33.24 H new ATOM 0 HE1 PHE A 397 6.451 2.128 4.422 1.00 55.43 H new ATOM 0 HE2 PHE A 397 3.887 -1.229 4.504 1.00 70.33 H new ATOM 0 HZ PHE A 397 5.681 0.084 5.507 1.00 45.55 H new ATOM 177 N VAL A 398 0.210 2.807 1.431 1.00 44.13 N ATOM 178 CA VAL A 398 -0.988 2.576 2.221 1.00 74.03 C ATOM 179 C VAL A 398 -1.359 1.093 2.158 1.00 42.15 C ATOM 180 O VAL A 398 -1.747 0.592 1.104 1.00 35.15 O ATOM 181 CB VAL A 398 -2.114 3.495 1.744 1.00 64.15 C ATOM 182 CG1 VAL A 398 -2.878 2.866 0.578 1.00 15.44 C ATOM 183 CG2 VAL A 398 -3.060 3.846 2.894 1.00 3.52 C ATOM 0 H VAL A 398 0.037 3.060 0.458 1.00 44.13 H new ATOM 0 HA VAL A 398 -0.808 2.821 3.268 1.00 74.03 H new ATOM 0 HB VAL A 398 -1.662 4.421 1.388 1.00 64.15 H new ATOM 0 HG11 VAL A 398 -3.673 3.540 0.258 1.00 15.44 H new ATOM 0 HG12 VAL A 398 -2.194 2.691 -0.253 1.00 15.44 H new ATOM 0 HG13 VAL A 398 -3.312 1.918 0.896 1.00 15.44 H new ATOM 0 HG21 VAL A 398 -3.851 4.500 2.528 1.00 3.52 H new ATOM 0 HG22 VAL A 398 -3.501 2.933 3.294 1.00 3.52 H new ATOM 0 HG23 VAL A 398 -2.503 4.355 3.681 1.00 3.52 H new ATOM 193 N ILE A 399 -1.225 0.433 3.298 1.00 41.31 N ATOM 194 CA ILE A 399 -1.542 -0.982 3.386 1.00 73.01 C ATOM 195 C ILE A 399 -3.047 -1.152 3.603 1.00 41.12 C ATOM 196 O ILE A 399 -3.551 -0.908 4.698 1.00 64.25 O ATOM 197 CB ILE A 399 -0.686 -1.657 4.460 1.00 74.51 C ATOM 198 CG1 ILE A 399 0.804 -1.514 4.142 1.00 62.32 C ATOM 199 CG2 ILE A 399 -1.094 -3.119 4.647 1.00 2.32 C ATOM 200 CD1 ILE A 399 1.654 -1.696 5.402 1.00 1.24 C ATOM 0 H ILE A 399 -0.901 0.852 4.170 1.00 41.31 H new ATOM 0 HA ILE A 399 -1.296 -1.486 2.451 1.00 73.01 H new ATOM 0 HB ILE A 399 -0.864 -1.150 5.408 1.00 74.51 H new ATOM 0 HG12 ILE A 399 1.092 -2.253 3.395 1.00 62.32 H new ATOM 0 HG13 ILE A 399 0.994 -0.532 3.709 1.00 62.32 H new ATOM 0 HG21 ILE A 399 -0.470 -3.575 5.416 1.00 2.32 H new ATOM 0 HG22 ILE A 399 -2.140 -3.169 4.951 1.00 2.32 H new ATOM 0 HG23 ILE A 399 -0.963 -3.656 3.708 1.00 2.32 H new ATOM 0 HD11 ILE A 399 2.709 -1.590 5.148 1.00 1.24 H new ATOM 0 HD12 ILE A 399 1.380 -0.940 6.138 1.00 1.24 H new ATOM 0 HD13 ILE A 399 1.480 -2.688 5.818 1.00 1.24 H new ATOM 211 N LEU A 400 -3.721 -1.568 2.542 1.00 15.40 N ATOM 212 CA LEU A 400 -5.160 -1.774 2.604 1.00 74.15 C ATOM 213 C LEU A 400 -5.448 -3.188 3.111 1.00 71.12 C ATOM 214 O LEU A 400 -5.008 -4.167 2.511 1.00 12.23 O ATOM 215 CB LEU A 400 -5.802 -1.463 1.250 1.00 50.53 C ATOM 216 CG LEU A 400 -6.356 -0.046 1.079 1.00 25.13 C ATOM 217 CD1 LEU A 400 -6.158 0.451 -0.354 1.00 11.45 C ATOM 218 CD2 LEU A 400 -7.821 0.025 1.514 1.00 44.21 C ATOM 0 H LEU A 400 -3.300 -1.768 1.635 1.00 15.40 H new ATOM 0 HA LEU A 400 -5.614 -1.083 3.314 1.00 74.15 H new ATOM 0 HB2 LEU A 400 -5.061 -1.638 0.470 1.00 50.53 H new ATOM 0 HB3 LEU A 400 -6.614 -2.171 1.084 1.00 50.53 H new ATOM 0 HG LEU A 400 -5.794 0.622 1.731 1.00 25.13 H new ATOM 0 HD11 LEU A 400 -6.560 1.460 -0.448 1.00 11.45 H new ATOM 0 HD12 LEU A 400 -5.094 0.461 -0.592 1.00 11.45 H new ATOM 0 HD13 LEU A 400 -6.678 -0.213 -1.045 1.00 11.45 H new ATOM 0 HD21 LEU A 400 -8.191 1.042 1.383 1.00 44.21 H new ATOM 0 HD22 LEU A 400 -8.414 -0.658 0.906 1.00 44.21 H new ATOM 0 HD23 LEU A 400 -7.903 -0.258 2.563 1.00 44.21 H new ATOM 229 N HIS A 401 -6.183 -3.249 4.210 1.00 45.24 N ATOM 230 CA HIS A 401 -6.534 -4.527 4.806 1.00 40.52 C ATOM 231 C HIS A 401 -7.853 -4.392 5.571 1.00 52.03 C ATOM 232 O HIS A 401 -8.508 -3.352 5.507 1.00 60.51 O ATOM 233 CB HIS A 401 -5.393 -5.052 5.680 1.00 45.02 C ATOM 234 CG HIS A 401 -5.232 -4.312 6.987 1.00 64.31 C ATOM 235 ND1 HIS A 401 -5.834 -4.727 8.162 1.00 61.14 N ATOM 236 CD2 HIS A 401 -4.530 -3.183 7.292 1.00 25.24 C ATOM 237 CE1 HIS A 401 -5.502 -3.878 9.124 1.00 44.21 C ATOM 238 NE2 HIS A 401 -4.694 -2.921 8.582 1.00 13.34 N ATOM 0 H HIS A 401 -6.546 -2.434 4.704 1.00 45.24 H new ATOM 0 HA HIS A 401 -6.683 -5.269 4.021 1.00 40.52 H new ATOM 0 HB2 HIS A 401 -5.566 -6.107 5.890 1.00 45.02 H new ATOM 0 HB3 HIS A 401 -4.460 -4.987 5.120 1.00 45.02 H new ATOM 0 HD2 HIS A 401 -3.940 -2.601 6.600 1.00 25.24 H new ATOM 0 HE1 HIS A 401 -5.816 -3.934 10.156 1.00 44.21 H new ATOM 0 HE2 HIS A 401 -4.284 -2.134 9.086 1.00 13.34 H new ATOM 246 N ALA A 402 -8.204 -5.457 6.276 1.00 64.22 N ATOM 247 CA ALA A 402 -9.431 -5.471 7.052 1.00 63.12 C ATOM 248 C ALA A 402 -9.167 -4.853 8.427 1.00 1.25 C ATOM 249 O ALA A 402 -8.195 -4.122 8.607 1.00 22.41 O ATOM 250 CB ALA A 402 -9.960 -6.904 7.148 1.00 61.02 C ATOM 0 H ALA A 402 -7.659 -6.318 6.326 1.00 64.22 H new ATOM 0 HA ALA A 402 -10.200 -4.873 6.564 1.00 63.12 H new ATOM 0 HB1 ALA A 402 -10.881 -6.914 7.731 1.00 61.02 H new ATOM 0 HB2 ALA A 402 -10.160 -7.286 6.147 1.00 61.02 H new ATOM 0 HB3 ALA A 402 -9.216 -7.535 7.635 1.00 61.02 H new ATOM 256 N ARG A 403 -10.052 -5.170 9.362 1.00 12.13 N ATOM 257 CA ARG A 403 -9.926 -4.656 10.715 1.00 61.10 C ATOM 258 C ARG A 403 -9.292 -5.708 11.627 1.00 31.21 C ATOM 259 O ARG A 403 -8.848 -5.392 12.728 1.00 5.23 O ATOM 260 CB ARG A 403 -11.291 -4.258 11.281 1.00 22.21 C ATOM 261 CG ARG A 403 -11.153 -3.684 12.693 1.00 21.43 C ATOM 262 CD ARG A 403 -11.753 -4.634 13.732 1.00 61.14 C ATOM 263 NE ARG A 403 -13.225 -4.674 13.590 1.00 63.14 N ATOM 264 CZ ARG A 403 -14.067 -3.806 14.191 1.00 22.24 C ATOM 265 NH1 ARG A 403 -13.588 -2.823 14.981 1.00 73.23 N ATOM 266 NH2 ARG A 403 -15.366 -3.936 13.995 1.00 1.21 N ATOM 0 H ARG A 403 -10.858 -5.776 9.209 1.00 12.13 H new ATOM 0 HA ARG A 403 -9.288 -3.773 10.676 1.00 61.10 H new ATOM 0 HB2 ARG A 403 -11.758 -3.520 10.629 1.00 22.21 H new ATOM 0 HB3 ARG A 403 -11.948 -5.127 11.301 1.00 22.21 H new ATOM 0 HG2 ARG A 403 -10.101 -3.511 12.918 1.00 21.43 H new ATOM 0 HG3 ARG A 403 -11.653 -2.717 12.747 1.00 21.43 H new ATOM 0 HD2 ARG A 403 -11.340 -5.634 13.604 1.00 61.14 H new ATOM 0 HD3 ARG A 403 -11.485 -4.305 14.736 1.00 61.14 H new ATOM 0 HE ARG A 403 -13.629 -5.403 13.002 1.00 63.14 H new ATOM 0 HH11 ARG A 403 -12.583 -2.731 15.128 1.00 73.23 H new ATOM 0 HH12 ARG A 403 -14.231 -2.172 15.431 1.00 73.23 H new ATOM 0 HH21 ARG A 403 -15.719 -4.683 13.397 1.00 1.21 H new ATOM 0 HH22 ARG A 403 -16.016 -3.289 14.441 1.00 1.21 H new ATOM 276 N ALA A 404 -9.269 -6.938 11.132 1.00 74.13 N ATOM 277 CA ALA A 404 -8.696 -8.038 11.887 1.00 55.12 C ATOM 278 C ALA A 404 -7.362 -8.443 11.259 1.00 34.24 C ATOM 279 O ALA A 404 -6.853 -9.531 11.521 1.00 35.22 O ATOM 280 CB ALA A 404 -9.694 -9.196 11.937 1.00 24.43 C ATOM 0 H ALA A 404 -9.638 -7.196 10.217 1.00 74.13 H new ATOM 0 HA ALA A 404 -8.496 -7.735 12.915 1.00 55.12 H new ATOM 0 HB1 ALA A 404 -9.265 -10.022 12.504 1.00 24.43 H new ATOM 0 HB2 ALA A 404 -10.613 -8.864 12.420 1.00 24.43 H new ATOM 0 HB3 ALA A 404 -9.917 -9.528 10.923 1.00 24.43 H new ATOM 286 N ASP A 405 -6.834 -7.545 10.439 1.00 12.32 N ATOM 287 CA ASP A 405 -5.569 -7.796 9.770 1.00 74.11 C ATOM 288 C ASP A 405 -4.595 -6.661 10.088 1.00 43.04 C ATOM 289 O ASP A 405 -3.701 -6.365 9.296 1.00 60.11 O ATOM 290 CB ASP A 405 -5.750 -7.852 8.251 1.00 1.41 C ATOM 291 CG ASP A 405 -5.655 -9.251 7.640 1.00 21.03 C ATOM 292 OD1 ASP A 405 -5.075 -9.439 6.560 1.00 61.25 O ATOM 293 OD2 ASP A 405 -6.217 -10.186 8.328 1.00 1.32 O ATOM 0 H ASP A 405 -7.259 -6.643 10.223 1.00 12.32 H new ATOM 0 HA ASP A 405 -5.185 -8.753 10.123 1.00 74.11 H new ATOM 0 HB2 ASP A 405 -6.722 -7.428 8.000 1.00 1.41 H new ATOM 0 HB3 ASP A 405 -4.996 -7.217 7.787 1.00 1.41 H new ATOM 298 N GLU A 406 -4.801 -6.054 11.248 1.00 10.24 N ATOM 299 CA GLU A 406 -3.953 -4.958 11.680 1.00 62.13 C ATOM 300 C GLU A 406 -2.520 -5.448 11.899 1.00 52.12 C ATOM 301 O GLU A 406 -1.629 -5.147 11.106 1.00 41.13 O ATOM 302 CB GLU A 406 -4.506 -4.302 12.947 1.00 2.13 C ATOM 303 CG GLU A 406 -3.563 -3.212 13.459 1.00 3.20 C ATOM 304 CD GLU A 406 -3.987 -2.726 14.846 1.00 72.21 C ATOM 305 OE1 GLU A 406 -4.270 -1.532 15.025 1.00 14.03 O ATOM 306 OE2 GLU A 406 -4.018 -3.638 15.758 1.00 33.31 O ATOM 0 H GLU A 406 -5.544 -6.302 11.902 1.00 10.24 H new ATOM 0 HA GLU A 406 -3.942 -4.203 10.894 1.00 62.13 H new ATOM 0 HB2 GLU A 406 -5.486 -3.872 12.740 1.00 2.13 H new ATOM 0 HB3 GLU A 406 -4.647 -5.058 13.720 1.00 2.13 H new ATOM 0 HG2 GLU A 406 -2.544 -3.598 13.501 1.00 3.20 H new ATOM 0 HG3 GLU A 406 -3.558 -2.374 12.762 1.00 3.20 H new ATOM 312 N HIS A 407 -2.343 -6.196 12.978 1.00 14.05 N ATOM 313 CA HIS A 407 -1.035 -6.732 13.311 1.00 63.42 C ATOM 314 C HIS A 407 -0.346 -7.232 12.039 1.00 63.25 C ATOM 315 O HIS A 407 0.869 -7.107 11.897 1.00 33.20 O ATOM 316 CB HIS A 407 -1.147 -7.813 14.388 1.00 34.41 C ATOM 317 CG HIS A 407 -1.804 -9.087 13.914 1.00 75.02 C ATOM 318 ND1 HIS A 407 -3.130 -9.145 13.520 1.00 5.53 N ATOM 319 CD2 HIS A 407 -1.305 -10.347 13.770 1.00 5.05 C ATOM 320 CE1 HIS A 407 -3.406 -10.390 13.161 1.00 33.52 C ATOM 321 NE2 HIS A 407 -2.273 -11.134 13.317 1.00 71.34 N ATOM 0 H HIS A 407 -3.085 -6.443 13.633 1.00 14.05 H new ATOM 0 HA HIS A 407 -0.413 -5.943 13.734 1.00 63.42 H new ATOM 0 HB2 HIS A 407 -0.149 -8.047 14.758 1.00 34.41 H new ATOM 0 HB3 HIS A 407 -1.714 -7.415 15.230 1.00 34.41 H new ATOM 0 HD2 HIS A 407 -0.293 -10.653 13.988 1.00 5.05 H new ATOM 0 HE1 HIS A 407 -4.360 -10.752 12.807 1.00 33.52 H new ATOM 0 HE2 HIS A 407 -2.185 -12.131 13.118 1.00 71.34 H new ATOM 328 N ILE A 408 -1.153 -7.788 11.148 1.00 3.55 N ATOM 329 CA ILE A 408 -0.637 -8.308 9.893 1.00 15.41 C ATOM 330 C ILE A 408 0.052 -7.179 9.122 1.00 52.42 C ATOM 331 O ILE A 408 1.183 -7.334 8.665 1.00 22.22 O ATOM 332 CB ILE A 408 -1.748 -9.001 9.103 1.00 12.30 C ATOM 333 CG1 ILE A 408 -2.412 -10.098 9.938 1.00 3.52 C ATOM 334 CG2 ILE A 408 -1.222 -9.535 7.769 1.00 11.11 C ATOM 335 CD1 ILE A 408 -3.546 -10.770 9.160 1.00 32.22 C ATOM 0 H ILE A 408 -2.161 -7.890 11.270 1.00 3.55 H new ATOM 0 HA ILE A 408 0.116 -9.074 10.080 1.00 15.41 H new ATOM 0 HB ILE A 408 -2.516 -8.262 8.873 1.00 12.30 H new ATOM 0 HG12 ILE A 408 -1.669 -10.844 10.222 1.00 3.52 H new ATOM 0 HG13 ILE A 408 -2.803 -9.671 10.861 1.00 3.52 H new ATOM 0 HG21 ILE A 408 -2.032 -10.023 7.227 1.00 11.11 H new ATOM 0 HG22 ILE A 408 -0.834 -8.708 7.174 1.00 11.11 H new ATOM 0 HG23 ILE A 408 -0.424 -10.255 7.954 1.00 11.11 H new ATOM 0 HD11 ILE A 408 -4.001 -11.545 9.777 1.00 32.22 H new ATOM 0 HD12 ILE A 408 -4.299 -10.026 8.899 1.00 32.22 H new ATOM 0 HD13 ILE A 408 -3.147 -11.218 8.250 1.00 32.22 H new ATOM 346 N ALA A 409 -0.660 -6.067 9.004 1.00 34.20 N ATOM 347 CA ALA A 409 -0.131 -4.913 8.297 1.00 32.10 C ATOM 348 C ALA A 409 0.998 -4.288 9.121 1.00 30.10 C ATOM 349 O ALA A 409 2.121 -4.158 8.642 1.00 73.44 O ATOM 350 CB ALA A 409 -1.263 -3.923 8.015 1.00 2.14 C ATOM 0 H ALA A 409 -1.597 -5.941 9.386 1.00 34.20 H new ATOM 0 HA ALA A 409 0.288 -5.211 7.336 1.00 32.10 H new ATOM 0 HB1 ALA A 409 -0.866 -3.058 7.485 1.00 2.14 H new ATOM 0 HB2 ALA A 409 -2.024 -4.406 7.402 1.00 2.14 H new ATOM 0 HB3 ALA A 409 -1.706 -3.599 8.957 1.00 2.14 H new ATOM 356 N LEU A 410 0.657 -3.920 10.346 1.00 4.44 N ATOM 357 CA LEU A 410 1.627 -3.313 11.242 1.00 24.11 C ATOM 358 C LEU A 410 2.868 -4.203 11.321 1.00 21.41 C ATOM 359 O LEU A 410 3.949 -3.736 11.681 1.00 21.12 O ATOM 360 CB LEU A 410 0.991 -3.023 12.604 1.00 52.12 C ATOM 361 CG LEU A 410 0.072 -1.801 12.669 1.00 72.41 C ATOM 362 CD1 LEU A 410 -1.166 -1.999 11.793 1.00 2.31 C ATOM 363 CD2 LEU A 410 -0.295 -1.466 14.116 1.00 22.45 C ATOM 0 H LEU A 410 -0.277 -4.030 10.740 1.00 4.44 H new ATOM 0 HA LEU A 410 1.951 -2.347 10.855 1.00 24.11 H new ATOM 0 HB2 LEU A 410 0.419 -3.899 12.910 1.00 52.12 H new ATOM 0 HB3 LEU A 410 1.789 -2.892 13.335 1.00 52.12 H new ATOM 0 HG LEU A 410 0.614 -0.944 12.269 1.00 72.41 H new ATOM 0 HD11 LEU A 410 -1.802 -1.116 11.857 1.00 2.31 H new ATOM 0 HD12 LEU A 410 -0.859 -2.150 10.758 1.00 2.31 H new ATOM 0 HD13 LEU A 410 -1.720 -2.872 12.138 1.00 2.31 H new ATOM 0 HD21 LEU A 410 -0.949 -0.594 14.133 1.00 22.45 H new ATOM 0 HD22 LEU A 410 -0.810 -2.314 14.566 1.00 22.45 H new ATOM 0 HD23 LEU A 410 0.612 -1.251 14.681 1.00 22.45 H new ATOM 374 N ARG A 411 2.674 -5.467 10.978 1.00 2.04 N ATOM 375 CA ARG A 411 3.765 -6.427 11.005 1.00 10.12 C ATOM 376 C ARG A 411 4.642 -6.267 9.762 1.00 22.52 C ATOM 377 O ARG A 411 5.849 -6.502 9.815 1.00 11.51 O ATOM 378 CB ARG A 411 3.236 -7.861 11.069 1.00 74.22 C ATOM 379 CG ARG A 411 4.341 -8.867 10.744 1.00 24.32 C ATOM 380 CD ARG A 411 3.915 -10.289 11.117 1.00 1.11 C ATOM 381 NE ARG A 411 4.457 -11.254 10.135 1.00 31.25 N ATOM 382 CZ ARG A 411 5.669 -11.843 10.242 1.00 34.00 C ATOM 383 NH1 ARG A 411 6.473 -11.569 11.290 1.00 5.32 N ATOM 384 NH2 ARG A 411 6.052 -12.691 9.304 1.00 3.50 N ATOM 0 H ARG A 411 1.777 -5.850 10.679 1.00 2.04 H new ATOM 0 HA ARG A 411 4.357 -6.232 11.899 1.00 10.12 H new ATOM 0 HB2 ARG A 411 2.838 -8.062 12.064 1.00 74.22 H new ATOM 0 HB3 ARG A 411 2.412 -7.980 10.366 1.00 74.22 H new ATOM 0 HG2 ARG A 411 4.578 -8.822 9.681 1.00 24.32 H new ATOM 0 HG3 ARG A 411 5.250 -8.602 11.285 1.00 24.32 H new ATOM 0 HD2 ARG A 411 4.274 -10.535 12.117 1.00 1.11 H new ATOM 0 HD3 ARG A 411 2.827 -10.356 11.143 1.00 1.11 H new ATOM 0 HE ARG A 411 3.880 -11.489 9.327 1.00 31.25 H new ATOM 0 HH11 ARG A 411 6.168 -10.913 12.009 1.00 5.32 H new ATOM 0 HH12 ARG A 411 7.386 -12.018 11.363 1.00 5.32 H new ATOM 0 HH21 ARG A 411 5.437 -12.892 8.516 1.00 3.50 H new ATOM 0 HH22 ARG A 411 6.963 -13.145 9.368 1.00 3.50 H new ATOM 394 N VAL A 412 4.001 -5.872 8.672 1.00 74.45 N ATOM 395 CA VAL A 412 4.709 -5.679 7.417 1.00 51.31 C ATOM 396 C VAL A 412 5.430 -4.329 7.445 1.00 30.24 C ATOM 397 O VAL A 412 6.610 -4.246 7.108 1.00 24.20 O ATOM 398 CB VAL A 412 3.738 -5.814 6.243 1.00 53.33 C ATOM 399 CG1 VAL A 412 4.258 -5.067 5.013 1.00 12.25 C ATOM 400 CG2 VAL A 412 3.469 -7.284 5.919 1.00 43.12 C ATOM 0 H VAL A 412 3.000 -5.680 8.631 1.00 74.45 H new ATOM 0 HA VAL A 412 5.468 -6.450 7.284 1.00 51.31 H new ATOM 0 HB VAL A 412 2.792 -5.358 6.537 1.00 53.33 H new ATOM 0 HG11 VAL A 412 3.549 -5.179 4.193 1.00 12.25 H new ATOM 0 HG12 VAL A 412 4.373 -4.010 5.251 1.00 12.25 H new ATOM 0 HG13 VAL A 412 5.223 -5.480 4.718 1.00 12.25 H new ATOM 0 HG21 VAL A 412 2.776 -7.351 5.081 1.00 43.12 H new ATOM 0 HG22 VAL A 412 4.405 -7.776 5.656 1.00 43.12 H new ATOM 0 HG23 VAL A 412 3.034 -7.775 6.790 1.00 43.12 H new ATOM 410 N ARG A 413 4.691 -3.308 7.849 1.00 33.01 N ATOM 411 CA ARG A 413 5.244 -1.966 7.925 1.00 60.34 C ATOM 412 C ARG A 413 6.693 -2.018 8.417 1.00 72.04 C ATOM 413 O ARG A 413 7.578 -1.412 7.813 1.00 42.53 O ATOM 414 CB ARG A 413 4.424 -1.084 8.867 1.00 62.21 C ATOM 415 CG ARG A 413 2.934 -1.156 8.527 1.00 55.31 C ATOM 416 CD ARG A 413 2.188 0.063 9.074 1.00 51.34 C ATOM 417 NE ARG A 413 2.766 0.470 10.374 1.00 34.44 N ATOM 418 CZ ARG A 413 2.070 1.086 11.352 1.00 43.15 C ATOM 419 NH1 ARG A 413 0.762 1.374 11.185 1.00 12.23 N ATOM 420 NH2 ARG A 413 2.687 1.403 12.475 1.00 51.12 N ATOM 0 H ARG A 413 3.713 -3.382 8.128 1.00 33.01 H new ATOM 0 HA ARG A 413 5.211 -1.536 6.924 1.00 60.34 H new ATOM 0 HB2 ARG A 413 4.581 -1.402 9.898 1.00 62.21 H new ATOM 0 HB3 ARG A 413 4.767 -0.052 8.796 1.00 62.21 H new ATOM 0 HG2 ARG A 413 2.806 -1.210 7.446 1.00 55.31 H new ATOM 0 HG3 ARG A 413 2.505 -2.067 8.945 1.00 55.31 H new ATOM 0 HD2 ARG A 413 2.253 0.888 8.364 1.00 51.34 H new ATOM 0 HD3 ARG A 413 1.130 -0.172 9.195 1.00 51.34 H new ATOM 0 HE ARG A 413 3.753 0.272 10.541 1.00 34.44 H new ATOM 0 HH11 ARG A 413 0.292 1.126 10.314 1.00 12.23 H new ATOM 0 HH12 ARG A 413 0.243 1.840 11.930 1.00 12.23 H new ATOM 0 HH21 ARG A 413 3.676 1.182 12.594 1.00 51.12 H new ATOM 0 HH22 ARG A 413 2.175 1.869 13.224 1.00 51.12 H new ATOM 430 N GLU A 414 6.888 -2.745 9.506 1.00 25.42 N ATOM 431 CA GLU A 414 8.214 -2.883 10.085 1.00 34.23 C ATOM 432 C GLU A 414 9.079 -3.801 9.219 1.00 4.31 C ATOM 433 O GLU A 414 10.187 -3.433 8.831 1.00 0.13 O ATOM 434 CB GLU A 414 8.133 -3.403 11.521 1.00 65.15 C ATOM 435 CG GLU A 414 7.174 -2.554 12.359 1.00 54.40 C ATOM 436 CD GLU A 414 7.429 -1.061 12.139 1.00 3.41 C ATOM 437 OE1 GLU A 414 8.326 -0.485 12.772 1.00 33.33 O ATOM 438 OE2 GLU A 414 6.656 -0.498 11.273 1.00 54.45 O ATOM 0 H GLU A 414 6.151 -3.245 10.003 1.00 25.42 H new ATOM 0 HA GLU A 414 8.680 -1.898 10.115 1.00 34.23 H new ATOM 0 HB2 GLU A 414 7.798 -4.440 11.518 1.00 65.15 H new ATOM 0 HB3 GLU A 414 9.125 -3.390 11.973 1.00 65.15 H new ATOM 0 HG2 GLU A 414 6.144 -2.794 12.094 1.00 54.40 H new ATOM 0 HG3 GLU A 414 7.296 -2.796 13.415 1.00 54.40 H new ATOM 444 N LYS A 415 8.541 -4.980 8.941 1.00 34.10 N ATOM 445 CA LYS A 415 9.250 -5.953 8.128 1.00 73.01 C ATOM 446 C LYS A 415 9.774 -5.269 6.863 1.00 11.34 C ATOM 447 O LYS A 415 10.737 -5.736 6.255 1.00 50.24 O ATOM 448 CB LYS A 415 8.361 -7.166 7.848 1.00 2.42 C ATOM 449 CG LYS A 415 8.917 -8.422 8.525 1.00 42.23 C ATOM 450 CD LYS A 415 10.298 -8.776 7.971 1.00 45.45 C ATOM 451 CE LYS A 415 10.182 -9.688 6.750 1.00 73.33 C ATOM 452 NZ LYS A 415 9.610 -10.998 7.131 1.00 5.21 N ATOM 0 H LYS A 415 7.622 -5.283 9.265 1.00 34.10 H new ATOM 0 HA LYS A 415 10.117 -6.339 8.664 1.00 73.01 H new ATOM 0 HB2 LYS A 415 7.351 -6.972 8.208 1.00 2.42 H new ATOM 0 HB3 LYS A 415 8.290 -7.329 6.773 1.00 2.42 H new ATOM 0 HG2 LYS A 415 8.983 -8.261 9.601 1.00 42.23 H new ATOM 0 HG3 LYS A 415 8.234 -9.257 8.369 1.00 42.23 H new ATOM 0 HD2 LYS A 415 10.829 -7.864 7.699 1.00 45.45 H new ATOM 0 HD3 LYS A 415 10.888 -9.270 8.743 1.00 45.45 H new ATOM 0 HE2 LYS A 415 9.553 -9.216 5.995 1.00 73.33 H new ATOM 0 HE3 LYS A 415 11.165 -9.831 6.301 1.00 73.33 H new ATOM 0 HZ1 LYS A 415 9.167 -11.438 6.300 1.00 5.21 H new ATOM 0 HZ2 LYS A 415 10.366 -11.616 7.488 1.00 5.21 H new ATOM 0 HZ3 LYS A 415 8.895 -10.862 7.873 1.00 5.21 H new ATOM 461 N LEU A 416 9.117 -4.177 6.503 1.00 45.43 N ATOM 462 CA LEU A 416 9.504 -3.425 5.323 1.00 33.12 C ATOM 463 C LEU A 416 10.721 -2.558 5.652 1.00 32.24 C ATOM 464 O LEU A 416 11.627 -2.417 4.834 1.00 32.43 O ATOM 465 CB LEU A 416 8.314 -2.634 4.777 1.00 62.32 C ATOM 466 CG LEU A 416 7.160 -3.463 4.210 1.00 33.23 C ATOM 467 CD1 LEU A 416 5.883 -2.627 4.106 1.00 12.12 C ATOM 468 CD2 LEU A 416 7.543 -4.091 2.868 1.00 73.54 C ATOM 0 H LEU A 416 8.318 -3.795 7.009 1.00 45.43 H new ATOM 0 HA LEU A 416 9.802 -4.101 4.521 1.00 33.12 H new ATOM 0 HB2 LEU A 416 7.924 -2.005 5.577 1.00 62.32 H new ATOM 0 HB3 LEU A 416 8.675 -1.967 3.994 1.00 62.32 H new ATOM 0 HG LEU A 416 6.955 -4.280 4.902 1.00 33.23 H new ATOM 0 HD11 LEU A 416 5.079 -3.240 3.700 1.00 12.12 H new ATOM 0 HD12 LEU A 416 5.601 -2.268 5.096 1.00 12.12 H new ATOM 0 HD13 LEU A 416 6.058 -1.776 3.448 1.00 12.12 H new ATOM 0 HD21 LEU A 416 6.705 -4.675 2.487 1.00 73.54 H new ATOM 0 HD22 LEU A 416 7.791 -3.304 2.156 1.00 73.54 H new ATOM 0 HD23 LEU A 416 8.407 -4.742 3.004 1.00 73.54 H new ATOM 479 N GLU A 417 10.700 -1.997 6.852 1.00 22.41 N ATOM 480 CA GLU A 417 11.791 -1.148 7.299 1.00 1.43 C ATOM 481 C GLU A 417 13.075 -1.966 7.449 1.00 13.33 C ATOM 482 O GLU A 417 14.151 -1.407 7.653 1.00 72.54 O ATOM 483 CB GLU A 417 11.434 -0.443 8.610 1.00 72.41 C ATOM 484 CG GLU A 417 10.076 0.253 8.507 1.00 12.54 C ATOM 485 CD GLU A 417 10.128 1.654 9.118 1.00 63.31 C ATOM 486 OE1 GLU A 417 9.222 2.036 9.872 1.00 51.21 O ATOM 487 OE2 GLU A 417 11.159 2.355 8.786 1.00 12.20 O ATOM 0 H GLU A 417 9.945 -2.114 7.528 1.00 22.41 H new ATOM 0 HA GLU A 417 11.960 -0.380 6.544 1.00 1.43 H new ATOM 0 HB2 GLU A 417 11.414 -1.169 9.423 1.00 72.41 H new ATOM 0 HB3 GLU A 417 12.204 0.289 8.855 1.00 72.41 H new ATOM 0 HG2 GLU A 417 9.776 0.320 7.461 1.00 12.54 H new ATOM 0 HG3 GLU A 417 9.319 -0.342 9.018 1.00 12.54 H new ATOM 493 N ALA A 418 12.919 -3.276 7.343 1.00 24.24 N ATOM 494 CA ALA A 418 14.053 -4.177 7.464 1.00 4.34 C ATOM 495 C ALA A 418 14.704 -4.357 6.092 1.00 20.41 C ATOM 496 O ALA A 418 15.760 -4.980 5.977 1.00 3.45 O ATOM 497 CB ALA A 418 13.588 -5.505 8.066 1.00 3.33 C ATOM 0 H ALA A 418 12.025 -3.736 7.175 1.00 24.24 H new ATOM 0 HA ALA A 418 14.805 -3.760 8.134 1.00 4.34 H new ATOM 0 HB1 ALA A 418 14.438 -6.181 8.157 1.00 3.33 H new ATOM 0 HB2 ALA A 418 13.159 -5.327 9.052 1.00 3.33 H new ATOM 0 HB3 ALA A 418 12.835 -5.954 7.418 1.00 3.33 H new ATOM 503 N LEU A 419 14.051 -3.799 5.084 1.00 53.02 N ATOM 504 CA LEU A 419 14.554 -3.889 3.723 1.00 64.14 C ATOM 505 C LEU A 419 14.823 -2.480 3.190 1.00 64.32 C ATOM 506 O LEU A 419 15.864 -2.230 2.585 1.00 74.22 O ATOM 507 CB LEU A 419 13.598 -4.704 2.851 1.00 63.04 C ATOM 508 CG LEU A 419 13.034 -5.978 3.485 1.00 71.15 C ATOM 509 CD1 LEU A 419 11.688 -6.350 2.861 1.00 0.43 C ATOM 510 CD2 LEU A 419 14.042 -7.126 3.400 1.00 40.14 C ATOM 0 H LEU A 419 13.177 -3.282 5.182 1.00 53.02 H new ATOM 0 HA LEU A 419 15.503 -4.425 3.702 1.00 64.14 H new ATOM 0 HB2 LEU A 419 12.763 -4.064 2.565 1.00 63.04 H new ATOM 0 HB3 LEU A 419 14.119 -4.978 1.933 1.00 63.04 H new ATOM 0 HG LEU A 419 12.857 -5.784 4.543 1.00 71.15 H new ATOM 0 HD11 LEU A 419 11.309 -7.259 3.329 1.00 0.43 H new ATOM 0 HD12 LEU A 419 10.978 -5.538 3.017 1.00 0.43 H new ATOM 0 HD13 LEU A 419 11.817 -6.519 1.792 1.00 0.43 H new ATOM 0 HD21 LEU A 419 13.616 -8.019 3.858 1.00 40.14 H new ATOM 0 HD22 LEU A 419 14.274 -7.330 2.355 1.00 40.14 H new ATOM 0 HD23 LEU A 419 14.955 -6.848 3.927 1.00 40.14 H new ATOM 521 N GLY A 420 13.867 -1.596 3.435 1.00 54.41 N ATOM 522 CA GLY A 420 13.988 -0.220 2.986 1.00 53.42 C ATOM 523 C GLY A 420 12.750 0.594 3.371 1.00 2.52 C ATOM 524 O GLY A 420 12.775 1.347 4.342 1.00 5.32 O ATOM 0 H GLY A 420 13.005 -1.806 3.939 1.00 54.41 H new ATOM 0 HA2 GLY A 420 14.877 0.233 3.426 1.00 53.42 H new ATOM 0 HA3 GLY A 420 14.121 -0.197 1.904 1.00 53.42 H new ATOM 528 N VAL A 421 11.695 0.411 2.589 1.00 54.43 N ATOM 529 CA VAL A 421 10.449 1.119 2.836 1.00 35.41 C ATOM 530 C VAL A 421 10.192 1.176 4.343 1.00 53.34 C ATOM 531 O VAL A 421 10.400 0.192 5.050 1.00 10.31 O ATOM 532 CB VAL A 421 9.310 0.457 2.060 1.00 14.13 C ATOM 533 CG1 VAL A 421 9.516 -1.055 1.965 1.00 31.04 C ATOM 534 CG2 VAL A 421 7.955 0.788 2.687 1.00 45.21 C ATOM 0 H VAL A 421 11.677 -0.216 1.785 1.00 54.43 H new ATOM 0 HA VAL A 421 10.514 2.146 2.478 1.00 35.41 H new ATOM 0 HB VAL A 421 9.318 0.859 1.047 1.00 14.13 H new ATOM 0 HG11 VAL A 421 8.691 -1.500 1.408 1.00 31.04 H new ATOM 0 HG12 VAL A 421 10.455 -1.263 1.451 1.00 31.04 H new ATOM 0 HG13 VAL A 421 9.549 -1.481 2.968 1.00 31.04 H new ATOM 0 HG21 VAL A 421 7.162 0.305 2.116 1.00 45.21 H new ATOM 0 HG22 VAL A 421 7.932 0.428 3.716 1.00 45.21 H new ATOM 0 HG23 VAL A 421 7.803 1.867 2.677 1.00 45.21 H new ATOM 544 N PRO A 422 9.730 2.371 4.801 1.00 61.11 N ATOM 545 CA PRO A 422 9.442 2.571 6.212 1.00 12.41 C ATOM 546 C PRO A 422 8.138 1.874 6.608 1.00 54.42 C ATOM 547 O PRO A 422 7.646 1.009 5.884 1.00 70.34 O ATOM 548 CB PRO A 422 9.390 4.078 6.393 1.00 1.40 C ATOM 549 CG PRO A 422 9.188 4.659 5.003 1.00 23.11 C ATOM 550 CD PRO A 422 9.472 3.559 3.992 1.00 42.31 C ATOM 0 HA PRO A 422 10.198 2.132 6.863 1.00 12.41 H new ATOM 0 HB2 PRO A 422 8.575 4.363 7.058 1.00 1.40 H new ATOM 0 HB3 PRO A 422 10.312 4.449 6.841 1.00 1.40 H new ATOM 0 HG2 PRO A 422 8.169 5.029 4.888 1.00 23.11 H new ATOM 0 HG3 PRO A 422 9.855 5.506 4.843 1.00 23.11 H new ATOM 0 HD2 PRO A 422 8.625 3.407 3.324 1.00 42.31 H new ATOM 0 HD3 PRO A 422 10.330 3.807 3.367 1.00 42.31 H new ATOM 555 N ASP A 423 7.613 2.279 7.754 1.00 44.54 N ATOM 556 CA ASP A 423 6.375 1.706 8.255 1.00 64.52 C ATOM 557 C ASP A 423 5.245 2.002 7.268 1.00 31.23 C ATOM 558 O ASP A 423 4.426 1.132 6.977 1.00 25.40 O ATOM 559 CB ASP A 423 5.994 2.315 9.608 1.00 51.01 C ATOM 560 CG ASP A 423 6.066 3.842 9.673 1.00 73.22 C ATOM 561 OD1 ASP A 423 6.727 4.486 8.844 1.00 35.23 O ATOM 562 OD2 ASP A 423 5.399 4.379 10.638 1.00 13.12 O ATOM 0 H ASP A 423 8.022 2.998 8.351 1.00 44.54 H new ATOM 0 HA ASP A 423 6.523 0.632 8.371 1.00 64.52 H new ATOM 0 HB2 ASP A 423 4.980 2.003 9.857 1.00 51.01 H new ATOM 0 HB3 ASP A 423 6.651 1.902 10.373 1.00 51.01 H new ATOM 567 N GLY A 424 5.235 3.234 6.780 1.00 60.32 N ATOM 568 CA GLY A 424 4.220 3.654 5.832 1.00 71.14 C ATOM 569 C GLY A 424 2.895 3.949 6.540 1.00 3.11 C ATOM 570 O GLY A 424 2.702 5.042 7.072 1.00 31.15 O ATOM 0 H GLY A 424 5.915 3.954 7.024 1.00 60.32 H new ATOM 0 HA2 GLY A 424 4.559 4.544 5.302 1.00 71.14 H new ATOM 0 HA3 GLY A 424 4.071 2.875 5.084 1.00 71.14 H new ATOM 574 N ALA A 425 2.020 2.955 6.525 1.00 52.13 N ATOM 575 CA ALA A 425 0.720 3.094 7.158 1.00 3.41 C ATOM 576 C ALA A 425 -0.216 2.001 6.639 1.00 53.52 C ATOM 577 O ALA A 425 0.212 1.108 5.909 1.00 72.22 O ATOM 578 CB ALA A 425 0.173 4.499 6.903 1.00 72.05 C ATOM 0 H ALA A 425 2.186 2.050 6.085 1.00 52.13 H new ATOM 0 HA ALA A 425 0.806 2.969 8.237 1.00 3.41 H new ATOM 0 HB1 ALA A 425 -0.802 4.602 7.379 1.00 72.05 H new ATOM 0 HB2 ALA A 425 0.859 5.237 7.319 1.00 72.05 H new ATOM 0 HB3 ALA A 425 0.072 4.661 5.830 1.00 72.05 H new ATOM 584 N THR A 426 -1.476 2.108 7.033 1.00 71.21 N ATOM 585 CA THR A 426 -2.476 1.140 6.616 1.00 2.31 C ATOM 586 C THR A 426 -3.862 1.786 6.584 1.00 20.12 C ATOM 587 O THR A 426 -4.370 2.228 7.614 1.00 62.45 O ATOM 588 CB THR A 426 -2.388 -0.065 7.554 1.00 13.33 C ATOM 589 OG1 THR A 426 -3.113 0.341 8.711 1.00 60.15 O ATOM 590 CG2 THR A 426 -0.967 -0.304 8.069 1.00 61.13 C ATOM 0 H THR A 426 -1.828 2.851 7.637 1.00 71.21 H new ATOM 0 HA THR A 426 -2.291 0.792 5.600 1.00 2.31 H new ATOM 0 HB THR A 426 -2.740 -0.956 7.034 1.00 13.33 H new ATOM 0 HG1 THR A 426 -3.376 1.281 8.619 1.00 60.15 H new ATOM 0 HG21 THR A 426 -0.961 -1.171 8.730 1.00 61.13 H new ATOM 0 HG22 THR A 426 -0.300 -0.486 7.226 1.00 61.13 H new ATOM 0 HG23 THR A 426 -0.627 0.574 8.618 1.00 61.13 H new ATOM 598 N PHE A 427 -4.437 1.818 5.391 1.00 2.52 N ATOM 599 CA PHE A 427 -5.756 2.402 5.211 1.00 25.32 C ATOM 600 C PHE A 427 -6.809 1.317 4.974 1.00 4.22 C ATOM 601 O PHE A 427 -7.030 0.898 3.839 1.00 24.13 O ATOM 602 CB PHE A 427 -5.681 3.303 3.976 1.00 0.43 C ATOM 603 CG PHE A 427 -7.043 3.807 3.492 1.00 33.32 C ATOM 604 CD1 PHE A 427 -8.092 3.869 4.356 1.00 40.45 C ATOM 605 CD2 PHE A 427 -7.204 4.193 2.198 1.00 44.05 C ATOM 606 CE1 PHE A 427 -9.355 4.339 3.907 1.00 34.34 C ATOM 607 CE2 PHE A 427 -8.466 4.662 1.748 1.00 10.34 C ATOM 608 CZ PHE A 427 -9.515 4.724 2.612 1.00 43.12 C ATOM 0 H PHE A 427 -4.014 1.449 4.539 1.00 2.52 H new ATOM 0 HA PHE A 427 -6.042 2.958 6.104 1.00 25.32 H new ATOM 0 HB2 PHE A 427 -5.047 4.160 4.202 1.00 0.43 H new ATOM 0 HB3 PHE A 427 -5.199 2.754 3.167 1.00 0.43 H new ATOM 0 HD1 PHE A 427 -7.964 3.561 5.383 1.00 40.45 H new ATOM 0 HD2 PHE A 427 -6.371 4.143 1.512 1.00 44.05 H new ATOM 0 HE1 PHE A 427 -10.188 4.391 4.593 1.00 34.34 H new ATOM 0 HE2 PHE A 427 -8.593 4.969 0.721 1.00 10.34 H new ATOM 0 HZ PHE A 427 -10.476 5.079 2.270 1.00 43.12 H new ATOM 617 N CYS A 428 -7.430 0.894 6.066 1.00 34.14 N ATOM 618 CA CYS A 428 -8.455 -0.135 5.991 1.00 51.13 C ATOM 619 C CYS A 428 -9.824 0.544 6.081 1.00 31.33 C ATOM 620 O CYS A 428 -9.915 1.720 6.425 1.00 50.20 O ATOM 621 CB CYS A 428 -8.270 -1.196 7.077 1.00 1.35 C ATOM 622 SG CYS A 428 -8.161 -0.398 8.720 1.00 74.23 S ATOM 0 H CYS A 428 -7.244 1.244 7.006 1.00 34.14 H new ATOM 0 HA CYS A 428 -8.376 -0.664 5.041 1.00 51.13 H new ATOM 0 HB2 CYS A 428 -9.105 -1.896 7.059 1.00 1.35 H new ATOM 0 HB3 CYS A 428 -7.366 -1.773 6.883 1.00 1.35 H new ATOM 0 HG CYS A 428 -8.006 -1.308 9.635 1.00 74.23 H new ATOM 627 N GLU A 429 -10.853 -0.230 5.767 1.00 44.12 N ATOM 628 CA GLU A 429 -12.212 0.282 5.809 1.00 72.43 C ATOM 629 C GLU A 429 -12.896 -0.132 7.114 1.00 35.43 C ATOM 630 O GLU A 429 -13.064 -1.321 7.380 1.00 42.51 O ATOM 631 CB GLU A 429 -13.014 -0.193 4.595 1.00 72.20 C ATOM 632 CG GLU A 429 -14.430 0.386 4.614 1.00 41.32 C ATOM 633 CD GLU A 429 -15.121 0.187 3.262 1.00 63.33 C ATOM 634 OE1 GLU A 429 -16.332 -0.072 3.217 1.00 2.22 O ATOM 635 OE2 GLU A 429 -14.353 0.313 2.234 1.00 20.41 O ATOM 0 H GLU A 429 -10.773 -1.206 5.483 1.00 44.12 H new ATOM 0 HA GLU A 429 -12.171 1.371 5.773 1.00 72.43 H new ATOM 0 HB2 GLU A 429 -12.506 0.108 3.679 1.00 72.20 H new ATOM 0 HB3 GLU A 429 -13.062 -1.282 4.590 1.00 72.20 H new ATOM 0 HG2 GLU A 429 -15.013 -0.095 5.399 1.00 41.32 H new ATOM 0 HG3 GLU A 429 -14.389 1.449 4.853 1.00 41.32 H new ATOM 641 N ASP A 430 -13.270 0.872 7.893 1.00 60.11 N ATOM 642 CA ASP A 430 -13.932 0.626 9.162 1.00 64.04 C ATOM 643 C ASP A 430 -15.331 1.246 9.133 1.00 30.42 C ATOM 644 O ASP A 430 -15.534 2.300 8.534 1.00 63.21 O ATOM 645 CB ASP A 430 -13.157 1.264 10.319 1.00 42.51 C ATOM 646 CG ASP A 430 -12.432 2.566 9.971 1.00 31.14 C ATOM 647 OD1 ASP A 430 -13.064 3.610 9.753 1.00 73.42 O ATOM 648 OD2 ASP A 430 -11.146 2.478 9.927 1.00 30.03 O ATOM 0 H ASP A 430 -13.127 1.857 7.670 1.00 60.11 H new ATOM 0 HA ASP A 430 -13.984 -0.452 9.312 1.00 64.04 H new ATOM 0 HB2 ASP A 430 -13.850 1.459 11.137 1.00 42.51 H new ATOM 0 HB3 ASP A 430 -12.425 0.545 10.686 1.00 42.51 H new ATOM 653 N PHE A 431 -16.259 0.562 9.787 1.00 13.30 N ATOM 654 CA PHE A 431 -17.633 1.032 9.841 1.00 5.44 C ATOM 655 C PHE A 431 -17.998 1.491 11.255 1.00 41.21 C ATOM 656 O PHE A 431 -19.137 1.882 11.509 1.00 50.05 O ATOM 657 CB PHE A 431 -18.525 -0.151 9.455 1.00 42.45 C ATOM 658 CG PHE A 431 -20.019 0.181 9.428 1.00 32.54 C ATOM 659 CD1 PHE A 431 -20.433 1.426 9.069 1.00 21.41 C ATOM 660 CD2 PHE A 431 -20.932 -0.769 9.759 1.00 22.10 C ATOM 661 CE1 PHE A 431 -21.819 1.734 9.042 1.00 32.04 C ATOM 662 CE2 PHE A 431 -22.318 -0.462 9.733 1.00 10.24 C ATOM 663 CZ PHE A 431 -22.732 0.782 9.375 1.00 3.40 C ATOM 0 H PHE A 431 -16.087 -0.312 10.283 1.00 13.30 H new ATOM 0 HA PHE A 431 -17.765 1.878 9.167 1.00 5.44 H new ATOM 0 HB2 PHE A 431 -18.226 -0.513 8.472 1.00 42.45 H new ATOM 0 HB3 PHE A 431 -18.357 -0.965 10.160 1.00 42.45 H new ATOM 0 HD1 PHE A 431 -19.707 2.181 8.804 1.00 21.41 H new ATOM 0 HD2 PHE A 431 -20.603 -1.758 10.042 1.00 22.10 H new ATOM 0 HE1 PHE A 431 -22.148 2.723 8.758 1.00 32.04 H new ATOM 0 HE2 PHE A 431 -23.043 -1.217 9.998 1.00 10.24 H new ATOM 0 HZ PHE A 431 -23.786 1.015 9.355 1.00 3.40 H new ATOM 672 N GLN A 432 -17.013 1.427 12.137 1.00 51.30 N ATOM 673 CA GLN A 432 -17.217 1.832 13.518 1.00 11.41 C ATOM 674 C GLN A 432 -17.239 3.358 13.627 1.00 34.20 C ATOM 675 O GLN A 432 -17.852 3.910 14.538 1.00 1.31 O ATOM 676 CB GLN A 432 -16.144 1.232 14.428 1.00 44.13 C ATOM 677 CG GLN A 432 -14.914 2.140 14.498 1.00 62.22 C ATOM 678 CD GLN A 432 -13.839 1.538 15.405 1.00 24.24 C ATOM 679 OE1 GLN A 432 -14.044 0.540 16.075 1.00 31.50 O ATOM 680 NE2 GLN A 432 -12.685 2.199 15.387 1.00 23.32 N ATOM 0 H GLN A 432 -16.071 1.101 11.923 1.00 51.30 H new ATOM 0 HA GLN A 432 -18.183 1.451 13.849 1.00 11.41 H new ATOM 0 HB2 GLN A 432 -16.551 1.087 15.429 1.00 44.13 H new ATOM 0 HB3 GLN A 432 -15.854 0.249 14.056 1.00 44.13 H new ATOM 0 HG2 GLN A 432 -14.509 2.288 13.497 1.00 62.22 H new ATOM 0 HG3 GLN A 432 -15.203 3.122 14.873 1.00 62.22 H new ATOM 0 HE21 GLN A 432 -12.581 3.028 14.802 1.00 23.32 H new ATOM 0 HE22 GLN A 432 -11.904 1.877 15.958 1.00 23.32 H new ATOM 687 N VAL A 433 -16.561 3.996 12.683 1.00 73.23 N ATOM 688 CA VAL A 433 -16.494 5.448 12.660 1.00 2.24 C ATOM 689 C VAL A 433 -17.865 6.011 12.282 1.00 3.43 C ATOM 690 O VAL A 433 -18.783 5.256 11.963 1.00 42.02 O ATOM 691 CB VAL A 433 -15.379 5.906 11.719 1.00 4.51 C ATOM 692 CG1 VAL A 433 -14.010 5.446 12.226 1.00 15.51 C ATOM 693 CG2 VAL A 433 -15.629 5.414 10.293 1.00 65.21 C ATOM 0 H VAL A 433 -16.053 3.534 11.929 1.00 73.23 H new ATOM 0 HA VAL A 433 -16.245 5.835 13.648 1.00 2.24 H new ATOM 0 HB VAL A 433 -15.381 6.996 11.702 1.00 4.51 H new ATOM 0 HG11 VAL A 433 -13.235 5.785 11.539 1.00 15.51 H new ATOM 0 HG12 VAL A 433 -13.828 5.867 13.215 1.00 15.51 H new ATOM 0 HG13 VAL A 433 -13.991 4.358 12.286 1.00 15.51 H new ATOM 0 HG21 VAL A 433 -14.822 5.753 9.644 1.00 65.21 H new ATOM 0 HG22 VAL A 433 -15.667 4.325 10.285 1.00 65.21 H new ATOM 0 HG23 VAL A 433 -16.577 5.813 9.931 1.00 65.21 H new ATOM 703 N HIS A 434 -17.961 7.332 12.329 1.00 24.43 N ATOM 704 CA HIS A 434 -19.205 8.004 11.995 1.00 31.23 C ATOM 705 C HIS A 434 -19.693 7.529 10.625 1.00 73.23 C ATOM 706 O HIS A 434 -20.892 7.358 10.415 1.00 14.34 O ATOM 707 CB HIS A 434 -19.038 9.522 12.073 1.00 51.23 C ATOM 708 CG HIS A 434 -17.693 10.018 11.598 1.00 22.43 C ATOM 709 ND1 HIS A 434 -17.391 10.202 10.261 1.00 33.23 N ATOM 710 CD2 HIS A 434 -16.574 10.366 12.297 1.00 54.43 C ATOM 711 CE1 HIS A 434 -16.144 10.640 10.168 1.00 5.31 C ATOM 712 NE2 HIS A 434 -15.639 10.742 11.432 1.00 23.44 N ATOM 0 H HIS A 434 -17.197 7.955 12.593 1.00 24.43 H new ATOM 0 HA HIS A 434 -19.972 7.743 12.724 1.00 31.23 H new ATOM 0 HB2 HIS A 434 -19.819 9.994 11.477 1.00 51.23 H new ATOM 0 HB3 HIS A 434 -19.188 9.841 13.104 1.00 51.23 H new ATOM 0 HD2 HIS A 434 -16.467 10.340 13.371 1.00 54.43 H new ATOM 0 HE1 HIS A 434 -15.620 10.875 9.253 1.00 5.31 H new ATOM 0 HE2 HIS A 434 -14.699 11.055 11.673 1.00 23.44 H new ATOM 719 N GLY A 435 -18.736 7.332 9.729 1.00 12.33 N ATOM 720 CA GLY A 435 -19.055 6.880 8.385 1.00 62.22 C ATOM 721 C GLY A 435 -17.807 6.880 7.498 1.00 11.35 C ATOM 722 O GLY A 435 -16.744 6.426 7.918 1.00 62.34 O ATOM 0 H GLY A 435 -17.742 7.477 9.907 1.00 12.33 H new ATOM 0 HA2 GLY A 435 -19.477 5.876 8.425 1.00 62.22 H new ATOM 0 HA3 GLY A 435 -19.815 7.528 7.950 1.00 62.22 H new ATOM 726 N ARG A 436 -17.980 7.392 6.288 1.00 43.21 N ATOM 727 CA ARG A 436 -16.881 7.455 5.339 1.00 44.33 C ATOM 728 C ARG A 436 -16.227 8.837 5.376 1.00 45.25 C ATOM 729 O ARG A 436 -15.685 9.300 4.373 1.00 41.41 O ATOM 730 CB ARG A 436 -17.365 7.166 3.917 1.00 33.44 C ATOM 731 CG ARG A 436 -17.407 5.661 3.648 1.00 73.01 C ATOM 732 CD ARG A 436 -15.995 5.092 3.493 1.00 62.40 C ATOM 733 NE ARG A 436 -16.018 3.912 2.600 1.00 44.31 N ATOM 734 CZ ARG A 436 -14.961 3.490 1.875 1.00 52.34 C ATOM 735 NH1 ARG A 436 -13.785 4.151 1.931 1.00 13.30 N ATOM 736 NH2 ARG A 436 -15.095 2.424 1.110 1.00 13.03 N ATOM 0 H ARG A 436 -18.864 7.767 5.943 1.00 43.21 H new ATOM 0 HA ARG A 436 -16.152 6.696 5.624 1.00 44.33 H new ATOM 0 HB2 ARG A 436 -18.358 7.593 3.773 1.00 33.44 H new ATOM 0 HB3 ARG A 436 -16.703 7.649 3.198 1.00 33.44 H new ATOM 0 HG2 ARG A 436 -17.919 5.156 4.467 1.00 73.01 H new ATOM 0 HG3 ARG A 436 -17.983 5.466 2.744 1.00 73.01 H new ATOM 0 HD2 ARG A 436 -15.330 5.854 3.085 1.00 62.40 H new ATOM 0 HD3 ARG A 436 -15.598 4.812 4.469 1.00 62.40 H new ATOM 0 HE ARG A 436 -16.888 3.384 2.528 1.00 44.31 H new ATOM 0 HH11 ARG A 436 -13.691 4.975 2.524 1.00 13.30 H new ATOM 0 HH12 ARG A 436 -12.991 3.826 1.380 1.00 13.30 H new ATOM 0 HH21 ARG A 436 -15.988 1.932 1.073 1.00 13.03 H new ATOM 0 HH22 ARG A 436 -14.306 2.092 0.556 1.00 13.03 H new ATOM 746 N GLY A 437 -16.299 9.460 6.545 1.00 31.55 N ATOM 747 CA GLY A 437 -15.719 10.780 6.726 1.00 44.43 C ATOM 748 C GLY A 437 -14.286 10.683 7.250 1.00 73.20 C ATOM 749 O GLY A 437 -13.766 11.634 7.830 1.00 14.41 O ATOM 0 H GLY A 437 -16.750 9.075 7.375 1.00 31.55 H new ATOM 0 HA2 GLY A 437 -15.727 11.318 5.778 1.00 44.43 H new ATOM 0 HA3 GLY A 437 -16.327 11.355 7.424 1.00 44.43 H new ATOM 753 N GLU A 438 -13.685 9.523 7.027 1.00 34.22 N ATOM 754 CA GLU A 438 -12.320 9.288 7.469 1.00 43.11 C ATOM 755 C GLU A 438 -11.332 10.004 6.546 1.00 53.31 C ATOM 756 O GLU A 438 -10.722 10.997 6.935 1.00 51.12 O ATOM 757 CB GLU A 438 -12.018 7.791 7.541 1.00 64.20 C ATOM 758 CG GLU A 438 -12.947 7.091 8.536 1.00 51.40 C ATOM 759 CD GLU A 438 -12.821 7.704 9.931 1.00 44.13 C ATOM 760 OE1 GLU A 438 -13.693 8.482 10.348 1.00 0.43 O ATOM 761 OE2 GLU A 438 -11.771 7.348 10.591 1.00 71.21 O ATOM 0 H GLU A 438 -14.119 8.735 6.546 1.00 34.22 H new ATOM 0 HA GLU A 438 -12.208 9.696 8.474 1.00 43.11 H new ATOM 0 HB2 GLU A 438 -12.135 7.345 6.553 1.00 64.20 H new ATOM 0 HB3 GLU A 438 -10.980 7.640 7.838 1.00 64.20 H new ATOM 0 HG2 GLU A 438 -13.978 7.170 8.193 1.00 51.40 H new ATOM 0 HG3 GLU A 438 -12.705 6.029 8.579 1.00 51.40 H new ATOM 767 N LEU A 439 -11.206 9.469 5.340 1.00 12.13 N ATOM 768 CA LEU A 439 -10.303 10.044 4.357 1.00 1.13 C ATOM 769 C LEU A 439 -11.016 10.135 3.007 1.00 13.13 C ATOM 770 O LEU A 439 -11.986 9.418 2.764 1.00 34.21 O ATOM 771 CB LEU A 439 -8.992 9.256 4.310 1.00 1.02 C ATOM 772 CG LEU A 439 -9.033 7.931 3.544 1.00 52.33 C ATOM 773 CD1 LEU A 439 -8.691 8.141 2.068 1.00 74.40 C ATOM 774 CD2 LEU A 439 -8.126 6.891 4.202 1.00 72.31 C ATOM 0 H LEU A 439 -11.714 8.644 5.021 1.00 12.13 H new ATOM 0 HA LEU A 439 -10.027 11.060 4.640 1.00 1.13 H new ATOM 0 HB2 LEU A 439 -8.227 9.889 3.861 1.00 1.02 H new ATOM 0 HB3 LEU A 439 -8.677 9.052 5.333 1.00 1.02 H new ATOM 0 HG LEU A 439 -10.050 7.542 3.585 1.00 52.33 H new ATOM 0 HD11 LEU A 439 -8.727 7.185 1.546 1.00 74.40 H new ATOM 0 HD12 LEU A 439 -9.412 8.825 1.621 1.00 74.40 H new ATOM 0 HD13 LEU A 439 -7.690 8.563 1.983 1.00 74.40 H new ATOM 0 HD21 LEU A 439 -8.173 5.959 3.639 1.00 72.31 H new ATOM 0 HD22 LEU A 439 -7.100 7.258 4.212 1.00 72.31 H new ATOM 0 HD23 LEU A 439 -8.458 6.714 5.225 1.00 72.31 H new ATOM 785 N SER A 440 -10.508 11.021 2.165 1.00 75.23 N ATOM 786 CA SER A 440 -11.084 11.215 0.844 1.00 21.31 C ATOM 787 C SER A 440 -11.180 9.875 0.114 1.00 73.24 C ATOM 788 O SER A 440 -12.236 9.244 0.101 1.00 12.31 O ATOM 789 CB SER A 440 -10.259 12.209 0.023 1.00 45.45 C ATOM 790 OG SER A 440 -10.621 12.195 -1.354 1.00 44.43 O ATOM 0 H SER A 440 -9.704 11.613 2.371 1.00 75.23 H new ATOM 0 HA SER A 440 -12.085 11.629 0.965 1.00 21.31 H new ATOM 0 HB2 SER A 440 -10.398 13.213 0.424 1.00 45.45 H new ATOM 0 HB3 SER A 440 -9.200 11.970 0.122 1.00 45.45 H new ATOM 0 HG SER A 440 -10.073 12.844 -1.843 1.00 44.43 H new ATOM 795 N CYS A 441 -10.063 9.478 -0.478 1.00 75.52 N ATOM 796 CA CYS A 441 -10.007 8.225 -1.209 1.00 40.03 C ATOM 797 C CYS A 441 -8.560 7.729 -1.206 1.00 44.34 C ATOM 798 O CYS A 441 -7.643 8.482 -0.880 1.00 44.32 O ATOM 799 CB CYS A 441 -10.554 8.373 -2.631 1.00 60.13 C ATOM 800 SG CYS A 441 -11.048 6.739 -3.286 1.00 1.44 S ATOM 0 H CYS A 441 -9.189 10.003 -0.466 1.00 75.52 H new ATOM 0 HA CYS A 441 -10.644 7.489 -0.719 1.00 40.03 H new ATOM 0 HB2 CYS A 441 -11.410 9.048 -2.631 1.00 60.13 H new ATOM 0 HB3 CYS A 441 -9.797 8.818 -3.276 1.00 60.13 H new ATOM 0 HG CYS A 441 -11.513 6.877 -4.492 1.00 1.44 H new ATOM 805 N LEU A 442 -8.399 6.465 -1.569 1.00 61.23 N ATOM 806 CA LEU A 442 -7.079 5.860 -1.611 1.00 41.34 C ATOM 807 C LEU A 442 -6.146 6.738 -2.448 1.00 24.31 C ATOM 808 O LEU A 442 -4.935 6.743 -2.234 1.00 12.31 O ATOM 809 CB LEU A 442 -7.167 4.414 -2.100 1.00 75.33 C ATOM 810 CG LEU A 442 -7.032 4.208 -3.611 1.00 54.33 C ATOM 811 CD1 LEU A 442 -8.095 5.007 -4.369 1.00 24.32 C ATOM 812 CD2 LEU A 442 -5.617 4.542 -4.085 1.00 35.23 C ATOM 0 H LEU A 442 -9.162 5.843 -1.837 1.00 61.23 H new ATOM 0 HA LEU A 442 -6.653 5.807 -0.609 1.00 41.34 H new ATOM 0 HB2 LEU A 442 -6.388 3.835 -1.603 1.00 75.33 H new ATOM 0 HB3 LEU A 442 -8.124 4.001 -1.781 1.00 75.33 H new ATOM 0 HG LEU A 442 -7.204 3.154 -3.830 1.00 54.33 H new ATOM 0 HD11 LEU A 442 -7.978 4.844 -5.440 1.00 24.32 H new ATOM 0 HD12 LEU A 442 -9.087 4.679 -4.058 1.00 24.32 H new ATOM 0 HD13 LEU A 442 -7.978 6.068 -4.149 1.00 24.32 H new ATOM 0 HD21 LEU A 442 -5.548 4.387 -5.162 1.00 35.23 H new ATOM 0 HD22 LEU A 442 -5.392 5.583 -3.853 1.00 35.23 H new ATOM 0 HD23 LEU A 442 -4.901 3.894 -3.579 1.00 35.23 H new ATOM 823 N GLN A 443 -6.747 7.459 -3.384 1.00 21.31 N ATOM 824 CA GLN A 443 -5.986 8.338 -4.255 1.00 74.12 C ATOM 825 C GLN A 443 -4.984 9.157 -3.438 1.00 13.01 C ATOM 826 O GLN A 443 -3.962 9.596 -3.962 1.00 21.51 O ATOM 827 CB GLN A 443 -6.914 9.251 -5.060 1.00 24.34 C ATOM 828 CG GLN A 443 -8.061 8.452 -5.683 1.00 11.01 C ATOM 829 CD GLN A 443 -8.668 9.202 -6.870 1.00 40.34 C ATOM 830 OE1 GLN A 443 -9.862 9.448 -6.938 1.00 44.35 O ATOM 831 NE2 GLN A 443 -7.783 9.553 -7.800 1.00 20.24 N ATOM 0 H GLN A 443 -7.752 7.452 -3.558 1.00 21.31 H new ATOM 0 HA GLN A 443 -5.431 7.723 -4.964 1.00 74.12 H new ATOM 0 HB2 GLN A 443 -7.318 10.029 -4.412 1.00 24.34 H new ATOM 0 HB3 GLN A 443 -6.347 9.752 -5.844 1.00 24.34 H new ATOM 0 HG2 GLN A 443 -7.695 7.479 -6.011 1.00 11.01 H new ATOM 0 HG3 GLN A 443 -8.830 8.267 -4.933 1.00 11.01 H new ATOM 0 HE21 GLN A 443 -6.798 9.316 -7.682 1.00 20.24 H new ATOM 0 HE22 GLN A 443 -8.090 10.059 -8.631 1.00 20.24 H new ATOM 838 N ASP A 444 -5.314 9.339 -2.168 1.00 41.30 N ATOM 839 CA ASP A 444 -4.456 10.098 -1.274 1.00 13.31 C ATOM 840 C ASP A 444 -3.103 9.394 -1.151 1.00 14.14 C ATOM 841 O ASP A 444 -2.057 10.037 -1.214 1.00 31.45 O ATOM 842 CB ASP A 444 -5.067 10.193 0.126 1.00 51.11 C ATOM 843 CG ASP A 444 -4.592 11.385 0.959 1.00 60.14 C ATOM 844 OD1 ASP A 444 -4.623 12.538 0.501 1.00 30.25 O ATOM 845 OD2 ASP A 444 -4.170 11.090 2.142 1.00 60.23 O ATOM 0 H ASP A 444 -6.163 8.974 -1.737 1.00 41.30 H new ATOM 0 HA ASP A 444 -4.341 11.100 -1.688 1.00 13.31 H new ATOM 0 HB2 ASP A 444 -6.152 10.245 0.030 1.00 51.11 H new ATOM 0 HB3 ASP A 444 -4.839 9.276 0.669 1.00 51.11 H new ATOM 850 N ALA A 445 -3.169 8.081 -0.980 1.00 52.23 N ATOM 851 CA ALA A 445 -1.961 7.283 -0.849 1.00 50.25 C ATOM 852 C ALA A 445 -1.190 7.313 -2.169 1.00 33.20 C ATOM 853 O ALA A 445 0.033 7.187 -2.181 1.00 21.51 O ATOM 854 CB ALA A 445 -2.335 5.862 -0.422 1.00 61.40 C ATOM 0 H ALA A 445 -4.039 7.551 -0.929 1.00 52.23 H new ATOM 0 HA ALA A 445 -1.309 7.694 -0.079 1.00 50.25 H new ATOM 0 HB1 ALA A 445 -1.430 5.262 -0.323 1.00 61.40 H new ATOM 0 HB2 ALA A 445 -2.855 5.895 0.535 1.00 61.40 H new ATOM 0 HB3 ALA A 445 -2.986 5.416 -1.174 1.00 61.40 H new ATOM 860 N ILE A 446 -1.937 7.479 -3.250 1.00 12.30 N ATOM 861 CA ILE A 446 -1.339 7.525 -4.574 1.00 60.55 C ATOM 862 C ILE A 446 -0.726 8.909 -4.803 1.00 34.35 C ATOM 863 O ILE A 446 -0.050 9.134 -5.806 1.00 21.33 O ATOM 864 CB ILE A 446 -2.360 7.122 -5.639 1.00 55.03 C ATOM 865 CG1 ILE A 446 -2.474 5.601 -5.742 1.00 5.05 C ATOM 866 CG2 ILE A 446 -2.030 7.765 -6.987 1.00 74.42 C ATOM 867 CD1 ILE A 446 -3.689 5.196 -6.579 1.00 1.25 C ATOM 0 H ILE A 446 -2.952 7.583 -3.237 1.00 12.30 H new ATOM 0 HA ILE A 446 -0.530 6.799 -4.651 1.00 60.55 H new ATOM 0 HB ILE A 446 -3.337 7.498 -5.334 1.00 55.03 H new ATOM 0 HG12 ILE A 446 -1.568 5.195 -6.191 1.00 5.05 H new ATOM 0 HG13 ILE A 446 -2.556 5.171 -4.744 1.00 5.05 H new ATOM 0 HG21 ILE A 446 -2.772 7.462 -7.726 1.00 74.42 H new ATOM 0 HG22 ILE A 446 -2.042 8.850 -6.885 1.00 74.42 H new ATOM 0 HG23 ILE A 446 -1.041 7.442 -7.312 1.00 74.42 H new ATOM 0 HD11 ILE A 446 -3.746 4.109 -6.636 1.00 1.25 H new ATOM 0 HD12 ILE A 446 -4.596 5.583 -6.115 1.00 1.25 H new ATOM 0 HD13 ILE A 446 -3.592 5.607 -7.584 1.00 1.25 H new ATOM 878 N ASP A 447 -0.984 9.800 -3.857 1.00 22.12 N ATOM 879 CA ASP A 447 -0.465 11.154 -3.941 1.00 74.13 C ATOM 880 C ASP A 447 0.710 11.308 -2.974 1.00 24.50 C ATOM 881 O ASP A 447 1.730 11.903 -3.320 1.00 0.04 O ATOM 882 CB ASP A 447 -1.534 12.178 -3.555 1.00 72.30 C ATOM 883 CG ASP A 447 -2.382 12.700 -4.716 1.00 34.53 C ATOM 884 OD1 ASP A 447 -1.850 13.113 -5.758 1.00 63.01 O ATOM 885 OD2 ASP A 447 -3.655 12.670 -4.519 1.00 25.05 O ATOM 0 H ASP A 447 -1.546 9.610 -3.028 1.00 22.12 H new ATOM 0 HA ASP A 447 -0.151 11.331 -4.970 1.00 74.13 H new ATOM 0 HB2 ASP A 447 -2.196 11.728 -2.816 1.00 72.30 H new ATOM 0 HB3 ASP A 447 -1.046 13.025 -3.072 1.00 72.30 H new ATOM 890 N HIS A 448 0.529 10.762 -1.781 1.00 14.53 N ATOM 891 CA HIS A 448 1.561 10.831 -0.762 1.00 1.32 C ATOM 892 C HIS A 448 2.384 9.541 -0.776 1.00 61.40 C ATOM 893 O HIS A 448 3.607 9.582 -0.901 1.00 11.22 O ATOM 894 CB HIS A 448 0.951 11.129 0.610 1.00 12.00 C ATOM 895 CG HIS A 448 0.785 12.601 0.901 1.00 5.03 C ATOM 896 ND1 HIS A 448 1.744 13.544 0.572 1.00 34.51 N ATOM 897 CD2 HIS A 448 -0.237 13.282 1.494 1.00 41.01 C ATOM 898 CE1 HIS A 448 1.308 14.734 0.953 1.00 42.21 C ATOM 899 NE2 HIS A 448 0.080 14.571 1.526 1.00 12.00 N ATOM 0 H HIS A 448 -0.318 10.269 -1.497 1.00 14.53 H new ATOM 0 HA HIS A 448 2.239 11.656 -0.982 1.00 1.32 H new ATOM 0 HB2 HIS A 448 -0.023 10.644 0.676 1.00 12.00 H new ATOM 0 HB3 HIS A 448 1.581 10.685 1.381 1.00 12.00 H new ATOM 0 HD2 HIS A 448 -1.150 12.847 1.873 1.00 41.01 H new ATOM 0 HE1 HIS A 448 1.832 15.670 0.832 1.00 42.21 H new ATOM 0 HE2 HIS A 448 -0.498 15.316 1.914 1.00 12.00 H new ATOM 906 N SER A 449 1.681 8.426 -0.647 1.00 62.11 N ATOM 907 CA SER A 449 2.331 7.127 -0.644 1.00 41.24 C ATOM 908 C SER A 449 2.854 6.801 -2.045 1.00 70.43 C ATOM 909 O SER A 449 2.267 7.214 -3.044 1.00 22.43 O ATOM 910 CB SER A 449 1.373 6.033 -0.168 1.00 35.52 C ATOM 911 OG SER A 449 0.344 6.552 0.670 1.00 33.33 O ATOM 0 H SER A 449 0.667 8.395 -0.544 1.00 62.11 H new ATOM 0 HA SER A 449 3.170 7.166 0.051 1.00 41.24 H new ATOM 0 HB2 SER A 449 0.924 5.543 -1.032 1.00 35.52 H new ATOM 0 HB3 SER A 449 1.933 5.272 0.375 1.00 35.52 H new ATOM 0 HG SER A 449 0.066 5.864 1.310 1.00 33.33 H new ATOM 916 N ALA A 450 3.956 6.062 -2.072 1.00 75.35 N ATOM 917 CA ALA A 450 4.566 5.678 -3.334 1.00 11.23 C ATOM 918 C ALA A 450 3.637 4.710 -4.070 1.00 51.44 C ATOM 919 O ALA A 450 2.962 5.096 -5.023 1.00 15.35 O ATOM 920 CB ALA A 450 5.946 5.072 -3.069 1.00 52.21 C ATOM 0 H ALA A 450 4.440 5.720 -1.242 1.00 75.35 H new ATOM 0 HA ALA A 450 4.709 6.549 -3.973 1.00 11.23 H new ATOM 0 HB1 ALA A 450 6.404 4.784 -4.015 1.00 52.21 H new ATOM 0 HB2 ALA A 450 6.577 5.808 -2.569 1.00 52.21 H new ATOM 0 HB3 ALA A 450 5.841 4.193 -2.434 1.00 52.21 H new ATOM 926 N PHE A 451 3.631 3.471 -3.600 1.00 73.14 N ATOM 927 CA PHE A 451 2.796 2.446 -4.202 1.00 3.33 C ATOM 928 C PHE A 451 1.802 1.882 -3.185 1.00 45.24 C ATOM 929 O PHE A 451 2.181 1.542 -2.064 1.00 53.42 O ATOM 930 CB PHE A 451 3.728 1.324 -4.663 1.00 33.21 C ATOM 931 CG PHE A 451 4.794 1.772 -5.664 1.00 75.24 C ATOM 932 CD1 PHE A 451 4.592 2.886 -6.419 1.00 44.35 C ATOM 933 CD2 PHE A 451 5.943 1.057 -5.801 1.00 54.23 C ATOM 934 CE1 PHE A 451 5.581 3.303 -7.348 1.00 31.13 C ATOM 935 CE2 PHE A 451 6.931 1.474 -6.731 1.00 21.34 C ATOM 936 CZ PHE A 451 6.730 2.588 -7.485 1.00 11.23 C ATOM 0 H PHE A 451 4.191 3.154 -2.809 1.00 73.14 H new ATOM 0 HA PHE A 451 2.227 2.868 -5.030 1.00 3.33 H new ATOM 0 HB2 PHE A 451 4.221 0.894 -3.791 1.00 33.21 H new ATOM 0 HB3 PHE A 451 3.131 0.532 -5.114 1.00 33.21 H new ATOM 0 HD1 PHE A 451 3.679 3.453 -6.311 1.00 44.35 H new ATOM 0 HD2 PHE A 451 6.104 0.172 -5.202 1.00 54.23 H new ATOM 0 HE1 PHE A 451 5.421 4.188 -7.946 1.00 31.13 H new ATOM 0 HE2 PHE A 451 7.843 0.906 -6.840 1.00 21.34 H new ATOM 0 HZ PHE A 451 7.482 2.905 -8.192 1.00 11.23 H new ATOM 945 N ILE A 452 0.550 1.798 -3.612 1.00 62.42 N ATOM 946 CA ILE A 452 -0.500 1.281 -2.752 1.00 13.44 C ATOM 947 C ILE A 452 -0.285 -0.218 -2.535 1.00 63.34 C ATOM 948 O ILE A 452 -0.143 -0.973 -3.496 1.00 23.14 O ATOM 949 CB ILE A 452 -1.877 1.629 -3.322 1.00 11.42 C ATOM 950 CG1 ILE A 452 -1.966 3.114 -3.675 1.00 14.11 C ATOM 951 CG2 ILE A 452 -2.991 1.200 -2.363 1.00 24.22 C ATOM 952 CD1 ILE A 452 -1.687 3.987 -2.450 1.00 64.22 C ATOM 0 H ILE A 452 0.240 2.079 -4.542 1.00 62.42 H new ATOM 0 HA ILE A 452 -0.457 1.754 -1.771 1.00 13.44 H new ATOM 0 HB ILE A 452 -2.014 1.070 -4.248 1.00 11.42 H new ATOM 0 HG12 ILE A 452 -1.250 3.348 -4.463 1.00 14.11 H new ATOM 0 HG13 ILE A 452 -2.957 3.339 -4.068 1.00 14.11 H new ATOM 0 HG21 ILE A 452 -3.959 1.459 -2.791 1.00 24.22 H new ATOM 0 HG22 ILE A 452 -2.940 0.123 -2.205 1.00 24.22 H new ATOM 0 HG23 ILE A 452 -2.868 1.713 -1.409 1.00 24.22 H new ATOM 0 HD11 ILE A 452 -1.757 5.038 -2.729 1.00 64.22 H new ATOM 0 HD12 ILE A 452 -2.420 3.768 -1.673 1.00 64.22 H new ATOM 0 HD13 ILE A 452 -0.686 3.777 -2.074 1.00 64.22 H new ATOM 963 N ILE A 453 -0.268 -0.604 -1.267 1.00 34.24 N ATOM 964 CA ILE A 453 -0.071 -1.999 -0.913 1.00 4.42 C ATOM 965 C ILE A 453 -1.414 -2.611 -0.508 1.00 63.42 C ATOM 966 O ILE A 453 -1.982 -2.245 0.520 1.00 15.31 O ATOM 967 CB ILE A 453 1.014 -2.133 0.157 1.00 41.13 C ATOM 968 CG1 ILE A 453 2.405 -2.175 -0.474 1.00 71.42 C ATOM 969 CG2 ILE A 453 0.754 -3.344 1.054 1.00 4.23 C ATOM 970 CD1 ILE A 453 3.494 -1.964 0.580 1.00 3.31 C ATOM 0 H ILE A 453 -0.387 0.025 -0.473 1.00 34.24 H new ATOM 0 HA ILE A 453 0.291 -2.563 -1.772 1.00 4.42 H new ATOM 0 HB ILE A 453 0.976 -1.248 0.793 1.00 41.13 H new ATOM 0 HG12 ILE A 453 2.554 -3.135 -0.969 1.00 71.42 H new ATOM 0 HG13 ILE A 453 2.483 -1.405 -1.241 1.00 71.42 H new ATOM 0 HG21 ILE A 453 1.540 -3.416 1.806 1.00 4.23 H new ATOM 0 HG22 ILE A 453 -0.211 -3.230 1.548 1.00 4.23 H new ATOM 0 HG23 ILE A 453 0.747 -4.250 0.449 1.00 4.23 H new ATOM 0 HD11 ILE A 453 4.474 -1.999 0.103 1.00 3.31 H new ATOM 0 HD12 ILE A 453 3.356 -0.993 1.056 1.00 3.31 H new ATOM 0 HD13 ILE A 453 3.429 -2.750 1.333 1.00 3.31 H new ATOM 981 N LEU A 454 -1.882 -3.533 -1.337 1.00 64.51 N ATOM 982 CA LEU A 454 -3.146 -4.200 -1.077 1.00 75.15 C ATOM 983 C LEU A 454 -2.884 -5.514 -0.340 1.00 31.23 C ATOM 984 O LEU A 454 -2.452 -6.494 -0.945 1.00 71.33 O ATOM 985 CB LEU A 454 -3.937 -4.370 -2.376 1.00 31.42 C ATOM 986 CG LEU A 454 -4.143 -3.103 -3.208 1.00 53.24 C ATOM 987 CD1 LEU A 454 -4.442 -1.901 -2.309 1.00 72.35 C ATOM 988 CD2 LEU A 454 -2.947 -2.849 -4.128 1.00 5.21 C ATOM 0 H LEU A 454 -1.408 -3.833 -2.189 1.00 64.51 H new ATOM 0 HA LEU A 454 -3.772 -3.590 -0.426 1.00 75.15 H new ATOM 0 HB2 LEU A 454 -3.426 -5.108 -2.995 1.00 31.42 H new ATOM 0 HB3 LEU A 454 -4.916 -4.782 -2.131 1.00 31.42 H new ATOM 0 HG LEU A 454 -5.013 -3.252 -3.848 1.00 53.24 H new ATOM 0 HD11 LEU A 454 -4.584 -1.013 -2.925 1.00 72.35 H new ATOM 0 HD12 LEU A 454 -5.348 -2.093 -1.734 1.00 72.35 H new ATOM 0 HD13 LEU A 454 -3.607 -1.740 -1.627 1.00 72.35 H new ATOM 0 HD21 LEU A 454 -3.120 -1.942 -4.708 1.00 5.21 H new ATOM 0 HD22 LEU A 454 -2.045 -2.729 -3.528 1.00 5.21 H new ATOM 0 HD23 LEU A 454 -2.823 -3.694 -4.805 1.00 5.21 H new ATOM 999 N LEU A 455 -3.155 -5.493 0.957 1.00 12.12 N ATOM 1000 CA LEU A 455 -2.954 -6.670 1.782 1.00 40.14 C ATOM 1001 C LEU A 455 -3.991 -7.731 1.412 1.00 51.31 C ATOM 1002 O LEU A 455 -4.993 -7.895 2.107 1.00 52.24 O ATOM 1003 CB LEU A 455 -2.964 -6.292 3.265 1.00 31.41 C ATOM 1004 CG LEU A 455 -2.172 -7.213 4.197 1.00 33.24 C ATOM 1005 CD1 LEU A 455 -0.825 -7.592 3.579 1.00 71.10 C ATOM 1006 CD2 LEU A 455 -2.010 -6.584 5.582 1.00 54.45 C ATOM 0 H LEU A 455 -3.512 -4.678 1.456 1.00 12.12 H new ATOM 0 HA LEU A 455 -1.972 -7.104 1.593 1.00 40.14 H new ATOM 0 HB2 LEU A 455 -2.570 -5.281 3.365 1.00 31.41 H new ATOM 0 HB3 LEU A 455 -3.999 -6.266 3.606 1.00 31.41 H new ATOM 0 HG LEU A 455 -2.738 -8.136 4.326 1.00 33.24 H new ATOM 0 HD11 LEU A 455 -0.283 -8.246 4.262 1.00 71.10 H new ATOM 0 HD12 LEU A 455 -0.991 -8.110 2.634 1.00 71.10 H new ATOM 0 HD13 LEU A 455 -0.240 -6.690 3.400 1.00 71.10 H new ATOM 0 HD21 LEU A 455 -1.444 -7.259 6.224 1.00 54.45 H new ATOM 0 HD22 LEU A 455 -1.478 -5.637 5.492 1.00 54.45 H new ATOM 0 HD23 LEU A 455 -2.993 -6.407 6.019 1.00 54.45 H new ATOM 1017 N LEU A 456 -3.716 -8.426 0.318 1.00 32.25 N ATOM 1018 CA LEU A 456 -4.613 -9.467 -0.153 1.00 33.43 C ATOM 1019 C LEU A 456 -4.775 -10.529 0.938 1.00 33.50 C ATOM 1020 O LEU A 456 -3.979 -11.462 1.022 1.00 62.21 O ATOM 1021 CB LEU A 456 -4.127 -10.029 -1.490 1.00 34.54 C ATOM 1022 CG LEU A 456 -3.882 -9.004 -2.599 1.00 34.52 C ATOM 1023 CD1 LEU A 456 -3.990 -9.655 -3.981 1.00 64.31 C ATOM 1024 CD2 LEU A 456 -4.822 -7.806 -2.455 1.00 74.24 C ATOM 0 H LEU A 456 -2.884 -8.288 -0.256 1.00 32.25 H new ATOM 0 HA LEU A 456 -5.604 -9.056 -0.347 1.00 33.43 H new ATOM 0 HB2 LEU A 456 -3.200 -10.575 -1.316 1.00 34.54 H new ATOM 0 HB3 LEU A 456 -4.861 -10.752 -1.846 1.00 34.54 H new ATOM 0 HG LEU A 456 -2.864 -8.628 -2.499 1.00 34.52 H new ATOM 0 HD11 LEU A 456 -3.812 -8.905 -4.751 1.00 64.31 H new ATOM 0 HD12 LEU A 456 -3.248 -10.449 -4.068 1.00 64.31 H new ATOM 0 HD13 LEU A 456 -4.988 -10.076 -4.108 1.00 64.31 H new ATOM 0 HD21 LEU A 456 -4.627 -7.092 -3.256 1.00 74.24 H new ATOM 0 HD22 LEU A 456 -5.856 -8.146 -2.515 1.00 74.24 H new ATOM 0 HD23 LEU A 456 -4.654 -7.325 -1.491 1.00 74.24 H new ATOM 1035 N THR A 457 -5.809 -10.348 1.745 1.00 13.00 N ATOM 1036 CA THR A 457 -6.086 -11.279 2.827 1.00 32.41 C ATOM 1037 C THR A 457 -7.532 -11.768 2.753 1.00 3.22 C ATOM 1038 O THR A 457 -8.419 -11.033 2.321 1.00 2.20 O ATOM 1039 CB THR A 457 -5.745 -10.583 4.146 1.00 1.10 C ATOM 1040 OG1 THR A 457 -6.770 -9.605 4.298 1.00 31.31 O ATOM 1041 CG2 THR A 457 -4.458 -9.762 4.060 1.00 71.54 C ATOM 0 H THR A 457 -6.466 -9.571 1.672 1.00 13.00 H new ATOM 0 HA THR A 457 -5.470 -12.175 2.747 1.00 32.41 H new ATOM 0 HB THR A 457 -5.647 -11.329 4.934 1.00 1.10 H new ATOM 0 HG1 THR A 457 -6.639 -9.122 5.140 1.00 31.31 H new ATOM 0 HG21 THR A 457 -4.263 -9.290 5.023 1.00 71.54 H new ATOM 0 HG22 THR A 457 -3.626 -10.416 3.802 1.00 71.54 H new ATOM 0 HG23 THR A 457 -4.567 -8.994 3.294 1.00 71.54 H new ATOM 1049 N SER A 458 -7.727 -13.006 3.183 1.00 65.25 N ATOM 1050 CA SER A 458 -9.053 -13.602 3.172 1.00 25.45 C ATOM 1051 C SER A 458 -10.017 -12.749 3.997 1.00 45.12 C ATOM 1052 O SER A 458 -11.234 -12.891 3.882 1.00 34.43 O ATOM 1053 CB SER A 458 -9.016 -15.034 3.709 1.00 32.15 C ATOM 1054 OG SER A 458 -8.524 -15.091 5.045 1.00 44.40 O ATOM 0 H SER A 458 -6.989 -13.613 3.541 1.00 65.25 H new ATOM 0 HA SER A 458 -9.404 -13.639 2.141 1.00 25.45 H new ATOM 0 HB2 SER A 458 -10.018 -15.460 3.673 1.00 32.15 H new ATOM 0 HB3 SER A 458 -8.386 -15.647 3.064 1.00 32.15 H new ATOM 0 HG SER A 458 -7.854 -15.803 5.117 1.00 44.40 H new ATOM 1059 N ASN A 459 -9.439 -11.881 4.815 1.00 75.52 N ATOM 1060 CA ASN A 459 -10.231 -11.005 5.660 1.00 54.45 C ATOM 1061 C ASN A 459 -10.501 -9.694 4.918 1.00 64.22 C ATOM 1062 O ASN A 459 -11.464 -8.992 5.221 1.00 41.15 O ATOM 1063 CB ASN A 459 -9.491 -10.671 6.956 1.00 71.50 C ATOM 1064 CG ASN A 459 -9.615 -11.811 7.969 1.00 51.51 C ATOM 1065 OD1 ASN A 459 -8.896 -12.796 7.926 1.00 52.32 O ATOM 1066 ND2 ASN A 459 -10.567 -11.624 8.878 1.00 12.42 N ATOM 0 H ASN A 459 -8.430 -11.766 4.910 1.00 75.52 H new ATOM 0 HA ASN A 459 -11.162 -11.520 5.899 1.00 54.45 H new ATOM 0 HB2 ASN A 459 -8.439 -10.485 6.740 1.00 71.50 H new ATOM 0 HB3 ASN A 459 -9.896 -9.754 7.384 1.00 71.50 H new ATOM 0 HD21 ASN A 459 -10.731 -12.329 9.597 1.00 12.42 H new ATOM 0 HD22 ASN A 459 -11.133 -10.776 8.857 1.00 12.42 H new ATOM 1072 N PHE A 460 -9.632 -9.404 3.960 1.00 10.41 N ATOM 1073 CA PHE A 460 -9.763 -8.190 3.173 1.00 2.43 C ATOM 1074 C PHE A 460 -10.168 -8.511 1.733 1.00 53.12 C ATOM 1075 O PHE A 460 -10.095 -9.663 1.307 1.00 21.22 O ATOM 1076 CB PHE A 460 -8.393 -7.510 3.166 1.00 13.13 C ATOM 1077 CG PHE A 460 -8.333 -6.236 2.321 1.00 42.50 C ATOM 1078 CD1 PHE A 460 -9.196 -5.215 2.571 1.00 14.45 C ATOM 1079 CD2 PHE A 460 -7.420 -6.124 1.322 1.00 34.32 C ATOM 1080 CE1 PHE A 460 -9.143 -4.032 1.786 1.00 43.21 C ATOM 1081 CE2 PHE A 460 -7.364 -4.942 0.537 1.00 43.53 C ATOM 1082 CZ PHE A 460 -8.227 -3.921 0.787 1.00 13.41 C ATOM 0 H PHE A 460 -8.835 -9.989 3.711 1.00 10.41 H new ATOM 0 HA PHE A 460 -10.532 -7.549 3.604 1.00 2.43 H new ATOM 0 HB2 PHE A 460 -8.115 -7.267 4.191 1.00 13.13 H new ATOM 0 HB3 PHE A 460 -7.651 -8.216 2.793 1.00 13.13 H new ATOM 0 HD1 PHE A 460 -9.921 -5.303 3.366 1.00 14.45 H new ATOM 0 HD2 PHE A 460 -6.735 -6.935 1.124 1.00 34.32 H new ATOM 0 HE1 PHE A 460 -9.829 -3.222 1.982 1.00 43.21 H new ATOM 0 HE2 PHE A 460 -6.637 -4.854 -0.257 1.00 43.53 H new ATOM 0 HZ PHE A 460 -8.185 -3.021 0.191 1.00 13.41 H new ATOM 1091 N ASP A 461 -10.584 -7.473 1.023 1.00 74.43 N ATOM 1092 CA ASP A 461 -11.000 -7.630 -0.360 1.00 33.44 C ATOM 1093 C ASP A 461 -9.900 -7.099 -1.283 1.00 43.53 C ATOM 1094 O ASP A 461 -9.315 -6.051 -1.015 1.00 74.34 O ATOM 1095 CB ASP A 461 -12.278 -6.840 -0.645 1.00 42.15 C ATOM 1096 CG ASP A 461 -13.482 -7.228 0.215 1.00 74.11 C ATOM 1097 OD1 ASP A 461 -13.953 -6.439 1.049 1.00 70.54 O ATOM 1098 OD2 ASP A 461 -13.948 -8.411 0.000 1.00 34.24 O ATOM 0 H ASP A 461 -10.642 -6.519 1.380 1.00 74.43 H new ATOM 0 HA ASP A 461 -11.184 -8.690 -0.538 1.00 33.44 H new ATOM 0 HB2 ASP A 461 -12.072 -5.780 -0.498 1.00 42.15 H new ATOM 0 HB3 ASP A 461 -12.542 -6.971 -1.694 1.00 42.15 H new ATOM 1103 N CYS A 462 -9.653 -7.847 -2.348 1.00 52.51 N ATOM 1104 CA CYS A 462 -8.635 -7.463 -3.311 1.00 35.51 C ATOM 1105 C CYS A 462 -9.308 -6.677 -4.438 1.00 4.32 C ATOM 1106 O CYS A 462 -8.820 -5.625 -4.843 1.00 32.21 O ATOM 1107 CB CYS A 462 -7.871 -8.680 -3.840 1.00 55.11 C ATOM 1108 SG CYS A 462 -9.045 -9.908 -4.518 1.00 64.42 S ATOM 0 H CYS A 462 -10.140 -8.717 -2.565 1.00 52.51 H new ATOM 0 HA CYS A 462 -7.892 -6.831 -2.825 1.00 35.51 H new ATOM 0 HB2 CYS A 462 -7.168 -8.371 -4.614 1.00 55.11 H new ATOM 0 HB3 CYS A 462 -7.285 -9.129 -3.038 1.00 55.11 H new ATOM 0 HG CYS A 462 -8.783 -11.080 -4.020 1.00 64.42 H new ATOM 1113 N ARG A 463 -10.422 -7.219 -4.909 1.00 23.35 N ATOM 1114 CA ARG A 463 -11.169 -6.582 -5.980 1.00 24.15 C ATOM 1115 C ARG A 463 -11.306 -5.082 -5.713 1.00 24.22 C ATOM 1116 O ARG A 463 -10.854 -4.262 -6.511 1.00 22.31 O ATOM 1117 CB ARG A 463 -12.563 -7.197 -6.121 1.00 33.03 C ATOM 1118 CG ARG A 463 -12.502 -8.527 -6.877 1.00 63.23 C ATOM 1119 CD ARG A 463 -13.891 -9.162 -6.981 1.00 31.41 C ATOM 1120 NE ARG A 463 -14.178 -9.951 -5.764 1.00 5.41 N ATOM 1121 CZ ARG A 463 -14.746 -9.443 -4.649 1.00 42.31 C ATOM 1122 NH1 ARG A 463 -15.091 -8.140 -4.589 1.00 51.33 N ATOM 1123 NH2 ARG A 463 -14.959 -10.239 -3.618 1.00 24.15 N ATOM 0 H ARG A 463 -10.825 -8.092 -4.568 1.00 23.35 H new ATOM 0 HA ARG A 463 -10.619 -6.741 -6.907 1.00 24.15 H new ATOM 0 HB2 ARG A 463 -12.996 -7.356 -5.133 1.00 33.03 H new ATOM 0 HB3 ARG A 463 -13.218 -6.504 -6.649 1.00 33.03 H new ATOM 0 HG2 ARG A 463 -12.097 -8.364 -7.876 1.00 63.23 H new ATOM 0 HG3 ARG A 463 -11.823 -9.210 -6.366 1.00 63.23 H new ATOM 0 HD2 ARG A 463 -14.646 -8.386 -7.108 1.00 31.41 H new ATOM 0 HD3 ARG A 463 -13.942 -9.803 -7.861 1.00 31.41 H new ATOM 0 HE ARG A 463 -13.932 -10.941 -5.767 1.00 5.41 H new ATOM 0 HH11 ARG A 463 -14.923 -7.531 -5.390 1.00 51.33 H new ATOM 0 HH12 ARG A 463 -15.520 -7.764 -3.743 1.00 51.33 H new ATOM 0 HH21 ARG A 463 -14.695 -11.223 -3.670 1.00 24.15 H new ATOM 0 HH22 ARG A 463 -15.387 -9.870 -2.769 1.00 24.15 H new ATOM 1133 N LEU A 464 -11.930 -4.768 -4.588 1.00 4.52 N ATOM 1134 CA LEU A 464 -12.132 -3.381 -4.205 1.00 42.01 C ATOM 1135 C LEU A 464 -10.804 -2.630 -4.312 1.00 43.02 C ATOM 1136 O LEU A 464 -10.663 -1.723 -5.133 1.00 3.11 O ATOM 1137 CB LEU A 464 -12.777 -3.296 -2.820 1.00 12.54 C ATOM 1138 CG LEU A 464 -13.007 -1.886 -2.273 1.00 55.21 C ATOM 1139 CD1 LEU A 464 -11.686 -1.241 -1.851 1.00 45.43 C ATOM 1140 CD2 LEU A 464 -13.769 -1.023 -3.282 1.00 11.43 C ATOM 0 H LEU A 464 -12.303 -5.451 -3.928 1.00 4.52 H new ATOM 0 HA LEU A 464 -12.830 -2.895 -4.886 1.00 42.01 H new ATOM 0 HB2 LEU A 464 -13.737 -3.811 -2.856 1.00 12.54 H new ATOM 0 HB3 LEU A 464 -12.149 -3.840 -2.115 1.00 12.54 H new ATOM 0 HG LEU A 464 -13.629 -1.963 -1.381 1.00 55.21 H new ATOM 0 HD11 LEU A 464 -11.877 -0.239 -1.466 1.00 45.43 H new ATOM 0 HD12 LEU A 464 -11.218 -1.845 -1.074 1.00 45.43 H new ATOM 0 HD13 LEU A 464 -11.021 -1.178 -2.712 1.00 45.43 H new ATOM 0 HD21 LEU A 464 -13.919 -0.026 -2.868 1.00 11.43 H new ATOM 0 HD22 LEU A 464 -13.194 -0.950 -4.205 1.00 11.43 H new ATOM 0 HD23 LEU A 464 -14.737 -1.478 -3.492 1.00 11.43 H new ATOM 1151 N SER A 465 -9.862 -3.033 -3.472 1.00 2.21 N ATOM 1152 CA SER A 465 -8.551 -2.408 -3.461 1.00 74.03 C ATOM 1153 C SER A 465 -8.131 -2.050 -4.888 1.00 11.32 C ATOM 1154 O SER A 465 -7.805 -0.899 -5.173 1.00 45.22 O ATOM 1155 CB SER A 465 -7.510 -3.324 -2.815 1.00 2.05 C ATOM 1156 OG SER A 465 -8.067 -4.107 -1.762 1.00 74.44 O ATOM 0 H SER A 465 -9.981 -3.785 -2.794 1.00 2.21 H new ATOM 0 HA SER A 465 -8.611 -1.496 -2.867 1.00 74.03 H new ATOM 0 HB2 SER A 465 -7.088 -3.984 -3.573 1.00 2.05 H new ATOM 0 HB3 SER A 465 -6.690 -2.722 -2.424 1.00 2.05 H new ATOM 0 HG SER A 465 -7.648 -3.858 -0.912 1.00 74.44 H new ATOM 1161 N LEU A 466 -8.150 -3.058 -5.748 1.00 52.21 N ATOM 1162 CA LEU A 466 -7.775 -2.865 -7.138 1.00 52.21 C ATOM 1163 C LEU A 466 -8.627 -1.744 -7.740 1.00 23.42 C ATOM 1164 O LEU A 466 -8.097 -0.818 -8.352 1.00 45.44 O ATOM 1165 CB LEU A 466 -7.864 -4.185 -7.905 1.00 14.43 C ATOM 1166 CG LEU A 466 -7.088 -4.249 -9.222 1.00 72.22 C ATOM 1167 CD1 LEU A 466 -7.923 -3.696 -10.379 1.00 24.32 C ATOM 1168 CD2 LEU A 466 -5.738 -3.538 -9.098 1.00 50.14 C ATOM 0 H LEU A 466 -8.420 -4.012 -5.508 1.00 52.21 H new ATOM 0 HA LEU A 466 -6.734 -2.550 -7.212 1.00 52.21 H new ATOM 0 HB2 LEU A 466 -7.506 -4.984 -7.256 1.00 14.43 H new ATOM 0 HB3 LEU A 466 -8.914 -4.391 -8.114 1.00 14.43 H new ATOM 0 HG LEU A 466 -6.882 -5.296 -9.446 1.00 72.22 H new ATOM 0 HD11 LEU A 466 -7.348 -3.753 -11.303 1.00 24.32 H new ATOM 0 HD12 LEU A 466 -8.835 -4.283 -10.483 1.00 24.32 H new ATOM 0 HD13 LEU A 466 -8.182 -2.657 -10.177 1.00 24.32 H new ATOM 0 HD21 LEU A 466 -5.207 -3.598 -10.048 1.00 50.14 H new ATOM 0 HD22 LEU A 466 -5.900 -2.492 -8.839 1.00 50.14 H new ATOM 0 HD23 LEU A 466 -5.145 -4.017 -8.319 1.00 50.14 H new ATOM 1179 N HIS A 467 -9.931 -1.867 -7.545 1.00 71.30 N ATOM 1180 CA HIS A 467 -10.860 -0.876 -8.061 1.00 51.04 C ATOM 1181 C HIS A 467 -10.386 0.526 -7.671 1.00 5.25 C ATOM 1182 O HIS A 467 -10.172 1.375 -8.533 1.00 53.22 O ATOM 1183 CB HIS A 467 -12.286 -1.171 -7.590 1.00 12.01 C ATOM 1184 CG HIS A 467 -13.103 -1.975 -8.573 1.00 22.32 C ATOM 1185 ND1 HIS A 467 -13.122 -1.706 -9.930 1.00 51.02 N ATOM 1186 CD2 HIS A 467 -13.927 -3.045 -8.382 1.00 51.53 C ATOM 1187 CE1 HIS A 467 -13.926 -2.579 -10.520 1.00 65.44 C ATOM 1188 NE2 HIS A 467 -14.424 -3.408 -9.558 1.00 12.43 N ATOM 0 H HIS A 467 -10.366 -2.637 -7.037 1.00 71.30 H new ATOM 0 HA HIS A 467 -10.881 -0.925 -9.150 1.00 51.04 H new ATOM 0 HB2 HIS A 467 -12.241 -1.710 -6.644 1.00 12.01 H new ATOM 0 HB3 HIS A 467 -12.796 -0.228 -7.395 1.00 12.01 H new ATOM 0 HD2 HIS A 467 -14.139 -3.517 -7.434 1.00 51.53 H new ATOM 0 HE1 HIS A 467 -14.148 -2.626 -11.576 1.00 65.44 H new ATOM 0 HE2 HIS A 467 -15.072 -4.180 -9.716 1.00 12.43 H new ATOM 1195 N GLN A 468 -10.235 0.723 -6.370 1.00 63.22 N ATOM 1196 CA GLN A 468 -9.789 2.007 -5.854 1.00 14.24 C ATOM 1197 C GLN A 468 -8.535 2.470 -6.596 1.00 41.43 C ATOM 1198 O GLN A 468 -8.556 3.494 -7.280 1.00 5.13 O ATOM 1199 CB GLN A 468 -9.539 1.935 -4.347 1.00 23.20 C ATOM 1200 CG GLN A 468 -10.817 1.554 -3.596 1.00 73.12 C ATOM 1201 CD GLN A 468 -10.536 1.352 -2.105 1.00 15.54 C ATOM 1202 OE1 GLN A 468 -9.768 0.496 -1.702 1.00 1.15 O ATOM 1203 NE2 GLN A 468 -11.203 2.186 -1.311 1.00 14.50 N ATOM 0 H GLN A 468 -10.413 0.016 -5.657 1.00 63.22 H new ATOM 0 HA GLN A 468 -10.579 2.739 -6.023 1.00 14.24 H new ATOM 0 HB2 GLN A 468 -8.759 1.203 -4.139 1.00 23.20 H new ATOM 0 HB3 GLN A 468 -9.176 2.898 -3.989 1.00 23.20 H new ATOM 0 HG2 GLN A 468 -11.566 2.335 -3.726 1.00 73.12 H new ATOM 0 HG3 GLN A 468 -11.233 0.639 -4.019 1.00 73.12 H new ATOM 0 HE21 GLN A 468 -11.832 2.881 -1.714 1.00 14.50 H new ATOM 0 HE22 GLN A 468 -11.086 2.130 -0.299 1.00 14.50 H new ATOM 1210 N VAL A 469 -7.471 1.696 -6.438 1.00 13.11 N ATOM 1211 CA VAL A 469 -6.211 2.014 -7.085 1.00 73.05 C ATOM 1212 C VAL A 469 -6.477 2.436 -8.531 1.00 20.42 C ATOM 1213 O VAL A 469 -6.297 3.600 -8.885 1.00 23.43 O ATOM 1214 CB VAL A 469 -5.251 0.828 -6.975 1.00 4.15 C ATOM 1215 CG1 VAL A 469 -3.849 1.210 -7.453 1.00 20.12 C ATOM 1216 CG2 VAL A 469 -5.213 0.283 -5.544 1.00 61.13 C ATOM 0 H VAL A 469 -7.457 0.849 -5.870 1.00 13.11 H new ATOM 0 HA VAL A 469 -5.727 2.853 -6.585 1.00 73.05 H new ATOM 0 HB VAL A 469 -5.622 0.036 -7.626 1.00 4.15 H new ATOM 0 HG11 VAL A 469 -3.187 0.349 -7.364 1.00 20.12 H new ATOM 0 HG12 VAL A 469 -3.894 1.527 -8.495 1.00 20.12 H new ATOM 0 HG13 VAL A 469 -3.466 2.027 -6.841 1.00 20.12 H new ATOM 0 HG21 VAL A 469 -4.523 -0.559 -5.494 1.00 61.13 H new ATOM 0 HG22 VAL A 469 -4.878 1.067 -4.865 1.00 61.13 H new ATOM 0 HG23 VAL A 469 -6.210 -0.047 -5.254 1.00 61.13 H new ATOM 1226 N ASN A 470 -6.900 1.465 -9.329 1.00 60.24 N ATOM 1227 CA ASN A 470 -7.192 1.722 -10.728 1.00 70.43 C ATOM 1228 C ASN A 470 -7.903 3.070 -10.859 1.00 65.30 C ATOM 1229 O ASN A 470 -7.338 4.025 -11.388 1.00 23.24 O ATOM 1230 CB ASN A 470 -8.112 0.644 -11.304 1.00 11.54 C ATOM 1231 CG ASN A 470 -7.303 -0.470 -11.971 1.00 55.33 C ATOM 1232 OD1 ASN A 470 -7.397 -0.714 -13.162 1.00 72.21 O ATOM 1233 ND2 ASN A 470 -6.505 -1.131 -11.138 1.00 63.53 N ATOM 0 H ASN A 470 -7.047 0.500 -9.032 1.00 60.24 H new ATOM 0 HA ASN A 470 -6.249 1.722 -11.274 1.00 70.43 H new ATOM 0 HB2 ASN A 470 -8.728 0.224 -10.509 1.00 11.54 H new ATOM 0 HB3 ASN A 470 -8.790 1.091 -12.031 1.00 11.54 H new ATOM 0 HD21 ASN A 470 -5.924 -1.894 -11.486 1.00 63.53 H new ATOM 0 HD22 ASN A 470 -6.474 -0.876 -10.151 1.00 63.53 H new ATOM 1239 N GLN A 471 -9.132 3.104 -10.366 1.00 33.00 N ATOM 1240 CA GLN A 471 -9.927 4.319 -10.421 1.00 61.44 C ATOM 1241 C GLN A 471 -9.039 5.544 -10.185 1.00 54.30 C ATOM 1242 O GLN A 471 -9.141 6.536 -10.905 1.00 20.45 O ATOM 1243 CB GLN A 471 -11.074 4.271 -9.409 1.00 63.21 C ATOM 1244 CG GLN A 471 -12.033 3.120 -9.723 1.00 74.41 C ATOM 1245 CD GLN A 471 -13.228 3.612 -10.542 1.00 42.01 C ATOM 1246 OE1 GLN A 471 -13.424 3.238 -11.687 1.00 1.42 O ATOM 1247 NE2 GLN A 471 -14.014 4.467 -9.893 1.00 63.01 N ATOM 0 H GLN A 471 -9.597 2.310 -9.926 1.00 33.00 H new ATOM 0 HA GLN A 471 -10.367 4.398 -11.415 1.00 61.44 H new ATOM 0 HB2 GLN A 471 -10.672 4.150 -8.403 1.00 63.21 H new ATOM 0 HB3 GLN A 471 -11.617 5.216 -9.424 1.00 63.21 H new ATOM 0 HG2 GLN A 471 -11.505 2.342 -10.274 1.00 74.41 H new ATOM 0 HG3 GLN A 471 -12.384 2.670 -8.794 1.00 74.41 H new ATOM 0 HE21 GLN A 471 -13.792 4.738 -8.935 1.00 63.01 H new ATOM 0 HE22 GLN A 471 -14.839 4.852 -10.353 1.00 63.01 H new ATOM 1254 N ALA A 472 -8.190 5.434 -9.174 1.00 41.02 N ATOM 1255 CA ALA A 472 -7.287 6.521 -8.834 1.00 34.33 C ATOM 1256 C ALA A 472 -6.387 6.822 -10.035 1.00 53.24 C ATOM 1257 O ALA A 472 -6.335 7.959 -10.505 1.00 1.14 O ATOM 1258 CB ALA A 472 -6.487 6.149 -7.585 1.00 34.55 C ATOM 0 H ALA A 472 -8.108 4.609 -8.579 1.00 41.02 H new ATOM 0 HA ALA A 472 -7.846 7.428 -8.604 1.00 34.33 H new ATOM 0 HB1 ALA A 472 -5.810 6.964 -7.330 1.00 34.55 H new ATOM 0 HB2 ALA A 472 -7.170 5.972 -6.755 1.00 34.55 H new ATOM 0 HB3 ALA A 472 -5.910 5.245 -7.779 1.00 34.55 H new ATOM 1264 N MET A 473 -5.701 5.788 -10.495 1.00 33.43 N ATOM 1265 CA MET A 473 -4.807 5.928 -11.631 1.00 32.24 C ATOM 1266 C MET A 473 -5.519 6.588 -12.814 1.00 12.21 C ATOM 1267 O MET A 473 -5.266 7.750 -13.126 1.00 3.13 O ATOM 1268 CB MET A 473 -4.292 4.549 -12.049 1.00 14.24 C ATOM 1269 CG MET A 473 -3.174 4.075 -11.118 1.00 13.24 C ATOM 1270 SD MET A 473 -3.377 2.339 -10.758 1.00 33.12 S ATOM 1271 CE MET A 473 -1.854 2.024 -9.881 1.00 53.35 C ATOM 0 H MET A 473 -5.746 4.848 -10.101 1.00 33.43 H new ATOM 0 HA MET A 473 -3.972 6.563 -11.335 1.00 32.24 H new ATOM 0 HB2 MET A 473 -5.112 3.831 -12.033 1.00 14.24 H new ATOM 0 HB3 MET A 473 -3.923 4.590 -13.074 1.00 14.24 H new ATOM 0 HG2 MET A 473 -2.204 4.248 -11.584 1.00 13.24 H new ATOM 0 HG3 MET A 473 -3.191 4.651 -10.193 1.00 13.24 H new ATOM 0 HE1 MET A 473 -1.512 1.012 -10.097 1.00 53.35 H new ATOM 0 HE2 MET A 473 -1.096 2.739 -10.200 1.00 53.35 H new ATOM 0 HE3 MET A 473 -2.023 2.128 -8.809 1.00 53.35 H new ATOM 1279 N MET A 474 -6.397 5.816 -13.439 1.00 63.33 N ATOM 1280 CA MET A 474 -7.150 6.312 -14.580 1.00 65.15 C ATOM 1281 C MET A 474 -7.752 7.686 -14.284 1.00 44.14 C ATOM 1282 O MET A 474 -8.051 8.448 -15.203 1.00 5.50 O ATOM 1283 CB MET A 474 -8.268 5.326 -14.920 1.00 24.30 C ATOM 1284 CG MET A 474 -8.964 4.826 -13.653 1.00 61.31 C ATOM 1285 SD MET A 474 -10.672 4.448 -14.002 1.00 30.13 S ATOM 1286 CE MET A 474 -11.473 5.731 -13.056 1.00 41.43 C ATOM 0 H MET A 474 -6.604 4.852 -13.177 1.00 63.33 H new ATOM 0 HA MET A 474 -6.470 6.410 -15.426 1.00 65.15 H new ATOM 0 HB2 MET A 474 -8.996 5.808 -15.573 1.00 24.30 H new ATOM 0 HB3 MET A 474 -7.856 4.480 -15.471 1.00 24.30 H new ATOM 0 HG2 MET A 474 -8.456 3.938 -13.276 1.00 61.31 H new ATOM 0 HG3 MET A 474 -8.903 5.584 -12.872 1.00 61.31 H new ATOM 0 HE1 MET A 474 -12.287 6.159 -13.640 1.00 41.43 H new ATOM 0 HE2 MET A 474 -11.872 5.308 -12.134 1.00 41.43 H new ATOM 0 HE3 MET A 474 -10.750 6.510 -12.815 1.00 41.43 H new ATOM 1294 N SER A 475 -7.913 7.963 -12.998 1.00 12.10 N ATOM 1295 CA SER A 475 -8.475 9.232 -12.571 1.00 5.30 C ATOM 1296 C SER A 475 -7.390 10.309 -12.562 1.00 65.33 C ATOM 1297 O SER A 475 -7.661 11.472 -12.860 1.00 33.12 O ATOM 1298 CB SER A 475 -9.114 9.112 -11.184 1.00 74.32 C ATOM 1299 OG SER A 475 -9.423 10.387 -10.627 1.00 72.12 O ATOM 0 H SER A 475 -7.664 7.330 -12.238 1.00 12.10 H new ATOM 0 HA SER A 475 -9.254 9.516 -13.279 1.00 5.30 H new ATOM 0 HB2 SER A 475 -10.024 8.517 -11.254 1.00 74.32 H new ATOM 0 HB3 SER A 475 -8.436 8.580 -10.517 1.00 74.32 H new ATOM 0 HG SER A 475 -9.830 10.268 -9.743 1.00 72.12 H new ATOM 1304 N ASN A 476 -6.182 9.885 -12.218 1.00 24.13 N ATOM 1305 CA ASN A 476 -5.054 10.799 -12.167 1.00 11.21 C ATOM 1306 C ASN A 476 -3.886 10.206 -12.958 1.00 22.14 C ATOM 1307 O ASN A 476 -3.058 9.485 -12.403 1.00 10.30 O ATOM 1308 CB ASN A 476 -4.587 11.018 -10.726 1.00 74.03 C ATOM 1309 CG ASN A 476 -3.457 12.049 -10.668 1.00 70.14 C ATOM 1310 OD1 ASN A 476 -3.351 12.939 -11.494 1.00 34.22 O ATOM 1311 ND2 ASN A 476 -2.621 11.879 -9.646 1.00 1.53 N ATOM 0 H ASN A 476 -5.960 8.920 -11.972 1.00 24.13 H new ATOM 0 HA ASN A 476 -5.372 11.751 -12.592 1.00 11.21 H new ATOM 0 HB2 ASN A 476 -5.424 11.356 -10.116 1.00 74.03 H new ATOM 0 HB3 ASN A 476 -4.245 10.074 -10.303 1.00 74.03 H new ATOM 0 HD21 ASN A 476 -1.834 12.516 -9.519 1.00 1.53 H new ATOM 0 HD22 ASN A 476 -2.767 11.112 -8.990 1.00 1.53 H new ATOM 1317 N LEU A 477 -3.857 10.530 -14.241 1.00 74.11 N ATOM 1318 CA LEU A 477 -2.805 10.038 -15.114 1.00 3.25 C ATOM 1319 C LEU A 477 -1.923 11.209 -15.553 1.00 24.54 C ATOM 1320 O LEU A 477 -0.781 11.009 -15.967 1.00 1.35 O ATOM 1321 CB LEU A 477 -3.402 9.247 -16.281 1.00 21.21 C ATOM 1322 CG LEU A 477 -4.441 8.187 -15.911 1.00 62.25 C ATOM 1323 CD1 LEU A 477 -5.331 7.850 -17.108 1.00 24.14 C ATOM 1324 CD2 LEU A 477 -3.770 6.942 -15.328 1.00 31.44 C ATOM 0 H LEU A 477 -4.546 11.128 -14.698 1.00 74.11 H new ATOM 0 HA LEU A 477 -2.164 9.337 -14.579 1.00 3.25 H new ATOM 0 HB2 LEU A 477 -3.862 9.952 -16.974 1.00 21.21 H new ATOM 0 HB3 LEU A 477 -2.588 8.758 -16.817 1.00 21.21 H new ATOM 0 HG LEU A 477 -5.087 8.598 -15.135 1.00 62.25 H new ATOM 0 HD11 LEU A 477 -6.061 7.094 -16.818 1.00 24.14 H new ATOM 0 HD12 LEU A 477 -5.852 8.749 -17.439 1.00 24.14 H new ATOM 0 HD13 LEU A 477 -4.716 7.467 -17.922 1.00 24.14 H new ATOM 0 HD21 LEU A 477 -4.531 6.204 -15.073 1.00 31.44 H new ATOM 0 HD22 LEU A 477 -3.086 6.519 -16.064 1.00 31.44 H new ATOM 0 HD23 LEU A 477 -3.214 7.215 -14.431 1.00 31.44 H new ATOM 1335 N THR A 478 -2.483 12.403 -15.446 1.00 51.01 N ATOM 1336 CA THR A 478 -1.763 13.605 -15.827 1.00 63.15 C ATOM 1337 C THR A 478 -0.702 13.945 -14.776 1.00 12.12 C ATOM 1338 O THR A 478 0.040 14.915 -14.930 1.00 1.42 O ATOM 1339 CB THR A 478 -2.785 14.723 -16.042 1.00 61.43 C ATOM 1340 OG1 THR A 478 -1.995 15.851 -16.408 1.00 4.35 O ATOM 1341 CG2 THR A 478 -3.467 15.150 -14.742 1.00 2.51 C ATOM 0 H THR A 478 -3.429 12.565 -15.100 1.00 51.01 H new ATOM 0 HA THR A 478 -1.219 13.461 -16.760 1.00 63.15 H new ATOM 0 HB THR A 478 -3.540 14.392 -16.756 1.00 61.43 H new ATOM 0 HG1 THR A 478 -1.115 15.786 -15.982 1.00 4.35 H new ATOM 0 HG21 THR A 478 -4.182 15.945 -14.951 1.00 2.51 H new ATOM 0 HG22 THR A 478 -3.989 14.297 -14.308 1.00 2.51 H new ATOM 0 HG23 THR A 478 -2.717 15.512 -14.039 1.00 2.51 H new ATOM 1349 N ARG A 479 -0.666 13.129 -13.734 1.00 21.35 N ATOM 1350 CA ARG A 479 0.290 13.331 -12.658 1.00 41.04 C ATOM 1351 C ARG A 479 1.434 12.322 -12.768 1.00 72.52 C ATOM 1352 O ARG A 479 2.542 12.674 -13.169 1.00 23.00 O ATOM 1353 CB ARG A 479 -0.379 13.186 -11.291 1.00 63.11 C ATOM 1354 CG ARG A 479 -0.891 14.537 -10.785 1.00 11.20 C ATOM 1355 CD ARG A 479 -1.601 15.307 -11.901 1.00 63.15 C ATOM 1356 NE ARG A 479 -2.274 16.501 -11.342 1.00 50.14 N ATOM 1357 CZ ARG A 479 -3.335 16.452 -10.510 1.00 1.41 C ATOM 1358 NH1 ARG A 479 -3.857 15.265 -10.133 1.00 24.24 N ATOM 1359 NH2 ARG A 479 -3.859 17.582 -10.071 1.00 22.24 N ATOM 0 H ARG A 479 -1.283 12.326 -13.611 1.00 21.35 H new ATOM 0 HA ARG A 479 0.683 14.343 -12.751 1.00 41.04 H new ATOM 0 HB2 ARG A 479 -1.208 12.482 -11.361 1.00 63.11 H new ATOM 0 HB3 ARG A 479 0.332 12.772 -10.576 1.00 63.11 H new ATOM 0 HG2 ARG A 479 -1.577 14.381 -9.952 1.00 11.20 H new ATOM 0 HG3 ARG A 479 -0.057 15.127 -10.405 1.00 11.20 H new ATOM 0 HD2 ARG A 479 -0.881 15.608 -12.662 1.00 63.15 H new ATOM 0 HD3 ARG A 479 -2.332 14.663 -12.391 1.00 63.15 H new ATOM 0 HE ARG A 479 -1.913 17.419 -11.602 1.00 50.14 H new ATOM 0 HH11 ARG A 479 -3.449 14.396 -10.478 1.00 24.24 H new ATOM 0 HH12 ARG A 479 -4.659 15.237 -9.504 1.00 24.24 H new ATOM 0 HH21 ARG A 479 -3.461 18.475 -10.362 1.00 22.24 H new ATOM 0 HH22 ARG A 479 -4.661 17.561 -9.441 1.00 22.24 H new ATOM 1369 N GLN A 480 1.126 11.085 -12.405 1.00 52.53 N ATOM 1370 CA GLN A 480 2.115 10.021 -12.457 1.00 3.10 C ATOM 1371 C GLN A 480 1.692 8.956 -13.471 1.00 30.33 C ATOM 1372 O GLN A 480 2.541 8.313 -14.090 1.00 12.34 O ATOM 1373 CB GLN A 480 2.332 9.406 -11.072 1.00 15.41 C ATOM 1374 CG GLN A 480 1.012 8.903 -10.484 1.00 62.43 C ATOM 1375 CD GLN A 480 0.405 9.940 -9.537 1.00 41.31 C ATOM 1376 OE1 GLN A 480 0.923 11.029 -9.352 1.00 64.11 O ATOM 1377 NE2 GLN A 480 -0.721 9.543 -8.950 1.00 31.31 N ATOM 0 H GLN A 480 0.206 10.796 -12.074 1.00 52.53 H new ATOM 0 HA GLN A 480 3.065 10.447 -12.781 1.00 3.10 H new ATOM 0 HB2 GLN A 480 3.041 8.581 -11.143 1.00 15.41 H new ATOM 0 HB3 GLN A 480 2.772 10.148 -10.405 1.00 15.41 H new ATOM 0 HG2 GLN A 480 0.310 8.685 -11.289 1.00 62.43 H new ATOM 0 HG3 GLN A 480 1.181 7.969 -9.947 1.00 62.43 H new ATOM 0 HE21 GLN A 480 -1.101 8.618 -9.149 1.00 31.31 H new ATOM 0 HE22 GLN A 480 -1.204 10.164 -8.301 1.00 31.31 H new ATOM 1384 N GLY A 481 0.384 8.800 -13.609 1.00 23.33 N ATOM 1385 CA GLY A 481 -0.159 7.822 -14.536 1.00 32.23 C ATOM 1386 C GLY A 481 0.632 6.513 -14.480 1.00 55.21 C ATOM 1387 O GLY A 481 0.963 5.940 -15.517 1.00 75.31 O ATOM 0 H GLY A 481 -0.316 9.334 -13.094 1.00 23.33 H new ATOM 0 HA2 GLY A 481 -1.205 7.629 -14.296 1.00 32.23 H new ATOM 0 HA3 GLY A 481 -0.134 8.223 -15.549 1.00 32.23 H new ATOM 1391 N SER A 482 0.912 6.080 -13.260 1.00 14.41 N ATOM 1392 CA SER A 482 1.658 4.850 -13.056 1.00 21.33 C ATOM 1393 C SER A 482 0.743 3.773 -12.471 1.00 11.44 C ATOM 1394 O SER A 482 0.487 3.757 -11.268 1.00 72.34 O ATOM 1395 CB SER A 482 2.860 5.081 -12.138 1.00 32.35 C ATOM 1396 OG SER A 482 3.986 5.588 -12.850 1.00 3.22 O ATOM 0 H SER A 482 0.636 6.559 -12.403 1.00 14.41 H new ATOM 0 HA SER A 482 2.032 4.513 -14.023 1.00 21.33 H new ATOM 0 HB2 SER A 482 2.585 5.781 -11.349 1.00 32.35 H new ATOM 0 HB3 SER A 482 3.130 4.144 -11.652 1.00 32.35 H new ATOM 0 HG SER A 482 3.740 6.423 -13.300 1.00 3.22 H new ATOM 1401 N PRO A 483 0.259 2.876 -13.372 1.00 53.04 N ATOM 1402 CA PRO A 483 -0.623 1.800 -12.959 1.00 64.32 C ATOM 1403 C PRO A 483 0.157 0.701 -12.232 1.00 53.14 C ATOM 1404 O PRO A 483 -0.421 -0.301 -11.813 1.00 71.21 O ATOM 1405 CB PRO A 483 -1.280 1.313 -14.241 1.00 62.03 C ATOM 1406 CG PRO A 483 -0.402 1.817 -15.375 1.00 2.21 C ATOM 1407 CD PRO A 483 0.539 2.865 -14.806 1.00 63.14 C ATOM 0 HA PRO A 483 -1.376 2.126 -12.241 1.00 64.32 H new ATOM 0 HB2 PRO A 483 -1.351 0.225 -14.255 1.00 62.03 H new ATOM 0 HB3 PRO A 483 -2.295 1.700 -14.331 1.00 62.03 H new ATOM 0 HG2 PRO A 483 0.163 0.995 -15.814 1.00 2.21 H new ATOM 0 HG3 PRO A 483 -1.013 2.244 -16.170 1.00 2.21 H new ATOM 0 HD2 PRO A 483 1.580 2.611 -15.004 1.00 63.14 H new ATOM 0 HD3 PRO A 483 0.359 3.843 -15.252 1.00 63.14 H new ATOM 1412 N ASP A 484 1.456 0.926 -12.105 1.00 42.15 N ATOM 1413 CA ASP A 484 2.321 -0.031 -11.436 1.00 50.44 C ATOM 1414 C ASP A 484 2.481 0.372 -9.969 1.00 62.33 C ATOM 1415 O ASP A 484 3.435 -0.040 -9.311 1.00 64.44 O ATOM 1416 CB ASP A 484 3.711 -0.057 -12.074 1.00 14.34 C ATOM 1417 CG ASP A 484 3.750 -0.571 -13.515 1.00 34.33 C ATOM 1418 OD1 ASP A 484 2.766 -1.127 -14.023 1.00 13.50 O ATOM 1419 OD2 ASP A 484 4.869 -0.381 -14.131 1.00 12.34 O ATOM 0 H ASP A 484 1.931 1.758 -12.454 1.00 42.15 H new ATOM 0 HA ASP A 484 1.865 -1.017 -11.525 1.00 50.44 H new ATOM 0 HB2 ASP A 484 4.123 0.952 -12.052 1.00 14.34 H new ATOM 0 HB3 ASP A 484 4.363 -0.681 -11.463 1.00 14.34 H new ATOM 1424 N CYS A 485 1.535 1.173 -9.500 1.00 22.14 N ATOM 1425 CA CYS A 485 1.560 1.635 -8.123 1.00 22.22 C ATOM 1426 C CYS A 485 0.713 0.680 -7.281 1.00 25.51 C ATOM 1427 O CYS A 485 0.256 1.042 -6.196 1.00 34.13 O ATOM 1428 CB CYS A 485 1.078 3.082 -8.004 1.00 61.21 C ATOM 1429 SG CYS A 485 2.212 4.196 -8.910 1.00 45.43 S ATOM 0 H CYS A 485 0.746 1.514 -10.050 1.00 22.14 H new ATOM 0 HA CYS A 485 2.585 1.631 -7.753 1.00 22.22 H new ATOM 0 HB2 CYS A 485 0.069 3.172 -8.406 1.00 61.21 H new ATOM 0 HB3 CYS A 485 1.031 3.373 -6.955 1.00 61.21 H new ATOM 0 HG CYS A 485 1.709 4.471 -10.077 1.00 45.43 H new ATOM 1434 N VAL A 486 0.530 -0.521 -7.809 1.00 64.31 N ATOM 1435 CA VAL A 486 -0.254 -1.532 -7.119 1.00 42.11 C ATOM 1436 C VAL A 486 0.664 -2.677 -6.687 1.00 71.43 C ATOM 1437 O VAL A 486 1.391 -3.238 -7.506 1.00 72.24 O ATOM 1438 CB VAL A 486 -1.410 -1.995 -8.007 1.00 71.34 C ATOM 1439 CG1 VAL A 486 -2.416 -2.825 -7.208 1.00 34.02 C ATOM 1440 CG2 VAL A 486 -2.094 -0.804 -8.681 1.00 73.44 C ATOM 0 H VAL A 486 0.911 -0.817 -8.707 1.00 64.31 H new ATOM 0 HA VAL A 486 -0.702 -1.117 -6.216 1.00 42.11 H new ATOM 0 HB VAL A 486 -0.998 -2.631 -8.790 1.00 71.34 H new ATOM 0 HG11 VAL A 486 -3.228 -3.142 -7.863 1.00 34.02 H new ATOM 0 HG12 VAL A 486 -1.918 -3.703 -6.797 1.00 34.02 H new ATOM 0 HG13 VAL A 486 -2.820 -2.223 -6.394 1.00 34.02 H new ATOM 0 HG21 VAL A 486 -2.912 -1.161 -9.307 1.00 73.44 H new ATOM 0 HG22 VAL A 486 -2.487 -0.131 -7.919 1.00 73.44 H new ATOM 0 HG23 VAL A 486 -1.371 -0.271 -9.298 1.00 73.44 H new ATOM 1450 N ILE A 487 0.603 -2.990 -5.402 1.00 5.15 N ATOM 1451 CA ILE A 487 1.419 -4.059 -4.851 1.00 62.10 C ATOM 1452 C ILE A 487 0.574 -4.898 -3.889 1.00 75.45 C ATOM 1453 O ILE A 487 0.509 -4.605 -2.697 1.00 63.12 O ATOM 1454 CB ILE A 487 2.690 -3.490 -4.217 1.00 44.33 C ATOM 1455 CG1 ILE A 487 3.131 -2.208 -4.927 1.00 31.55 C ATOM 1456 CG2 ILE A 487 3.803 -4.538 -4.182 1.00 21.13 C ATOM 1457 CD1 ILE A 487 3.613 -2.509 -6.349 1.00 44.14 C ATOM 0 H ILE A 487 0.001 -2.522 -4.725 1.00 5.15 H new ATOM 0 HA ILE A 487 1.757 -4.727 -5.643 1.00 62.10 H new ATOM 0 HB ILE A 487 2.466 -3.225 -3.184 1.00 44.33 H new ATOM 0 HG12 ILE A 487 2.301 -1.503 -4.962 1.00 31.55 H new ATOM 0 HG13 ILE A 487 3.931 -1.731 -4.361 1.00 31.55 H new ATOM 0 HG21 ILE A 487 4.695 -4.107 -3.727 1.00 21.13 H new ATOM 0 HG22 ILE A 487 3.476 -5.397 -3.596 1.00 21.13 H new ATOM 0 HG23 ILE A 487 4.033 -4.858 -5.198 1.00 21.13 H new ATOM 0 HD11 ILE A 487 3.921 -1.582 -6.833 1.00 44.14 H new ATOM 0 HD12 ILE A 487 4.459 -3.196 -6.309 1.00 44.14 H new ATOM 0 HD13 ILE A 487 2.803 -2.964 -6.919 1.00 44.14 H new ATOM 1468 N PRO A 488 -0.069 -5.952 -4.459 1.00 33.02 N ATOM 1469 CA PRO A 488 -0.907 -6.835 -3.667 1.00 75.40 C ATOM 1470 C PRO A 488 -0.056 -7.773 -2.809 1.00 0.12 C ATOM 1471 O PRO A 488 0.510 -8.741 -3.315 1.00 21.14 O ATOM 1472 CB PRO A 488 -1.768 -7.573 -4.679 1.00 4.20 C ATOM 1473 CG PRO A 488 -1.064 -7.420 -6.017 1.00 42.32 C ATOM 1474 CD PRO A 488 -0.016 -6.329 -5.870 1.00 61.22 C ATOM 0 HA PRO A 488 -1.530 -6.296 -2.953 1.00 75.40 H new ATOM 0 HB2 PRO A 488 -1.872 -8.624 -4.410 1.00 4.20 H new ATOM 0 HB3 PRO A 488 -2.773 -7.153 -4.716 1.00 4.20 H new ATOM 0 HG2 PRO A 488 -0.598 -8.360 -6.313 1.00 42.32 H new ATOM 0 HG3 PRO A 488 -1.779 -7.160 -6.797 1.00 42.32 H new ATOM 0 HD2 PRO A 488 0.974 -6.691 -6.146 1.00 61.22 H new ATOM 0 HD3 PRO A 488 -0.236 -5.479 -6.516 1.00 61.22 H new ATOM 1479 N PHE A 489 0.007 -7.455 -1.524 1.00 73.04 N ATOM 1480 CA PHE A 489 0.779 -8.257 -0.591 1.00 31.42 C ATOM 1481 C PHE A 489 0.026 -9.534 -0.212 1.00 73.00 C ATOM 1482 O PHE A 489 -1.175 -9.645 -0.454 1.00 12.33 O ATOM 1483 CB PHE A 489 0.985 -7.409 0.665 1.00 61.21 C ATOM 1484 CG PHE A 489 2.238 -7.774 1.464 1.00 53.40 C ATOM 1485 CD1 PHE A 489 2.198 -8.788 2.369 1.00 12.54 C ATOM 1486 CD2 PHE A 489 3.393 -7.082 1.270 1.00 32.23 C ATOM 1487 CE1 PHE A 489 3.360 -9.126 3.110 1.00 2.24 C ATOM 1488 CE2 PHE A 489 4.555 -7.421 2.010 1.00 22.53 C ATOM 1489 CZ PHE A 489 4.514 -8.436 2.916 1.00 63.43 C ATOM 0 H PHE A 489 -0.465 -6.652 -1.107 1.00 73.04 H new ATOM 0 HA PHE A 489 1.726 -8.547 -1.046 1.00 31.42 H new ATOM 0 HB2 PHE A 489 1.043 -6.359 0.377 1.00 61.21 H new ATOM 0 HB3 PHE A 489 0.112 -7.515 1.309 1.00 61.21 H new ATOM 0 HD1 PHE A 489 1.281 -9.337 2.524 1.00 12.54 H new ATOM 0 HD2 PHE A 489 3.425 -6.275 0.553 1.00 32.23 H new ATOM 0 HE1 PHE A 489 3.327 -9.932 3.828 1.00 2.24 H new ATOM 0 HE2 PHE A 489 5.473 -6.873 1.854 1.00 22.53 H new ATOM 0 HZ PHE A 489 5.398 -8.693 3.480 1.00 63.43 H new ATOM 1498 N LEU A 490 0.762 -10.465 0.376 1.00 42.41 N ATOM 1499 CA LEU A 490 0.178 -11.730 0.792 1.00 34.02 C ATOM 1500 C LEU A 490 0.794 -12.157 2.125 1.00 4.24 C ATOM 1501 O LEU A 490 1.890 -12.714 2.156 1.00 2.54 O ATOM 1502 CB LEU A 490 0.322 -12.776 -0.317 1.00 63.34 C ATOM 1503 CG LEU A 490 -0.515 -14.046 -0.152 1.00 74.24 C ATOM 1504 CD1 LEU A 490 0.308 -15.168 0.484 1.00 51.05 C ATOM 1505 CD2 LEU A 490 -1.797 -13.759 0.631 1.00 1.22 C ATOM 0 H LEU A 490 1.758 -10.369 0.575 1.00 42.41 H new ATOM 0 HA LEU A 490 -0.894 -11.620 0.957 1.00 34.02 H new ATOM 0 HB2 LEU A 490 0.056 -12.310 -1.266 1.00 63.34 H new ATOM 0 HB3 LEU A 490 1.371 -13.062 -0.385 1.00 63.34 H new ATOM 0 HG LEU A 490 -0.813 -14.390 -1.143 1.00 74.24 H new ATOM 0 HD11 LEU A 490 -0.311 -16.059 0.590 1.00 51.05 H new ATOM 0 HD12 LEU A 490 1.165 -15.395 -0.150 1.00 51.05 H new ATOM 0 HD13 LEU A 490 0.658 -14.851 1.466 1.00 51.05 H new ATOM 0 HD21 LEU A 490 -2.374 -14.678 0.734 1.00 1.22 H new ATOM 0 HD22 LEU A 490 -1.542 -13.378 1.620 1.00 1.22 H new ATOM 0 HD23 LEU A 490 -2.390 -13.016 0.098 1.00 1.22 H new ATOM 1516 N PRO A 491 0.043 -11.872 3.222 1.00 45.33 N ATOM 1517 CA PRO A 491 0.503 -12.221 4.555 1.00 40.11 C ATOM 1518 C PRO A 491 0.364 -13.723 4.807 1.00 5.25 C ATOM 1519 O PRO A 491 -0.535 -14.367 4.269 1.00 41.02 O ATOM 1520 CB PRO A 491 -0.343 -11.379 5.497 1.00 11.14 C ATOM 1521 CG PRO A 491 -1.556 -10.942 4.689 1.00 63.13 C ATOM 1522 CD PRO A 491 -1.259 -11.212 3.223 1.00 3.32 C ATOM 0 HA PRO A 491 1.563 -12.014 4.702 1.00 40.11 H new ATOM 0 HB2 PRO A 491 -0.643 -11.955 6.372 1.00 11.14 H new ATOM 0 HB3 PRO A 491 0.216 -10.517 5.859 1.00 11.14 H new ATOM 0 HG2 PRO A 491 -2.444 -11.489 5.006 1.00 63.13 H new ATOM 0 HG3 PRO A 491 -1.760 -9.883 4.849 1.00 63.13 H new ATOM 0 HD2 PRO A 491 -2.024 -11.846 2.775 1.00 3.32 H new ATOM 0 HD3 PRO A 491 -1.234 -10.287 2.647 1.00 3.32 H new ATOM 1527 N LEU A 492 1.268 -14.240 5.627 1.00 14.13 N ATOM 1528 CA LEU A 492 1.257 -15.655 5.957 1.00 64.41 C ATOM 1529 C LEU A 492 -0.056 -16.000 6.663 1.00 63.35 C ATOM 1530 O LEU A 492 -0.465 -17.159 6.690 1.00 54.11 O ATOM 1531 CB LEU A 492 2.504 -16.026 6.763 1.00 61.41 C ATOM 1532 CG LEU A 492 3.825 -15.435 6.266 1.00 13.50 C ATOM 1533 CD1 LEU A 492 4.999 -16.355 6.604 1.00 1.01 C ATOM 1534 CD2 LEU A 492 3.755 -15.117 4.771 1.00 22.24 C ATOM 0 H LEU A 492 2.013 -13.704 6.072 1.00 14.13 H new ATOM 0 HA LEU A 492 1.300 -16.258 5.050 1.00 64.41 H new ATOM 0 HB2 LEU A 492 2.353 -15.709 7.795 1.00 61.41 H new ATOM 0 HB3 LEU A 492 2.596 -17.112 6.773 1.00 61.41 H new ATOM 0 HG LEU A 492 3.996 -14.493 6.787 1.00 13.50 H new ATOM 0 HD11 LEU A 492 5.926 -15.911 6.240 1.00 1.01 H new ATOM 0 HD12 LEU A 492 5.060 -16.486 7.684 1.00 1.01 H new ATOM 0 HD13 LEU A 492 4.850 -17.325 6.129 1.00 1.01 H new ATOM 0 HD21 LEU A 492 4.706 -14.698 4.443 1.00 22.24 H new ATOM 0 HD22 LEU A 492 3.550 -16.031 4.214 1.00 22.24 H new ATOM 0 HD23 LEU A 492 2.959 -14.395 4.590 1.00 22.24 H new ATOM 1545 N GLU A 493 -0.680 -14.970 7.219 1.00 33.25 N ATOM 1546 CA GLU A 493 -1.939 -15.149 7.922 1.00 22.04 C ATOM 1547 C GLU A 493 -3.069 -15.420 6.927 1.00 11.43 C ATOM 1548 O GLU A 493 -4.125 -15.928 7.304 1.00 60.02 O ATOM 1549 CB GLU A 493 -2.256 -13.935 8.797 1.00 32.13 C ATOM 1550 CG GLU A 493 -1.452 -13.970 10.096 1.00 64.31 C ATOM 1551 CD GLU A 493 -1.711 -15.267 10.866 1.00 64.22 C ATOM 1552 OE1 GLU A 493 -2.832 -15.488 11.347 1.00 24.43 O ATOM 1553 OE2 GLU A 493 -0.696 -16.059 10.958 1.00 44.34 O ATOM 0 H GLU A 493 -0.337 -14.010 7.196 1.00 33.25 H new ATOM 0 HA GLU A 493 -1.846 -16.014 8.579 1.00 22.04 H new ATOM 0 HB2 GLU A 493 -2.030 -13.019 8.250 1.00 32.13 H new ATOM 0 HB3 GLU A 493 -3.322 -13.915 9.025 1.00 32.13 H new ATOM 0 HG2 GLU A 493 -0.389 -13.882 9.872 1.00 64.31 H new ATOM 0 HG3 GLU A 493 -1.719 -13.115 10.717 1.00 64.31 H new ATOM 1559 N SER A 494 -2.811 -15.069 5.676 1.00 33.44 N ATOM 1560 CA SER A 494 -3.793 -15.268 4.624 1.00 22.34 C ATOM 1561 C SER A 494 -3.146 -15.971 3.430 1.00 33.00 C ATOM 1562 O SER A 494 -1.948 -16.249 3.442 1.00 53.23 O ATOM 1563 CB SER A 494 -4.408 -13.938 4.189 1.00 14.44 C ATOM 1564 OG SER A 494 -5.373 -13.463 5.124 1.00 42.11 O ATOM 0 H SER A 494 -1.935 -14.648 5.367 1.00 33.44 H new ATOM 0 HA SER A 494 -4.593 -15.896 5.016 1.00 22.34 H new ATOM 0 HB2 SER A 494 -3.619 -13.195 4.074 1.00 14.44 H new ATOM 0 HB3 SER A 494 -4.878 -14.058 3.213 1.00 14.44 H new ATOM 0 HG SER A 494 -4.921 -13.182 5.947 1.00 42.11 H new ATOM 1569 N SER A 495 -3.969 -16.240 2.425 1.00 70.13 N ATOM 1570 CA SER A 495 -3.491 -16.905 1.225 1.00 43.20 C ATOM 1571 C SER A 495 -4.272 -16.409 0.006 1.00 1.41 C ATOM 1572 O SER A 495 -5.346 -15.828 0.147 1.00 50.44 O ATOM 1573 CB SER A 495 -3.614 -18.424 1.352 1.00 35.32 C ATOM 1574 OG SER A 495 -2.407 -19.021 1.819 1.00 61.22 O ATOM 0 H SER A 495 -4.963 -16.009 2.418 1.00 70.13 H new ATOM 0 HA SER A 495 -2.436 -16.663 1.096 1.00 43.20 H new ATOM 0 HB2 SER A 495 -4.427 -18.666 2.037 1.00 35.32 H new ATOM 0 HB3 SER A 495 -3.877 -18.849 0.383 1.00 35.32 H new ATOM 0 HG SER A 495 -1.948 -18.401 2.423 1.00 61.22 H new ATOM 1579 N PRO A 496 -3.685 -16.663 -1.195 1.00 2.54 N ATOM 1580 CA PRO A 496 -4.315 -16.250 -2.437 1.00 41.13 C ATOM 1581 C PRO A 496 -5.498 -17.158 -2.782 1.00 70.12 C ATOM 1582 O PRO A 496 -6.473 -16.712 -3.384 1.00 53.32 O ATOM 1583 CB PRO A 496 -3.205 -16.298 -3.475 1.00 14.25 C ATOM 1584 CG PRO A 496 -2.117 -17.177 -2.881 1.00 43.32 C ATOM 1585 CD PRO A 496 -2.413 -17.350 -1.400 1.00 53.44 C ATOM 0 HA PRO A 496 -4.745 -15.250 -2.379 1.00 41.13 H new ATOM 0 HB2 PRO A 496 -3.568 -16.709 -4.417 1.00 14.25 H new ATOM 0 HB3 PRO A 496 -2.826 -15.298 -3.689 1.00 14.25 H new ATOM 0 HG2 PRO A 496 -2.093 -18.145 -3.381 1.00 43.32 H new ATOM 0 HG3 PRO A 496 -1.137 -16.721 -3.024 1.00 43.32 H new ATOM 0 HD2 PRO A 496 -2.484 -18.404 -1.131 1.00 53.44 H new ATOM 0 HD3 PRO A 496 -1.625 -16.916 -0.785 1.00 53.44 H new ATOM 1590 N ALA A 497 -5.371 -18.415 -2.387 1.00 4.22 N ATOM 1591 CA ALA A 497 -6.416 -19.391 -2.646 1.00 73.23 C ATOM 1592 C ALA A 497 -7.710 -18.938 -1.967 1.00 11.14 C ATOM 1593 O ALA A 497 -8.803 -19.207 -2.463 1.00 24.43 O ATOM 1594 CB ALA A 497 -5.958 -20.770 -2.168 1.00 12.21 C ATOM 0 H ALA A 497 -4.560 -18.781 -1.889 1.00 4.22 H new ATOM 0 HA ALA A 497 -6.614 -19.467 -3.715 1.00 73.23 H new ATOM 0 HB1 ALA A 497 -6.742 -21.502 -2.363 1.00 12.21 H new ATOM 0 HB2 ALA A 497 -5.053 -21.058 -2.702 1.00 12.21 H new ATOM 0 HB3 ALA A 497 -5.752 -20.734 -1.098 1.00 12.21 H new ATOM 1600 N GLN A 498 -7.545 -18.257 -0.843 1.00 63.22 N ATOM 1601 CA GLN A 498 -8.684 -17.764 -0.091 1.00 12.30 C ATOM 1602 C GLN A 498 -9.406 -16.668 -0.878 1.00 0.42 C ATOM 1603 O GLN A 498 -10.515 -16.269 -0.520 1.00 70.53 O ATOM 1604 CB GLN A 498 -8.255 -17.256 1.288 1.00 72.54 C ATOM 1605 CG GLN A 498 -7.134 -18.121 1.866 1.00 11.42 C ATOM 1606 CD GLN A 498 -7.202 -18.158 3.394 1.00 40.25 C ATOM 1607 OE1 GLN A 498 -7.028 -17.159 4.073 1.00 12.42 O ATOM 1608 NE2 GLN A 498 -7.464 -19.362 3.896 1.00 32.01 N ATOM 0 H GLN A 498 -6.637 -18.035 -0.435 1.00 63.22 H new ATOM 0 HA GLN A 498 -9.377 -18.591 0.063 1.00 12.30 H new ATOM 0 HB2 GLN A 498 -7.918 -16.222 1.210 1.00 72.54 H new ATOM 0 HB3 GLN A 498 -9.110 -17.263 1.964 1.00 72.54 H new ATOM 0 HG2 GLN A 498 -7.211 -19.134 1.470 1.00 11.42 H new ATOM 0 HG3 GLN A 498 -6.167 -17.728 1.551 1.00 11.42 H new ATOM 0 HE21 GLN A 498 -7.599 -20.157 3.271 1.00 32.01 H new ATOM 0 HE22 GLN A 498 -7.530 -19.490 4.906 1.00 32.01 H new ATOM 1615 N LEU A 499 -8.751 -16.214 -1.935 1.00 33.12 N ATOM 1616 CA LEU A 499 -9.316 -15.172 -2.776 1.00 31.14 C ATOM 1617 C LEU A 499 -9.956 -15.811 -4.011 1.00 43.51 C ATOM 1618 O LEU A 499 -9.748 -16.993 -4.281 1.00 44.24 O ATOM 1619 CB LEU A 499 -8.258 -14.118 -3.109 1.00 21.35 C ATOM 1620 CG LEU A 499 -7.178 -13.894 -2.048 1.00 12.20 C ATOM 1621 CD1 LEU A 499 -6.212 -12.788 -2.475 1.00 63.54 C ATOM 1622 CD2 LEU A 499 -7.804 -13.611 -0.680 1.00 10.24 C ATOM 0 H LEU A 499 -7.833 -16.548 -2.229 1.00 33.12 H new ATOM 0 HA LEU A 499 -10.105 -14.641 -2.244 1.00 31.14 H new ATOM 0 HB2 LEU A 499 -7.770 -14.403 -4.041 1.00 21.35 H new ATOM 0 HB3 LEU A 499 -8.763 -13.169 -3.291 1.00 21.35 H new ATOM 0 HG LEU A 499 -6.597 -14.811 -1.953 1.00 12.20 H new ATOM 0 HD11 LEU A 499 -5.455 -12.649 -1.704 1.00 63.54 H new ATOM 0 HD12 LEU A 499 -5.729 -13.068 -3.411 1.00 63.54 H new ATOM 0 HD13 LEU A 499 -6.763 -11.858 -2.615 1.00 63.54 H new ATOM 0 HD21 LEU A 499 -7.015 -13.456 0.056 1.00 10.24 H new ATOM 0 HD22 LEU A 499 -8.424 -12.717 -0.742 1.00 10.24 H new ATOM 0 HD23 LEU A 499 -8.419 -14.459 -0.379 1.00 10.24 H new ATOM 1633 N SER A 500 -10.723 -15.001 -4.725 1.00 3.23 N ATOM 1634 CA SER A 500 -11.396 -15.472 -5.924 1.00 3.25 C ATOM 1635 C SER A 500 -10.363 -15.857 -6.986 1.00 1.22 C ATOM 1636 O SER A 500 -9.233 -15.373 -6.963 1.00 42.04 O ATOM 1637 CB SER A 500 -12.352 -14.412 -6.472 1.00 2.12 C ATOM 1638 OG SER A 500 -13.615 -14.440 -5.814 1.00 4.43 O ATOM 0 H SER A 500 -10.894 -14.022 -4.497 1.00 3.23 H new ATOM 0 HA SER A 500 -11.985 -16.351 -5.663 1.00 3.25 H new ATOM 0 HB2 SER A 500 -11.904 -13.425 -6.355 1.00 2.12 H new ATOM 0 HB3 SER A 500 -12.496 -14.572 -7.540 1.00 2.12 H new ATOM 0 HG SER A 500 -14.196 -13.747 -6.192 1.00 4.43 H new ATOM 1643 N SER A 501 -10.789 -16.725 -7.893 1.00 44.33 N ATOM 1644 CA SER A 501 -9.916 -17.179 -8.961 1.00 12.12 C ATOM 1645 C SER A 501 -9.580 -16.014 -9.894 1.00 11.23 C ATOM 1646 O SER A 501 -8.706 -16.132 -10.751 1.00 30.40 O ATOM 1647 CB SER A 501 -10.561 -18.322 -9.750 1.00 73.13 C ATOM 1648 OG SER A 501 -9.699 -18.815 -10.773 1.00 3.13 O ATOM 0 H SER A 501 -11.727 -17.125 -7.909 1.00 44.33 H new ATOM 0 HA SER A 501 -8.996 -17.555 -8.514 1.00 12.12 H new ATOM 0 HB2 SER A 501 -10.817 -19.134 -9.069 1.00 73.13 H new ATOM 0 HB3 SER A 501 -11.493 -17.974 -10.197 1.00 73.13 H new ATOM 0 HG SER A 501 -9.112 -18.094 -11.082 1.00 3.13 H new ATOM 1653 N ASP A 502 -10.293 -14.915 -9.697 1.00 4.44 N ATOM 1654 CA ASP A 502 -10.083 -13.729 -10.510 1.00 24.53 C ATOM 1655 C ASP A 502 -8.871 -12.959 -9.976 1.00 11.54 C ATOM 1656 O ASP A 502 -8.174 -12.290 -10.735 1.00 32.12 O ATOM 1657 CB ASP A 502 -11.296 -12.799 -10.453 1.00 13.33 C ATOM 1658 CG ASP A 502 -12.633 -13.460 -10.793 1.00 34.11 C ATOM 1659 OD1 ASP A 502 -12.897 -13.807 -11.954 1.00 11.03 O ATOM 1660 OD2 ASP A 502 -13.433 -13.618 -9.794 1.00 40.30 O ATOM 0 H ASP A 502 -11.018 -14.821 -8.985 1.00 4.44 H new ATOM 0 HA ASP A 502 -9.924 -14.050 -11.539 1.00 24.53 H new ATOM 0 HB2 ASP A 502 -11.362 -12.374 -9.452 1.00 13.33 H new ATOM 0 HB3 ASP A 502 -11.132 -11.970 -11.141 1.00 13.33 H new ATOM 1665 N THR A 503 -8.661 -13.081 -8.673 1.00 74.32 N ATOM 1666 CA THR A 503 -7.547 -12.405 -8.030 1.00 41.20 C ATOM 1667 C THR A 503 -6.256 -12.638 -8.815 1.00 70.12 C ATOM 1668 O THR A 503 -5.532 -11.694 -9.122 1.00 40.35 O ATOM 1669 CB THR A 503 -7.474 -12.891 -6.580 1.00 54.22 C ATOM 1670 OG1 THR A 503 -8.791 -12.682 -6.077 1.00 22.22 O ATOM 1671 CG2 THR A 503 -6.595 -11.995 -5.707 1.00 62.23 C ATOM 0 H THR A 503 -9.243 -13.637 -8.046 1.00 74.32 H new ATOM 0 HA THR A 503 -7.692 -11.325 -8.020 1.00 41.20 H new ATOM 0 HB THR A 503 -7.089 -13.910 -6.558 1.00 54.22 H new ATOM 0 HG1 THR A 503 -8.873 -11.763 -5.747 1.00 22.22 H new ATOM 0 HG21 THR A 503 -6.577 -12.384 -4.689 1.00 62.23 H new ATOM 0 HG22 THR A 503 -5.581 -11.979 -6.107 1.00 62.23 H new ATOM 0 HG23 THR A 503 -6.999 -10.983 -5.702 1.00 62.23 H new ATOM 1679 N ALA A 504 -6.005 -13.904 -9.118 1.00 22.13 N ATOM 1680 CA ALA A 504 -4.814 -14.274 -9.862 1.00 64.14 C ATOM 1681 C ALA A 504 -4.640 -13.321 -11.046 1.00 43.13 C ATOM 1682 O ALA A 504 -3.517 -13.021 -11.448 1.00 4.32 O ATOM 1683 CB ALA A 504 -4.919 -15.736 -10.300 1.00 51.41 C ATOM 0 H ALA A 504 -6.607 -14.686 -8.861 1.00 22.13 H new ATOM 0 HA ALA A 504 -3.927 -14.185 -9.235 1.00 64.14 H new ATOM 0 HB1 ALA A 504 -4.025 -16.014 -10.858 1.00 51.41 H new ATOM 0 HB2 ALA A 504 -5.010 -16.374 -9.421 1.00 51.41 H new ATOM 0 HB3 ALA A 504 -5.797 -15.864 -10.933 1.00 51.41 H new ATOM 1689 N SER A 505 -5.770 -12.871 -11.573 1.00 42.32 N ATOM 1690 CA SER A 505 -5.757 -11.958 -12.702 1.00 51.43 C ATOM 1691 C SER A 505 -5.730 -10.511 -12.206 1.00 70.24 C ATOM 1692 O SER A 505 -5.186 -9.632 -12.873 1.00 15.02 O ATOM 1693 CB SER A 505 -6.970 -12.186 -13.607 1.00 55.55 C ATOM 1694 OG SER A 505 -6.844 -11.499 -14.850 1.00 51.33 O ATOM 0 H SER A 505 -6.700 -13.122 -11.238 1.00 42.32 H new ATOM 0 HA SER A 505 -4.858 -12.151 -13.287 1.00 51.43 H new ATOM 0 HB2 SER A 505 -7.088 -13.253 -13.793 1.00 55.55 H new ATOM 0 HB3 SER A 505 -7.872 -11.849 -13.096 1.00 55.55 H new ATOM 0 HG SER A 505 -7.637 -11.670 -15.400 1.00 51.33 H new ATOM 1699 N LEU A 506 -6.323 -10.307 -11.039 1.00 10.35 N ATOM 1700 CA LEU A 506 -6.372 -8.982 -10.446 1.00 45.11 C ATOM 1701 C LEU A 506 -4.949 -8.446 -10.284 1.00 12.05 C ATOM 1702 O LEU A 506 -4.702 -7.260 -10.490 1.00 44.22 O ATOM 1703 CB LEU A 506 -7.171 -9.009 -9.140 1.00 1.30 C ATOM 1704 CG LEU A 506 -8.636 -9.436 -9.258 1.00 23.10 C ATOM 1705 CD1 LEU A 506 -9.294 -9.524 -7.881 1.00 65.13 C ATOM 1706 CD2 LEU A 506 -9.403 -8.507 -10.202 1.00 40.25 C ATOM 0 H LEU A 506 -6.774 -11.038 -10.488 1.00 10.35 H new ATOM 0 HA LEU A 506 -6.900 -8.291 -11.103 1.00 45.11 H new ATOM 0 HB2 LEU A 506 -6.671 -9.684 -8.446 1.00 1.30 H new ATOM 0 HB3 LEU A 506 -7.138 -8.014 -8.696 1.00 1.30 H new ATOM 0 HG LEU A 506 -8.667 -10.435 -9.693 1.00 23.10 H new ATOM 0 HD11 LEU A 506 -10.334 -9.829 -7.994 1.00 65.13 H new ATOM 0 HD12 LEU A 506 -8.765 -10.256 -7.271 1.00 65.13 H new ATOM 0 HD13 LEU A 506 -9.253 -8.549 -7.395 1.00 65.13 H new ATOM 0 HD21 LEU A 506 -10.441 -8.832 -10.268 1.00 40.25 H new ATOM 0 HD22 LEU A 506 -9.366 -7.487 -9.819 1.00 40.25 H new ATOM 0 HD23 LEU A 506 -8.949 -8.539 -11.192 1.00 40.25 H new ATOM 1717 N LEU A 507 -4.049 -9.347 -9.918 1.00 41.22 N ATOM 1718 CA LEU A 507 -2.657 -8.979 -9.727 1.00 35.12 C ATOM 1719 C LEU A 507 -1.852 -9.386 -10.964 1.00 21.05 C ATOM 1720 O LEU A 507 -0.626 -9.463 -10.912 1.00 72.54 O ATOM 1721 CB LEU A 507 -2.121 -9.572 -8.422 1.00 3.10 C ATOM 1722 CG LEU A 507 -2.622 -10.973 -8.066 1.00 1.10 C ATOM 1723 CD1 LEU A 507 -1.535 -11.778 -7.349 1.00 11.52 C ATOM 1724 CD2 LEU A 507 -3.914 -10.901 -7.249 1.00 73.21 C ATOM 0 H LEU A 507 -4.257 -10.331 -9.749 1.00 41.22 H new ATOM 0 HA LEU A 507 -2.559 -7.898 -9.624 1.00 35.12 H new ATOM 0 HB2 LEU A 507 -1.033 -9.601 -8.479 1.00 3.10 H new ATOM 0 HB3 LEU A 507 -2.380 -8.897 -7.606 1.00 3.10 H new ATOM 0 HG LEU A 507 -2.855 -11.499 -8.992 1.00 1.10 H new ATOM 0 HD11 LEU A 507 -1.917 -12.770 -7.107 1.00 11.52 H new ATOM 0 HD12 LEU A 507 -0.664 -11.873 -7.998 1.00 11.52 H new ATOM 0 HD13 LEU A 507 -1.249 -11.265 -6.431 1.00 11.52 H new ATOM 0 HD21 LEU A 507 -4.249 -11.910 -7.009 1.00 73.21 H new ATOM 0 HD22 LEU A 507 -3.731 -10.350 -6.326 1.00 73.21 H new ATOM 0 HD23 LEU A 507 -4.683 -10.391 -7.829 1.00 73.21 H new ATOM 1735 N SER A 508 -2.576 -9.637 -12.044 1.00 14.21 N ATOM 1736 CA SER A 508 -1.945 -10.033 -13.292 1.00 23.41 C ATOM 1737 C SER A 508 -0.843 -9.039 -13.660 1.00 61.40 C ATOM 1738 O SER A 508 -1.127 -7.924 -14.095 1.00 34.52 O ATOM 1739 CB SER A 508 -2.971 -10.131 -14.422 1.00 53.22 C ATOM 1740 OG SER A 508 -2.351 -10.203 -15.702 1.00 11.04 O ATOM 0 H SER A 508 -3.593 -9.574 -12.081 1.00 14.21 H new ATOM 0 HA SER A 508 -1.503 -11.020 -13.153 1.00 23.41 H new ATOM 0 HB2 SER A 508 -3.593 -11.013 -14.271 1.00 53.22 H new ATOM 0 HB3 SER A 508 -3.632 -9.265 -14.388 1.00 53.22 H new ATOM 0 HG SER A 508 -3.040 -10.266 -16.396 1.00 11.04 H new ATOM 1745 N GLY A 509 0.393 -9.477 -13.471 1.00 73.34 N ATOM 1746 CA GLY A 509 1.540 -8.639 -13.778 1.00 64.31 C ATOM 1747 C GLY A 509 1.951 -7.804 -12.564 1.00 4.45 C ATOM 1748 O GLY A 509 3.129 -7.501 -12.382 1.00 1.31 O ATOM 0 H GLY A 509 0.625 -10.402 -13.109 1.00 73.34 H new ATOM 0 HA2 GLY A 509 2.376 -9.263 -14.094 1.00 64.31 H new ATOM 0 HA3 GLY A 509 1.300 -7.980 -14.612 1.00 64.31 H new ATOM 1752 N LEU A 510 0.954 -7.456 -11.762 1.00 70.15 N ATOM 1753 CA LEU A 510 1.197 -6.662 -10.570 1.00 52.31 C ATOM 1754 C LEU A 510 2.378 -7.253 -9.799 1.00 23.31 C ATOM 1755 O LEU A 510 2.875 -8.325 -10.143 1.00 14.53 O ATOM 1756 CB LEU A 510 -0.082 -6.539 -9.738 1.00 3.53 C ATOM 1757 CG LEU A 510 -1.289 -5.924 -10.448 1.00 13.11 C ATOM 1758 CD1 LEU A 510 -2.305 -5.387 -9.440 1.00 52.55 C ATOM 1759 CD2 LEU A 510 -0.849 -4.849 -11.445 1.00 40.32 C ATOM 0 H LEU A 510 -0.022 -7.709 -11.915 1.00 70.15 H new ATOM 0 HA LEU A 510 1.472 -5.643 -10.841 1.00 52.31 H new ATOM 0 HB2 LEU A 510 -0.360 -7.533 -9.387 1.00 3.53 H new ATOM 0 HB3 LEU A 510 0.139 -5.939 -8.855 1.00 3.53 H new ATOM 0 HG LEU A 510 -1.786 -6.709 -11.018 1.00 13.11 H new ATOM 0 HD11 LEU A 510 -3.153 -4.956 -9.972 1.00 52.55 H new ATOM 0 HD12 LEU A 510 -2.652 -6.202 -8.804 1.00 52.55 H new ATOM 0 HD13 LEU A 510 -1.836 -4.620 -8.823 1.00 52.55 H new ATOM 0 HD21 LEU A 510 -1.726 -4.428 -11.936 1.00 40.32 H new ATOM 0 HD22 LEU A 510 -0.315 -4.059 -10.917 1.00 40.32 H new ATOM 0 HD23 LEU A 510 -0.193 -5.293 -12.193 1.00 40.32 H new ATOM 1770 N VAL A 511 2.793 -6.530 -8.768 1.00 33.31 N ATOM 1771 CA VAL A 511 3.907 -6.971 -7.946 1.00 33.44 C ATOM 1772 C VAL A 511 3.380 -7.414 -6.579 1.00 64.51 C ATOM 1773 O VAL A 511 3.128 -6.583 -5.709 1.00 42.03 O ATOM 1774 CB VAL A 511 4.957 -5.863 -7.852 1.00 62.43 C ATOM 1775 CG1 VAL A 511 6.056 -6.233 -6.852 1.00 31.51 C ATOM 1776 CG2 VAL A 511 5.551 -5.551 -9.228 1.00 2.33 C ATOM 0 H VAL A 511 2.378 -5.643 -8.484 1.00 33.31 H new ATOM 0 HA VAL A 511 4.401 -7.831 -8.399 1.00 33.44 H new ATOM 0 HB VAL A 511 4.462 -4.962 -7.489 1.00 62.43 H new ATOM 0 HG11 VAL A 511 6.790 -5.429 -6.804 1.00 31.51 H new ATOM 0 HG12 VAL A 511 5.616 -6.382 -5.866 1.00 31.51 H new ATOM 0 HG13 VAL A 511 6.546 -7.152 -7.173 1.00 31.51 H new ATOM 0 HG21 VAL A 511 6.295 -4.760 -9.132 1.00 2.33 H new ATOM 0 HG22 VAL A 511 6.024 -6.446 -9.632 1.00 2.33 H new ATOM 0 HG23 VAL A 511 4.758 -5.224 -9.901 1.00 2.33 H new ATOM 1786 N ARG A 512 3.232 -8.723 -6.435 1.00 44.30 N ATOM 1787 CA ARG A 512 2.741 -9.286 -5.187 1.00 34.23 C ATOM 1788 C ARG A 512 3.912 -9.698 -4.294 1.00 43.24 C ATOM 1789 O ARG A 512 4.860 -10.330 -4.758 1.00 63.11 O ATOM 1790 CB ARG A 512 1.854 -10.505 -5.447 1.00 12.30 C ATOM 1791 CG ARG A 512 1.654 -11.320 -4.168 1.00 62.23 C ATOM 1792 CD ARG A 512 0.384 -12.170 -4.251 1.00 63.14 C ATOM 1793 NE ARG A 512 0.704 -13.504 -4.802 1.00 21.43 N ATOM 1794 CZ ARG A 512 -0.224 -14.390 -5.225 1.00 22.44 C ATOM 1795 NH1 ARG A 512 -1.538 -14.089 -5.161 1.00 34.40 N ATOM 1796 NH2 ARG A 512 0.174 -15.555 -5.702 1.00 21.21 N ATOM 0 H ARG A 512 3.443 -9.409 -7.160 1.00 44.30 H new ATOM 0 HA ARG A 512 2.150 -8.519 -4.686 1.00 34.23 H new ATOM 0 HB2 ARG A 512 0.887 -10.180 -5.831 1.00 12.30 H new ATOM 0 HB3 ARG A 512 2.307 -11.132 -6.215 1.00 12.30 H new ATOM 0 HG2 ARG A 512 2.517 -11.965 -4.005 1.00 62.23 H new ATOM 0 HG3 ARG A 512 1.591 -10.649 -3.311 1.00 62.23 H new ATOM 0 HD2 ARG A 512 -0.060 -12.273 -3.261 1.00 63.14 H new ATOM 0 HD3 ARG A 512 -0.355 -11.675 -4.881 1.00 63.14 H new ATOM 0 HE ARG A 512 1.686 -13.772 -4.867 1.00 21.43 H new ATOM 0 HH11 ARG A 512 -1.837 -13.187 -4.791 1.00 34.40 H new ATOM 0 HH12 ARG A 512 -2.232 -14.764 -5.483 1.00 34.40 H new ATOM 0 HH21 ARG A 512 1.169 -15.775 -5.747 1.00 21.21 H new ATOM 0 HH22 ARG A 512 -0.514 -16.235 -6.026 1.00 21.21 H new ATOM 1806 N LEU A 513 3.809 -9.322 -3.027 1.00 21.32 N ATOM 1807 CA LEU A 513 4.849 -9.643 -2.064 1.00 4.10 C ATOM 1808 C LEU A 513 4.361 -10.774 -1.155 1.00 70.33 C ATOM 1809 O LEU A 513 3.162 -11.029 -1.062 1.00 75.42 O ATOM 1810 CB LEU A 513 5.283 -8.388 -1.306 1.00 30.50 C ATOM 1811 CG LEU A 513 6.184 -7.419 -2.075 1.00 53.14 C ATOM 1812 CD1 LEU A 513 6.963 -8.147 -3.172 1.00 21.24 C ATOM 1813 CD2 LEU A 513 5.376 -6.244 -2.630 1.00 64.35 C ATOM 0 H LEU A 513 3.021 -8.798 -2.645 1.00 21.32 H new ATOM 0 HA LEU A 513 5.743 -10.004 -2.572 1.00 4.10 H new ATOM 0 HB2 LEU A 513 4.389 -7.850 -0.992 1.00 30.50 H new ATOM 0 HB3 LEU A 513 5.804 -8.697 -0.400 1.00 30.50 H new ATOM 0 HG LEU A 513 6.916 -7.008 -1.380 1.00 53.14 H new ATOM 0 HD11 LEU A 513 7.595 -7.435 -3.703 1.00 21.24 H new ATOM 0 HD12 LEU A 513 7.586 -8.921 -2.724 1.00 21.24 H new ATOM 0 HD13 LEU A 513 6.264 -8.604 -3.872 1.00 21.24 H new ATOM 0 HD21 LEU A 513 6.039 -5.570 -3.172 1.00 64.35 H new ATOM 0 HD22 LEU A 513 4.607 -6.618 -3.306 1.00 64.35 H new ATOM 0 HD23 LEU A 513 4.905 -5.706 -1.808 1.00 64.35 H new ATOM 1824 N ASP A 514 5.318 -11.421 -0.505 1.00 71.45 N ATOM 1825 CA ASP A 514 5.002 -12.518 0.393 1.00 63.13 C ATOM 1826 C ASP A 514 5.983 -12.508 1.568 1.00 42.14 C ATOM 1827 O ASP A 514 7.189 -12.371 1.373 1.00 61.15 O ATOM 1828 CB ASP A 514 5.130 -13.866 -0.317 1.00 4.13 C ATOM 1829 CG ASP A 514 4.006 -14.187 -1.304 1.00 35.12 C ATOM 1830 OD1 ASP A 514 3.899 -13.568 -2.374 1.00 44.25 O ATOM 1831 OD2 ASP A 514 3.207 -15.129 -0.933 1.00 41.54 O ATOM 0 H ASP A 514 6.312 -11.206 -0.583 1.00 71.45 H new ATOM 0 HA ASP A 514 3.976 -12.387 0.736 1.00 63.13 H new ATOM 0 HB2 ASP A 514 6.080 -13.889 -0.851 1.00 4.13 H new ATOM 0 HB3 ASP A 514 5.168 -14.654 0.435 1.00 4.13 H new ATOM 1836 N GLU A 515 5.428 -12.653 2.762 1.00 1.13 N ATOM 1837 CA GLU A 515 6.237 -12.662 3.969 1.00 31.53 C ATOM 1838 C GLU A 515 6.891 -14.032 4.159 1.00 23.45 C ATOM 1839 O GLU A 515 7.568 -14.267 5.158 1.00 23.44 O ATOM 1840 CB GLU A 515 5.405 -12.278 5.192 1.00 54.40 C ATOM 1841 CG GLU A 515 6.303 -11.861 6.359 1.00 11.43 C ATOM 1842 CD GLU A 515 7.059 -10.571 6.033 1.00 43.11 C ATOM 1843 OE1 GLU A 515 8.017 -10.596 5.248 1.00 70.02 O ATOM 1844 OE2 GLU A 515 6.619 -9.515 6.631 1.00 32.01 O ATOM 0 H GLU A 515 4.427 -12.765 2.920 1.00 1.13 H new ATOM 0 HA GLU A 515 7.024 -11.916 3.859 1.00 31.53 H new ATOM 0 HB2 GLU A 515 4.732 -11.459 4.936 1.00 54.40 H new ATOM 0 HB3 GLU A 515 4.782 -13.121 5.491 1.00 54.40 H new ATOM 0 HG2 GLU A 515 5.699 -11.717 7.254 1.00 11.43 H new ATOM 0 HG3 GLU A 515 7.013 -12.658 6.579 1.00 11.43 H new ATOM 1850 N HIS A 516 6.665 -14.900 3.184 1.00 0.21 N ATOM 1851 CA HIS A 516 7.224 -16.242 3.231 1.00 41.43 C ATOM 1852 C HIS A 516 8.037 -16.504 1.962 1.00 45.20 C ATOM 1853 O HIS A 516 8.009 -17.609 1.421 1.00 42.34 O ATOM 1854 CB HIS A 516 6.123 -17.281 3.457 1.00 50.22 C ATOM 1855 CG HIS A 516 4.995 -17.208 2.455 1.00 62.14 C ATOM 1856 ND1 HIS A 516 3.681 -17.489 2.784 1.00 14.32 N ATOM 1857 CD2 HIS A 516 4.999 -16.879 1.132 1.00 33.32 C ATOM 1858 CE1 HIS A 516 2.937 -17.336 1.700 1.00 1.41 C ATOM 1859 NE2 HIS A 516 3.754 -16.959 0.676 1.00 41.02 N ATOM 0 H HIS A 516 6.103 -14.701 2.357 1.00 0.21 H new ATOM 0 HA HIS A 516 7.903 -16.328 4.079 1.00 41.43 H new ATOM 0 HB2 HIS A 516 6.564 -18.277 3.420 1.00 50.22 H new ATOM 0 HB3 HIS A 516 5.714 -17.150 4.459 1.00 50.22 H new ATOM 0 HD2 HIS A 516 5.867 -16.601 0.553 1.00 33.32 H new ATOM 0 HE1 HIS A 516 1.869 -17.484 1.638 1.00 1.41 H new ATOM 0 HE2 HIS A 516 3.458 -16.770 -0.282 1.00 41.02 H new ATOM 1866 N SER A 517 8.742 -15.471 1.525 1.00 44.34 N ATOM 1867 CA SER A 517 9.561 -15.576 0.330 1.00 24.52 C ATOM 1868 C SER A 517 10.945 -14.976 0.591 1.00 30.14 C ATOM 1869 O SER A 517 11.057 -13.833 1.027 1.00 60.24 O ATOM 1870 CB SER A 517 8.895 -14.879 -0.857 1.00 33.43 C ATOM 1871 OG SER A 517 9.302 -15.441 -2.102 1.00 13.14 O ATOM 0 H SER A 517 8.763 -14.557 1.977 1.00 44.34 H new ATOM 0 HA SER A 517 9.670 -16.632 0.081 1.00 24.52 H new ATOM 0 HB2 SER A 517 7.812 -14.955 -0.761 1.00 33.43 H new ATOM 0 HB3 SER A 517 9.143 -13.818 -0.840 1.00 33.43 H new ATOM 0 HG SER A 517 8.854 -14.970 -2.835 1.00 13.14 H new ATOM 1876 N GLN A 518 11.964 -15.776 0.310 1.00 51.53 N ATOM 1877 CA GLN A 518 13.335 -15.339 0.508 1.00 72.51 C ATOM 1878 C GLN A 518 13.750 -14.372 -0.603 1.00 1.21 C ATOM 1879 O GLN A 518 14.875 -13.873 -0.608 1.00 54.54 O ATOM 1880 CB GLN A 518 14.287 -16.534 0.578 1.00 31.25 C ATOM 1881 CG GLN A 518 14.388 -17.235 -0.779 1.00 64.11 C ATOM 1882 CD GLN A 518 13.329 -18.330 -0.911 1.00 30.42 C ATOM 1883 OE1 GLN A 518 13.024 -19.051 0.027 1.00 33.51 O ATOM 1884 NE2 GLN A 518 12.787 -18.417 -2.122 1.00 14.33 N ATOM 0 H GLN A 518 11.867 -16.724 -0.053 1.00 51.53 H new ATOM 0 HA GLN A 518 13.394 -14.813 1.461 1.00 72.51 H new ATOM 0 HB2 GLN A 518 15.275 -16.198 0.892 1.00 31.25 H new ATOM 0 HB3 GLN A 518 13.936 -17.240 1.331 1.00 31.25 H new ATOM 0 HG2 GLN A 518 14.263 -16.505 -1.579 1.00 64.11 H new ATOM 0 HG3 GLN A 518 15.381 -17.669 -0.895 1.00 64.11 H new ATOM 0 HE21 GLN A 518 13.088 -17.783 -2.862 1.00 14.33 H new ATOM 0 HE22 GLN A 518 12.070 -19.118 -2.311 1.00 14.33 H new ATOM 1891 N ILE A 519 12.819 -14.137 -1.516 1.00 1.12 N ATOM 1892 CA ILE A 519 13.073 -13.239 -2.630 1.00 63.43 C ATOM 1893 C ILE A 519 12.254 -11.960 -2.446 1.00 32.41 C ATOM 1894 O ILE A 519 12.635 -10.899 -2.934 1.00 70.33 O ATOM 1895 CB ILE A 519 12.816 -13.949 -3.961 1.00 3.13 C ATOM 1896 CG1 ILE A 519 12.113 -13.017 -4.951 1.00 23.33 C ATOM 1897 CG2 ILE A 519 12.038 -15.250 -3.747 1.00 60.44 C ATOM 1898 CD1 ILE A 519 13.057 -11.909 -5.425 1.00 43.20 C ATOM 0 H ILE A 519 11.888 -14.553 -1.507 1.00 1.12 H new ATOM 0 HA ILE A 519 14.122 -12.945 -2.650 1.00 63.43 H new ATOM 0 HB ILE A 519 13.778 -14.217 -4.398 1.00 3.13 H new ATOM 0 HG12 ILE A 519 11.760 -13.590 -5.808 1.00 23.33 H new ATOM 0 HG13 ILE A 519 11.235 -12.575 -4.480 1.00 23.33 H new ATOM 0 HG21 ILE A 519 11.869 -15.735 -4.708 1.00 60.44 H new ATOM 0 HG22 ILE A 519 12.612 -15.915 -3.101 1.00 60.44 H new ATOM 0 HG23 ILE A 519 11.079 -15.028 -3.279 1.00 60.44 H new ATOM 0 HD11 ILE A 519 12.533 -11.261 -6.127 1.00 43.20 H new ATOM 0 HD12 ILE A 519 13.389 -11.323 -4.568 1.00 43.20 H new ATOM 0 HD13 ILE A 519 13.922 -12.354 -5.917 1.00 43.20 H new ATOM 1909 N PHE A 520 11.142 -12.105 -1.740 1.00 22.32 N ATOM 1910 CA PHE A 520 10.265 -10.975 -1.485 1.00 73.12 C ATOM 1911 C PHE A 520 11.074 -9.713 -1.178 1.00 3.44 C ATOM 1912 O PHE A 520 10.671 -8.609 -1.543 1.00 2.12 O ATOM 1913 CB PHE A 520 9.417 -11.334 -0.265 1.00 1.52 C ATOM 1914 CG PHE A 520 9.041 -10.134 0.608 1.00 61.50 C ATOM 1915 CD1 PHE A 520 8.115 -9.238 0.171 1.00 22.21 C ATOM 1916 CD2 PHE A 520 9.635 -9.962 1.820 1.00 53.14 C ATOM 1917 CE1 PHE A 520 7.768 -8.125 0.980 1.00 61.01 C ATOM 1918 CE2 PHE A 520 9.288 -8.848 2.629 1.00 5.14 C ATOM 1919 CZ PHE A 520 8.360 -7.954 2.193 1.00 73.55 C ATOM 0 H PHE A 520 10.828 -12.988 -1.337 1.00 22.32 H new ATOM 0 HA PHE A 520 9.650 -10.775 -2.362 1.00 73.12 H new ATOM 0 HB2 PHE A 520 8.504 -11.825 -0.602 1.00 1.52 H new ATOM 0 HB3 PHE A 520 9.962 -12.056 0.343 1.00 1.52 H new ATOM 0 HD1 PHE A 520 7.644 -9.374 -0.791 1.00 22.21 H new ATOM 0 HD2 PHE A 520 10.370 -10.673 2.167 1.00 53.14 H new ATOM 0 HE1 PHE A 520 7.034 -7.413 0.633 1.00 61.01 H new ATOM 0 HE2 PHE A 520 9.761 -8.710 3.590 1.00 5.14 H new ATOM 0 HZ PHE A 520 8.093 -7.109 2.810 1.00 73.55 H new ATOM 1928 N ALA A 521 12.198 -9.917 -0.505 1.00 14.41 N ATOM 1929 CA ALA A 521 13.064 -8.810 -0.143 1.00 54.10 C ATOM 1930 C ALA A 521 13.466 -8.046 -1.408 1.00 20.21 C ATOM 1931 O ALA A 521 13.402 -6.819 -1.443 1.00 41.21 O ATOM 1932 CB ALA A 521 14.276 -9.340 0.626 1.00 23.42 C ATOM 0 H ALA A 521 12.528 -10.833 -0.202 1.00 14.41 H new ATOM 0 HA ALA A 521 12.541 -8.113 0.511 1.00 54.10 H new ATOM 0 HB1 ALA A 521 14.926 -8.509 0.898 1.00 23.42 H new ATOM 0 HB2 ALA A 521 13.940 -9.848 1.530 1.00 23.42 H new ATOM 0 HB3 ALA A 521 14.827 -10.041 -0.001 1.00 23.42 H new ATOM 1938 N ARG A 522 13.869 -8.807 -2.416 1.00 43.05 N ATOM 1939 CA ARG A 522 14.281 -8.217 -3.679 1.00 22.45 C ATOM 1940 C ARG A 522 13.060 -7.713 -4.451 1.00 61.44 C ATOM 1941 O ARG A 522 13.184 -6.849 -5.318 1.00 13.04 O ATOM 1942 CB ARG A 522 15.037 -9.232 -4.538 1.00 74.02 C ATOM 1943 CG ARG A 522 16.420 -9.525 -3.954 1.00 41.31 C ATOM 1944 CD ARG A 522 16.319 -10.483 -2.764 1.00 62.24 C ATOM 1945 NE ARG A 522 17.673 -10.902 -2.337 1.00 43.13 N ATOM 1946 CZ ARG A 522 18.472 -11.722 -3.051 1.00 10.33 C ATOM 1947 NH1 ARG A 522 18.059 -12.218 -4.238 1.00 24.43 N ATOM 1948 NH2 ARG A 522 19.663 -12.032 -2.574 1.00 11.12 N ATOM 0 H ARG A 522 13.919 -9.825 -2.384 1.00 43.05 H new ATOM 0 HA ARG A 522 14.944 -7.381 -3.456 1.00 22.45 H new ATOM 0 HB2 ARG A 522 14.463 -10.156 -4.604 1.00 74.02 H new ATOM 0 HB3 ARG A 522 15.141 -8.848 -5.553 1.00 74.02 H new ATOM 0 HG2 ARG A 522 17.059 -9.960 -4.723 1.00 41.31 H new ATOM 0 HG3 ARG A 522 16.890 -8.594 -3.638 1.00 41.31 H new ATOM 0 HD2 ARG A 522 15.802 -9.996 -1.937 1.00 62.24 H new ATOM 0 HD3 ARG A 522 15.728 -11.357 -3.039 1.00 62.24 H new ATOM 0 HE ARG A 522 18.024 -10.549 -1.447 1.00 43.13 H new ATOM 0 HH11 ARG A 522 17.137 -11.973 -4.600 1.00 24.43 H new ATOM 0 HH12 ARG A 522 18.669 -12.837 -4.772 1.00 24.43 H new ATOM 0 HH21 ARG A 522 19.968 -11.653 -1.677 1.00 11.12 H new ATOM 0 HH22 ARG A 522 20.279 -12.651 -3.102 1.00 11.12 H new ATOM 1958 N LYS A 523 11.910 -8.273 -4.108 1.00 72.12 N ATOM 1959 CA LYS A 523 10.668 -7.890 -4.758 1.00 35.12 C ATOM 1960 C LYS A 523 10.255 -6.497 -4.280 1.00 73.04 C ATOM 1961 O LYS A 523 9.887 -5.645 -5.087 1.00 71.04 O ATOM 1962 CB LYS A 523 9.596 -8.959 -4.537 1.00 54.41 C ATOM 1963 CG LYS A 523 10.116 -10.345 -4.924 1.00 63.10 C ATOM 1964 CD LYS A 523 10.667 -10.347 -6.351 1.00 4.11 C ATOM 1965 CE LYS A 523 9.589 -9.933 -7.354 1.00 23.41 C ATOM 1966 NZ LYS A 523 10.052 -10.174 -8.740 1.00 55.35 N ATOM 0 H LYS A 523 11.812 -8.989 -3.388 1.00 72.12 H new ATOM 0 HA LYS A 523 10.806 -7.828 -5.837 1.00 35.12 H new ATOM 0 HB2 LYS A 523 9.289 -8.961 -3.491 1.00 54.41 H new ATOM 0 HB3 LYS A 523 8.712 -8.720 -5.128 1.00 54.41 H new ATOM 0 HG2 LYS A 523 10.898 -10.651 -4.229 1.00 63.10 H new ATOM 0 HG3 LYS A 523 9.311 -11.075 -4.840 1.00 63.10 H new ATOM 0 HD2 LYS A 523 11.514 -9.664 -6.419 1.00 4.11 H new ATOM 0 HD3 LYS A 523 11.038 -11.341 -6.600 1.00 4.11 H new ATOM 0 HE2 LYS A 523 8.674 -10.495 -7.167 1.00 23.41 H new ATOM 0 HE3 LYS A 523 9.347 -8.878 -7.223 1.00 23.41 H new ATOM 0 HZ1 LYS A 523 9.309 -9.888 -9.409 1.00 55.35 H new ATOM 0 HZ2 LYS A 523 10.913 -9.619 -8.920 1.00 55.35 H new ATOM 0 HZ3 LYS A 523 10.260 -11.185 -8.866 1.00 55.35 H new ATOM 1975 N VAL A 524 10.330 -6.309 -2.971 1.00 42.44 N ATOM 1976 CA VAL A 524 9.970 -5.033 -2.375 1.00 14.41 C ATOM 1977 C VAL A 524 11.079 -4.016 -2.649 1.00 1.22 C ATOM 1978 O VAL A 524 10.804 -2.881 -3.035 1.00 14.34 O ATOM 1979 CB VAL A 524 9.677 -5.216 -0.885 1.00 31.33 C ATOM 1980 CG1 VAL A 524 10.965 -5.136 -0.061 1.00 52.23 C ATOM 1981 CG2 VAL A 524 8.651 -4.191 -0.397 1.00 12.25 C ATOM 0 H VAL A 524 10.635 -7.019 -2.305 1.00 42.44 H new ATOM 0 HA VAL A 524 9.057 -4.644 -2.825 1.00 14.41 H new ATOM 0 HB VAL A 524 9.250 -6.209 -0.747 1.00 31.33 H new ATOM 0 HG11 VAL A 524 10.730 -5.269 0.995 1.00 52.23 H new ATOM 0 HG12 VAL A 524 11.651 -5.920 -0.382 1.00 52.23 H new ATOM 0 HG13 VAL A 524 11.432 -4.162 -0.209 1.00 52.23 H new ATOM 0 HG21 VAL A 524 8.461 -4.344 0.665 1.00 12.25 H new ATOM 0 HG22 VAL A 524 9.038 -3.185 -0.555 1.00 12.25 H new ATOM 0 HG23 VAL A 524 7.721 -4.314 -0.953 1.00 12.25 H new ATOM 1991 N ALA A 525 12.308 -4.458 -2.435 1.00 72.41 N ATOM 1992 CA ALA A 525 13.461 -3.600 -2.654 1.00 62.22 C ATOM 1993 C ALA A 525 13.562 -3.259 -4.143 1.00 20.42 C ATOM 1994 O ALA A 525 14.342 -2.390 -4.531 1.00 13.24 O ATOM 1995 CB ALA A 525 14.720 -4.291 -2.127 1.00 1.51 C ATOM 0 H ALA A 525 12.532 -5.399 -2.112 1.00 72.41 H new ATOM 0 HA ALA A 525 13.351 -2.663 -2.108 1.00 62.22 H new ATOM 0 HB1 ALA A 525 15.584 -3.647 -2.291 1.00 1.51 H new ATOM 0 HB2 ALA A 525 14.609 -4.484 -1.060 1.00 1.51 H new ATOM 0 HB3 ALA A 525 14.865 -5.234 -2.654 1.00 1.51 H new ATOM 2001 N ASN A 526 12.765 -3.962 -4.933 1.00 71.42 N ATOM 2002 CA ASN A 526 12.756 -3.745 -6.370 1.00 72.31 C ATOM 2003 C ASN A 526 11.787 -2.608 -6.704 1.00 63.43 C ATOM 2004 O ASN A 526 12.159 -1.650 -7.380 1.00 62.14 O ATOM 2005 CB ASN A 526 12.290 -4.998 -7.114 1.00 42.34 C ATOM 2006 CG ASN A 526 13.480 -5.781 -7.671 1.00 72.45 C ATOM 2007 OD1 ASN A 526 14.533 -5.237 -7.961 1.00 64.14 O ATOM 2008 ND2 ASN A 526 13.256 -7.085 -7.803 1.00 34.14 N ATOM 0 H ASN A 526 12.121 -4.682 -4.606 1.00 71.42 H new ATOM 0 HA ASN A 526 13.772 -3.499 -6.680 1.00 72.31 H new ATOM 0 HB2 ASN A 526 11.716 -5.633 -6.439 1.00 42.34 H new ATOM 0 HB3 ASN A 526 11.624 -4.714 -7.929 1.00 42.34 H new ATOM 0 HD21 ASN A 526 13.989 -7.694 -8.166 1.00 34.14 H new ATOM 0 HD22 ASN A 526 12.351 -7.476 -7.541 1.00 34.14 H new ATOM 2014 N THR A 527 10.565 -2.753 -6.216 1.00 25.11 N ATOM 2015 CA THR A 527 9.540 -1.753 -6.453 1.00 73.11 C ATOM 2016 C THR A 527 9.730 -0.560 -5.512 1.00 21.45 C ATOM 2017 O THR A 527 9.840 0.580 -5.962 1.00 31.31 O ATOM 2018 CB THR A 527 8.176 -2.428 -6.309 1.00 51.11 C ATOM 2019 OG1 THR A 527 7.241 -1.379 -6.548 1.00 70.32 O ATOM 2020 CG2 THR A 527 7.886 -2.863 -4.871 1.00 51.24 C ATOM 0 H THR A 527 10.261 -3.550 -5.656 1.00 25.11 H new ATOM 0 HA THR A 527 9.612 -1.346 -7.462 1.00 73.11 H new ATOM 0 HB THR A 527 8.131 -3.295 -6.967 1.00 51.11 H new ATOM 0 HG1 THR A 527 7.419 -0.636 -5.934 1.00 70.32 H new ATOM 0 HG21 THR A 527 6.905 -3.336 -4.825 1.00 51.24 H new ATOM 0 HG22 THR A 527 8.647 -3.572 -4.545 1.00 51.24 H new ATOM 0 HG23 THR A 527 7.899 -1.991 -4.217 1.00 51.24 H new ATOM 2028 N PHE A 528 9.763 -0.865 -4.224 1.00 23.40 N ATOM 2029 CA PHE A 528 9.939 0.167 -3.216 1.00 64.12 C ATOM 2030 C PHE A 528 11.417 0.524 -3.047 1.00 25.41 C ATOM 2031 O PHE A 528 11.959 0.432 -1.947 1.00 71.44 O ATOM 2032 CB PHE A 528 9.410 -0.402 -1.897 1.00 61.34 C ATOM 2033 CG PHE A 528 7.888 -0.335 -1.756 1.00 64.04 C ATOM 2034 CD1 PHE A 528 7.265 0.872 -1.692 1.00 55.11 C ATOM 2035 CD2 PHE A 528 7.159 -1.481 -1.693 1.00 32.44 C ATOM 2036 CE1 PHE A 528 5.852 0.933 -1.561 1.00 51.23 C ATOM 2037 CE2 PHE A 528 5.747 -1.419 -1.562 1.00 22.22 C ATOM 2038 CZ PHE A 528 5.123 -0.212 -1.499 1.00 3.04 C ATOM 0 H PHE A 528 9.671 -1.811 -3.855 1.00 23.40 H new ATOM 0 HA PHE A 528 9.407 1.071 -3.513 1.00 64.12 H new ATOM 0 HB2 PHE A 528 9.727 -1.441 -1.808 1.00 61.34 H new ATOM 0 HB3 PHE A 528 9.866 0.142 -1.070 1.00 61.34 H new ATOM 0 HD1 PHE A 528 7.844 1.783 -1.741 1.00 55.11 H new ATOM 0 HD2 PHE A 528 7.655 -2.439 -1.743 1.00 32.44 H new ATOM 0 HE1 PHE A 528 5.356 1.891 -1.511 1.00 51.23 H new ATOM 0 HE2 PHE A 528 5.168 -2.330 -1.512 1.00 22.22 H new ATOM 0 HZ PHE A 528 4.049 -0.164 -1.400 1.00 3.04 H new ATOM 2047 N LYS A 529 12.026 0.923 -4.154 1.00 23.21 N ATOM 2048 CA LYS A 529 13.432 1.294 -4.143 1.00 5.51 C ATOM 2049 C LYS A 529 13.591 2.646 -3.444 1.00 34.11 C ATOM 2050 O LYS A 529 12.638 3.417 -3.350 1.00 34.10 O ATOM 2051 CB LYS A 529 14.005 1.262 -5.561 1.00 31.24 C ATOM 2052 CG LYS A 529 14.290 -0.174 -6.004 1.00 10.40 C ATOM 2053 CD LYS A 529 14.569 -0.238 -7.506 1.00 34.52 C ATOM 2054 CE LYS A 529 14.977 -1.652 -7.929 1.00 73.22 C ATOM 2055 NZ LYS A 529 15.970 -1.599 -9.025 1.00 75.42 N ATOM 0 H LYS A 529 11.572 0.998 -5.064 1.00 23.21 H new ATOM 0 HA LYS A 529 14.014 0.570 -3.573 1.00 5.51 H new ATOM 0 HB2 LYS A 529 13.302 1.727 -6.252 1.00 31.24 H new ATOM 0 HB3 LYS A 529 14.924 1.847 -5.599 1.00 31.24 H new ATOM 0 HG2 LYS A 529 15.146 -0.565 -5.454 1.00 10.40 H new ATOM 0 HG3 LYS A 529 13.438 -0.809 -5.761 1.00 10.40 H new ATOM 0 HD2 LYS A 529 13.680 0.068 -8.058 1.00 34.52 H new ATOM 0 HD3 LYS A 529 15.362 0.465 -7.763 1.00 34.52 H new ATOM 0 HE2 LYS A 529 15.396 -2.186 -7.076 1.00 73.22 H new ATOM 0 HE3 LYS A 529 14.098 -2.209 -8.253 1.00 73.22 H new ATOM 0 HZ1 LYS A 529 16.236 -2.566 -9.300 1.00 75.42 H new ATOM 0 HZ2 LYS A 529 15.558 -1.108 -9.844 1.00 75.42 H new ATOM 0 HZ3 LYS A 529 16.815 -1.086 -8.703 1.00 75.42 H new ATOM 2064 N PRO A 530 14.836 2.898 -2.960 1.00 60.25 N ATOM 2065 CA PRO A 530 15.135 4.144 -2.274 1.00 31.44 C ATOM 2066 C PRO A 530 15.247 5.304 -3.265 1.00 25.25 C ATOM 2067 O PRO A 530 14.884 6.435 -2.947 1.00 65.33 O ATOM 2068 CB PRO A 530 16.428 3.878 -1.520 1.00 74.01 C ATOM 2069 CG PRO A 530 17.051 2.657 -2.178 1.00 73.24 C ATOM 2070 CD PRO A 530 15.990 2.009 -3.054 1.00 71.41 C ATOM 0 HA PRO A 530 14.344 4.446 -1.587 1.00 31.44 H new ATOM 0 HB2 PRO A 530 17.097 4.737 -1.577 1.00 74.01 H new ATOM 0 HB3 PRO A 530 16.233 3.695 -0.463 1.00 74.01 H new ATOM 0 HG2 PRO A 530 17.916 2.945 -2.775 1.00 73.24 H new ATOM 0 HG3 PRO A 530 17.404 1.955 -1.423 1.00 73.24 H new ATOM 0 HD2 PRO A 530 16.332 1.913 -4.084 1.00 71.41 H new ATOM 0 HD3 PRO A 530 15.746 1.006 -2.704 1.00 71.41 H new ATOM 2075 N HIS A 531 15.753 4.982 -4.447 1.00 40.41 N ATOM 2076 CA HIS A 531 15.917 5.983 -5.488 1.00 22.41 C ATOM 2077 C HIS A 531 14.544 6.418 -6.004 1.00 25.24 C ATOM 2078 O HIS A 531 14.433 7.400 -6.735 1.00 40.23 O ATOM 2079 CB HIS A 531 16.832 5.466 -6.600 1.00 63.44 C ATOM 2080 CG HIS A 531 16.109 4.712 -7.689 1.00 42.40 C ATOM 2081 ND1 HIS A 531 15.854 3.354 -7.621 1.00 43.15 N ATOM 2082 CD2 HIS A 531 15.588 5.142 -8.876 1.00 4.21 C ATOM 2083 CE1 HIS A 531 15.210 2.992 -8.720 1.00 12.41 C ATOM 2084 NE2 HIS A 531 15.046 4.102 -9.497 1.00 22.31 N ATOM 0 H HIS A 531 16.055 4.043 -4.707 1.00 40.41 H new ATOM 0 HA HIS A 531 16.407 6.865 -5.075 1.00 22.41 H new ATOM 0 HB2 HIS A 531 17.359 6.310 -7.045 1.00 63.44 H new ATOM 0 HB3 HIS A 531 17.588 4.814 -6.161 1.00 63.44 H new ATOM 0 HD2 HIS A 531 15.613 6.156 -9.246 1.00 4.21 H new ATOM 0 HE1 HIS A 531 14.874 1.994 -8.959 1.00 12.41 H new ATOM 0 HE2 HIS A 531 14.583 4.128 -10.406 1.00 22.31 H new ATOM 2091 N ARG A 532 13.530 5.662 -5.604 1.00 75.34 N ATOM 2092 CA ARG A 532 12.169 5.957 -6.017 1.00 70.30 C ATOM 2093 C ARG A 532 11.410 6.654 -4.887 1.00 34.22 C ATOM 2094 O ARG A 532 10.617 7.560 -5.133 1.00 13.13 O ATOM 2095 CB ARG A 532 11.425 4.679 -6.411 1.00 24.10 C ATOM 2096 CG ARG A 532 12.226 3.870 -7.432 1.00 40.50 C ATOM 2097 CD ARG A 532 12.446 4.672 -8.717 1.00 50.22 C ATOM 2098 NE ARG A 532 11.205 5.388 -9.084 1.00 13.31 N ATOM 2099 CZ ARG A 532 11.174 6.522 -9.818 1.00 14.44 C ATOM 2100 NH1 ARG A 532 12.319 7.077 -10.269 1.00 52.44 N ATOM 2101 NH2 ARG A 532 10.008 7.078 -10.088 1.00 22.24 N ATOM 0 H ARG A 532 13.625 4.847 -4.999 1.00 75.34 H new ATOM 0 HA ARG A 532 12.220 6.616 -6.884 1.00 70.30 H new ATOM 0 HB2 ARG A 532 11.242 4.072 -5.524 1.00 24.10 H new ATOM 0 HB3 ARG A 532 10.451 4.935 -6.828 1.00 24.10 H new ATOM 0 HG2 ARG A 532 13.189 3.590 -7.005 1.00 40.50 H new ATOM 0 HG3 ARG A 532 11.698 2.945 -7.663 1.00 40.50 H new ATOM 0 HD2 ARG A 532 13.259 5.384 -8.576 1.00 50.22 H new ATOM 0 HD3 ARG A 532 12.744 4.005 -9.526 1.00 50.22 H new ATOM 0 HE ARG A 532 10.317 5.002 -8.763 1.00 13.31 H new ATOM 0 HH11 ARG A 532 13.216 6.640 -10.056 1.00 52.44 H new ATOM 0 HH12 ARG A 532 12.287 7.933 -10.823 1.00 52.44 H new ATOM 0 HH21 ARG A 532 9.148 6.652 -9.744 1.00 22.24 H new ATOM 0 HH22 ARG A 532 9.967 7.934 -10.641 1.00 22.24 H new ATOM 2111 N LEU A 533 11.680 6.204 -3.670 1.00 41.10 N ATOM 2112 CA LEU A 533 11.032 6.772 -2.501 1.00 62.42 C ATOM 2113 C LEU A 533 11.491 8.222 -2.325 1.00 13.42 C ATOM 2114 O LEU A 533 10.667 9.134 -2.268 1.00 0.11 O ATOM 2115 CB LEU A 533 11.281 5.896 -1.271 1.00 12.40 C ATOM 2116 CG LEU A 533 10.234 4.815 -0.996 1.00 34.35 C ATOM 2117 CD1 LEU A 533 8.817 5.385 -1.096 1.00 74.41 C ATOM 2118 CD2 LEU A 533 10.433 3.611 -1.919 1.00 60.40 C ATOM 0 H LEU A 533 12.339 5.452 -3.469 1.00 41.10 H new ATOM 0 HA LEU A 533 9.951 6.792 -2.636 1.00 62.42 H new ATOM 0 HB2 LEU A 533 12.252 5.414 -1.383 1.00 12.40 H new ATOM 0 HB3 LEU A 533 11.346 6.543 -0.396 1.00 12.40 H new ATOM 0 HG LEU A 533 10.368 4.463 0.027 1.00 34.35 H new ATOM 0 HD11 LEU A 533 8.092 4.596 -0.896 1.00 74.41 H new ATOM 0 HD12 LEU A 533 8.694 6.184 -0.365 1.00 74.41 H new ATOM 0 HD13 LEU A 533 8.654 5.782 -2.098 1.00 74.41 H new ATOM 0 HD21 LEU A 533 9.676 2.857 -1.703 1.00 60.40 H new ATOM 0 HD22 LEU A 533 10.342 3.930 -2.957 1.00 60.40 H new ATOM 0 HD23 LEU A 533 11.424 3.187 -1.756 1.00 60.40 H new ATOM 2129 N GLN A 534 12.802 8.389 -2.243 1.00 44.30 N ATOM 2130 CA GLN A 534 13.378 9.713 -2.073 1.00 35.11 C ATOM 2131 C GLN A 534 12.954 10.626 -3.226 1.00 51.24 C ATOM 2132 O GLN A 534 12.672 11.805 -3.015 1.00 33.01 O ATOM 2133 CB GLN A 534 14.902 9.638 -1.966 1.00 0.42 C ATOM 2134 CG GLN A 534 15.553 9.668 -3.351 1.00 42.35 C ATOM 2135 CD GLN A 534 17.025 9.258 -3.274 1.00 21.12 C ATOM 2136 OE1 GLN A 534 17.926 10.079 -3.313 1.00 30.02 O ATOM 2137 NE2 GLN A 534 17.217 7.947 -3.164 1.00 3.42 N ATOM 0 H GLN A 534 13.482 7.630 -2.291 1.00 44.30 H new ATOM 0 HA GLN A 534 13.002 10.136 -1.141 1.00 35.11 H new ATOM 0 HB2 GLN A 534 15.269 10.473 -1.370 1.00 0.42 H new ATOM 0 HB3 GLN A 534 15.189 8.724 -1.446 1.00 0.42 H new ATOM 0 HG2 GLN A 534 15.019 8.995 -4.022 1.00 42.35 H new ATOM 0 HG3 GLN A 534 15.472 10.670 -3.773 1.00 42.35 H new ATOM 0 HE21 GLN A 534 16.417 7.315 -3.137 1.00 3.42 H new ATOM 0 HE22 GLN A 534 18.164 7.573 -3.107 1.00 3.42 H new ATOM 2144 N ALA A 535 12.924 10.048 -4.417 1.00 51.32 N ATOM 2145 CA ALA A 535 12.540 10.797 -5.602 1.00 72.20 C ATOM 2146 C ALA A 535 11.043 11.103 -5.543 1.00 41.51 C ATOM 2147 O ALA A 535 10.526 11.857 -6.367 1.00 73.22 O ATOM 2148 CB ALA A 535 12.924 10.003 -6.852 1.00 32.13 C ATOM 0 H ALA A 535 13.159 9.070 -4.588 1.00 51.32 H new ATOM 0 HA ALA A 535 13.069 11.749 -5.644 1.00 72.20 H new ATOM 0 HB1 ALA A 535 12.637 10.563 -7.742 1.00 32.13 H new ATOM 0 HB2 ALA A 535 14.001 9.836 -6.860 1.00 32.13 H new ATOM 0 HB3 ALA A 535 12.408 9.043 -6.846 1.00 32.13 H new ATOM 2154 N ARG A 536 10.387 10.503 -4.561 1.00 42.24 N ATOM 2155 CA ARG A 536 8.957 10.703 -4.384 1.00 22.21 C ATOM 2156 C ARG A 536 8.681 12.108 -3.847 1.00 42.22 C ATOM 2157 O ARG A 536 7.748 12.775 -4.292 1.00 32.44 O ATOM 2158 CB ARG A 536 8.373 9.670 -3.417 1.00 42.20 C ATOM 2159 CG ARG A 536 6.853 9.581 -3.566 1.00 50.22 C ATOM 2160 CD ARG A 536 6.460 8.434 -4.499 1.00 74.40 C ATOM 2161 NE ARG A 536 7.014 8.671 -5.851 1.00 2.22 N ATOM 2162 CZ ARG A 536 6.529 9.585 -6.719 1.00 72.32 C ATOM 2163 NH1 ARG A 536 5.476 10.359 -6.382 1.00 0.44 N ATOM 2164 NH2 ARG A 536 7.103 9.711 -7.902 1.00 50.00 N ATOM 0 H ARG A 536 10.818 9.878 -3.879 1.00 42.24 H new ATOM 0 HA ARG A 536 8.481 10.583 -5.357 1.00 22.21 H new ATOM 0 HB2 ARG A 536 8.819 8.694 -3.608 1.00 42.20 H new ATOM 0 HB3 ARG A 536 8.627 9.941 -2.392 1.00 42.20 H new ATOM 0 HG2 ARG A 536 6.396 9.432 -2.588 1.00 50.22 H new ATOM 0 HG3 ARG A 536 6.467 10.522 -3.958 1.00 50.22 H new ATOM 0 HD2 ARG A 536 6.833 7.489 -4.104 1.00 74.40 H new ATOM 0 HD3 ARG A 536 5.374 8.352 -4.551 1.00 74.40 H new ATOM 0 HE ARG A 536 7.812 8.109 -6.146 1.00 2.22 H new ATOM 0 HH11 ARG A 536 5.040 10.256 -5.466 1.00 0.44 H new ATOM 0 HH12 ARG A 536 5.116 11.047 -7.044 1.00 0.44 H new ATOM 0 HH21 ARG A 536 7.899 9.123 -8.148 1.00 50.00 H new ATOM 0 HH22 ARG A 536 6.750 10.396 -8.570 1.00 50.00 H new ATOM 2174 N LYS A 537 9.508 12.518 -2.898 1.00 63.35 N ATOM 2175 CA LYS A 537 9.365 13.832 -2.296 1.00 44.33 C ATOM 2176 C LYS A 537 10.318 14.812 -2.984 1.00 50.10 C ATOM 2177 O LYS A 537 10.190 16.025 -2.824 1.00 21.21 O ATOM 2178 CB LYS A 537 9.558 13.751 -0.779 1.00 73.14 C ATOM 2179 CG LYS A 537 11.023 13.488 -0.425 1.00 33.52 C ATOM 2180 CD LYS A 537 11.244 13.563 1.086 1.00 22.12 C ATOM 2181 CE LYS A 537 12.381 12.636 1.520 1.00 1.05 C ATOM 2182 NZ LYS A 537 12.870 13.010 2.866 1.00 3.01 N ATOM 0 H LYS A 537 10.281 11.963 -2.530 1.00 63.35 H new ATOM 0 HA LYS A 537 8.354 14.211 -2.447 1.00 44.33 H new ATOM 0 HB2 LYS A 537 9.230 14.682 -0.317 1.00 73.14 H new ATOM 0 HB3 LYS A 537 8.933 12.956 -0.371 1.00 73.14 H new ATOM 0 HG2 LYS A 537 11.318 12.505 -0.791 1.00 33.52 H new ATOM 0 HG3 LYS A 537 11.659 14.218 -0.926 1.00 33.52 H new ATOM 0 HD2 LYS A 537 11.477 14.589 1.373 1.00 22.12 H new ATOM 0 HD3 LYS A 537 10.326 13.287 1.606 1.00 22.12 H new ATOM 0 HE2 LYS A 537 12.033 11.603 1.527 1.00 1.05 H new ATOM 0 HE3 LYS A 537 13.198 12.692 0.801 1.00 1.05 H new ATOM 0 HZ1 LYS A 537 13.641 12.371 3.145 1.00 3.01 H new ATOM 0 HZ2 LYS A 537 13.221 13.989 2.848 1.00 3.01 H new ATOM 0 HZ3 LYS A 537 12.092 12.933 3.552 1.00 3.01 H new ATOM 2191 N ALA A 538 11.252 14.248 -3.736 1.00 54.44 N ATOM 2192 CA ALA A 538 12.225 15.056 -4.451 1.00 70.25 C ATOM 2193 C ALA A 538 11.507 16.206 -5.160 1.00 13.34 C ATOM 2194 O ALA A 538 12.101 17.250 -5.418 1.00 53.15 O ATOM 2195 CB ALA A 538 13.011 14.172 -5.421 1.00 14.52 C ATOM 0 H ALA A 538 11.355 13.242 -3.866 1.00 54.44 H new ATOM 0 HA ALA A 538 12.942 15.494 -3.757 1.00 70.25 H new ATOM 0 HB1 ALA A 538 13.741 14.779 -5.957 1.00 14.52 H new ATOM 0 HB2 ALA A 538 13.528 13.391 -4.864 1.00 14.52 H new ATOM 0 HB3 ALA A 538 12.325 13.715 -6.134 1.00 14.52 H new ATOM 2201 N MET A 539 10.235 15.973 -5.456 1.00 70.24 N ATOM 2202 CA MET A 539 9.429 16.976 -6.132 1.00 4.11 C ATOM 2203 C MET A 539 9.153 18.167 -5.212 1.00 50.33 C ATOM 2204 O MET A 539 9.357 19.316 -5.601 1.00 51.33 O ATOM 2205 CB MET A 539 8.103 16.353 -6.570 1.00 11.24 C ATOM 2206 CG MET A 539 8.328 15.285 -7.643 1.00 15.35 C ATOM 2207 SD MET A 539 8.467 13.676 -6.884 1.00 45.41 S ATOM 2208 CE MET A 539 6.742 13.231 -6.779 1.00 55.11 C ATOM 0 H MET A 539 9.744 15.105 -5.240 1.00 70.24 H new ATOM 0 HA MET A 539 9.979 17.332 -7.003 1.00 4.11 H new ATOM 0 HB2 MET A 539 7.603 15.909 -5.709 1.00 11.24 H new ATOM 0 HB3 MET A 539 7.442 17.129 -6.957 1.00 11.24 H new ATOM 0 HG2 MET A 539 7.501 15.291 -8.353 1.00 15.35 H new ATOM 0 HG3 MET A 539 9.233 15.510 -8.207 1.00 15.35 H new ATOM 0 HE1 MET A 539 6.600 12.512 -5.972 1.00 55.11 H new ATOM 0 HE2 MET A 539 6.148 14.123 -6.579 1.00 55.11 H new ATOM 0 HE3 MET A 539 6.423 12.786 -7.722 1.00 55.11 H new ATOM 2216 N TRP A 540 8.695 17.854 -4.008 1.00 30.45 N ATOM 2217 CA TRP A 540 8.391 18.883 -3.032 1.00 44.53 C ATOM 2218 C TRP A 540 9.713 19.455 -2.518 1.00 24.52 C ATOM 2219 O TRP A 540 9.759 20.583 -2.029 1.00 3.13 O ATOM 2220 CB TRP A 540 7.502 18.333 -1.914 1.00 52.33 C ATOM 2221 CG TRP A 540 6.006 18.362 -2.235 1.00 43.23 C ATOM 2222 CD1 TRP A 540 5.272 17.413 -2.831 1.00 2.01 C ATOM 2223 CD2 TRP A 540 5.088 19.439 -1.955 1.00 43.33 C ATOM 2224 NE1 TRP A 540 3.952 17.796 -2.952 1.00 64.02 N ATOM 2225 CE2 TRP A 540 3.836 19.069 -2.402 1.00 50.02 C ATOM 2226 CE3 TRP A 540 5.306 20.687 -1.341 1.00 23.24 C ATOM 2227 CZ2 TRP A 540 2.706 19.887 -2.284 1.00 20.34 C ATOM 2228 CZ3 TRP A 540 4.167 21.491 -1.232 1.00 50.04 C ATOM 2229 CH2 TRP A 540 2.901 21.133 -1.677 1.00 33.34 C ATOM 0 H TRP A 540 8.527 16.900 -3.688 1.00 30.45 H new ATOM 0 HA TRP A 540 7.818 19.690 -3.489 1.00 44.53 H new ATOM 0 HB2 TRP A 540 7.797 17.306 -1.702 1.00 52.33 H new ATOM 0 HB3 TRP A 540 7.679 18.910 -1.006 1.00 52.33 H new ATOM 0 HD1 TRP A 540 5.664 16.467 -3.174 1.00 2.01 H new ATOM 0 HE1 TRP A 540 3.200 17.247 -3.368 1.00 64.02 H new ATOM 0 HE3 TRP A 540 6.276 20.999 -0.983 1.00 23.24 H new ATOM 0 HZ2 TRP A 540 1.736 19.574 -2.642 1.00 20.34 H new ATOM 0 HZ3 TRP A 540 4.280 22.460 -0.768 1.00 50.04 H new ATOM 0 HH2 TRP A 540 2.071 21.813 -1.555 1.00 33.34 H new ATOM 2239 N ARG A 541 10.758 18.649 -2.645 1.00 51.43 N ATOM 2240 CA ARG A 541 12.078 19.060 -2.201 1.00 65.42 C ATOM 2241 C ARG A 541 12.619 20.174 -3.098 1.00 72.44 C ATOM 2242 O ARG A 541 13.271 21.101 -2.620 1.00 61.32 O ATOM 2243 CB ARG A 541 13.056 17.883 -2.216 1.00 42.42 C ATOM 2244 CG ARG A 541 12.710 16.869 -1.123 1.00 53.34 C ATOM 2245 CD ARG A 541 13.950 16.084 -0.690 1.00 15.51 C ATOM 2246 NE ARG A 541 14.817 16.934 0.157 1.00 13.24 N ATOM 2247 CZ ARG A 541 14.579 17.190 1.461 1.00 61.14 C ATOM 2248 NH1 ARG A 541 13.500 16.665 2.079 1.00 23.34 N ATOM 2249 NH2 ARG A 541 15.420 17.963 2.123 1.00 61.11 N ATOM 0 H ARG A 541 10.716 17.713 -3.049 1.00 51.43 H new ATOM 0 HA ARG A 541 11.983 19.427 -1.179 1.00 65.42 H new ATOM 0 HB2 ARG A 541 13.029 17.396 -3.191 1.00 42.42 H new ATOM 0 HB3 ARG A 541 14.073 18.248 -2.070 1.00 42.42 H new ATOM 0 HG2 ARG A 541 12.285 17.387 -0.263 1.00 53.34 H new ATOM 0 HG3 ARG A 541 11.949 16.180 -1.489 1.00 53.34 H new ATOM 0 HD2 ARG A 541 13.652 15.192 -0.139 1.00 15.51 H new ATOM 0 HD3 ARG A 541 14.502 15.747 -1.567 1.00 15.51 H new ATOM 0 HE ARG A 541 15.644 17.351 -0.270 1.00 13.24 H new ATOM 0 HH11 ARG A 541 12.855 16.069 1.560 1.00 23.34 H new ATOM 0 HH12 ARG A 541 13.329 16.865 3.065 1.00 23.34 H new ATOM 0 HH21 ARG A 541 16.233 18.356 1.649 1.00 61.11 H new ATOM 0 HH22 ARG A 541 15.257 18.168 3.109 1.00 61.11 H new ATOM 2259 N LYS A 542 12.327 20.049 -4.385 1.00 45.02 N ATOM 2260 CA LYS A 542 12.776 21.034 -5.354 1.00 12.43 C ATOM 2261 C LYS A 542 12.629 22.434 -4.757 1.00 71.35 C ATOM 2262 O LYS A 542 13.457 23.308 -5.005 1.00 15.02 O ATOM 2263 CB LYS A 542 12.038 20.851 -6.683 1.00 43.10 C ATOM 2264 CG LYS A 542 12.180 19.417 -7.196 1.00 33.43 C ATOM 2265 CD LYS A 542 12.554 19.400 -8.681 1.00 44.51 C ATOM 2266 CE LYS A 542 14.065 19.246 -8.864 1.00 23.35 C ATOM 2267 NZ LYS A 542 14.360 18.349 -10.004 1.00 23.03 N ATOM 0 H LYS A 542 11.785 19.280 -4.779 1.00 45.02 H new ATOM 0 HA LYS A 542 13.833 20.893 -5.580 1.00 12.43 H new ATOM 0 HB2 LYS A 542 10.983 21.092 -6.553 1.00 43.10 H new ATOM 0 HB3 LYS A 542 12.435 21.547 -7.422 1.00 43.10 H new ATOM 0 HG2 LYS A 542 12.943 18.894 -6.619 1.00 33.43 H new ATOM 0 HG3 LYS A 542 11.244 18.879 -7.047 1.00 33.43 H new ATOM 0 HD2 LYS A 542 12.038 18.580 -9.180 1.00 44.51 H new ATOM 0 HD3 LYS A 542 12.219 20.323 -9.155 1.00 44.51 H new ATOM 0 HE2 LYS A 542 14.518 20.223 -9.035 1.00 23.35 H new ATOM 0 HE3 LYS A 542 14.509 18.844 -7.953 1.00 23.35 H new ATOM 0 HZ1 LYS A 542 15.390 18.255 -10.114 1.00 23.03 H new ATOM 0 HZ2 LYS A 542 13.944 17.413 -9.826 1.00 23.03 H new ATOM 0 HZ3 LYS A 542 13.953 18.748 -10.874 1.00 23.03 H new ATOM 2276 N GLU A 543 11.570 22.602 -3.980 1.00 54.54 N ATOM 2277 CA GLU A 543 11.303 23.883 -3.345 1.00 71.33 C ATOM 2278 C GLU A 543 12.401 24.210 -2.332 1.00 50.15 C ATOM 2279 O GLU A 543 12.961 25.306 -2.349 1.00 71.14 O ATOM 2280 CB GLU A 543 9.925 23.891 -2.681 1.00 12.31 C ATOM 2281 CG GLU A 543 8.813 23.794 -3.727 1.00 41.13 C ATOM 2282 CD GLU A 543 8.334 25.186 -4.147 1.00 53.20 C ATOM 2283 OE1 GLU A 543 8.739 25.687 -5.206 1.00 54.35 O ATOM 2284 OE2 GLU A 543 7.510 25.749 -3.328 1.00 73.51 O ATOM 0 H GLU A 543 10.886 21.873 -3.775 1.00 54.54 H new ATOM 0 HA GLU A 543 11.302 24.655 -4.115 1.00 71.33 H new ATOM 0 HB2 GLU A 543 9.848 23.056 -1.984 1.00 12.31 H new ATOM 0 HB3 GLU A 543 9.803 24.804 -2.099 1.00 12.31 H new ATOM 0 HG2 GLU A 543 9.176 23.251 -4.600 1.00 41.13 H new ATOM 0 HG3 GLU A 543 7.977 23.224 -3.322 1.00 41.13 H new ATOM 2290 N GLN A 544 12.678 23.241 -1.471 1.00 74.13 N ATOM 2291 CA GLN A 544 13.699 23.413 -0.452 1.00 11.43 C ATOM 2292 C GLN A 544 15.085 23.475 -1.095 1.00 74.41 C ATOM 2293 O GLN A 544 16.024 24.009 -0.506 1.00 44.24 O ATOM 2294 CB GLN A 544 13.628 22.295 0.589 1.00 4.22 C ATOM 2295 CG GLN A 544 12.222 22.188 1.185 1.00 74.11 C ATOM 2296 CD GLN A 544 12.045 23.167 2.347 1.00 11.43 C ATOM 2297 OE1 GLN A 544 12.958 23.442 3.107 1.00 73.51 O ATOM 2298 NE2 GLN A 544 10.820 23.675 2.442 1.00 52.44 N ATOM 0 H GLN A 544 12.212 22.334 -1.459 1.00 74.13 H new ATOM 0 HA GLN A 544 13.516 24.356 0.063 1.00 11.43 H new ATOM 0 HB2 GLN A 544 13.905 21.347 0.129 1.00 4.22 H new ATOM 0 HB3 GLN A 544 14.350 22.486 1.383 1.00 4.22 H new ATOM 0 HG2 GLN A 544 11.479 22.394 0.414 1.00 74.11 H new ATOM 0 HG3 GLN A 544 12.047 21.170 1.532 1.00 74.11 H new ATOM 0 HE21 GLN A 544 10.101 23.402 1.772 1.00 52.44 H new ATOM 0 HE22 GLN A 544 10.599 24.338 3.185 1.00 52.44 H new ATOM 2305 N ASP A 545 15.171 22.924 -2.297 1.00 31.30 N ATOM 2306 CA ASP A 545 16.427 22.910 -3.027 1.00 21.51 C ATOM 2307 C ASP A 545 16.470 24.105 -3.982 1.00 20.43 C ATOM 2308 O ASP A 545 17.519 24.420 -4.542 1.00 25.21 O ATOM 2309 CB ASP A 545 16.568 21.634 -3.860 1.00 12.22 C ATOM 2310 CG ASP A 545 17.979 21.351 -4.377 1.00 71.45 C ATOM 2311 OD1 ASP A 545 18.698 20.497 -3.837 1.00 25.01 O ATOM 2312 OD2 ASP A 545 18.340 22.060 -5.393 1.00 23.00 O ATOM 0 H ASP A 545 14.390 22.484 -2.784 1.00 31.30 H new ATOM 0 HA ASP A 545 17.239 22.957 -2.301 1.00 21.51 H new ATOM 0 HB2 ASP A 545 16.242 20.787 -3.257 1.00 12.22 H new ATOM 0 HB3 ASP A 545 15.891 21.698 -4.712 1.00 12.22 H new TER 2317 ASP A 545