USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 443 GLN : amide:sc= -5.73! C(o=-18!,f=-21!) USER MOD Set 1.2: A 475 SER OG : rot 65:sc= -2.69! USER MOD Set 1.3: A 476 ASN : amide:sc= -4.84 K(o=-18,f=-25!) USER MOD Set 1.4: A 480 GLN : amide:sc= -5.12! C(o=-18!,f=-26!) USER MOD Set 2.1: A 473 MET CE :methyl 142:sc= -8.41! (180deg=-5.2!) USER MOD Set 2.2: A 485 CYS SG : rot -105:sc= -3.5! USER MOD Set 3.1: A 471 GLN : amide:sc= -0.0313 X(o=-0.74,f=-0.89) USER MOD Set 3.2: A 474 MET CE :methyl -146:sc= -0.707 (180deg=-1.19) USER MOD Set 4.1: A 462 CYS SG : rot -127:sc= 0.224 USER MOD Set 4.2: A 503 THR OG1 : rot -81:sc= 0.402 USER MOD Set 5.1: A 458 SER OG : rot -119:sc= 1.67 USER MOD Set 5.2: A 494 SER OG : rot -45:sc= -0.746 USER MOD Set 5.3: A 498 GLN : amide:sc= 0.998 K(o=1.9,f=-5.3!) USER MOD Single : A 386 MET CE :methyl 157:sc= -0.0354 (180deg=-0.105) USER MOD Single : A 388 SER OG : rot 180:sc= 0 USER MOD Single : A 389 SER OG : rot -39:sc= 1.03 USER MOD Single : A 390 SER OG : rot 180:sc=-0.00276 USER MOD Single : A 392 GLN : amide:sc= -0.629 K(o=-0.63,f=-1.2) USER MOD Single : A 393 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -6.99! C(o=-7!,f=-8.3!) USER MOD Single : A 401 HIS : no HD1:sc= -16.1! C(o=-16!,f=-15!) USER MOD Single : A 407 HIS : no HD1:sc= -1.38 X(o=-1.4,f=-0.9) USER MOD Single : A 415 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 426 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 CYS SG : rot 23:sc= 0.812 USER MOD Single : A 432 GLN : amide:sc= -1.22 K(o=-1.2,f=-8.8!) USER MOD Single : A 434 HIS : no HD1:sc= -1.69 K(o=-1.7,f=-4.1) USER MOD Single : A 440 SER OG : rot 180:sc= 0 USER MOD Single : A 441 CYS SG : rot 180:sc= 0.118 USER MOD Single : A 448 HIS : no HD1:sc= -8.7! C(o=-8.7!,f=-13!) USER MOD Single : A 449 SER OG : rot 155:sc= -3.02! USER MOD Single : A 457 THR OG1 : rot 173:sc= 0.134 USER MOD Single : A 459 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 465 SER OG : rot -157:sc= -1.53 USER MOD Single : A 467 HIS : no HE2:sc= -1.63 K(o=-1.6,f=-3.1!) USER MOD Single : A 468 GLN : amide:sc= -3.66! C(o=-3.7!,f=-7.1!) USER MOD Single : A 470 ASN : amide:sc= -6.94! K(o=-6.9!,f=-3.7) USER MOD Single : A 478 THR OG1 : rot -19:sc= 0.46 USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot 180:sc= 0 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot -58:sc= 0.385 USER MOD Single : A 516 HIS : no HD1:sc= -2.93! C(o=-2.9!,f=-2.6!) USER MOD Single : A 517 SER OG : rot 180:sc= 0.65 USER MOD Single : A 518 GLN : amide:sc= -3.97! C(o=-4!,f=-8.7!) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.68! C(o=-3.7!,f=-5!) USER MOD Single : A 527 THR OG1 : rot 130:sc= -1.18 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -7.04! C(o=-7!,f=-10!) USER MOD Single : A 534 GLN : amide:sc= -0.829 K(o=-0.83,f=-0.12) USER MOD Single : A 537 LYS NZ :NH3+ -128:sc= -3.1! (180deg=-3.56!) USER MOD Single : A 539 MET CE :methyl -126:sc= -5.38! (180deg=-10.4!) USER MOD Single : A 542 LYS NZ :NH3+ -179:sc= -0.19 (180deg=-0.196) USER MOD Single : A 544 GLN : amide:sc= -0.0873 X(o=-0.087,f=-0.52) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 20.884 14.603 14.440 1.00 10.14 N ATOM 2 CA MET A 386 22.298 14.369 14.205 1.00 3.55 C ATOM 3 C MET A 386 22.533 13.783 12.811 1.00 45.43 C ATOM 4 O MET A 386 23.529 14.097 12.161 1.00 40.51 O ATOM 5 CB MET A 386 22.838 13.404 15.262 1.00 32.43 C ATOM 6 CG MET A 386 24.367 13.401 15.270 1.00 22.34 C ATOM 7 SD MET A 386 24.976 14.689 16.345 1.00 3.31 S ATOM 8 CE MET A 386 25.673 15.800 15.134 1.00 72.33 C ATOM 0 HA MET A 386 22.821 15.323 14.270 1.00 3.55 H new ATOM 0 HB2 MET A 386 22.466 13.691 16.246 1.00 32.43 H new ATOM 0 HB3 MET A 386 22.470 12.398 15.063 1.00 32.43 H new ATOM 0 HG2 MET A 386 24.735 12.432 15.606 1.00 22.34 H new ATOM 0 HG3 MET A 386 24.744 13.552 14.259 1.00 22.34 H new ATOM 0 HE1 MET A 386 25.725 16.806 15.551 1.00 72.33 H new ATOM 0 HE2 MET A 386 26.675 15.465 14.867 1.00 72.33 H new ATOM 0 HE3 MET A 386 25.044 15.808 14.244 1.00 72.33 H new ATOM 16 N GLU A 387 21.599 12.942 12.393 1.00 13.41 N ATOM 17 CA GLU A 387 21.691 12.310 11.087 1.00 43.25 C ATOM 18 C GLU A 387 21.258 13.286 9.993 1.00 10.15 C ATOM 19 O GLU A 387 20.266 14.000 10.149 1.00 34.45 O ATOM 20 CB GLU A 387 20.860 11.026 11.039 1.00 54.33 C ATOM 21 CG GLU A 387 21.486 10.001 10.092 1.00 63.32 C ATOM 22 CD GLU A 387 22.627 9.246 10.780 1.00 53.41 C ATOM 23 OE1 GLU A 387 22.394 8.550 11.779 1.00 73.44 O ATOM 24 OE2 GLU A 387 23.788 9.401 10.239 1.00 12.53 O ATOM 0 H GLU A 387 20.775 12.683 12.935 1.00 13.41 H new ATOM 0 HA GLU A 387 22.731 12.036 10.910 1.00 43.25 H new ATOM 0 HB2 GLU A 387 20.783 10.601 12.040 1.00 54.33 H new ATOM 0 HB3 GLU A 387 19.846 11.257 10.711 1.00 54.33 H new ATOM 0 HG2 GLU A 387 20.725 9.294 9.760 1.00 63.32 H new ATOM 0 HG3 GLU A 387 21.863 10.505 9.202 1.00 63.32 H new ATOM 30 N SER A 388 22.019 13.286 8.908 1.00 64.04 N ATOM 31 CA SER A 388 21.725 14.163 7.788 1.00 31.10 C ATOM 32 C SER A 388 20.793 13.457 6.800 1.00 2.34 C ATOM 33 O SER A 388 20.701 13.849 5.639 1.00 31.40 O ATOM 34 CB SER A 388 23.008 14.605 7.083 1.00 34.33 C ATOM 35 OG SER A 388 23.744 15.551 7.854 1.00 32.15 O ATOM 0 H SER A 388 22.839 12.692 8.781 1.00 64.04 H new ATOM 0 HA SER A 388 21.228 15.054 8.173 1.00 31.10 H new ATOM 0 HB2 SER A 388 23.632 13.733 6.887 1.00 34.33 H new ATOM 0 HB3 SER A 388 22.758 15.042 6.116 1.00 34.33 H new ATOM 0 HG SER A 388 24.557 15.806 7.370 1.00 32.15 H new ATOM 40 N SER A 389 20.125 12.428 7.300 1.00 0.35 N ATOM 41 CA SER A 389 19.203 11.663 6.477 1.00 50.43 C ATOM 42 C SER A 389 17.904 11.409 7.245 1.00 40.20 C ATOM 43 O SER A 389 17.140 10.509 6.898 1.00 43.45 O ATOM 44 CB SER A 389 19.827 10.339 6.036 1.00 60.42 C ATOM 45 OG SER A 389 18.946 9.580 5.212 1.00 44.31 O ATOM 0 H SER A 389 20.204 12.106 8.265 1.00 0.35 H new ATOM 0 HA SER A 389 18.981 12.244 5.582 1.00 50.43 H new ATOM 0 HB2 SER A 389 20.751 10.537 5.492 1.00 60.42 H new ATOM 0 HB3 SER A 389 20.094 9.754 6.916 1.00 60.42 H new ATOM 0 HG SER A 389 18.029 9.666 5.547 1.00 44.31 H new ATOM 50 N SER A 390 17.695 12.216 8.274 1.00 14.52 N ATOM 51 CA SER A 390 16.501 12.089 9.095 1.00 72.23 C ATOM 52 C SER A 390 15.339 12.845 8.448 1.00 23.20 C ATOM 53 O SER A 390 15.250 14.066 8.562 1.00 74.13 O ATOM 54 CB SER A 390 16.750 12.608 10.513 1.00 14.14 C ATOM 55 OG SER A 390 15.568 13.147 11.097 1.00 62.24 O ATOM 0 H SER A 390 18.331 12.960 8.559 1.00 14.52 H new ATOM 0 HA SER A 390 16.244 11.032 9.165 1.00 72.23 H new ATOM 0 HB2 SER A 390 17.125 11.796 11.136 1.00 14.14 H new ATOM 0 HB3 SER A 390 17.525 13.374 10.488 1.00 14.14 H new ATOM 0 HG SER A 390 15.767 13.466 12.002 1.00 62.24 H new ATOM 60 N GLU A 391 14.478 12.088 7.784 1.00 71.52 N ATOM 61 CA GLU A 391 13.326 12.673 7.119 1.00 63.10 C ATOM 62 C GLU A 391 12.168 12.831 8.107 1.00 53.02 C ATOM 63 O GLU A 391 12.288 12.463 9.274 1.00 3.25 O ATOM 64 CB GLU A 391 12.905 11.833 5.912 1.00 32.43 C ATOM 65 CG GLU A 391 12.069 10.627 6.346 1.00 53.24 C ATOM 66 CD GLU A 391 12.259 9.452 5.384 1.00 71.23 C ATOM 67 OE1 GLU A 391 11.359 9.156 4.584 1.00 31.14 O ATOM 68 OE2 GLU A 391 13.389 8.840 5.487 1.00 40.34 O ATOM 0 H GLU A 391 14.555 11.075 7.692 1.00 71.52 H new ATOM 0 HA GLU A 391 13.605 13.661 6.753 1.00 63.10 H new ATOM 0 HB2 GLU A 391 12.330 12.448 5.220 1.00 32.43 H new ATOM 0 HB3 GLU A 391 13.790 11.492 5.376 1.00 32.43 H new ATOM 0 HG2 GLU A 391 12.355 10.326 7.354 1.00 53.24 H new ATOM 0 HG3 GLU A 391 11.016 10.905 6.383 1.00 53.24 H new ATOM 74 N GLN A 392 11.073 13.381 7.601 1.00 71.31 N ATOM 75 CA GLN A 392 9.894 13.592 8.425 1.00 13.10 C ATOM 76 C GLN A 392 8.956 12.388 8.328 1.00 20.13 C ATOM 77 O GLN A 392 9.306 11.370 7.734 1.00 33.31 O ATOM 78 CB GLN A 392 9.174 14.882 8.027 1.00 43.23 C ATOM 79 CG GLN A 392 9.666 16.066 8.864 1.00 31.12 C ATOM 80 CD GLN A 392 9.518 15.779 10.360 1.00 71.34 C ATOM 81 OE1 GLN A 392 8.538 15.215 10.815 1.00 24.02 O ATOM 82 NE2 GLN A 392 10.545 16.200 11.094 1.00 45.21 N ATOM 0 H GLN A 392 10.978 13.686 6.632 1.00 71.31 H new ATOM 0 HA GLN A 392 10.212 13.696 9.462 1.00 13.10 H new ATOM 0 HB2 GLN A 392 9.342 15.085 6.969 1.00 43.23 H new ATOM 0 HB3 GLN A 392 8.099 14.759 8.161 1.00 43.23 H new ATOM 0 HG2 GLN A 392 10.711 16.271 8.631 1.00 31.12 H new ATOM 0 HG3 GLN A 392 9.100 16.960 8.604 1.00 31.12 H new ATOM 0 HE21 GLN A 392 11.335 16.666 10.647 1.00 45.21 H new ATOM 0 HE22 GLN A 392 10.543 16.057 12.104 1.00 45.21 H new ATOM 89 N LYS A 393 7.781 12.544 8.921 1.00 64.11 N ATOM 90 CA LYS A 393 6.789 11.482 8.910 1.00 63.42 C ATOM 91 C LYS A 393 5.923 11.613 7.655 1.00 44.33 C ATOM 92 O LYS A 393 5.318 12.659 7.420 1.00 24.30 O ATOM 93 CB LYS A 393 5.990 11.482 10.214 1.00 73.11 C ATOM 94 CG LYS A 393 4.925 10.382 10.203 1.00 54.24 C ATOM 95 CD LYS A 393 5.563 9.001 10.345 1.00 24.22 C ATOM 96 CE LYS A 393 5.670 8.594 11.817 1.00 54.01 C ATOM 97 NZ LYS A 393 6.731 7.578 11.999 1.00 53.53 N ATOM 0 H LYS A 393 7.494 13.390 9.412 1.00 64.11 H new ATOM 0 HA LYS A 393 7.274 10.507 8.862 1.00 63.42 H new ATOM 0 HB2 LYS A 393 6.664 11.333 11.058 1.00 73.11 H new ATOM 0 HB3 LYS A 393 5.514 12.453 10.354 1.00 73.11 H new ATOM 0 HG2 LYS A 393 4.219 10.546 11.017 1.00 54.24 H new ATOM 0 HG3 LYS A 393 4.357 10.430 9.274 1.00 54.24 H new ATOM 0 HD2 LYS A 393 4.969 8.265 9.803 1.00 24.22 H new ATOM 0 HD3 LYS A 393 6.555 9.006 9.893 1.00 24.22 H new ATOM 0 HE2 LYS A 393 5.889 9.470 12.427 1.00 54.01 H new ATOM 0 HE3 LYS A 393 4.715 8.196 12.161 1.00 54.01 H new ATOM 0 HZ1 LYS A 393 6.790 7.313 13.003 1.00 53.53 H new ATOM 0 HZ2 LYS A 393 6.506 6.736 11.432 1.00 53.53 H new ATOM 0 HZ3 LYS A 393 7.644 7.970 11.690 1.00 53.53 H new ATOM 106 N PHE A 394 5.890 10.538 6.883 1.00 34.52 N ATOM 107 CA PHE A 394 5.108 10.519 5.658 1.00 51.14 C ATOM 108 C PHE A 394 4.802 9.085 5.224 1.00 23.03 C ATOM 109 O PHE A 394 5.452 8.144 5.678 1.00 13.12 O ATOM 110 CB PHE A 394 5.952 11.197 4.577 1.00 62.34 C ATOM 111 CG PHE A 394 5.134 11.784 3.425 1.00 22.13 C ATOM 112 CD1 PHE A 394 4.601 13.030 3.534 1.00 41.11 C ATOM 113 CD2 PHE A 394 4.938 11.057 2.292 1.00 74.00 C ATOM 114 CE1 PHE A 394 3.841 13.573 2.465 1.00 33.44 C ATOM 115 CE2 PHE A 394 4.179 11.600 1.223 1.00 21.45 C ATOM 116 CZ PHE A 394 3.645 12.847 1.331 1.00 21.21 C ATOM 0 H PHE A 394 6.392 9.673 7.082 1.00 34.52 H new ATOM 0 HA PHE A 394 4.159 11.032 5.815 1.00 51.14 H new ATOM 0 HB2 PHE A 394 6.539 11.993 5.035 1.00 62.34 H new ATOM 0 HB3 PHE A 394 6.659 10.472 4.174 1.00 62.34 H new ATOM 0 HD1 PHE A 394 4.756 13.607 4.434 1.00 41.11 H new ATOM 0 HD2 PHE A 394 5.360 10.067 2.206 1.00 74.00 H new ATOM 0 HE1 PHE A 394 3.418 14.563 2.552 1.00 33.44 H new ATOM 0 HE2 PHE A 394 4.025 11.023 0.323 1.00 21.45 H new ATOM 0 HZ PHE A 394 3.066 13.260 0.518 1.00 21.21 H new ATOM 125 N TYR A 395 3.815 8.962 4.351 1.00 3.34 N ATOM 126 CA TYR A 395 3.415 7.657 3.851 1.00 73.11 C ATOM 127 C TYR A 395 3.967 7.417 2.444 1.00 14.23 C ATOM 128 O TYR A 395 3.944 8.315 1.602 1.00 63.12 O ATOM 129 CB TYR A 395 1.886 7.679 3.789 1.00 20.52 C ATOM 130 CG TYR A 395 1.212 7.897 5.144 1.00 61.33 C ATOM 131 CD1 TYR A 395 1.953 7.810 6.306 1.00 74.43 C ATOM 132 CD2 TYR A 395 -0.137 8.182 5.206 1.00 64.41 C ATOM 133 CE1 TYR A 395 1.319 8.016 7.582 1.00 62.13 C ATOM 134 CE2 TYR A 395 -0.771 8.387 6.483 1.00 70.12 C ATOM 135 CZ TYR A 395 -0.012 8.295 7.607 1.00 50.10 C ATOM 136 OH TYR A 395 -0.612 8.488 8.813 1.00 42.32 O ATOM 0 H TYR A 395 3.279 9.745 3.976 1.00 3.34 H new ATOM 0 HA TYR A 395 3.796 6.865 4.497 1.00 73.11 H new ATOM 0 HB2 TYR A 395 1.572 8.469 3.107 1.00 20.52 H new ATOM 0 HB3 TYR A 395 1.536 6.736 3.368 1.00 20.52 H new ATOM 0 HD1 TYR A 395 3.009 7.587 6.258 1.00 74.43 H new ATOM 0 HD2 TYR A 395 -0.717 8.251 4.298 1.00 64.41 H new ATOM 0 HE1 TYR A 395 1.887 7.951 8.498 1.00 62.13 H new ATOM 0 HE2 TYR A 395 -1.826 8.609 6.546 1.00 70.12 H new ATOM 0 HH TYR A 395 -1.563 8.680 8.678 1.00 42.32 H new ATOM 145 N ASN A 396 4.448 6.201 2.231 1.00 73.11 N ATOM 146 CA ASN A 396 5.005 5.832 0.940 1.00 5.53 C ATOM 147 C ASN A 396 4.140 4.738 0.311 1.00 31.41 C ATOM 148 O ASN A 396 4.322 4.392 -0.855 1.00 14.33 O ATOM 149 CB ASN A 396 6.426 5.285 1.090 1.00 60.32 C ATOM 150 CG ASN A 396 7.440 6.422 1.225 1.00 0.11 C ATOM 151 OD1 ASN A 396 8.129 6.790 0.287 1.00 10.24 O ATOM 152 ND2 ASN A 396 7.494 6.957 2.442 1.00 70.41 N ATOM 0 H ASN A 396 4.464 5.459 2.930 1.00 73.11 H new ATOM 0 HA ASN A 396 5.027 6.724 0.314 1.00 5.53 H new ATOM 0 HB2 ASN A 396 6.480 4.639 1.966 1.00 60.32 H new ATOM 0 HB3 ASN A 396 6.676 4.671 0.225 1.00 60.32 H new ATOM 0 HD21 ASN A 396 8.140 7.723 2.634 1.00 70.41 H new ATOM 0 HD22 ASN A 396 6.889 6.602 3.183 1.00 70.41 H new ATOM 158 N PHE A 397 3.218 4.223 1.112 1.00 35.41 N ATOM 159 CA PHE A 397 2.324 3.175 0.648 1.00 73.41 C ATOM 160 C PHE A 397 1.195 2.934 1.651 1.00 54.03 C ATOM 161 O PHE A 397 1.396 3.052 2.859 1.00 35.04 O ATOM 162 CB PHE A 397 3.160 1.899 0.523 1.00 15.11 C ATOM 163 CG PHE A 397 3.850 1.477 1.822 1.00 15.32 C ATOM 164 CD1 PHE A 397 4.904 2.193 2.296 1.00 42.34 C ATOM 165 CD2 PHE A 397 3.409 0.384 2.501 1.00 12.15 C ATOM 166 CE1 PHE A 397 5.543 1.802 3.501 1.00 73.23 C ATOM 167 CE2 PHE A 397 4.050 -0.008 3.707 1.00 62.44 C ATOM 168 CZ PHE A 397 5.103 0.710 4.181 1.00 30.30 C ATOM 0 H PHE A 397 3.071 4.512 2.079 1.00 35.41 H new ATOM 0 HA PHE A 397 1.874 3.462 -0.302 1.00 73.41 H new ATOM 0 HB2 PHE A 397 2.516 1.087 0.185 1.00 15.11 H new ATOM 0 HB3 PHE A 397 3.917 2.047 -0.247 1.00 15.11 H new ATOM 0 HD1 PHE A 397 5.255 3.060 1.755 1.00 42.34 H new ATOM 0 HD2 PHE A 397 2.572 -0.185 2.124 1.00 12.15 H new ATOM 0 HE1 PHE A 397 6.379 2.372 3.878 1.00 73.23 H new ATOM 0 HE2 PHE A 397 3.701 -0.876 4.247 1.00 62.44 H new ATOM 0 HZ PHE A 397 5.590 0.413 5.098 1.00 30.30 H new ATOM 177 N VAL A 398 0.030 2.603 1.113 1.00 25.51 N ATOM 178 CA VAL A 398 -1.132 2.344 1.945 1.00 40.14 C ATOM 179 C VAL A 398 -1.499 0.862 1.856 1.00 63.24 C ATOM 180 O VAL A 398 -1.989 0.400 0.827 1.00 51.41 O ATOM 181 CB VAL A 398 -2.282 3.270 1.540 1.00 63.33 C ATOM 182 CG1 VAL A 398 -3.633 2.660 1.916 1.00 44.51 C ATOM 183 CG2 VAL A 398 -2.113 4.657 2.163 1.00 14.11 C ATOM 0 H VAL A 398 -0.134 2.508 0.111 1.00 25.51 H new ATOM 0 HA VAL A 398 -0.909 2.561 2.990 1.00 40.14 H new ATOM 0 HB VAL A 398 -2.256 3.385 0.456 1.00 63.33 H new ATOM 0 HG11 VAL A 398 -4.434 3.337 1.618 1.00 44.51 H new ATOM 0 HG12 VAL A 398 -3.756 1.705 1.405 1.00 44.51 H new ATOM 0 HG13 VAL A 398 -3.674 2.502 2.994 1.00 44.51 H new ATOM 0 HG21 VAL A 398 -2.943 5.296 1.860 1.00 14.11 H new ATOM 0 HG22 VAL A 398 -2.101 4.569 3.249 1.00 14.11 H new ATOM 0 HG23 VAL A 398 -1.175 5.096 1.824 1.00 14.11 H new ATOM 193 N ILE A 399 -1.246 0.156 2.950 1.00 33.43 N ATOM 194 CA ILE A 399 -1.543 -1.266 3.007 1.00 70.13 C ATOM 195 C ILE A 399 -3.058 -1.461 3.103 1.00 23.45 C ATOM 196 O ILE A 399 -3.618 -1.472 4.200 1.00 73.43 O ATOM 197 CB ILE A 399 -0.763 -1.930 4.143 1.00 53.40 C ATOM 198 CG1 ILE A 399 0.745 -1.795 3.924 1.00 73.13 C ATOM 199 CG2 ILE A 399 -1.189 -3.388 4.321 1.00 32.04 C ATOM 200 CD1 ILE A 399 1.524 -2.578 4.984 1.00 34.31 C ATOM 0 H ILE A 399 -0.839 0.542 3.802 1.00 33.43 H new ATOM 0 HA ILE A 399 -1.215 -1.762 2.094 1.00 70.13 H new ATOM 0 HB ILE A 399 -1.001 -1.410 5.071 1.00 53.40 H new ATOM 0 HG12 ILE A 399 1.006 -2.161 2.931 1.00 73.13 H new ATOM 0 HG13 ILE A 399 1.029 -0.743 3.961 1.00 73.13 H new ATOM 0 HG21 ILE A 399 -0.619 -3.837 5.135 1.00 32.04 H new ATOM 0 HG22 ILE A 399 -2.252 -3.430 4.556 1.00 32.04 H new ATOM 0 HG23 ILE A 399 -0.999 -3.938 3.399 1.00 32.04 H new ATOM 0 HD11 ILE A 399 2.594 -2.466 4.806 1.00 34.31 H new ATOM 0 HD12 ILE A 399 1.278 -2.194 5.974 1.00 34.31 H new ATOM 0 HD13 ILE A 399 1.255 -3.633 4.928 1.00 34.31 H new ATOM 211 N LEU A 400 -3.678 -1.613 1.943 1.00 45.24 N ATOM 212 CA LEU A 400 -5.117 -1.808 1.883 1.00 64.44 C ATOM 213 C LEU A 400 -5.457 -3.211 2.387 1.00 2.24 C ATOM 214 O LEU A 400 -5.317 -4.189 1.654 1.00 33.14 O ATOM 215 CB LEU A 400 -5.638 -1.516 0.475 1.00 71.13 C ATOM 216 CG LEU A 400 -6.117 -0.086 0.219 1.00 72.35 C ATOM 217 CD1 LEU A 400 -5.939 0.297 -1.251 1.00 15.12 C ATOM 218 CD2 LEU A 400 -7.559 0.104 0.691 1.00 15.34 C ATOM 0 H LEU A 400 -3.211 -1.605 1.036 1.00 45.24 H new ATOM 0 HA LEU A 400 -5.626 -1.102 2.538 1.00 64.44 H new ATOM 0 HB2 LEU A 400 -4.847 -1.746 -0.238 1.00 71.13 H new ATOM 0 HB3 LEU A 400 -6.463 -2.197 0.266 1.00 71.13 H new ATOM 0 HG LEU A 400 -5.496 0.591 0.805 1.00 72.35 H new ATOM 0 HD11 LEU A 400 -6.287 1.318 -1.406 1.00 15.12 H new ATOM 0 HD12 LEU A 400 -4.885 0.228 -1.520 1.00 15.12 H new ATOM 0 HD13 LEU A 400 -6.518 -0.382 -1.877 1.00 15.12 H new ATOM 0 HD21 LEU A 400 -7.873 1.129 0.497 1.00 15.34 H new ATOM 0 HD22 LEU A 400 -8.212 -0.584 0.153 1.00 15.34 H new ATOM 0 HD23 LEU A 400 -7.621 -0.098 1.760 1.00 15.34 H new ATOM 229 N HIS A 401 -5.900 -3.266 3.635 1.00 12.44 N ATOM 230 CA HIS A 401 -6.262 -4.534 4.245 1.00 42.34 C ATOM 231 C HIS A 401 -7.520 -4.352 5.097 1.00 33.44 C ATOM 232 O HIS A 401 -7.995 -3.233 5.280 1.00 53.14 O ATOM 233 CB HIS A 401 -5.087 -5.110 5.039 1.00 51.12 C ATOM 234 CG HIS A 401 -4.913 -4.499 6.409 1.00 34.03 C ATOM 235 ND1 HIS A 401 -5.597 -4.951 7.524 1.00 1.22 N ATOM 236 CD2 HIS A 401 -4.127 -3.468 6.831 1.00 3.50 C ATOM 237 CE1 HIS A 401 -5.231 -4.218 8.565 1.00 33.12 C ATOM 238 NE2 HIS A 401 -4.320 -3.299 8.134 1.00 71.22 N ATOM 0 H HIS A 401 -6.016 -2.453 4.240 1.00 12.44 H new ATOM 0 HA HIS A 401 -6.493 -5.263 3.468 1.00 42.34 H new ATOM 0 HB2 HIS A 401 -5.227 -6.185 5.147 1.00 51.12 H new ATOM 0 HB3 HIS A 401 -4.170 -4.964 4.468 1.00 51.12 H new ATOM 0 HD2 HIS A 401 -3.460 -2.887 6.211 1.00 3.50 H new ATOM 0 HE1 HIS A 401 -5.591 -4.329 9.577 1.00 33.12 H new ATOM 0 HE2 HIS A 401 -3.862 -2.598 8.716 1.00 71.22 H new ATOM 246 N ALA A 402 -8.025 -5.472 5.594 1.00 41.41 N ATOM 247 CA ALA A 402 -9.219 -5.450 6.422 1.00 52.30 C ATOM 248 C ALA A 402 -8.918 -4.710 7.726 1.00 3.41 C ATOM 249 O ALA A 402 -7.851 -4.119 7.875 1.00 52.04 O ATOM 250 CB ALA A 402 -9.700 -6.883 6.662 1.00 20.20 C ATOM 0 H ALA A 402 -7.630 -6.399 5.439 1.00 41.41 H new ATOM 0 HA ALA A 402 -10.025 -4.915 5.919 1.00 52.30 H new ATOM 0 HB1 ALA A 402 -10.596 -6.867 7.283 1.00 20.20 H new ATOM 0 HB2 ALA A 402 -9.929 -7.355 5.706 1.00 20.20 H new ATOM 0 HB3 ALA A 402 -8.918 -7.449 7.168 1.00 20.20 H new ATOM 256 N ARG A 403 -9.878 -4.768 8.637 1.00 42.45 N ATOM 257 CA ARG A 403 -9.728 -4.110 9.924 1.00 40.45 C ATOM 258 C ARG A 403 -9.347 -5.129 11.001 1.00 74.53 C ATOM 259 O ARG A 403 -9.081 -4.760 12.142 1.00 65.14 O ATOM 260 CB ARG A 403 -11.023 -3.406 10.337 1.00 74.54 C ATOM 261 CG ARG A 403 -10.746 -2.306 11.365 1.00 22.11 C ATOM 262 CD ARG A 403 -11.167 -2.748 12.767 1.00 2.44 C ATOM 263 NE ARG A 403 -11.673 -1.588 13.534 1.00 70.14 N ATOM 264 CZ ARG A 403 -12.060 -1.645 14.825 1.00 54.25 C ATOM 265 NH1 ARG A 403 -12.001 -2.808 15.508 1.00 50.52 N ATOM 266 NH2 ARG A 403 -12.497 -0.544 15.411 1.00 24.12 N ATOM 0 H ARG A 403 -10.762 -5.260 8.510 1.00 42.45 H new ATOM 0 HA ARG A 403 -8.937 -3.366 9.825 1.00 40.45 H new ATOM 0 HB2 ARG A 403 -11.503 -2.975 9.458 1.00 74.54 H new ATOM 0 HB3 ARG A 403 -11.719 -4.133 10.756 1.00 74.54 H new ATOM 0 HG2 ARG A 403 -9.684 -2.059 11.361 1.00 22.11 H new ATOM 0 HG3 ARG A 403 -11.285 -1.400 11.088 1.00 22.11 H new ATOM 0 HD2 ARG A 403 -11.939 -3.514 12.699 1.00 2.44 H new ATOM 0 HD3 ARG A 403 -10.319 -3.195 13.286 1.00 2.44 H new ATOM 0 HE ARG A 403 -11.733 -0.689 13.056 1.00 70.14 H new ATOM 0 HH11 ARG A 403 -11.662 -3.653 15.048 1.00 50.52 H new ATOM 0 HH12 ARG A 403 -12.296 -2.842 16.484 1.00 50.52 H new ATOM 0 HH21 ARG A 403 -12.538 0.331 14.888 1.00 24.12 H new ATOM 0 HH22 ARG A 403 -12.794 -0.569 16.387 1.00 24.12 H new ATOM 276 N ALA A 404 -9.330 -6.389 10.596 1.00 23.55 N ATOM 277 CA ALA A 404 -8.983 -7.465 11.511 1.00 15.21 C ATOM 278 C ALA A 404 -7.596 -8.002 11.157 1.00 63.33 C ATOM 279 O ALA A 404 -7.225 -9.099 11.576 1.00 52.23 O ATOM 280 CB ALA A 404 -10.061 -8.550 11.455 1.00 72.24 C ATOM 0 H ALA A 404 -9.551 -6.691 9.647 1.00 23.55 H new ATOM 0 HA ALA A 404 -8.942 -7.099 12.537 1.00 15.21 H new ATOM 0 HB1 ALA A 404 -9.801 -9.357 12.141 1.00 72.24 H new ATOM 0 HB2 ALA A 404 -11.022 -8.124 11.744 1.00 72.24 H new ATOM 0 HB3 ALA A 404 -10.129 -8.944 10.441 1.00 72.24 H new ATOM 286 N ASP A 405 -6.865 -7.206 10.390 1.00 60.41 N ATOM 287 CA ASP A 405 -5.525 -7.588 9.976 1.00 11.25 C ATOM 288 C ASP A 405 -4.576 -6.410 10.188 1.00 74.44 C ATOM 289 O ASP A 405 -3.666 -6.190 9.390 1.00 74.22 O ATOM 290 CB ASP A 405 -5.494 -7.961 8.491 1.00 43.44 C ATOM 291 CG ASP A 405 -6.860 -8.266 7.872 1.00 25.55 C ATOM 292 OD1 ASP A 405 -7.817 -8.617 8.578 1.00 51.43 O ATOM 293 OD2 ASP A 405 -6.919 -8.130 6.591 1.00 23.23 O ATOM 0 H ASP A 405 -7.175 -6.298 10.044 1.00 60.41 H new ATOM 0 HA ASP A 405 -5.220 -8.449 10.571 1.00 11.25 H new ATOM 0 HB2 ASP A 405 -5.035 -7.143 7.936 1.00 43.44 H new ATOM 0 HB3 ASP A 405 -4.852 -8.832 8.364 1.00 43.44 H new ATOM 298 N GLU A 406 -4.818 -5.681 11.268 1.00 71.00 N ATOM 299 CA GLU A 406 -3.995 -4.529 11.594 1.00 61.43 C ATOM 300 C GLU A 406 -2.548 -4.964 11.841 1.00 13.53 C ATOM 301 O GLU A 406 -1.672 -4.716 11.014 1.00 41.01 O ATOM 302 CB GLU A 406 -4.556 -3.779 12.803 1.00 64.33 C ATOM 303 CG GLU A 406 -3.499 -2.858 13.416 1.00 41.21 C ATOM 304 CD GLU A 406 -4.046 -2.143 14.654 1.00 35.44 C ATOM 305 OE1 GLU A 406 -4.621 -1.050 14.535 1.00 72.22 O ATOM 306 OE2 GLU A 406 -3.859 -2.761 15.769 1.00 62.40 O ATOM 0 H GLU A 406 -5.573 -5.866 11.929 1.00 71.00 H new ATOM 0 HA GLU A 406 -4.009 -3.845 10.746 1.00 61.43 H new ATOM 0 HB2 GLU A 406 -5.424 -3.192 12.501 1.00 64.33 H new ATOM 0 HB3 GLU A 406 -4.899 -4.493 13.551 1.00 64.33 H new ATOM 0 HG2 GLU A 406 -2.618 -3.440 13.687 1.00 41.21 H new ATOM 0 HG3 GLU A 406 -3.180 -2.122 12.678 1.00 41.21 H new ATOM 312 N HIS A 407 -2.344 -5.605 12.982 1.00 23.33 N ATOM 313 CA HIS A 407 -1.019 -6.078 13.349 1.00 71.42 C ATOM 314 C HIS A 407 -0.339 -6.696 12.126 1.00 24.34 C ATOM 315 O HIS A 407 0.871 -6.562 11.950 1.00 20.51 O ATOM 316 CB HIS A 407 -1.094 -7.038 14.536 1.00 22.52 C ATOM 317 CG HIS A 407 -1.754 -8.358 14.218 1.00 24.51 C ATOM 318 ND1 HIS A 407 -3.077 -8.458 13.823 1.00 22.45 N ATOM 319 CD2 HIS A 407 -1.260 -9.630 14.239 1.00 40.44 C ATOM 320 CE1 HIS A 407 -3.356 -9.737 13.619 1.00 32.44 C ATOM 321 NE2 HIS A 407 -2.229 -10.461 13.879 1.00 31.32 N ATOM 0 H HIS A 407 -3.074 -5.808 13.665 1.00 23.33 H new ATOM 0 HA HIS A 407 -0.406 -5.238 13.676 1.00 71.42 H new ATOM 0 HB2 HIS A 407 -0.085 -7.227 14.901 1.00 22.52 H new ATOM 0 HB3 HIS A 407 -1.641 -6.556 15.346 1.00 22.52 H new ATOM 0 HD2 HIS A 407 -0.252 -9.912 14.504 1.00 40.44 H new ATOM 0 HE1 HIS A 407 -4.308 -10.136 13.303 1.00 32.44 H new ATOM 0 HE2 HIS A 407 -2.145 -11.475 13.808 1.00 31.32 H new ATOM 328 N ILE A 408 -1.146 -7.362 11.314 1.00 35.13 N ATOM 329 CA ILE A 408 -0.639 -8.003 10.112 1.00 65.25 C ATOM 330 C ILE A 408 0.033 -6.953 9.225 1.00 61.05 C ATOM 331 O ILE A 408 1.145 -7.162 8.742 1.00 63.03 O ATOM 332 CB ILE A 408 -1.749 -8.783 9.410 1.00 54.42 C ATOM 333 CG1 ILE A 408 -2.265 -9.920 10.294 1.00 31.41 C ATOM 334 CG2 ILE A 408 -1.287 -9.285 8.040 1.00 62.40 C ATOM 335 CD1 ILE A 408 -3.350 -10.726 9.575 1.00 23.00 C ATOM 0 H ILE A 408 -2.149 -7.472 11.465 1.00 35.13 H new ATOM 0 HA ILE A 408 0.122 -8.741 10.366 1.00 65.25 H new ATOM 0 HB ILE A 408 -2.585 -8.105 9.238 1.00 54.42 H new ATOM 0 HG12 ILE A 408 -1.439 -10.577 10.566 1.00 31.41 H new ATOM 0 HG13 ILE A 408 -2.666 -9.511 11.222 1.00 31.41 H new ATOM 0 HG21 ILE A 408 -2.097 -9.837 7.563 1.00 62.40 H new ATOM 0 HG22 ILE A 408 -1.009 -8.436 7.416 1.00 62.40 H new ATOM 0 HG23 ILE A 408 -0.425 -9.941 8.164 1.00 62.40 H new ATOM 0 HD11 ILE A 408 -3.699 -11.528 10.226 1.00 23.00 H new ATOM 0 HD12 ILE A 408 -4.185 -10.071 9.326 1.00 23.00 H new ATOM 0 HD13 ILE A 408 -2.939 -11.154 8.660 1.00 23.00 H new ATOM 346 N ALA A 409 -0.671 -5.847 9.035 1.00 43.23 N ATOM 347 CA ALA A 409 -0.157 -4.764 8.214 1.00 0.42 C ATOM 348 C ALA A 409 0.964 -4.045 8.967 1.00 42.40 C ATOM 349 O ALA A 409 2.080 -3.930 8.465 1.00 43.32 O ATOM 350 CB ALA A 409 -1.303 -3.822 7.836 1.00 73.43 C ATOM 0 H ALA A 409 -1.594 -5.677 9.436 1.00 43.23 H new ATOM 0 HA ALA A 409 0.266 -5.153 7.287 1.00 0.42 H new ATOM 0 HB1 ALA A 409 -0.918 -3.009 7.220 1.00 73.43 H new ATOM 0 HB2 ALA A 409 -2.059 -4.374 7.277 1.00 73.43 H new ATOM 0 HB3 ALA A 409 -1.750 -3.411 8.741 1.00 73.43 H new ATOM 356 N LEU A 410 0.626 -3.579 10.162 1.00 30.52 N ATOM 357 CA LEU A 410 1.591 -2.875 10.989 1.00 21.02 C ATOM 358 C LEU A 410 2.843 -3.739 11.154 1.00 74.41 C ATOM 359 O LEU A 410 3.915 -3.228 11.479 1.00 33.30 O ATOM 360 CB LEU A 410 0.953 -2.458 12.317 1.00 71.54 C ATOM 361 CG LEU A 410 0.000 -1.262 12.257 1.00 74.13 C ATOM 362 CD1 LEU A 410 -1.225 -1.581 11.399 1.00 33.53 C ATOM 363 CD2 LEU A 410 -0.389 -0.799 13.662 1.00 5.11 C ATOM 0 H LEU A 410 -0.301 -3.675 10.576 1.00 30.52 H new ATOM 0 HA LEU A 410 1.904 -1.950 10.505 1.00 21.02 H new ATOM 0 HB2 LEU A 410 0.408 -3.312 12.719 1.00 71.54 H new ATOM 0 HB3 LEU A 410 1.750 -2.227 13.024 1.00 71.54 H new ATOM 0 HG LEU A 410 0.522 -0.433 11.779 1.00 74.13 H new ATOM 0 HD11 LEU A 410 -1.886 -0.715 11.373 1.00 33.53 H new ATOM 0 HD12 LEU A 410 -0.906 -1.825 10.386 1.00 33.53 H new ATOM 0 HD13 LEU A 410 -1.757 -2.431 11.826 1.00 33.53 H new ATOM 0 HD21 LEU A 410 -1.067 0.052 13.590 1.00 5.11 H new ATOM 0 HD22 LEU A 410 -0.885 -1.614 14.189 1.00 5.11 H new ATOM 0 HD23 LEU A 410 0.507 -0.504 14.209 1.00 5.11 H new ATOM 374 N ARG A 411 2.667 -5.030 10.921 1.00 30.13 N ATOM 375 CA ARG A 411 3.769 -5.970 11.038 1.00 63.24 C ATOM 376 C ARG A 411 4.682 -5.873 9.814 1.00 73.14 C ATOM 377 O ARG A 411 5.890 -6.081 9.918 1.00 52.54 O ATOM 378 CB ARG A 411 3.259 -7.405 11.173 1.00 32.11 C ATOM 379 CG ARG A 411 4.389 -8.413 10.952 1.00 43.24 C ATOM 380 CD ARG A 411 4.058 -9.758 11.602 1.00 74.10 C ATOM 381 NE ARG A 411 3.239 -10.577 10.682 1.00 73.45 N ATOM 382 CZ ARG A 411 2.680 -11.760 11.016 1.00 50.22 C ATOM 383 NH1 ARG A 411 2.849 -12.273 12.253 1.00 71.33 N ATOM 384 NH2 ARG A 411 1.966 -12.408 10.113 1.00 43.13 N ATOM 0 H ARG A 411 1.777 -5.449 10.651 1.00 30.13 H new ATOM 0 HA ARG A 411 4.330 -5.711 11.936 1.00 63.24 H new ATOM 0 HB2 ARG A 411 2.827 -7.549 12.163 1.00 32.11 H new ATOM 0 HB3 ARG A 411 2.463 -7.581 10.449 1.00 32.11 H new ATOM 0 HG2 ARG A 411 4.553 -8.552 9.883 1.00 43.24 H new ATOM 0 HG3 ARG A 411 5.317 -8.022 11.369 1.00 43.24 H new ATOM 0 HD2 ARG A 411 4.978 -10.287 11.851 1.00 74.10 H new ATOM 0 HD3 ARG A 411 3.519 -9.597 12.536 1.00 74.10 H new ATOM 0 HE ARG A 411 3.087 -10.226 9.736 1.00 73.45 H new ATOM 0 HH11 ARG A 411 3.402 -11.766 12.944 1.00 71.33 H new ATOM 0 HH12 ARG A 411 2.423 -13.167 12.497 1.00 71.33 H new ATOM 0 HH21 ARG A 411 1.844 -12.014 9.180 1.00 43.13 H new ATOM 0 HH22 ARG A 411 1.537 -13.303 10.348 1.00 43.13 H new ATOM 394 N VAL A 412 4.070 -5.557 8.682 1.00 42.32 N ATOM 395 CA VAL A 412 4.811 -5.430 7.440 1.00 21.22 C ATOM 396 C VAL A 412 5.491 -4.060 7.395 1.00 73.30 C ATOM 397 O VAL A 412 6.687 -3.966 7.120 1.00 53.14 O ATOM 398 CB VAL A 412 3.883 -5.676 6.249 1.00 61.31 C ATOM 399 CG1 VAL A 412 4.399 -4.964 4.996 1.00 1.44 C ATOM 400 CG2 VAL A 412 3.704 -7.174 5.994 1.00 13.52 C ATOM 0 H VAL A 412 3.068 -5.385 8.600 1.00 42.32 H new ATOM 0 HA VAL A 412 5.596 -6.185 7.385 1.00 21.22 H new ATOM 0 HB VAL A 412 2.906 -5.259 6.493 1.00 61.31 H new ATOM 0 HG11 VAL A 412 3.721 -5.155 4.164 1.00 1.44 H new ATOM 0 HG12 VAL A 412 4.451 -3.891 5.183 1.00 1.44 H new ATOM 0 HG13 VAL A 412 5.392 -5.338 4.748 1.00 1.44 H new ATOM 0 HG21 VAL A 412 3.040 -7.321 5.142 1.00 13.52 H new ATOM 0 HG22 VAL A 412 4.673 -7.625 5.781 1.00 13.52 H new ATOM 0 HG23 VAL A 412 3.271 -7.644 6.877 1.00 13.52 H new ATOM 410 N ARG A 413 4.701 -3.033 7.669 1.00 60.32 N ATOM 411 CA ARG A 413 5.213 -1.673 7.663 1.00 51.22 C ATOM 412 C ARG A 413 6.641 -1.641 8.208 1.00 62.33 C ATOM 413 O ARG A 413 7.511 -0.979 7.642 1.00 31.44 O ATOM 414 CB ARG A 413 4.332 -0.750 8.507 1.00 13.51 C ATOM 415 CG ARG A 413 2.858 -0.891 8.118 1.00 22.34 C ATOM 416 CD ARG A 413 2.053 0.331 8.566 1.00 35.14 C ATOM 417 NE ARG A 413 2.565 0.827 9.863 1.00 22.55 N ATOM 418 CZ ARG A 413 1.812 1.478 10.774 1.00 12.54 C ATOM 419 NH1 ARG A 413 0.504 1.718 10.538 1.00 32.42 N ATOM 420 NH2 ARG A 413 2.373 1.878 11.900 1.00 25.14 N ATOM 0 H ARG A 413 3.710 -3.115 7.897 1.00 60.32 H new ATOM 0 HA ARG A 413 5.206 -1.321 6.632 1.00 51.22 H new ATOM 0 HB2 ARG A 413 4.457 -0.988 9.563 1.00 13.51 H new ATOM 0 HB3 ARG A 413 4.650 0.284 8.373 1.00 13.51 H new ATOM 0 HG2 ARG A 413 2.773 -1.011 7.038 1.00 22.34 H new ATOM 0 HG3 ARG A 413 2.443 -1.791 8.572 1.00 22.34 H new ATOM 0 HD2 ARG A 413 2.121 1.117 7.814 1.00 35.14 H new ATOM 0 HD3 ARG A 413 0.999 0.069 8.658 1.00 35.14 H new ATOM 0 HE ARG A 413 3.548 0.667 10.082 1.00 22.55 H new ATOM 0 HH11 ARG A 413 0.078 1.406 9.665 1.00 32.42 H new ATOM 0 HH12 ARG A 413 -0.057 2.211 11.232 1.00 32.42 H new ATOM 0 HH21 ARG A 413 3.362 1.694 12.071 1.00 25.14 H new ATOM 0 HH22 ARG A 413 1.818 2.371 12.599 1.00 25.14 H new ATOM 430 N GLU A 414 6.841 -2.362 9.300 1.00 60.32 N ATOM 431 CA GLU A 414 8.150 -2.424 9.928 1.00 43.21 C ATOM 432 C GLU A 414 9.107 -3.263 9.078 1.00 1.12 C ATOM 433 O GLU A 414 10.162 -2.780 8.667 1.00 2.24 O ATOM 434 CB GLU A 414 8.051 -2.982 11.350 1.00 61.03 C ATOM 435 CG GLU A 414 7.410 -1.962 12.293 1.00 43.33 C ATOM 436 CD GLU A 414 8.413 -0.876 12.690 1.00 33.12 C ATOM 437 OE1 GLU A 414 9.474 -0.753 12.061 1.00 4.10 O ATOM 438 OE2 GLU A 414 8.056 -0.141 13.689 1.00 32.21 O ATOM 0 H GLU A 414 6.118 -2.909 9.767 1.00 60.32 H new ATOM 0 HA GLU A 414 8.546 -1.411 9.996 1.00 43.21 H new ATOM 0 HB2 GLU A 414 7.462 -3.899 11.345 1.00 61.03 H new ATOM 0 HB3 GLU A 414 9.045 -3.244 11.712 1.00 61.03 H new ATOM 0 HG2 GLU A 414 6.547 -1.505 11.808 1.00 43.33 H new ATOM 0 HG3 GLU A 414 7.043 -2.468 13.186 1.00 43.33 H new ATOM 444 N LYS A 415 8.705 -4.501 8.837 1.00 74.11 N ATOM 445 CA LYS A 415 9.513 -5.410 8.043 1.00 53.20 C ATOM 446 C LYS A 415 10.007 -4.685 6.790 1.00 74.31 C ATOM 447 O LYS A 415 11.067 -5.010 6.256 1.00 43.45 O ATOM 448 CB LYS A 415 8.737 -6.695 7.743 1.00 65.41 C ATOM 449 CG LYS A 415 9.113 -7.804 8.727 1.00 5.21 C ATOM 450 CD LYS A 415 9.802 -8.966 8.008 1.00 14.24 C ATOM 451 CE LYS A 415 10.845 -8.454 7.012 1.00 43.41 C ATOM 452 NZ LYS A 415 11.945 -9.431 6.865 1.00 2.01 N ATOM 0 H LYS A 415 7.829 -4.897 9.178 1.00 74.11 H new ATOM 0 HA LYS A 415 10.396 -5.721 8.602 1.00 53.20 H new ATOM 0 HB2 LYS A 415 7.666 -6.500 7.801 1.00 65.41 H new ATOM 0 HB3 LYS A 415 8.946 -7.021 6.724 1.00 65.41 H new ATOM 0 HG2 LYS A 415 9.774 -7.404 9.496 1.00 5.21 H new ATOM 0 HG3 LYS A 415 8.218 -8.165 9.233 1.00 5.21 H new ATOM 0 HD2 LYS A 415 10.281 -9.618 8.739 1.00 14.24 H new ATOM 0 HD3 LYS A 415 9.058 -9.567 7.484 1.00 14.24 H new ATOM 0 HE2 LYS A 415 10.376 -8.277 6.044 1.00 43.41 H new ATOM 0 HE3 LYS A 415 11.243 -7.498 7.353 1.00 43.41 H new ATOM 0 HZ1 LYS A 415 12.644 -9.068 6.186 1.00 2.01 H new ATOM 0 HZ2 LYS A 415 12.403 -9.579 7.787 1.00 2.01 H new ATOM 0 HZ3 LYS A 415 11.563 -10.334 6.519 1.00 2.01 H new ATOM 461 N LEU A 416 9.217 -3.714 6.357 1.00 12.32 N ATOM 462 CA LEU A 416 9.560 -2.938 5.176 1.00 5.34 C ATOM 463 C LEU A 416 10.753 -2.036 5.495 1.00 75.03 C ATOM 464 O LEU A 416 11.685 -1.929 4.699 1.00 24.35 O ATOM 465 CB LEU A 416 8.336 -2.180 4.658 1.00 23.10 C ATOM 466 CG LEU A 416 7.183 -3.043 4.139 1.00 74.30 C ATOM 467 CD1 LEU A 416 5.978 -2.178 3.764 1.00 4.44 C ATOM 468 CD2 LEU A 416 7.640 -3.925 2.975 1.00 60.21 C ATOM 0 H LEU A 416 8.340 -3.446 6.803 1.00 12.32 H new ATOM 0 HA LEU A 416 9.865 -3.596 4.362 1.00 5.34 H new ATOM 0 HB2 LEU A 416 7.958 -1.548 5.462 1.00 23.10 H new ATOM 0 HB3 LEU A 416 8.657 -1.516 3.855 1.00 23.10 H new ATOM 0 HG LEU A 416 6.865 -3.708 4.942 1.00 74.30 H new ATOM 0 HD11 LEU A 416 5.173 -2.815 3.398 1.00 4.44 H new ATOM 0 HD12 LEU A 416 5.637 -1.629 4.642 1.00 4.44 H new ATOM 0 HD13 LEU A 416 6.265 -1.472 2.984 1.00 4.44 H new ATOM 0 HD21 LEU A 416 6.802 -4.528 2.625 1.00 60.21 H new ATOM 0 HD22 LEU A 416 7.999 -3.296 2.161 1.00 60.21 H new ATOM 0 HD23 LEU A 416 8.444 -4.580 3.309 1.00 60.21 H new ATOM 479 N GLU A 417 10.685 -1.408 6.659 1.00 62.35 N ATOM 480 CA GLU A 417 11.749 -0.517 7.093 1.00 52.21 C ATOM 481 C GLU A 417 13.048 -1.300 7.296 1.00 3.23 C ATOM 482 O GLU A 417 14.113 -0.709 7.463 1.00 43.34 O ATOM 483 CB GLU A 417 11.353 0.229 8.368 1.00 42.54 C ATOM 484 CG GLU A 417 9.917 0.748 8.278 1.00 34.02 C ATOM 485 CD GLU A 417 9.759 2.063 9.043 1.00 60.23 C ATOM 486 OE1 GLU A 417 10.170 3.123 8.546 1.00 44.41 O ATOM 487 OE2 GLU A 417 9.187 1.958 10.194 1.00 72.13 O ATOM 0 H GLU A 417 9.910 -1.498 7.316 1.00 62.35 H new ATOM 0 HA GLU A 417 11.915 0.226 6.313 1.00 52.21 H new ATOM 0 HB2 GLU A 417 11.450 -0.435 9.227 1.00 42.54 H new ATOM 0 HB3 GLU A 417 12.035 1.063 8.532 1.00 42.54 H new ATOM 0 HG2 GLU A 417 9.645 0.897 7.233 1.00 34.02 H new ATOM 0 HG3 GLU A 417 9.232 0.003 8.683 1.00 34.02 H new ATOM 493 N ALA A 418 12.915 -2.617 7.274 1.00 33.44 N ATOM 494 CA ALA A 418 14.065 -3.489 7.453 1.00 72.31 C ATOM 495 C ALA A 418 14.753 -3.703 6.104 1.00 31.30 C ATOM 496 O ALA A 418 15.818 -4.316 6.036 1.00 51.32 O ATOM 497 CB ALA A 418 13.615 -4.804 8.095 1.00 71.43 C ATOM 0 H ALA A 418 12.029 -3.103 7.135 1.00 33.44 H new ATOM 0 HA ALA A 418 14.792 -3.032 8.124 1.00 72.31 H new ATOM 0 HB1 ALA A 418 14.477 -5.457 8.229 1.00 71.43 H new ATOM 0 HB2 ALA A 418 13.161 -4.599 9.065 1.00 71.43 H new ATOM 0 HB3 ALA A 418 12.886 -5.293 7.449 1.00 71.43 H new ATOM 503 N LEU A 419 14.117 -3.186 5.062 1.00 1.24 N ATOM 504 CA LEU A 419 14.654 -3.315 3.719 1.00 40.02 C ATOM 505 C LEU A 419 14.885 -1.919 3.133 1.00 11.02 C ATOM 506 O LEU A 419 15.931 -1.658 2.539 1.00 11.03 O ATOM 507 CB LEU A 419 13.747 -4.199 2.861 1.00 14.41 C ATOM 508 CG LEU A 419 13.191 -5.450 3.544 1.00 22.42 C ATOM 509 CD1 LEU A 419 11.874 -5.888 2.898 1.00 60.20 C ATOM 510 CD2 LEU A 419 14.227 -6.577 3.551 1.00 41.14 C ATOM 0 H LEU A 419 13.235 -2.677 5.122 1.00 1.24 H new ATOM 0 HA LEU A 419 15.621 -3.818 3.741 1.00 40.02 H new ATOM 0 HB2 LEU A 419 12.908 -3.596 2.513 1.00 14.41 H new ATOM 0 HB3 LEU A 419 14.305 -4.509 1.977 1.00 14.41 H new ATOM 0 HG LEU A 419 12.975 -5.204 4.584 1.00 22.42 H new ATOM 0 HD11 LEU A 419 11.500 -6.779 3.402 1.00 60.20 H new ATOM 0 HD12 LEU A 419 11.141 -5.086 2.987 1.00 60.20 H new ATOM 0 HD13 LEU A 419 12.042 -6.111 1.844 1.00 60.20 H new ATOM 0 HD21 LEU A 419 13.807 -7.455 4.042 1.00 41.14 H new ATOM 0 HD22 LEU A 419 14.497 -6.829 2.526 1.00 41.14 H new ATOM 0 HD23 LEU A 419 15.116 -6.250 4.090 1.00 41.14 H new ATOM 521 N GLY A 420 13.894 -1.062 3.319 1.00 52.10 N ATOM 522 CA GLY A 420 13.976 0.298 2.817 1.00 73.33 C ATOM 523 C GLY A 420 12.695 1.076 3.128 1.00 74.14 C ATOM 524 O GLY A 420 12.673 1.905 4.036 1.00 25.00 O ATOM 0 H GLY A 420 13.028 -1.283 3.811 1.00 52.10 H new ATOM 0 HA2 GLY A 420 14.831 0.804 3.266 1.00 73.33 H new ATOM 0 HA3 GLY A 420 14.144 0.282 1.740 1.00 73.33 H new ATOM 528 N VAL A 421 11.660 0.782 2.355 1.00 74.03 N ATOM 529 CA VAL A 421 10.379 1.445 2.536 1.00 20.42 C ATOM 530 C VAL A 421 10.086 1.577 4.032 1.00 55.33 C ATOM 531 O VAL A 421 10.315 0.643 4.798 1.00 4.22 O ATOM 532 CB VAL A 421 9.288 0.687 1.778 1.00 52.31 C ATOM 533 CG1 VAL A 421 9.567 -0.816 1.771 1.00 1.44 C ATOM 534 CG2 VAL A 421 7.906 0.987 2.362 1.00 51.50 C ATOM 0 H VAL A 421 11.682 0.094 1.602 1.00 74.03 H new ATOM 0 HA VAL A 421 10.406 2.452 2.120 1.00 20.42 H new ATOM 0 HB VAL A 421 9.297 1.032 0.744 1.00 52.31 H new ATOM 0 HG11 VAL A 421 8.776 -1.330 1.226 1.00 1.44 H new ATOM 0 HG12 VAL A 421 10.525 -1.006 1.286 1.00 1.44 H new ATOM 0 HG13 VAL A 421 9.600 -1.185 2.796 1.00 1.44 H new ATOM 0 HG21 VAL A 421 7.148 0.436 1.805 1.00 51.50 H new ATOM 0 HG22 VAL A 421 7.880 0.684 3.409 1.00 51.50 H new ATOM 0 HG23 VAL A 421 7.704 2.056 2.289 1.00 51.50 H new ATOM 544 N PRO A 422 9.570 2.777 4.412 1.00 2.30 N ATOM 545 CA PRO A 422 9.242 3.043 5.802 1.00 25.22 C ATOM 546 C PRO A 422 7.957 2.321 6.212 1.00 11.43 C ATOM 547 O PRO A 422 7.505 1.411 5.519 1.00 13.51 O ATOM 548 CB PRO A 422 9.129 4.556 5.897 1.00 32.34 C ATOM 549 CG PRO A 422 8.938 5.050 4.471 1.00 25.41 C ATOM 550 CD PRO A 422 9.285 3.906 3.532 1.00 65.20 C ATOM 0 HA PRO A 422 9.999 2.669 6.491 1.00 25.22 H new ATOM 0 HB2 PRO A 422 8.288 4.846 6.527 1.00 32.34 H new ATOM 0 HB3 PRO A 422 10.025 4.987 6.343 1.00 32.34 H new ATOM 0 HG2 PRO A 422 7.909 5.374 4.314 1.00 25.41 H new ATOM 0 HG3 PRO A 422 9.577 5.911 4.276 1.00 25.41 H new ATOM 0 HD2 PRO A 422 8.459 3.683 2.857 1.00 65.20 H new ATOM 0 HD3 PRO A 422 10.146 4.151 2.911 1.00 65.20 H new ATOM 555 N ASP A 423 7.405 2.754 7.335 1.00 52.13 N ATOM 556 CA ASP A 423 6.181 2.161 7.846 1.00 11.22 C ATOM 557 C ASP A 423 5.060 2.358 6.822 1.00 21.35 C ATOM 558 O ASP A 423 4.292 1.435 6.553 1.00 4.42 O ATOM 559 CB ASP A 423 5.749 2.827 9.154 1.00 33.41 C ATOM 560 CG ASP A 423 5.797 4.356 9.147 1.00 33.42 C ATOM 561 OD1 ASP A 423 4.755 5.029 9.123 1.00 32.45 O ATOM 562 OD2 ASP A 423 6.983 4.865 9.168 1.00 21.15 O ATOM 0 H ASP A 423 7.783 3.510 7.906 1.00 52.13 H new ATOM 0 HA ASP A 423 6.368 1.102 8.026 1.00 11.22 H new ATOM 0 HB2 ASP A 423 4.732 2.511 9.386 1.00 33.41 H new ATOM 0 HB3 ASP A 423 6.388 2.462 9.958 1.00 33.41 H new ATOM 567 N GLY A 424 5.003 3.565 6.279 1.00 3.22 N ATOM 568 CA GLY A 424 3.988 3.893 5.292 1.00 51.25 C ATOM 569 C GLY A 424 2.636 4.154 5.960 1.00 12.23 C ATOM 570 O GLY A 424 2.377 5.258 6.434 1.00 2.15 O ATOM 0 H GLY A 424 5.643 4.327 6.503 1.00 3.22 H new ATOM 0 HA2 GLY A 424 4.295 4.774 4.729 1.00 51.25 H new ATOM 0 HA3 GLY A 424 3.893 3.075 4.578 1.00 51.25 H new ATOM 574 N ALA A 425 1.810 3.116 5.975 1.00 64.01 N ATOM 575 CA ALA A 425 0.492 3.219 6.578 1.00 43.13 C ATOM 576 C ALA A 425 -0.387 2.077 6.065 1.00 54.51 C ATOM 577 O ALA A 425 0.094 1.179 5.377 1.00 50.31 O ATOM 578 CB ALA A 425 -0.103 4.595 6.273 1.00 60.11 C ATOM 0 H ALA A 425 2.028 2.201 5.580 1.00 64.01 H new ATOM 0 HA ALA A 425 0.556 3.125 7.662 1.00 43.13 H new ATOM 0 HB1 ALA A 425 -1.092 4.672 6.725 1.00 60.11 H new ATOM 0 HB2 ALA A 425 0.545 5.370 6.682 1.00 60.11 H new ATOM 0 HB3 ALA A 425 -0.187 4.724 5.194 1.00 60.11 H new ATOM 584 N THR A 426 -1.662 2.149 6.422 1.00 72.20 N ATOM 585 CA THR A 426 -2.614 1.133 6.006 1.00 75.21 C ATOM 586 C THR A 426 -4.022 1.723 5.922 1.00 43.40 C ATOM 587 O THR A 426 -4.340 2.681 6.624 1.00 63.35 O ATOM 588 CB THR A 426 -2.504 -0.043 6.979 1.00 24.13 C ATOM 589 OG1 THR A 426 -3.296 0.355 8.094 1.00 45.44 O ATOM 590 CG2 THR A 426 -1.095 -0.195 7.557 1.00 45.34 C ATOM 0 H THR A 426 -2.057 2.895 6.994 1.00 72.20 H new ATOM 0 HA THR A 426 -2.390 0.767 5.004 1.00 75.21 H new ATOM 0 HB THR A 426 -2.788 -0.964 6.470 1.00 24.13 H new ATOM 0 HG1 THR A 426 -3.282 -0.351 8.774 1.00 45.44 H new ATOM 0 HG21 THR A 426 -1.072 -1.043 8.241 1.00 45.34 H new ATOM 0 HG22 THR A 426 -0.385 -0.363 6.747 1.00 45.34 H new ATOM 0 HG23 THR A 426 -0.823 0.713 8.096 1.00 45.34 H new ATOM 598 N PHE A 427 -4.829 1.125 5.058 1.00 12.41 N ATOM 599 CA PHE A 427 -6.198 1.581 4.874 1.00 72.34 C ATOM 600 C PHE A 427 -7.173 0.403 4.885 1.00 13.15 C ATOM 601 O PHE A 427 -6.978 -0.577 4.167 1.00 54.34 O ATOM 602 CB PHE A 427 -6.260 2.267 3.508 1.00 0.34 C ATOM 603 CG PHE A 427 -7.593 2.960 3.221 1.00 45.42 C ATOM 604 CD1 PHE A 427 -8.280 3.557 4.231 1.00 11.02 C ATOM 605 CD2 PHE A 427 -8.090 2.983 1.956 1.00 33.41 C ATOM 606 CE1 PHE A 427 -9.518 4.201 3.966 1.00 30.15 C ATOM 607 CE2 PHE A 427 -9.327 3.627 1.689 1.00 11.44 C ATOM 608 CZ PHE A 427 -10.015 4.222 2.700 1.00 42.12 C ATOM 0 H PHE A 427 -4.562 0.330 4.478 1.00 12.41 H new ATOM 0 HA PHE A 427 -6.478 2.257 5.682 1.00 72.34 H new ATOM 0 HB2 PHE A 427 -5.459 3.003 3.446 1.00 0.34 H new ATOM 0 HB3 PHE A 427 -6.073 1.525 2.731 1.00 0.34 H new ATOM 0 HD1 PHE A 427 -7.884 3.542 5.236 1.00 11.02 H new ATOM 0 HD2 PHE A 427 -7.543 2.511 1.153 1.00 33.41 H new ATOM 0 HE1 PHE A 427 -10.064 4.674 4.769 1.00 30.15 H new ATOM 0 HE2 PHE A 427 -9.721 3.644 0.684 1.00 11.44 H new ATOM 0 HZ PHE A 427 -10.956 4.711 2.498 1.00 42.12 H new ATOM 617 N CYS A 428 -8.203 0.535 5.708 1.00 42.13 N ATOM 618 CA CYS A 428 -9.209 -0.505 5.822 1.00 2.10 C ATOM 619 C CYS A 428 -10.587 0.160 5.862 1.00 41.55 C ATOM 620 O CYS A 428 -10.831 1.039 6.688 1.00 10.30 O ATOM 621 CB CYS A 428 -8.969 -1.394 7.045 1.00 63.33 C ATOM 622 SG CYS A 428 -9.270 -0.441 8.579 1.00 42.51 S ATOM 0 H CYS A 428 -8.362 1.348 6.303 1.00 42.13 H new ATOM 0 HA CYS A 428 -9.151 -1.166 4.957 1.00 2.10 H new ATOM 0 HB2 CYS A 428 -9.629 -2.261 7.010 1.00 63.33 H new ATOM 0 HB3 CYS A 428 -7.946 -1.771 7.036 1.00 63.33 H new ATOM 0 HG CYS A 428 -10.060 0.558 8.321 1.00 42.51 H new ATOM 627 N GLU A 429 -11.449 -0.284 4.960 1.00 2.50 N ATOM 628 CA GLU A 429 -12.796 0.258 4.883 1.00 30.22 C ATOM 629 C GLU A 429 -13.551 -0.008 6.187 1.00 41.50 C ATOM 630 O GLU A 429 -13.663 -1.154 6.621 1.00 13.32 O ATOM 631 CB GLU A 429 -13.551 -0.320 3.684 1.00 63.41 C ATOM 632 CG GLU A 429 -13.355 0.551 2.441 1.00 3.32 C ATOM 633 CD GLU A 429 -13.737 -0.213 1.172 1.00 35.13 C ATOM 634 OE1 GLU A 429 -13.611 -1.445 1.127 1.00 33.42 O ATOM 635 OE2 GLU A 429 -14.180 0.520 0.207 1.00 32.03 O ATOM 0 H GLU A 429 -11.242 -1.012 4.276 1.00 2.50 H new ATOM 0 HA GLU A 429 -12.726 1.336 4.741 1.00 30.22 H new ATOM 0 HB2 GLU A 429 -13.200 -1.332 3.482 1.00 63.41 H new ATOM 0 HB3 GLU A 429 -14.613 -0.392 3.919 1.00 63.41 H new ATOM 0 HG2 GLU A 429 -13.963 1.452 2.524 1.00 3.32 H new ATOM 0 HG3 GLU A 429 -12.315 0.872 2.378 1.00 3.32 H new ATOM 641 N ASP A 430 -14.050 1.069 6.773 1.00 24.31 N ATOM 642 CA ASP A 430 -14.791 0.968 8.020 1.00 2.13 C ATOM 643 C ASP A 430 -15.680 2.202 8.182 1.00 63.20 C ATOM 644 O ASP A 430 -15.209 3.331 8.057 1.00 45.13 O ATOM 645 CB ASP A 430 -13.845 0.904 9.220 1.00 71.21 C ATOM 646 CG ASP A 430 -13.279 -0.483 9.525 1.00 62.52 C ATOM 647 OD1 ASP A 430 -12.494 -1.039 8.741 1.00 22.23 O ATOM 648 OD2 ASP A 430 -13.679 -1.004 10.634 1.00 21.43 O ATOM 0 H ASP A 430 -13.956 2.017 6.408 1.00 24.31 H new ATOM 0 HA ASP A 430 -15.388 0.057 7.984 1.00 2.13 H new ATOM 0 HB2 ASP A 430 -13.015 1.588 9.045 1.00 71.21 H new ATOM 0 HB3 ASP A 430 -14.376 1.265 10.101 1.00 71.21 H new ATOM 653 N PHE A 431 -16.951 1.945 8.457 1.00 43.01 N ATOM 654 CA PHE A 431 -17.908 3.022 8.639 1.00 15.44 C ATOM 655 C PHE A 431 -18.441 3.047 10.073 1.00 2.44 C ATOM 656 O PHE A 431 -19.436 3.713 10.358 1.00 10.12 O ATOM 657 CB PHE A 431 -19.070 2.752 7.681 1.00 4.44 C ATOM 658 CG PHE A 431 -18.641 2.194 6.323 1.00 22.11 C ATOM 659 CD1 PHE A 431 -18.346 3.041 5.301 1.00 13.14 C ATOM 660 CD2 PHE A 431 -18.553 0.849 6.139 1.00 34.53 C ATOM 661 CE1 PHE A 431 -17.948 2.522 4.041 1.00 72.43 C ATOM 662 CE2 PHE A 431 -18.154 0.329 4.878 1.00 55.04 C ATOM 663 CZ PHE A 431 -17.859 1.177 3.855 1.00 41.21 C ATOM 0 H PHE A 431 -17.339 1.007 8.558 1.00 43.01 H new ATOM 0 HA PHE A 431 -17.430 3.982 8.441 1.00 15.44 H new ATOM 0 HB2 PHE A 431 -19.758 2.049 8.150 1.00 4.44 H new ATOM 0 HB3 PHE A 431 -19.620 3.680 7.524 1.00 4.44 H new ATOM 0 HD1 PHE A 431 -18.414 4.109 5.448 1.00 13.14 H new ATOM 0 HD2 PHE A 431 -18.786 0.176 6.951 1.00 34.53 H new ATOM 0 HE1 PHE A 431 -17.716 3.195 3.229 1.00 72.43 H new ATOM 0 HE2 PHE A 431 -18.085 -0.739 4.731 1.00 55.04 H new ATOM 0 HZ PHE A 431 -17.555 0.783 2.897 1.00 41.21 H new ATOM 672 N GLN A 432 -17.756 2.313 10.937 1.00 23.23 N ATOM 673 CA GLN A 432 -18.148 2.243 12.335 1.00 24.34 C ATOM 674 C GLN A 432 -17.008 2.734 13.230 1.00 30.22 C ATOM 675 O GLN A 432 -17.167 2.828 14.447 1.00 54.11 O ATOM 676 CB GLN A 432 -18.571 0.823 12.715 1.00 41.12 C ATOM 677 CG GLN A 432 -19.599 0.274 11.724 1.00 21.44 C ATOM 678 CD GLN A 432 -18.911 -0.407 10.540 1.00 65.55 C ATOM 679 OE1 GLN A 432 -17.763 -0.143 10.220 1.00 22.12 O ATOM 680 NE2 GLN A 432 -19.672 -1.296 9.909 1.00 22.10 N ATOM 0 H GLN A 432 -16.932 1.762 10.697 1.00 23.23 H new ATOM 0 HA GLN A 432 -19.009 2.895 12.485 1.00 24.34 H new ATOM 0 HB2 GLN A 432 -17.697 0.172 12.735 1.00 41.12 H new ATOM 0 HB3 GLN A 432 -18.993 0.822 13.720 1.00 41.12 H new ATOM 0 HG2 GLN A 432 -20.251 -0.439 12.229 1.00 21.44 H new ATOM 0 HG3 GLN A 432 -20.231 1.085 11.364 1.00 21.44 H new ATOM 0 HE21 GLN A 432 -20.625 -1.470 10.228 1.00 22.10 H new ATOM 0 HE22 GLN A 432 -19.303 -1.804 9.106 1.00 22.10 H new ATOM 687 N VAL A 433 -15.886 3.033 12.594 1.00 62.35 N ATOM 688 CA VAL A 433 -14.720 3.511 13.319 1.00 10.10 C ATOM 689 C VAL A 433 -15.148 4.608 14.297 1.00 74.31 C ATOM 690 O VAL A 433 -16.292 5.059 14.268 1.00 62.11 O ATOM 691 CB VAL A 433 -13.646 3.975 12.334 1.00 74.31 C ATOM 692 CG1 VAL A 433 -12.807 2.793 11.841 1.00 74.13 C ATOM 693 CG2 VAL A 433 -14.268 4.733 11.158 1.00 11.35 C ATOM 0 H VAL A 433 -15.758 2.954 11.585 1.00 62.35 H new ATOM 0 HA VAL A 433 -14.278 2.706 13.906 1.00 10.10 H new ATOM 0 HB VAL A 433 -12.983 4.661 12.861 1.00 74.31 H new ATOM 0 HG11 VAL A 433 -12.051 3.150 11.142 1.00 74.13 H new ATOM 0 HG12 VAL A 433 -12.319 2.314 12.690 1.00 74.13 H new ATOM 0 HG13 VAL A 433 -13.453 2.072 11.340 1.00 74.13 H new ATOM 0 HG21 VAL A 433 -13.482 5.051 10.473 1.00 11.35 H new ATOM 0 HG22 VAL A 433 -14.965 4.080 10.632 1.00 11.35 H new ATOM 0 HG23 VAL A 433 -14.801 5.608 11.530 1.00 11.35 H new ATOM 703 N HIS A 434 -14.205 5.006 15.138 1.00 21.13 N ATOM 704 CA HIS A 434 -14.469 6.042 16.123 1.00 32.23 C ATOM 705 C HIS A 434 -15.145 7.234 15.445 1.00 70.31 C ATOM 706 O HIS A 434 -16.114 7.783 15.967 1.00 61.03 O ATOM 707 CB HIS A 434 -13.187 6.428 16.861 1.00 24.52 C ATOM 708 CG HIS A 434 -11.946 6.385 16.003 1.00 41.12 C ATOM 709 ND1 HIS A 434 -11.475 7.486 15.308 1.00 43.54 N ATOM 710 CD2 HIS A 434 -11.083 5.363 15.734 1.00 12.11 C ATOM 711 CE1 HIS A 434 -10.380 7.132 14.654 1.00 3.25 C ATOM 712 NE2 HIS A 434 -10.138 5.816 14.919 1.00 32.03 N ATOM 0 H HIS A 434 -13.257 4.630 15.158 1.00 21.13 H new ATOM 0 HA HIS A 434 -15.155 5.663 16.880 1.00 32.23 H new ATOM 0 HB2 HIS A 434 -13.302 7.434 17.265 1.00 24.52 H new ATOM 0 HB3 HIS A 434 -13.053 5.757 17.709 1.00 24.52 H new ATOM 0 HD2 HIS A 434 -11.156 4.357 16.119 1.00 12.11 H new ATOM 0 HE1 HIS A 434 -9.783 7.773 14.022 1.00 3.25 H new ATOM 0 HE2 HIS A 434 -9.359 5.270 14.551 1.00 32.03 H new ATOM 719 N GLY A 435 -14.608 7.599 14.290 1.00 41.22 N ATOM 720 CA GLY A 435 -15.148 8.717 13.535 1.00 62.34 C ATOM 721 C GLY A 435 -14.375 10.003 13.832 1.00 53.51 C ATOM 722 O GLY A 435 -14.975 11.055 14.057 1.00 1.11 O ATOM 0 H GLY A 435 -13.805 7.141 13.859 1.00 41.22 H new ATOM 0 HA2 GLY A 435 -15.100 8.497 12.468 1.00 62.34 H new ATOM 0 HA3 GLY A 435 -16.200 8.855 13.785 1.00 62.34 H new ATOM 726 N ARG A 436 -13.057 9.881 13.825 1.00 2.15 N ATOM 727 CA ARG A 436 -12.196 11.020 14.091 1.00 23.13 C ATOM 728 C ARG A 436 -11.460 11.438 12.817 1.00 74.43 C ATOM 729 O ARG A 436 -10.608 12.325 12.851 1.00 4.30 O ATOM 730 CB ARG A 436 -11.172 10.695 15.180 1.00 3.44 C ATOM 731 CG ARG A 436 -11.860 10.460 16.527 1.00 65.51 C ATOM 732 CD ARG A 436 -12.328 11.781 17.140 1.00 44.13 C ATOM 733 NE ARG A 436 -11.164 12.553 17.631 1.00 31.53 N ATOM 734 CZ ARG A 436 -11.198 13.869 17.924 1.00 43.22 C ATOM 735 NH1 ARG A 436 -12.342 14.574 17.779 1.00 2.30 N ATOM 736 NH2 ARG A 436 -10.099 14.458 18.355 1.00 33.42 N ATOM 0 H ARG A 436 -12.563 9.008 13.639 1.00 2.15 H new ATOM 0 HA ARG A 436 -12.827 11.839 14.435 1.00 23.13 H new ATOM 0 HB2 ARG A 436 -10.605 9.808 14.898 1.00 3.44 H new ATOM 0 HB3 ARG A 436 -10.459 11.514 15.270 1.00 3.44 H new ATOM 0 HG2 ARG A 436 -12.713 9.795 16.393 1.00 65.51 H new ATOM 0 HG3 ARG A 436 -11.171 9.962 17.209 1.00 65.51 H new ATOM 0 HD2 ARG A 436 -12.873 12.363 16.397 1.00 44.13 H new ATOM 0 HD3 ARG A 436 -13.018 11.586 17.961 1.00 44.13 H new ATOM 0 HE ARG A 436 -10.281 12.058 17.756 1.00 31.53 H new ATOM 0 HH11 ARG A 436 -13.188 14.111 17.446 1.00 2.30 H new ATOM 0 HH12 ARG A 436 -12.360 15.569 18.003 1.00 2.30 H new ATOM 0 HH21 ARG A 436 -9.240 13.919 18.462 1.00 33.42 H new ATOM 0 HH22 ARG A 436 -10.108 15.453 18.581 1.00 33.42 H new ATOM 746 N GLY A 437 -11.816 10.782 11.723 1.00 3.14 N ATOM 747 CA GLY A 437 -11.199 11.075 10.440 1.00 41.40 C ATOM 748 C GLY A 437 -9.800 10.463 10.351 1.00 53.35 C ATOM 749 O GLY A 437 -8.830 11.056 10.821 1.00 54.54 O ATOM 0 H GLY A 437 -12.524 10.048 11.698 1.00 3.14 H new ATOM 0 HA2 GLY A 437 -11.822 10.685 9.635 1.00 41.40 H new ATOM 0 HA3 GLY A 437 -11.137 12.154 10.300 1.00 41.40 H new ATOM 753 N GLU A 438 -9.741 9.286 9.747 1.00 70.54 N ATOM 754 CA GLU A 438 -8.476 8.588 9.590 1.00 51.43 C ATOM 755 C GLU A 438 -7.729 9.111 8.362 1.00 11.32 C ATOM 756 O GLU A 438 -6.764 9.864 8.491 1.00 13.54 O ATOM 757 CB GLU A 438 -8.692 7.076 9.498 1.00 24.24 C ATOM 758 CG GLU A 438 -9.470 6.559 10.710 1.00 53.50 C ATOM 759 CD GLU A 438 -8.526 6.219 11.864 1.00 24.42 C ATOM 760 OE1 GLU A 438 -8.167 7.105 12.654 1.00 51.31 O ATOM 761 OE2 GLU A 438 -8.165 4.982 11.925 1.00 63.05 O ATOM 0 H GLU A 438 -10.549 8.798 9.360 1.00 70.54 H new ATOM 0 HA GLU A 438 -7.865 8.782 10.472 1.00 51.43 H new ATOM 0 HB2 GLU A 438 -9.235 6.838 8.584 1.00 24.24 H new ATOM 0 HB3 GLU A 438 -7.728 6.570 9.437 1.00 24.24 H new ATOM 0 HG2 GLU A 438 -10.189 7.312 11.033 1.00 53.50 H new ATOM 0 HG3 GLU A 438 -10.041 5.674 10.429 1.00 53.50 H new ATOM 767 N LEU A 439 -8.204 8.692 7.198 1.00 30.21 N ATOM 768 CA LEU A 439 -7.592 9.108 5.946 1.00 65.10 C ATOM 769 C LEU A 439 -8.686 9.543 4.970 1.00 33.33 C ATOM 770 O LEU A 439 -9.872 9.340 5.228 1.00 42.34 O ATOM 771 CB LEU A 439 -6.683 8.005 5.402 1.00 53.21 C ATOM 772 CG LEU A 439 -7.385 6.848 4.688 1.00 45.53 C ATOM 773 CD1 LEU A 439 -8.027 7.320 3.381 1.00 22.02 C ATOM 774 CD2 LEU A 439 -6.427 5.677 4.466 1.00 42.34 C ATOM 0 H LEU A 439 -9.005 8.069 7.095 1.00 30.21 H new ATOM 0 HA LEU A 439 -6.945 9.971 6.105 1.00 65.10 H new ATOM 0 HB2 LEU A 439 -5.973 8.456 4.709 1.00 53.21 H new ATOM 0 HB3 LEU A 439 -6.104 7.597 6.231 1.00 53.21 H new ATOM 0 HG LEU A 439 -8.188 6.488 5.330 1.00 45.53 H new ATOM 0 HD11 LEU A 439 -8.519 6.479 2.893 1.00 22.02 H new ATOM 0 HD12 LEU A 439 -8.762 8.096 3.596 1.00 22.02 H new ATOM 0 HD13 LEU A 439 -7.257 7.722 2.722 1.00 22.02 H new ATOM 0 HD21 LEU A 439 -6.952 4.869 3.957 1.00 42.34 H new ATOM 0 HD22 LEU A 439 -5.586 6.005 3.855 1.00 42.34 H new ATOM 0 HD23 LEU A 439 -6.059 5.321 5.428 1.00 42.34 H new ATOM 785 N SER A 440 -8.249 10.133 3.867 1.00 55.01 N ATOM 786 CA SER A 440 -9.178 10.598 2.849 1.00 43.43 C ATOM 787 C SER A 440 -9.745 9.407 2.075 1.00 20.33 C ATOM 788 O SER A 440 -10.924 9.080 2.206 1.00 63.41 O ATOM 789 CB SER A 440 -8.498 11.579 1.892 1.00 43.23 C ATOM 790 OG SER A 440 -8.598 12.925 2.347 1.00 43.54 O ATOM 0 H SER A 440 -7.265 10.300 3.655 1.00 55.01 H new ATOM 0 HA SER A 440 -9.995 11.122 3.344 1.00 43.43 H new ATOM 0 HB2 SER A 440 -7.447 11.310 1.784 1.00 43.23 H new ATOM 0 HB3 SER A 440 -8.952 11.496 0.905 1.00 43.23 H new ATOM 0 HG SER A 440 -8.150 13.520 1.710 1.00 43.54 H new ATOM 795 N CYS A 441 -8.879 8.789 1.284 1.00 55.02 N ATOM 796 CA CYS A 441 -9.279 7.642 0.487 1.00 61.41 C ATOM 797 C CYS A 441 -8.034 7.079 -0.201 1.00 32.44 C ATOM 798 O CYS A 441 -6.973 7.701 -0.181 1.00 31.14 O ATOM 799 CB CYS A 441 -10.373 8.005 -0.519 1.00 30.02 C ATOM 800 SG CYS A 441 -11.395 6.533 -0.890 1.00 51.11 S ATOM 0 H CYS A 441 -7.902 9.062 1.178 1.00 55.02 H new ATOM 0 HA CYS A 441 -9.712 6.879 1.134 1.00 61.41 H new ATOM 0 HB2 CYS A 441 -11.000 8.801 -0.116 1.00 30.02 H new ATOM 0 HB3 CYS A 441 -9.924 8.386 -1.436 1.00 30.02 H new ATOM 0 HG CYS A 441 -12.322 6.852 -1.743 1.00 51.11 H new ATOM 805 N LEU A 442 -8.205 5.906 -0.794 1.00 73.14 N ATOM 806 CA LEU A 442 -7.109 5.251 -1.487 1.00 54.23 C ATOM 807 C LEU A 442 -6.488 6.227 -2.488 1.00 70.03 C ATOM 808 O LEU A 442 -5.283 6.192 -2.731 1.00 22.41 O ATOM 809 CB LEU A 442 -7.581 3.940 -2.118 1.00 10.11 C ATOM 810 CG LEU A 442 -6.787 3.457 -3.334 1.00 23.23 C ATOM 811 CD1 LEU A 442 -7.039 4.355 -4.546 1.00 62.24 C ATOM 812 CD2 LEU A 442 -5.297 3.341 -3.005 1.00 55.43 C ATOM 0 H LEU A 442 -9.086 5.393 -0.809 1.00 73.14 H new ATOM 0 HA LEU A 442 -6.324 4.974 -0.783 1.00 54.23 H new ATOM 0 HB2 LEU A 442 -7.550 3.161 -1.356 1.00 10.11 H new ATOM 0 HB3 LEU A 442 -8.624 4.056 -2.413 1.00 10.11 H new ATOM 0 HG LEU A 442 -7.137 2.459 -3.596 1.00 23.23 H new ATOM 0 HD11 LEU A 442 -6.463 3.989 -5.396 1.00 62.24 H new ATOM 0 HD12 LEU A 442 -8.100 4.342 -4.794 1.00 62.24 H new ATOM 0 HD13 LEU A 442 -6.734 5.375 -4.313 1.00 62.24 H new ATOM 0 HD21 LEU A 442 -4.756 2.996 -3.886 1.00 55.43 H new ATOM 0 HD22 LEU A 442 -4.914 4.316 -2.703 1.00 55.43 H new ATOM 0 HD23 LEU A 442 -5.158 2.629 -2.192 1.00 55.43 H new ATOM 823 N GLN A 443 -7.341 7.077 -3.043 1.00 24.52 N ATOM 824 CA GLN A 443 -6.890 8.062 -4.012 1.00 13.15 C ATOM 825 C GLN A 443 -5.863 9.000 -3.380 1.00 62.13 C ATOM 826 O GLN A 443 -4.948 9.471 -4.054 1.00 44.55 O ATOM 827 CB GLN A 443 -8.073 8.848 -4.584 1.00 72.02 C ATOM 828 CG GLN A 443 -7.595 9.917 -5.568 1.00 63.11 C ATOM 829 CD GLN A 443 -7.653 9.402 -7.008 1.00 64.44 C ATOM 830 OE1 GLN A 443 -8.706 9.280 -7.610 1.00 52.14 O ATOM 831 NE2 GLN A 443 -6.462 9.107 -7.524 1.00 13.40 N ATOM 0 H GLN A 443 -8.340 7.104 -2.840 1.00 24.52 H new ATOM 0 HA GLN A 443 -6.410 7.537 -4.838 1.00 13.15 H new ATOM 0 HB2 GLN A 443 -8.759 8.166 -5.087 1.00 72.02 H new ATOM 0 HB3 GLN A 443 -8.629 9.318 -3.773 1.00 72.02 H new ATOM 0 HG2 GLN A 443 -8.215 10.808 -5.472 1.00 63.11 H new ATOM 0 HG3 GLN A 443 -6.574 10.211 -5.324 1.00 63.11 H new ATOM 0 HE21 GLN A 443 -5.618 9.233 -6.964 1.00 13.40 H new ATOM 0 HE22 GLN A 443 -6.393 8.755 -8.479 1.00 13.40 H new ATOM 838 N ASP A 444 -6.046 9.243 -2.089 1.00 54.43 N ATOM 839 CA ASP A 444 -5.147 10.117 -1.357 1.00 21.41 C ATOM 840 C ASP A 444 -3.877 9.345 -0.993 1.00 32.32 C ATOM 841 O ASP A 444 -2.946 9.908 -0.421 1.00 63.54 O ATOM 842 CB ASP A 444 -5.790 10.607 -0.058 1.00 75.34 C ATOM 843 CG ASP A 444 -5.518 12.073 0.285 1.00 53.14 C ATOM 844 OD1 ASP A 444 -5.501 12.943 -0.598 1.00 52.33 O ATOM 845 OD2 ASP A 444 -5.316 12.312 1.537 1.00 22.15 O ATOM 0 H ASP A 444 -6.804 8.849 -1.532 1.00 54.43 H new ATOM 0 HA ASP A 444 -4.919 10.973 -1.992 1.00 21.41 H new ATOM 0 HB2 ASP A 444 -6.868 10.459 -0.125 1.00 75.34 H new ATOM 0 HB3 ASP A 444 -5.434 9.985 0.763 1.00 75.34 H new ATOM 850 N ALA A 445 -3.880 8.067 -1.341 1.00 34.20 N ATOM 851 CA ALA A 445 -2.739 7.210 -1.059 1.00 51.45 C ATOM 852 C ALA A 445 -1.918 7.026 -2.335 1.00 24.32 C ATOM 853 O ALA A 445 -0.700 6.865 -2.277 1.00 2.33 O ATOM 854 CB ALA A 445 -3.230 5.880 -0.483 1.00 61.25 C ATOM 0 H ALA A 445 -4.654 7.603 -1.816 1.00 34.20 H new ATOM 0 HA ALA A 445 -2.089 7.668 -0.313 1.00 51.45 H new ATOM 0 HB1 ALA A 445 -2.375 5.237 -0.272 1.00 61.25 H new ATOM 0 HB2 ALA A 445 -3.782 6.064 0.439 1.00 61.25 H new ATOM 0 HB3 ALA A 445 -3.883 5.390 -1.205 1.00 61.25 H new ATOM 860 N ILE A 446 -2.617 7.054 -3.461 1.00 2.33 N ATOM 861 CA ILE A 446 -1.967 6.891 -4.750 1.00 51.03 C ATOM 862 C ILE A 446 -1.306 8.211 -5.153 1.00 10.05 C ATOM 863 O ILE A 446 -0.466 8.239 -6.051 1.00 24.11 O ATOM 864 CB ILE A 446 -2.958 6.358 -5.786 1.00 24.00 C ATOM 865 CG1 ILE A 446 -2.285 5.354 -6.725 1.00 45.33 C ATOM 866 CG2 ILE A 446 -3.621 7.504 -6.553 1.00 73.43 C ATOM 867 CD1 ILE A 446 -3.304 4.362 -7.289 1.00 71.43 C ATOM 0 H ILE A 446 -3.627 7.187 -3.507 1.00 2.33 H new ATOM 0 HA ILE A 446 -1.176 6.144 -4.686 1.00 51.03 H new ATOM 0 HB ILE A 446 -3.748 5.825 -5.258 1.00 24.00 H new ATOM 0 HG12 ILE A 446 -1.798 5.885 -7.543 1.00 45.33 H new ATOM 0 HG13 ILE A 446 -1.506 4.814 -6.187 1.00 45.33 H new ATOM 0 HG21 ILE A 446 -4.321 7.097 -7.283 1.00 73.43 H new ATOM 0 HG22 ILE A 446 -4.158 8.146 -5.855 1.00 73.43 H new ATOM 0 HG23 ILE A 446 -2.857 8.087 -7.068 1.00 73.43 H new ATOM 0 HD11 ILE A 446 -2.799 3.660 -7.953 1.00 71.43 H new ATOM 0 HD12 ILE A 446 -3.771 3.815 -6.470 1.00 71.43 H new ATOM 0 HD13 ILE A 446 -4.068 4.903 -7.847 1.00 71.43 H new ATOM 878 N ASP A 447 -1.712 9.271 -4.471 1.00 33.33 N ATOM 879 CA ASP A 447 -1.169 10.591 -4.747 1.00 14.55 C ATOM 880 C ASP A 447 -0.144 10.952 -3.670 1.00 12.22 C ATOM 881 O ASP A 447 0.925 11.475 -3.979 1.00 62.02 O ATOM 882 CB ASP A 447 -2.270 11.654 -4.727 1.00 32.32 C ATOM 883 CG ASP A 447 -3.177 11.669 -5.959 1.00 32.32 C ATOM 884 OD1 ASP A 447 -3.408 12.723 -6.570 1.00 42.14 O ATOM 885 OD2 ASP A 447 -3.664 10.521 -6.293 1.00 70.33 O ATOM 0 H ASP A 447 -2.410 9.244 -3.728 1.00 33.33 H new ATOM 0 HA ASP A 447 -0.708 10.567 -5.735 1.00 14.55 H new ATOM 0 HB2 ASP A 447 -2.887 11.500 -3.842 1.00 32.32 H new ATOM 0 HB3 ASP A 447 -1.805 12.635 -4.624 1.00 32.32 H new ATOM 890 N HIS A 448 -0.506 10.656 -2.432 1.00 64.01 N ATOM 891 CA HIS A 448 0.369 10.943 -1.307 1.00 31.14 C ATOM 892 C HIS A 448 1.465 9.878 -1.227 1.00 2.41 C ATOM 893 O HIS A 448 2.645 10.182 -1.396 1.00 4.30 O ATOM 894 CB HIS A 448 -0.434 11.067 -0.011 1.00 51.54 C ATOM 895 CG HIS A 448 -1.552 12.081 -0.075 1.00 12.04 C ATOM 896 ND1 HIS A 448 -1.931 12.705 -1.251 1.00 61.34 N ATOM 897 CD2 HIS A 448 -2.367 12.573 0.901 1.00 34.24 C ATOM 898 CE1 HIS A 448 -2.929 13.532 -0.982 1.00 60.25 C ATOM 899 NE2 HIS A 448 -3.198 13.450 0.353 1.00 14.11 N ATOM 0 H HIS A 448 -1.394 10.220 -2.182 1.00 64.01 H new ATOM 0 HA HIS A 448 0.856 11.907 -1.456 1.00 31.14 H new ATOM 0 HB2 HIS A 448 -0.855 10.093 0.238 1.00 51.54 H new ATOM 0 HB3 HIS A 448 0.243 11.338 0.799 1.00 51.54 H new ATOM 0 HD2 HIS A 448 -2.341 12.296 1.944 1.00 34.24 H new ATOM 0 HE1 HIS A 448 -3.441 14.162 -1.695 1.00 60.25 H new ATOM 0 HE2 HIS A 448 -3.919 13.976 0.848 1.00 14.11 H new ATOM 906 N SER A 449 1.036 8.652 -0.966 1.00 24.01 N ATOM 907 CA SER A 449 1.965 7.540 -0.859 1.00 63.25 C ATOM 908 C SER A 449 2.525 7.194 -2.240 1.00 64.51 C ATOM 909 O SER A 449 1.884 7.451 -3.257 1.00 71.42 O ATOM 910 CB SER A 449 1.292 6.317 -0.238 1.00 3.24 C ATOM 911 OG SER A 449 1.638 6.156 1.136 1.00 40.24 O ATOM 0 H SER A 449 0.057 8.404 -0.825 1.00 24.01 H new ATOM 0 HA SER A 449 2.784 7.840 -0.205 1.00 63.25 H new ATOM 0 HB2 SER A 449 0.210 6.413 -0.330 1.00 3.24 H new ATOM 0 HB3 SER A 449 1.581 5.424 -0.792 1.00 3.24 H new ATOM 0 HG SER A 449 0.931 5.656 1.595 1.00 40.24 H new ATOM 916 N ALA A 450 3.718 6.615 -2.231 1.00 1.20 N ATOM 917 CA ALA A 450 4.373 6.231 -3.471 1.00 3.14 C ATOM 918 C ALA A 450 3.515 5.191 -4.194 1.00 43.13 C ATOM 919 O ALA A 450 2.787 5.524 -5.129 1.00 44.52 O ATOM 920 CB ALA A 450 5.781 5.714 -3.166 1.00 15.20 C ATOM 0 H ALA A 450 4.247 6.403 -1.385 1.00 1.20 H new ATOM 0 HA ALA A 450 4.477 7.091 -4.132 1.00 3.14 H new ATOM 0 HB1 ALA A 450 6.272 5.426 -4.095 1.00 15.20 H new ATOM 0 HB2 ALA A 450 6.359 6.499 -2.678 1.00 15.20 H new ATOM 0 HB3 ALA A 450 5.716 4.848 -2.507 1.00 15.20 H new ATOM 926 N PHE A 451 3.628 3.953 -3.735 1.00 12.22 N ATOM 927 CA PHE A 451 2.871 2.864 -4.326 1.00 54.02 C ATOM 928 C PHE A 451 1.915 2.242 -3.305 1.00 73.40 C ATOM 929 O PHE A 451 2.281 2.045 -2.149 1.00 43.20 O ATOM 930 CB PHE A 451 3.884 1.805 -4.770 1.00 53.43 C ATOM 931 CG PHE A 451 5.003 2.351 -5.660 1.00 11.24 C ATOM 932 CD1 PHE A 451 4.699 3.083 -6.765 1.00 41.31 C ATOM 933 CD2 PHE A 451 6.303 2.102 -5.345 1.00 52.14 C ATOM 934 CE1 PHE A 451 5.739 3.588 -7.590 1.00 41.53 C ATOM 935 CE2 PHE A 451 7.343 2.607 -6.170 1.00 52.45 C ATOM 936 CZ PHE A 451 7.038 3.340 -7.275 1.00 50.41 C ATOM 0 H PHE A 451 4.233 3.681 -2.960 1.00 12.22 H new ATOM 0 HA PHE A 451 2.276 3.235 -5.161 1.00 54.02 H new ATOM 0 HB2 PHE A 451 4.327 1.347 -3.886 1.00 53.43 H new ATOM 0 HB3 PHE A 451 3.358 1.016 -5.308 1.00 53.43 H new ATOM 0 HD1 PHE A 451 3.667 3.280 -7.015 1.00 41.31 H new ATOM 0 HD2 PHE A 451 6.544 1.520 -4.468 1.00 52.14 H new ATOM 0 HE1 PHE A 451 5.498 4.169 -8.468 1.00 41.53 H new ATOM 0 HE2 PHE A 451 8.375 2.409 -5.920 1.00 52.45 H new ATOM 0 HZ PHE A 451 7.828 3.725 -7.902 1.00 50.41 H new ATOM 945 N ILE A 452 0.710 1.949 -3.773 1.00 2.02 N ATOM 946 CA ILE A 452 -0.300 1.353 -2.916 1.00 64.03 C ATOM 947 C ILE A 452 -0.068 -0.156 -2.833 1.00 65.01 C ATOM 948 O ILE A 452 0.228 -0.799 -3.840 1.00 62.11 O ATOM 949 CB ILE A 452 -1.702 1.734 -3.395 1.00 24.31 C ATOM 950 CG1 ILE A 452 -1.773 3.220 -3.759 1.00 33.53 C ATOM 951 CG2 ILE A 452 -2.760 1.347 -2.360 1.00 44.35 C ATOM 952 CD1 ILE A 452 -1.807 4.091 -2.502 1.00 32.04 C ATOM 0 H ILE A 452 0.411 2.113 -4.734 1.00 2.02 H new ATOM 0 HA ILE A 452 -0.217 1.744 -1.902 1.00 64.03 H new ATOM 0 HB ILE A 452 -1.917 1.169 -4.302 1.00 24.31 H new ATOM 0 HG12 ILE A 452 -0.912 3.490 -4.370 1.00 33.53 H new ATOM 0 HG13 ILE A 452 -2.662 3.409 -4.361 1.00 33.53 H new ATOM 0 HG21 ILE A 452 -3.747 1.629 -2.726 1.00 44.35 H new ATOM 0 HG22 ILE A 452 -2.729 0.270 -2.193 1.00 44.35 H new ATOM 0 HG23 ILE A 452 -2.559 1.865 -1.423 1.00 44.35 H new ATOM 0 HD11 ILE A 452 -1.857 5.141 -2.788 1.00 32.04 H new ATOM 0 HD12 ILE A 452 -2.683 3.835 -1.906 1.00 32.04 H new ATOM 0 HD13 ILE A 452 -0.905 3.918 -1.915 1.00 32.04 H new ATOM 963 N ILE A 453 -0.208 -0.680 -1.624 1.00 51.53 N ATOM 964 CA ILE A 453 -0.017 -2.102 -1.398 1.00 43.24 C ATOM 965 C ILE A 453 -1.364 -2.747 -1.067 1.00 32.24 C ATOM 966 O ILE A 453 -2.031 -2.349 -0.113 1.00 15.43 O ATOM 967 CB ILE A 453 1.054 -2.334 -0.329 1.00 32.55 C ATOM 968 CG1 ILE A 453 2.356 -1.621 -0.695 1.00 62.42 C ATOM 969 CG2 ILE A 453 1.269 -3.831 -0.085 1.00 42.41 C ATOM 970 CD1 ILE A 453 3.389 -1.756 0.427 1.00 12.22 C ATOM 0 H ILE A 453 -0.452 -0.145 -0.791 1.00 51.53 H new ATOM 0 HA ILE A 453 0.355 -2.585 -2.302 1.00 43.24 H new ATOM 0 HB ILE A 453 0.702 -1.902 0.608 1.00 32.55 H new ATOM 0 HG12 ILE A 453 2.758 -2.041 -1.617 1.00 62.42 H new ATOM 0 HG13 ILE A 453 2.156 -0.567 -0.886 1.00 62.42 H new ATOM 0 HG21 ILE A 453 2.035 -3.969 0.679 1.00 42.41 H new ATOM 0 HG22 ILE A 453 0.336 -4.283 0.251 1.00 42.41 H new ATOM 0 HG23 ILE A 453 1.590 -4.308 -1.011 1.00 42.41 H new ATOM 0 HD11 ILE A 453 4.306 -1.240 0.141 1.00 12.22 H new ATOM 0 HD12 ILE A 453 2.993 -1.313 1.341 1.00 12.22 H new ATOM 0 HD13 ILE A 453 3.604 -2.811 0.598 1.00 12.22 H new ATOM 981 N LEU A 454 -1.726 -3.733 -1.875 1.00 30.43 N ATOM 982 CA LEU A 454 -2.981 -4.438 -1.682 1.00 55.21 C ATOM 983 C LEU A 454 -2.732 -5.699 -0.854 1.00 31.22 C ATOM 984 O LEU A 454 -2.154 -6.666 -1.349 1.00 24.43 O ATOM 985 CB LEU A 454 -3.657 -4.708 -3.027 1.00 42.00 C ATOM 986 CG LEU A 454 -3.616 -3.562 -4.042 1.00 25.33 C ATOM 987 CD1 LEU A 454 -4.397 -3.923 -5.307 1.00 51.41 C ATOM 988 CD2 LEU A 454 -4.111 -2.259 -3.415 1.00 53.44 C ATOM 0 H LEU A 454 -1.171 -4.060 -2.666 1.00 30.43 H new ATOM 0 HA LEU A 454 -3.681 -3.821 -1.119 1.00 55.21 H new ATOM 0 HB2 LEU A 454 -3.188 -5.583 -3.478 1.00 42.00 H new ATOM 0 HB3 LEU A 454 -4.700 -4.965 -2.842 1.00 42.00 H new ATOM 0 HG LEU A 454 -2.579 -3.403 -4.338 1.00 25.33 H new ATOM 0 HD11 LEU A 454 -4.352 -3.093 -6.012 1.00 51.41 H new ATOM 0 HD12 LEU A 454 -3.959 -4.811 -5.764 1.00 51.41 H new ATOM 0 HD13 LEU A 454 -5.437 -4.123 -5.048 1.00 51.41 H new ATOM 0 HD21 LEU A 454 -4.072 -1.461 -4.156 1.00 53.44 H new ATOM 0 HD22 LEU A 454 -5.138 -2.387 -3.073 1.00 53.44 H new ATOM 0 HD23 LEU A 454 -3.476 -1.999 -2.568 1.00 53.44 H new ATOM 999 N LEU A 455 -3.178 -5.650 0.392 1.00 14.23 N ATOM 1000 CA LEU A 455 -3.011 -6.778 1.293 1.00 33.42 C ATOM 1001 C LEU A 455 -3.972 -7.896 0.889 1.00 5.21 C ATOM 1002 O LEU A 455 -5.143 -7.880 1.269 1.00 5.55 O ATOM 1003 CB LEU A 455 -3.165 -6.329 2.747 1.00 4.54 C ATOM 1004 CG LEU A 455 -2.442 -7.180 3.793 1.00 72.11 C ATOM 1005 CD1 LEU A 455 -1.036 -7.552 3.320 1.00 31.23 C ATOM 1006 CD2 LEU A 455 -2.421 -6.479 5.152 1.00 11.23 C ATOM 0 H LEU A 455 -3.655 -4.846 0.800 1.00 14.23 H new ATOM 0 HA LEU A 455 -2.002 -7.182 1.214 1.00 33.42 H new ATOM 0 HB2 LEU A 455 -2.804 -5.304 2.830 1.00 4.54 H new ATOM 0 HB3 LEU A 455 -4.227 -6.314 2.991 1.00 4.54 H new ATOM 0 HG LEU A 455 -2.997 -8.110 3.919 1.00 72.11 H new ATOM 0 HD11 LEU A 455 -0.544 -8.157 4.082 1.00 31.23 H new ATOM 0 HD12 LEU A 455 -1.103 -8.121 2.392 1.00 31.23 H new ATOM 0 HD13 LEU A 455 -0.458 -6.644 3.148 1.00 31.23 H new ATOM 0 HD21 LEU A 455 -1.901 -7.106 5.877 1.00 11.23 H new ATOM 0 HD22 LEU A 455 -1.903 -5.524 5.061 1.00 11.23 H new ATOM 0 HD23 LEU A 455 -3.443 -6.307 5.488 1.00 11.23 H new ATOM 1017 N LEU A 456 -3.446 -8.840 0.124 1.00 64.21 N ATOM 1018 CA LEU A 456 -4.244 -9.963 -0.336 1.00 32.23 C ATOM 1019 C LEU A 456 -4.459 -10.939 0.824 1.00 33.21 C ATOM 1020 O LEU A 456 -3.594 -11.765 1.113 1.00 34.12 O ATOM 1021 CB LEU A 456 -3.604 -10.605 -1.569 1.00 1.22 C ATOM 1022 CG LEU A 456 -3.195 -9.646 -2.689 1.00 24.42 C ATOM 1023 CD1 LEU A 456 -3.105 -10.376 -4.030 1.00 54.01 C ATOM 1024 CD2 LEU A 456 -4.137 -8.442 -2.752 1.00 71.52 C ATOM 0 H LEU A 456 -2.475 -8.850 -0.189 1.00 64.21 H new ATOM 0 HA LEU A 456 -5.230 -9.625 -0.656 1.00 32.23 H new ATOM 0 HB2 LEU A 456 -2.720 -11.157 -1.249 1.00 1.22 H new ATOM 0 HB3 LEU A 456 -4.303 -11.334 -1.979 1.00 1.22 H new ATOM 0 HG LEU A 456 -2.200 -9.263 -2.464 1.00 24.42 H new ATOM 0 HD11 LEU A 456 -2.813 -9.672 -4.809 1.00 54.01 H new ATOM 0 HD12 LEU A 456 -2.362 -11.171 -3.962 1.00 54.01 H new ATOM 0 HD13 LEU A 456 -4.076 -10.806 -4.276 1.00 54.01 H new ATOM 0 HD21 LEU A 456 -3.824 -7.777 -3.556 1.00 71.52 H new ATOM 0 HD22 LEU A 456 -5.154 -8.785 -2.941 1.00 71.52 H new ATOM 0 HD23 LEU A 456 -4.105 -7.905 -1.804 1.00 71.52 H new ATOM 1035 N THR A 457 -5.615 -10.810 1.455 1.00 12.44 N ATOM 1036 CA THR A 457 -5.956 -11.670 2.577 1.00 60.50 C ATOM 1037 C THR A 457 -7.449 -12.003 2.560 1.00 22.53 C ATOM 1038 O THR A 457 -8.266 -11.187 2.136 1.00 44.44 O ATOM 1039 CB THR A 457 -5.504 -10.973 3.861 1.00 14.41 C ATOM 1040 OG1 THR A 457 -6.526 -10.013 4.113 1.00 50.13 O ATOM 1041 CG2 THR A 457 -4.243 -10.130 3.658 1.00 73.32 C ATOM 0 H THR A 457 -6.329 -10.123 1.212 1.00 12.44 H new ATOM 0 HA THR A 457 -5.441 -12.628 2.511 1.00 60.50 H new ATOM 0 HB THR A 457 -5.320 -11.720 4.633 1.00 14.41 H new ATOM 0 HG1 THR A 457 -6.377 -9.599 4.988 1.00 50.13 H new ATOM 0 HG21 THR A 457 -3.966 -9.657 4.600 1.00 73.32 H new ATOM 0 HG22 THR A 457 -3.428 -10.770 3.319 1.00 73.32 H new ATOM 0 HG23 THR A 457 -4.436 -9.361 2.910 1.00 73.32 H new ATOM 1049 N SER A 458 -7.760 -13.206 3.024 1.00 72.45 N ATOM 1050 CA SER A 458 -9.140 -13.657 3.066 1.00 63.54 C ATOM 1051 C SER A 458 -9.972 -12.714 3.937 1.00 11.25 C ATOM 1052 O SER A 458 -11.201 -12.736 3.884 1.00 11.00 O ATOM 1053 CB SER A 458 -9.234 -15.089 3.595 1.00 44.10 C ATOM 1054 OG SER A 458 -8.155 -15.407 4.471 1.00 53.42 O ATOM 0 H SER A 458 -7.080 -13.881 3.374 1.00 72.45 H new ATOM 0 HA SER A 458 -9.535 -13.646 2.050 1.00 63.54 H new ATOM 0 HB2 SER A 458 -10.179 -15.219 4.122 1.00 44.10 H new ATOM 0 HB3 SER A 458 -9.238 -15.786 2.757 1.00 44.10 H new ATOM 0 HG SER A 458 -7.637 -16.150 4.096 1.00 53.42 H new ATOM 1059 N ASN A 459 -9.269 -11.906 4.718 1.00 31.10 N ATOM 1060 CA ASN A 459 -9.928 -10.957 5.599 1.00 75.12 C ATOM 1061 C ASN A 459 -10.229 -9.673 4.822 1.00 52.24 C ATOM 1062 O ASN A 459 -11.130 -8.918 5.190 1.00 34.30 O ATOM 1063 CB ASN A 459 -9.032 -10.593 6.784 1.00 53.34 C ATOM 1064 CG ASN A 459 -8.909 -11.766 7.758 1.00 3.14 C ATOM 1065 OD1 ASN A 459 -8.040 -12.616 7.640 1.00 55.13 O ATOM 1066 ND2 ASN A 459 -9.824 -11.767 8.725 1.00 35.50 N ATOM 0 H ASN A 459 -8.250 -11.889 4.759 1.00 31.10 H new ATOM 0 HA ASN A 459 -10.844 -11.418 5.968 1.00 75.12 H new ATOM 0 HB2 ASN A 459 -8.043 -10.310 6.423 1.00 53.34 H new ATOM 0 HB3 ASN A 459 -9.443 -9.727 7.302 1.00 53.34 H new ATOM 0 HD21 ASN A 459 -9.826 -12.509 9.425 1.00 35.50 H new ATOM 0 HD22 ASN A 459 -10.523 -11.026 8.766 1.00 35.50 H new ATOM 1072 N PHE A 460 -9.460 -9.464 3.764 1.00 53.41 N ATOM 1073 CA PHE A 460 -9.633 -8.284 2.933 1.00 5.40 C ATOM 1074 C PHE A 460 -10.250 -8.651 1.582 1.00 23.30 C ATOM 1075 O PHE A 460 -10.428 -9.829 1.276 1.00 25.51 O ATOM 1076 CB PHE A 460 -8.242 -7.692 2.702 1.00 10.32 C ATOM 1077 CG PHE A 460 -8.250 -6.366 1.937 1.00 53.23 C ATOM 1078 CD1 PHE A 460 -8.875 -5.280 2.466 1.00 54.41 C ATOM 1079 CD2 PHE A 460 -7.632 -6.275 0.730 1.00 21.13 C ATOM 1080 CE1 PHE A 460 -8.882 -4.050 1.756 1.00 20.14 C ATOM 1081 CE2 PHE A 460 -7.640 -5.045 0.019 1.00 64.52 C ATOM 1082 CZ PHE A 460 -8.265 -3.958 0.547 1.00 24.30 C ATOM 0 H PHE A 460 -8.715 -10.092 3.463 1.00 53.41 H new ATOM 0 HA PHE A 460 -10.299 -7.576 3.426 1.00 5.40 H new ATOM 0 HB2 PHE A 460 -7.758 -7.540 3.667 1.00 10.32 H new ATOM 0 HB3 PHE A 460 -7.638 -8.414 2.152 1.00 10.32 H new ATOM 0 HD1 PHE A 460 -9.366 -5.353 3.425 1.00 54.41 H new ATOM 0 HD2 PHE A 460 -7.135 -7.138 0.311 1.00 21.13 H new ATOM 0 HE1 PHE A 460 -9.377 -3.187 2.176 1.00 20.14 H new ATOM 0 HE2 PHE A 460 -7.150 -4.973 -0.941 1.00 64.52 H new ATOM 0 HZ PHE A 460 -8.271 -3.023 0.007 1.00 24.30 H new ATOM 1091 N ASP A 461 -10.560 -7.621 0.809 1.00 70.55 N ATOM 1092 CA ASP A 461 -11.152 -7.820 -0.502 1.00 74.01 C ATOM 1093 C ASP A 461 -10.435 -6.933 -1.521 1.00 73.35 C ATOM 1094 O ASP A 461 -10.644 -5.721 -1.551 1.00 45.22 O ATOM 1095 CB ASP A 461 -12.633 -7.437 -0.501 1.00 73.53 C ATOM 1096 CG ASP A 461 -13.464 -8.069 0.616 1.00 43.44 C ATOM 1097 OD1 ASP A 461 -13.916 -7.379 1.542 1.00 50.40 O ATOM 1098 OD2 ASP A 461 -13.643 -9.343 0.511 1.00 73.05 O ATOM 0 H ASP A 461 -10.412 -6.645 1.066 1.00 70.55 H new ATOM 0 HA ASP A 461 -11.052 -8.874 -0.760 1.00 74.01 H new ATOM 0 HB2 ASP A 461 -12.712 -6.353 -0.423 1.00 73.53 H new ATOM 0 HB3 ASP A 461 -13.066 -7.720 -1.460 1.00 73.53 H new ATOM 1103 N CYS A 462 -9.603 -7.571 -2.332 1.00 35.11 N ATOM 1104 CA CYS A 462 -8.853 -6.854 -3.351 1.00 5.42 C ATOM 1105 C CYS A 462 -9.848 -6.253 -4.345 1.00 72.45 C ATOM 1106 O CYS A 462 -9.656 -5.136 -4.821 1.00 33.11 O ATOM 1107 CB CYS A 462 -7.830 -7.758 -4.040 1.00 12.34 C ATOM 1108 SG CYS A 462 -8.637 -9.301 -4.602 1.00 11.22 S ATOM 0 H CYS A 462 -9.432 -8.576 -2.304 1.00 35.11 H new ATOM 0 HA CYS A 462 -8.277 -6.053 -2.888 1.00 5.42 H new ATOM 0 HB2 CYS A 462 -7.388 -7.239 -4.890 1.00 12.34 H new ATOM 0 HB3 CYS A 462 -7.018 -7.992 -3.352 1.00 12.34 H new ATOM 0 HG CYS A 462 -7.977 -10.326 -4.149 1.00 11.22 H new ATOM 1113 N ARG A 463 -10.888 -7.023 -4.631 1.00 53.35 N ATOM 1114 CA ARG A 463 -11.913 -6.579 -5.561 1.00 55.22 C ATOM 1115 C ARG A 463 -12.194 -5.088 -5.372 1.00 64.04 C ATOM 1116 O ARG A 463 -12.544 -4.392 -6.323 1.00 15.02 O ATOM 1117 CB ARG A 463 -13.212 -7.364 -5.364 1.00 21.42 C ATOM 1118 CG ARG A 463 -13.070 -8.797 -5.885 1.00 52.50 C ATOM 1119 CD ARG A 463 -14.383 -9.568 -5.731 1.00 23.21 C ATOM 1120 NE ARG A 463 -14.370 -10.340 -4.469 1.00 25.44 N ATOM 1121 CZ ARG A 463 -14.787 -9.854 -3.280 1.00 62.30 C ATOM 1122 NH1 ARG A 463 -15.253 -8.591 -3.181 1.00 41.13 N ATOM 1123 NH2 ARG A 463 -14.731 -10.632 -2.215 1.00 24.14 N ATOM 0 H ARG A 463 -11.043 -7.950 -4.236 1.00 53.35 H new ATOM 0 HA ARG A 463 -11.543 -6.756 -6.571 1.00 55.22 H new ATOM 0 HB2 ARG A 463 -13.474 -7.382 -4.306 1.00 21.42 H new ATOM 0 HB3 ARG A 463 -14.027 -6.862 -5.886 1.00 21.42 H new ATOM 0 HG2 ARG A 463 -12.775 -8.779 -6.934 1.00 52.50 H new ATOM 0 HG3 ARG A 463 -12.277 -9.309 -5.340 1.00 52.50 H new ATOM 0 HD2 ARG A 463 -15.224 -8.875 -5.734 1.00 23.21 H new ATOM 0 HD3 ARG A 463 -14.521 -10.241 -6.577 1.00 23.21 H new ATOM 0 HE ARG A 463 -14.025 -11.299 -4.499 1.00 25.44 H new ATOM 0 HH11 ARG A 463 -15.292 -7.996 -4.008 1.00 41.13 H new ATOM 0 HH12 ARG A 463 -15.566 -8.232 -2.279 1.00 41.13 H new ATOM 0 HH21 ARG A 463 -14.377 -11.585 -2.298 1.00 24.14 H new ATOM 0 HH22 ARG A 463 -15.042 -10.280 -1.310 1.00 24.14 H new ATOM 1133 N LEU A 464 -12.030 -4.640 -4.135 1.00 34.25 N ATOM 1134 CA LEU A 464 -12.261 -3.243 -3.809 1.00 43.13 C ATOM 1135 C LEU A 464 -11.009 -2.431 -4.143 1.00 70.40 C ATOM 1136 O LEU A 464 -11.028 -1.598 -5.050 1.00 5.12 O ATOM 1137 CB LEU A 464 -12.714 -3.101 -2.354 1.00 42.31 C ATOM 1138 CG LEU A 464 -13.119 -1.693 -1.912 1.00 63.33 C ATOM 1139 CD1 LEU A 464 -11.982 -1.010 -1.150 1.00 4.11 C ATOM 1140 CD2 LEU A 464 -13.593 -0.859 -3.105 1.00 63.12 C ATOM 0 H LEU A 464 -11.740 -5.220 -3.347 1.00 34.25 H new ATOM 0 HA LEU A 464 -13.073 -2.841 -4.414 1.00 43.13 H new ATOM 0 HB2 LEU A 464 -13.560 -3.769 -2.191 1.00 42.31 H new ATOM 0 HB3 LEU A 464 -11.907 -3.445 -1.708 1.00 42.31 H new ATOM 0 HG LEU A 464 -13.961 -1.779 -1.225 1.00 63.33 H new ATOM 0 HD11 LEU A 464 -12.296 -0.011 -0.847 1.00 4.11 H new ATOM 0 HD12 LEU A 464 -11.733 -1.596 -0.265 1.00 4.11 H new ATOM 0 HD13 LEU A 464 -11.106 -0.936 -1.794 1.00 4.11 H new ATOM 0 HD21 LEU A 464 -13.875 0.137 -2.764 1.00 63.12 H new ATOM 0 HD22 LEU A 464 -12.788 -0.778 -3.835 1.00 63.12 H new ATOM 0 HD23 LEU A 464 -14.454 -1.341 -3.567 1.00 63.12 H new ATOM 1151 N SER A 465 -9.948 -2.701 -3.397 1.00 41.10 N ATOM 1152 CA SER A 465 -8.690 -2.007 -3.604 1.00 62.34 C ATOM 1153 C SER A 465 -8.440 -1.813 -5.100 1.00 64.34 C ATOM 1154 O SER A 465 -8.365 -0.681 -5.579 1.00 13.23 O ATOM 1155 CB SER A 465 -7.528 -2.771 -2.965 1.00 73.45 C ATOM 1156 OG SER A 465 -7.213 -3.961 -3.683 1.00 53.42 O ATOM 0 H SER A 465 -9.935 -3.392 -2.647 1.00 41.10 H new ATOM 0 HA SER A 465 -8.754 -1.031 -3.124 1.00 62.34 H new ATOM 0 HB2 SER A 465 -6.649 -2.128 -2.926 1.00 73.45 H new ATOM 0 HB3 SER A 465 -7.783 -3.025 -1.936 1.00 73.45 H new ATOM 0 HG SER A 465 -6.753 -4.590 -3.089 1.00 53.42 H new ATOM 1161 N LEU A 466 -8.314 -2.932 -5.797 1.00 72.40 N ATOM 1162 CA LEU A 466 -8.073 -2.898 -7.230 1.00 1.04 C ATOM 1163 C LEU A 466 -9.070 -1.942 -7.888 1.00 20.35 C ATOM 1164 O LEU A 466 -8.709 -1.192 -8.793 1.00 53.34 O ATOM 1165 CB LEU A 466 -8.104 -4.314 -7.811 1.00 33.11 C ATOM 1166 CG LEU A 466 -7.419 -4.498 -9.166 1.00 62.15 C ATOM 1167 CD1 LEU A 466 -8.306 -3.988 -10.303 1.00 32.13 C ATOM 1168 CD2 LEU A 466 -6.039 -3.837 -9.177 1.00 60.24 C ATOM 0 H LEU A 466 -8.374 -3.868 -5.397 1.00 72.40 H new ATOM 0 HA LEU A 466 -7.075 -2.513 -7.440 1.00 1.04 H new ATOM 0 HB2 LEU A 466 -7.636 -4.989 -7.095 1.00 33.11 H new ATOM 0 HB3 LEU A 466 -9.145 -4.623 -7.907 1.00 33.11 H new ATOM 0 HG LEU A 466 -7.267 -5.565 -9.329 1.00 62.15 H new ATOM 0 HD11 LEU A 466 -7.795 -4.131 -11.255 1.00 32.13 H new ATOM 0 HD12 LEU A 466 -9.245 -4.542 -10.308 1.00 32.13 H new ATOM 0 HD13 LEU A 466 -8.511 -2.928 -10.157 1.00 32.13 H new ATOM 0 HD21 LEU A 466 -5.574 -3.983 -10.152 1.00 60.24 H new ATOM 0 HD22 LEU A 466 -6.145 -2.770 -8.981 1.00 60.24 H new ATOM 0 HD23 LEU A 466 -5.414 -4.287 -8.406 1.00 60.24 H new ATOM 1179 N HIS A 467 -10.303 -2.001 -7.407 1.00 74.34 N ATOM 1180 CA HIS A 467 -11.353 -1.149 -7.938 1.00 14.42 C ATOM 1181 C HIS A 467 -11.073 0.308 -7.560 1.00 33.14 C ATOM 1182 O HIS A 467 -11.452 1.225 -8.288 1.00 4.32 O ATOM 1183 CB HIS A 467 -12.729 -1.628 -7.472 1.00 61.22 C ATOM 1184 CG HIS A 467 -13.761 -0.530 -7.370 1.00 75.12 C ATOM 1185 ND1 HIS A 467 -13.914 0.447 -8.339 1.00 71.32 N ATOM 1186 CD2 HIS A 467 -14.689 -0.265 -6.407 1.00 24.20 C ATOM 1187 CE1 HIS A 467 -14.891 1.258 -7.964 1.00 41.31 C ATOM 1188 NE2 HIS A 467 -15.370 0.816 -6.765 1.00 11.03 N ATOM 0 H HIS A 467 -10.598 -2.625 -6.656 1.00 74.34 H new ATOM 0 HA HIS A 467 -11.360 -1.211 -9.026 1.00 14.42 H new ATOM 0 HB2 HIS A 467 -13.091 -2.389 -8.164 1.00 61.22 H new ATOM 0 HB3 HIS A 467 -12.625 -2.106 -6.498 1.00 61.22 H new ATOM 0 HD1 HIS A 467 -13.367 0.528 -9.196 1.00 71.32 H new ATOM 0 HD2 HIS A 467 -14.844 -0.838 -5.505 1.00 24.20 H new ATOM 0 HE1 HIS A 467 -15.247 2.119 -8.511 1.00 41.31 H new ATOM 1195 N GLN A 468 -10.412 0.473 -6.425 1.00 50.43 N ATOM 1196 CA GLN A 468 -10.077 1.802 -5.942 1.00 41.14 C ATOM 1197 C GLN A 468 -8.919 2.385 -6.754 1.00 71.21 C ATOM 1198 O GLN A 468 -9.109 3.322 -7.528 1.00 41.22 O ATOM 1199 CB GLN A 468 -9.741 1.774 -4.450 1.00 64.13 C ATOM 1200 CG GLN A 468 -10.993 1.517 -3.610 1.00 51.55 C ATOM 1201 CD GLN A 468 -10.681 1.608 -2.115 1.00 43.25 C ATOM 1202 OE1 GLN A 468 -9.948 0.807 -1.559 1.00 24.53 O ATOM 1203 NE2 GLN A 468 -11.275 2.626 -1.498 1.00 35.02 N ATOM 0 H GLN A 468 -10.099 -0.291 -5.826 1.00 50.43 H new ATOM 0 HA GLN A 468 -10.947 2.445 -6.073 1.00 41.14 H new ATOM 0 HB2 GLN A 468 -9.002 0.997 -4.255 1.00 64.13 H new ATOM 0 HB3 GLN A 468 -9.291 2.723 -4.157 1.00 64.13 H new ATOM 0 HG2 GLN A 468 -11.764 2.243 -3.869 1.00 51.55 H new ATOM 0 HG3 GLN A 468 -11.394 0.530 -3.842 1.00 51.55 H new ATOM 0 HE21 GLN A 468 -11.877 3.260 -2.024 1.00 35.02 H new ATOM 0 HE22 GLN A 468 -11.128 2.773 -0.499 1.00 35.02 H new ATOM 1210 N VAL A 469 -7.743 1.808 -6.549 1.00 0.32 N ATOM 1211 CA VAL A 469 -6.555 2.259 -7.252 1.00 11.34 C ATOM 1212 C VAL A 469 -6.890 2.465 -8.730 1.00 14.42 C ATOM 1213 O VAL A 469 -6.611 3.524 -9.292 1.00 52.43 O ATOM 1214 CB VAL A 469 -5.410 1.269 -7.032 1.00 1.01 C ATOM 1215 CG1 VAL A 469 -5.858 -0.164 -7.331 1.00 61.34 C ATOM 1216 CG2 VAL A 469 -4.188 1.648 -7.871 1.00 14.10 C ATOM 0 H VAL A 469 -7.589 1.032 -5.906 1.00 0.32 H new ATOM 0 HA VAL A 469 -6.219 3.218 -6.858 1.00 11.34 H new ATOM 0 HB VAL A 469 -5.123 1.318 -5.982 1.00 1.01 H new ATOM 0 HG11 VAL A 469 -5.025 -0.847 -7.167 1.00 61.34 H new ATOM 0 HG12 VAL A 469 -6.683 -0.432 -6.671 1.00 61.34 H new ATOM 0 HG13 VAL A 469 -6.185 -0.234 -8.368 1.00 61.34 H new ATOM 0 HG21 VAL A 469 -3.389 0.928 -7.696 1.00 14.10 H new ATOM 0 HG22 VAL A 469 -4.456 1.642 -8.927 1.00 14.10 H new ATOM 0 HG23 VAL A 469 -3.847 2.644 -7.588 1.00 14.10 H new ATOM 1226 N ASN A 470 -7.485 1.438 -9.319 1.00 41.02 N ATOM 1227 CA ASN A 470 -7.862 1.495 -10.722 1.00 25.52 C ATOM 1228 C ASN A 470 -8.420 2.883 -11.040 1.00 62.21 C ATOM 1229 O ASN A 470 -7.993 3.521 -12.001 1.00 13.30 O ATOM 1230 CB ASN A 470 -8.946 0.463 -11.042 1.00 42.32 C ATOM 1231 CG ASN A 470 -8.328 -0.861 -11.493 1.00 64.02 C ATOM 1232 OD1 ASN A 470 -8.808 -1.525 -12.397 1.00 43.11 O ATOM 1233 ND2 ASN A 470 -7.237 -1.207 -10.814 1.00 42.03 N ATOM 0 H ASN A 470 -7.715 0.562 -8.851 1.00 41.02 H new ATOM 0 HA ASN A 470 -6.975 1.283 -11.319 1.00 25.52 H new ATOM 0 HB2 ASN A 470 -9.566 0.297 -10.161 1.00 42.32 H new ATOM 0 HB3 ASN A 470 -9.600 0.848 -11.824 1.00 42.32 H new ATOM 0 HD21 ASN A 470 -6.750 -2.074 -11.039 1.00 42.03 H new ATOM 0 HD22 ASN A 470 -6.888 -0.605 -10.068 1.00 42.03 H new ATOM 1239 N GLN A 471 -9.365 3.309 -10.216 1.00 42.03 N ATOM 1240 CA GLN A 471 -9.986 4.609 -10.398 1.00 61.13 C ATOM 1241 C GLN A 471 -8.998 5.724 -10.048 1.00 62.21 C ATOM 1242 O GLN A 471 -8.925 6.737 -10.743 1.00 33.34 O ATOM 1243 CB GLN A 471 -11.263 4.730 -9.564 1.00 2.35 C ATOM 1244 CG GLN A 471 -12.185 3.531 -9.800 1.00 50.45 C ATOM 1245 CD GLN A 471 -13.143 3.798 -10.964 1.00 43.43 C ATOM 1246 OE1 GLN A 471 -14.176 4.432 -10.818 1.00 34.15 O ATOM 1247 NE2 GLN A 471 -12.743 3.281 -12.122 1.00 12.30 N ATOM 0 H GLN A 471 -9.716 2.776 -9.420 1.00 42.03 H new ATOM 0 HA GLN A 471 -10.264 4.711 -11.447 1.00 61.13 H new ATOM 0 HB2 GLN A 471 -11.007 4.794 -8.506 1.00 2.35 H new ATOM 0 HB3 GLN A 471 -11.785 5.652 -9.822 1.00 2.35 H new ATOM 0 HG2 GLN A 471 -11.588 2.644 -10.012 1.00 50.45 H new ATOM 0 HG3 GLN A 471 -12.756 3.322 -8.895 1.00 50.45 H new ATOM 0 HE21 GLN A 471 -11.867 2.761 -12.173 1.00 12.30 H new ATOM 0 HE22 GLN A 471 -13.312 3.404 -12.959 1.00 12.30 H new ATOM 1254 N ALA A 472 -8.258 5.499 -8.972 1.00 44.23 N ATOM 1255 CA ALA A 472 -7.277 6.472 -8.520 1.00 13.15 C ATOM 1256 C ALA A 472 -6.239 6.689 -9.623 1.00 23.42 C ATOM 1257 O ALA A 472 -5.538 7.700 -9.629 1.00 33.12 O ATOM 1258 CB ALA A 472 -6.646 5.992 -7.211 1.00 52.30 C ATOM 0 H ALA A 472 -8.318 4.657 -8.400 1.00 44.23 H new ATOM 0 HA ALA A 472 -7.752 7.432 -8.319 1.00 13.15 H new ATOM 0 HB1 ALA A 472 -5.911 6.722 -6.873 1.00 52.30 H new ATOM 0 HB2 ALA A 472 -7.421 5.880 -6.453 1.00 52.30 H new ATOM 0 HB3 ALA A 472 -6.156 5.032 -7.374 1.00 52.30 H new ATOM 1264 N MET A 473 -6.170 5.723 -10.527 1.00 1.54 N ATOM 1265 CA MET A 473 -5.229 5.797 -11.632 1.00 4.24 C ATOM 1266 C MET A 473 -5.801 6.622 -12.785 1.00 72.05 C ATOM 1267 O MET A 473 -5.171 7.575 -13.244 1.00 12.43 O ATOM 1268 CB MET A 473 -4.910 4.383 -12.124 1.00 70.55 C ATOM 1269 CG MET A 473 -4.041 3.634 -11.112 1.00 44.20 C ATOM 1270 SD MET A 473 -3.306 2.201 -11.881 1.00 21.22 S ATOM 1271 CE MET A 473 -2.127 1.744 -10.623 1.00 62.31 C ATOM 0 H MET A 473 -6.751 4.884 -10.517 1.00 1.54 H new ATOM 0 HA MET A 473 -4.320 6.283 -11.279 1.00 4.24 H new ATOM 0 HB2 MET A 473 -5.837 3.834 -12.290 1.00 70.55 H new ATOM 0 HB3 MET A 473 -4.395 4.435 -13.083 1.00 70.55 H new ATOM 0 HG2 MET A 473 -3.261 4.293 -10.732 1.00 44.20 H new ATOM 0 HG3 MET A 473 -4.645 3.329 -10.257 1.00 44.20 H new ATOM 0 HE1 MET A 473 -2.077 0.658 -10.548 1.00 62.31 H new ATOM 0 HE2 MET A 473 -1.144 2.135 -10.886 1.00 62.31 H new ATOM 0 HE3 MET A 473 -2.438 2.160 -9.665 1.00 62.31 H new ATOM 1279 N MET A 474 -6.988 6.227 -13.223 1.00 44.45 N ATOM 1280 CA MET A 474 -7.652 6.919 -14.314 1.00 35.12 C ATOM 1281 C MET A 474 -8.159 8.292 -13.866 1.00 11.33 C ATOM 1282 O MET A 474 -8.686 9.056 -14.673 1.00 3.23 O ATOM 1283 CB MET A 474 -8.829 6.078 -14.812 1.00 70.01 C ATOM 1284 CG MET A 474 -9.715 5.631 -13.648 1.00 30.01 C ATOM 1285 SD MET A 474 -11.427 5.629 -14.150 1.00 42.44 S ATOM 1286 CE MET A 474 -12.156 6.497 -12.770 1.00 54.15 C ATOM 0 H MET A 474 -7.507 5.436 -12.841 1.00 44.45 H new ATOM 0 HA MET A 474 -6.931 7.064 -15.119 1.00 35.12 H new ATOM 0 HB2 MET A 474 -9.420 6.657 -15.522 1.00 70.01 H new ATOM 0 HB3 MET A 474 -8.456 5.204 -15.346 1.00 70.01 H new ATOM 0 HG2 MET A 474 -9.423 4.634 -13.320 1.00 30.01 H new ATOM 0 HG3 MET A 474 -9.577 6.299 -12.798 1.00 30.01 H new ATOM 0 HE1 MET A 474 -13.152 6.100 -12.576 1.00 54.15 H new ATOM 0 HE2 MET A 474 -11.533 6.363 -11.886 1.00 54.15 H new ATOM 0 HE3 MET A 474 -12.228 7.559 -13.005 1.00 54.15 H new ATOM 1294 N SER A 475 -7.981 8.562 -12.583 1.00 62.33 N ATOM 1295 CA SER A 475 -8.414 9.829 -12.017 1.00 73.22 C ATOM 1296 C SER A 475 -7.379 10.915 -12.313 1.00 44.02 C ATOM 1297 O SER A 475 -7.714 11.967 -12.855 1.00 60.32 O ATOM 1298 CB SER A 475 -8.643 9.709 -10.509 1.00 51.13 C ATOM 1299 OG SER A 475 -7.420 9.556 -9.794 1.00 30.22 O ATOM 0 H SER A 475 -7.543 7.925 -11.918 1.00 62.33 H new ATOM 0 HA SER A 475 -9.362 10.104 -12.480 1.00 73.22 H new ATOM 0 HB2 SER A 475 -9.164 10.596 -10.150 1.00 51.13 H new ATOM 0 HB3 SER A 475 -9.290 8.855 -10.307 1.00 51.13 H new ATOM 0 HG SER A 475 -6.879 10.367 -9.894 1.00 30.22 H new ATOM 1304 N ASN A 476 -6.140 10.623 -11.943 1.00 31.33 N ATOM 1305 CA ASN A 476 -5.052 11.561 -12.162 1.00 34.10 C ATOM 1306 C ASN A 476 -3.845 10.813 -12.730 1.00 21.11 C ATOM 1307 O ASN A 476 -3.028 10.282 -11.977 1.00 33.33 O ATOM 1308 CB ASN A 476 -4.624 12.223 -10.851 1.00 51.21 C ATOM 1309 CG ASN A 476 -4.371 11.176 -9.765 1.00 4.11 C ATOM 1310 OD1 ASN A 476 -5.121 10.229 -9.592 1.00 11.32 O ATOM 1311 ND2 ASN A 476 -3.276 11.397 -9.044 1.00 54.23 N ATOM 0 H ASN A 476 -5.866 9.750 -11.493 1.00 31.33 H new ATOM 0 HA ASN A 476 -5.401 12.326 -12.856 1.00 34.10 H new ATOM 0 HB2 ASN A 476 -3.720 12.809 -11.014 1.00 51.21 H new ATOM 0 HB3 ASN A 476 -5.398 12.916 -10.520 1.00 51.21 H new ATOM 0 HD21 ASN A 476 -3.021 10.754 -8.294 1.00 54.23 H new ATOM 0 HD22 ASN A 476 -2.691 12.209 -9.241 1.00 54.23 H new ATOM 1317 N LEU A 477 -3.770 10.794 -14.053 1.00 71.44 N ATOM 1318 CA LEU A 477 -2.675 10.119 -14.730 1.00 20.54 C ATOM 1319 C LEU A 477 -1.524 11.106 -14.938 1.00 63.41 C ATOM 1320 O LEU A 477 -0.357 10.743 -14.796 1.00 42.10 O ATOM 1321 CB LEU A 477 -3.166 9.466 -16.024 1.00 40.42 C ATOM 1322 CG LEU A 477 -4.275 8.424 -15.870 1.00 71.12 C ATOM 1323 CD1 LEU A 477 -5.041 8.239 -17.182 1.00 4.01 C ATOM 1324 CD2 LEU A 477 -3.715 7.102 -15.341 1.00 4.30 C ATOM 0 H LEU A 477 -4.449 11.235 -14.674 1.00 71.44 H new ATOM 0 HA LEU A 477 -2.291 9.305 -14.115 1.00 20.54 H new ATOM 0 HB2 LEU A 477 -3.522 10.251 -16.691 1.00 40.42 H new ATOM 0 HB3 LEU A 477 -2.315 8.993 -16.514 1.00 40.42 H new ATOM 0 HG LEU A 477 -4.988 8.790 -15.131 1.00 71.12 H new ATOM 0 HD11 LEU A 477 -5.824 7.493 -17.044 1.00 4.01 H new ATOM 0 HD12 LEU A 477 -5.491 9.187 -17.477 1.00 4.01 H new ATOM 0 HD13 LEU A 477 -4.355 7.905 -17.960 1.00 4.01 H new ATOM 0 HD21 LEU A 477 -4.524 6.378 -15.241 1.00 4.30 H new ATOM 0 HD22 LEU A 477 -2.969 6.718 -16.037 1.00 4.30 H new ATOM 0 HD23 LEU A 477 -3.252 7.266 -14.368 1.00 4.30 H new ATOM 1335 N THR A 478 -1.892 12.333 -15.272 1.00 41.54 N ATOM 1336 CA THR A 478 -0.905 13.375 -15.499 1.00 33.10 C ATOM 1337 C THR A 478 -0.165 13.703 -14.201 1.00 32.12 C ATOM 1338 O THR A 478 0.832 14.422 -14.215 1.00 74.41 O ATOM 1339 CB THR A 478 -1.622 14.580 -16.112 1.00 73.32 C ATOM 1340 OG1 THR A 478 -0.576 15.515 -16.360 1.00 50.24 O ATOM 1341 CG2 THR A 478 -2.530 15.292 -15.109 1.00 12.42 C ATOM 0 H THR A 478 -2.861 12.630 -15.391 1.00 41.54 H new ATOM 0 HA THR A 478 -0.137 13.045 -16.198 1.00 33.10 H new ATOM 0 HB THR A 478 -2.213 14.255 -16.969 1.00 73.32 H new ATOM 0 HG1 THR A 478 0.207 15.281 -15.819 1.00 50.24 H new ATOM 0 HG21 THR A 478 -3.015 16.139 -15.594 1.00 12.42 H new ATOM 0 HG22 THR A 478 -3.289 14.598 -14.748 1.00 12.42 H new ATOM 0 HG23 THR A 478 -1.935 15.648 -14.268 1.00 12.42 H new ATOM 1349 N ARG A 479 -0.682 13.159 -13.110 1.00 12.50 N ATOM 1350 CA ARG A 479 -0.084 13.385 -11.806 1.00 60.45 C ATOM 1351 C ARG A 479 1.151 12.499 -11.628 1.00 50.13 C ATOM 1352 O ARG A 479 2.280 12.986 -11.673 1.00 23.14 O ATOM 1353 CB ARG A 479 -1.081 13.089 -10.683 1.00 51.24 C ATOM 1354 CG ARG A 479 -1.896 14.335 -10.332 1.00 13.12 C ATOM 1355 CD ARG A 479 -0.980 15.513 -9.992 1.00 44.40 C ATOM 1356 NE ARG A 479 -1.687 16.463 -9.105 1.00 74.21 N ATOM 1357 CZ ARG A 479 -1.783 16.322 -7.765 1.00 72.31 C ATOM 1358 NH1 ARG A 479 -1.216 15.265 -7.147 1.00 42.21 N ATOM 1359 NH2 ARG A 479 -2.437 17.233 -7.071 1.00 55.44 N ATOM 0 H ARG A 479 -1.509 12.562 -13.102 1.00 12.50 H new ATOM 0 HA ARG A 479 0.206 14.434 -11.752 1.00 60.45 H new ATOM 0 HB2 ARG A 479 -1.751 12.286 -10.989 1.00 51.24 H new ATOM 0 HB3 ARG A 479 -0.546 12.739 -9.800 1.00 51.24 H new ATOM 0 HG2 ARG A 479 -2.540 14.601 -11.171 1.00 13.12 H new ATOM 0 HG3 ARG A 479 -2.548 14.121 -9.485 1.00 13.12 H new ATOM 0 HD2 ARG A 479 -0.075 15.152 -9.504 1.00 44.40 H new ATOM 0 HD3 ARG A 479 -0.669 16.019 -10.906 1.00 44.40 H new ATOM 0 HE ARG A 479 -2.130 17.276 -9.533 1.00 74.21 H new ATOM 0 HH11 ARG A 479 -0.711 14.566 -7.692 1.00 42.21 H new ATOM 0 HH12 ARG A 479 -1.292 15.165 -6.135 1.00 42.21 H new ATOM 0 HH21 ARG A 479 -2.861 18.029 -7.547 1.00 55.44 H new ATOM 0 HH22 ARG A 479 -2.519 17.141 -6.058 1.00 55.44 H new ATOM 1369 N GLN A 480 0.895 11.215 -11.428 1.00 10.02 N ATOM 1370 CA GLN A 480 1.971 10.256 -11.244 1.00 45.14 C ATOM 1371 C GLN A 480 2.021 9.280 -12.421 1.00 64.35 C ATOM 1372 O GLN A 480 3.075 8.723 -12.725 1.00 74.41 O ATOM 1373 CB GLN A 480 1.819 9.509 -9.917 1.00 20.43 C ATOM 1374 CG GLN A 480 0.347 9.422 -9.505 1.00 3.00 C ATOM 1375 CD GLN A 480 -0.437 8.524 -10.461 1.00 0.44 C ATOM 1376 OE1 GLN A 480 0.108 7.675 -11.147 1.00 73.33 O ATOM 1377 NE2 GLN A 480 -1.746 8.757 -10.470 1.00 3.43 N ATOM 0 H GLN A 480 -0.043 10.816 -11.389 1.00 10.02 H new ATOM 0 HA GLN A 480 2.914 10.801 -11.210 1.00 45.14 H new ATOM 0 HB2 GLN A 480 2.235 8.506 -10.010 1.00 20.43 H new ATOM 0 HB3 GLN A 480 2.389 10.019 -9.140 1.00 20.43 H new ATOM 0 HG2 GLN A 480 0.272 9.032 -8.490 1.00 3.00 H new ATOM 0 HG3 GLN A 480 -0.091 10.420 -9.496 1.00 3.00 H new ATOM 0 HE21 GLN A 480 -2.139 9.483 -9.871 1.00 3.43 H new ATOM 0 HE22 GLN A 480 -2.357 8.210 -11.076 1.00 3.43 H new ATOM 1384 N GLY A 481 0.869 9.103 -13.051 1.00 64.44 N ATOM 1385 CA GLY A 481 0.768 8.204 -14.188 1.00 45.30 C ATOM 1386 C GLY A 481 1.639 6.963 -13.983 1.00 23.40 C ATOM 1387 O GLY A 481 2.579 6.727 -14.742 1.00 11.21 O ATOM 0 H GLY A 481 -0.003 9.567 -12.796 1.00 64.44 H new ATOM 0 HA2 GLY A 481 -0.271 7.905 -14.329 1.00 45.30 H new ATOM 0 HA3 GLY A 481 1.076 8.723 -15.096 1.00 45.30 H new ATOM 1391 N SER A 482 1.295 6.201 -12.955 1.00 73.53 N ATOM 1392 CA SER A 482 2.034 4.989 -12.643 1.00 64.44 C ATOM 1393 C SER A 482 1.064 3.832 -12.397 1.00 1.23 C ATOM 1394 O SER A 482 0.561 3.664 -11.287 1.00 55.33 O ATOM 1395 CB SER A 482 2.936 5.193 -11.423 1.00 14.32 C ATOM 1396 OG SER A 482 4.112 4.392 -11.489 1.00 41.32 O ATOM 0 H SER A 482 0.515 6.399 -12.328 1.00 73.53 H new ATOM 0 HA SER A 482 2.669 4.747 -13.495 1.00 64.44 H new ATOM 0 HB2 SER A 482 3.217 6.244 -11.351 1.00 14.32 H new ATOM 0 HB3 SER A 482 2.381 4.949 -10.517 1.00 14.32 H new ATOM 0 HG SER A 482 4.662 4.552 -10.694 1.00 41.32 H new ATOM 1401 N PRO A 483 0.822 3.045 -13.478 1.00 75.51 N ATOM 1402 CA PRO A 483 -0.080 1.910 -13.392 1.00 24.32 C ATOM 1403 C PRO A 483 0.575 0.745 -12.646 1.00 24.55 C ATOM 1404 O PRO A 483 -0.034 -0.311 -12.478 1.00 51.42 O ATOM 1405 CB PRO A 483 -0.428 1.573 -14.832 1.00 2.03 C ATOM 1406 CG PRO A 483 0.646 2.225 -15.685 1.00 74.43 C ATOM 1407 CD PRO A 483 1.399 3.213 -14.809 1.00 74.45 C ATOM 0 HA PRO A 483 -0.981 2.131 -12.821 1.00 24.32 H new ATOM 0 HB2 PRO A 483 -0.448 0.494 -14.987 1.00 2.03 H new ATOM 0 HB3 PRO A 483 -1.417 1.951 -15.093 1.00 2.03 H new ATOM 0 HG2 PRO A 483 1.326 1.472 -16.084 1.00 74.43 H new ATOM 0 HG3 PRO A 483 0.199 2.735 -16.538 1.00 74.43 H new ATOM 0 HD2 PRO A 483 2.469 3.004 -14.806 1.00 74.45 H new ATOM 0 HD3 PRO A 483 1.275 4.235 -15.168 1.00 74.45 H new ATOM 1412 N ASP A 484 1.808 0.975 -12.220 1.00 22.13 N ATOM 1413 CA ASP A 484 2.553 -0.042 -11.496 1.00 63.33 C ATOM 1414 C ASP A 484 2.794 0.433 -10.062 1.00 20.11 C ATOM 1415 O ASP A 484 3.893 0.281 -9.530 1.00 2.12 O ATOM 1416 CB ASP A 484 3.915 -0.293 -12.146 1.00 1.13 C ATOM 1417 CG ASP A 484 4.752 -1.391 -11.487 1.00 62.13 C ATOM 1418 OD1 ASP A 484 4.264 -2.502 -11.234 1.00 52.30 O ATOM 1419 OD2 ASP A 484 5.974 -1.063 -11.228 1.00 41.11 O ATOM 0 H ASP A 484 2.311 1.851 -12.362 1.00 22.13 H new ATOM 0 HA ASP A 484 1.970 -0.963 -11.512 1.00 63.33 H new ATOM 0 HB2 ASP A 484 3.759 -0.554 -13.193 1.00 1.13 H new ATOM 0 HB3 ASP A 484 4.485 0.636 -12.131 1.00 1.13 H new ATOM 1424 N CYS A 485 1.748 0.998 -9.476 1.00 42.25 N ATOM 1425 CA CYS A 485 1.833 1.496 -8.113 1.00 15.45 C ATOM 1426 C CYS A 485 0.953 0.614 -7.224 1.00 54.05 C ATOM 1427 O CYS A 485 0.508 1.046 -6.163 1.00 3.42 O ATOM 1428 CB CYS A 485 1.437 2.971 -8.025 1.00 44.31 C ATOM 1429 SG CYS A 485 -0.266 3.200 -8.654 1.00 61.31 S ATOM 0 H CYS A 485 0.838 1.122 -9.920 1.00 42.25 H new ATOM 0 HA CYS A 485 2.865 1.444 -7.767 1.00 15.45 H new ATOM 0 HB2 CYS A 485 1.501 3.312 -6.992 1.00 44.31 H new ATOM 0 HB3 CYS A 485 2.132 3.578 -8.605 1.00 44.31 H new ATOM 0 HG CYS A 485 -0.224 3.753 -9.830 1.00 61.31 H new ATOM 1434 N VAL A 486 0.729 -0.605 -7.693 1.00 43.40 N ATOM 1435 CA VAL A 486 -0.091 -1.551 -6.954 1.00 44.22 C ATOM 1436 C VAL A 486 0.751 -2.778 -6.598 1.00 23.42 C ATOM 1437 O VAL A 486 1.252 -3.469 -7.484 1.00 5.53 O ATOM 1438 CB VAL A 486 -1.344 -1.898 -7.758 1.00 14.33 C ATOM 1439 CG1 VAL A 486 -2.403 -2.553 -6.869 1.00 12.14 C ATOM 1440 CG2 VAL A 486 -1.907 -0.661 -8.460 1.00 70.25 C ATOM 0 H VAL A 486 1.100 -0.959 -8.574 1.00 43.40 H new ATOM 0 HA VAL A 486 -0.435 -1.110 -6.019 1.00 44.22 H new ATOM 0 HB VAL A 486 -1.059 -2.618 -8.526 1.00 14.33 H new ATOM 0 HG11 VAL A 486 -3.284 -2.789 -7.466 1.00 12.14 H new ATOM 0 HG12 VAL A 486 -2.000 -3.469 -6.438 1.00 12.14 H new ATOM 0 HG13 VAL A 486 -2.681 -1.867 -6.069 1.00 12.14 H new ATOM 0 HG21 VAL A 486 -2.798 -0.937 -9.024 1.00 70.25 H new ATOM 0 HG22 VAL A 486 -2.167 0.092 -7.717 1.00 70.25 H new ATOM 0 HG23 VAL A 486 -1.158 -0.256 -9.140 1.00 70.25 H new ATOM 1450 N ILE A 487 0.881 -3.011 -5.300 1.00 54.24 N ATOM 1451 CA ILE A 487 1.654 -4.142 -4.816 1.00 30.10 C ATOM 1452 C ILE A 487 0.748 -5.054 -3.985 1.00 64.43 C ATOM 1453 O ILE A 487 0.465 -4.764 -2.824 1.00 54.04 O ATOM 1454 CB ILE A 487 2.897 -3.660 -4.066 1.00 20.14 C ATOM 1455 CG1 ILE A 487 3.439 -2.366 -4.675 1.00 63.20 C ATOM 1456 CG2 ILE A 487 3.962 -4.758 -4.009 1.00 52.11 C ATOM 1457 CD1 ILE A 487 4.964 -2.407 -4.783 1.00 43.14 C ATOM 0 H ILE A 487 0.464 -2.435 -4.569 1.00 54.24 H new ATOM 0 HA ILE A 487 2.025 -4.736 -5.651 1.00 30.10 H new ATOM 0 HB ILE A 487 2.610 -3.435 -3.039 1.00 20.14 H new ATOM 0 HG12 ILE A 487 3.005 -2.216 -5.663 1.00 63.20 H new ATOM 0 HG13 ILE A 487 3.137 -1.517 -4.062 1.00 63.20 H new ATOM 0 HG21 ILE A 487 4.835 -4.390 -3.471 1.00 52.11 H new ATOM 0 HG22 ILE A 487 3.559 -5.630 -3.494 1.00 52.11 H new ATOM 0 HG23 ILE A 487 4.251 -5.037 -5.022 1.00 52.11 H new ATOM 0 HD11 ILE A 487 5.323 -1.475 -5.219 1.00 43.14 H new ATOM 0 HD12 ILE A 487 5.396 -2.533 -3.790 1.00 43.14 H new ATOM 0 HD13 ILE A 487 5.262 -3.242 -5.417 1.00 43.14 H new ATOM 1468 N PRO A 488 0.308 -6.168 -4.630 1.00 44.12 N ATOM 1469 CA PRO A 488 -0.558 -7.124 -3.963 1.00 4.34 C ATOM 1470 C PRO A 488 0.228 -7.973 -2.961 1.00 41.11 C ATOM 1471 O PRO A 488 0.858 -8.959 -3.338 1.00 70.43 O ATOM 1472 CB PRO A 488 -1.173 -7.947 -5.083 1.00 34.41 C ATOM 1473 CG PRO A 488 -0.280 -7.733 -6.296 1.00 53.34 C ATOM 1474 CD PRO A 488 0.623 -6.545 -6.005 1.00 65.43 C ATOM 0 HA PRO A 488 -1.334 -6.642 -3.367 1.00 4.34 H new ATOM 0 HB2 PRO A 488 -1.219 -9.002 -4.813 1.00 34.41 H new ATOM 0 HB3 PRO A 488 -2.194 -7.626 -5.288 1.00 34.41 H new ATOM 0 HG2 PRO A 488 0.314 -8.625 -6.495 1.00 53.34 H new ATOM 0 HG3 PRO A 488 -0.882 -7.546 -7.185 1.00 53.34 H new ATOM 0 HD2 PRO A 488 1.675 -6.811 -6.112 1.00 65.43 H new ATOM 0 HD3 PRO A 488 0.431 -5.723 -6.695 1.00 65.43 H new ATOM 1479 N PHE A 489 0.164 -7.557 -1.704 1.00 60.40 N ATOM 1480 CA PHE A 489 0.862 -8.267 -0.646 1.00 73.12 C ATOM 1481 C PHE A 489 0.106 -9.533 -0.243 1.00 2.34 C ATOM 1482 O PHE A 489 -1.035 -9.738 -0.657 1.00 21.02 O ATOM 1483 CB PHE A 489 0.929 -7.323 0.556 1.00 62.24 C ATOM 1484 CG PHE A 489 2.135 -7.559 1.467 1.00 4.25 C ATOM 1485 CD1 PHE A 489 2.080 -8.515 2.434 1.00 53.31 C ATOM 1486 CD2 PHE A 489 3.262 -6.815 1.311 1.00 24.23 C ATOM 1487 CE1 PHE A 489 3.199 -8.736 3.279 1.00 73.24 C ATOM 1488 CE2 PHE A 489 4.381 -7.034 2.156 1.00 44.31 C ATOM 1489 CZ PHE A 489 4.327 -7.990 3.123 1.00 13.43 C ATOM 0 H PHE A 489 -0.360 -6.738 -1.395 1.00 60.40 H new ATOM 0 HA PHE A 489 1.854 -8.563 -0.988 1.00 73.12 H new ATOM 0 HB2 PHE A 489 0.955 -6.294 0.196 1.00 62.24 H new ATOM 0 HB3 PHE A 489 0.017 -7.433 1.142 1.00 62.24 H new ATOM 0 HD1 PHE A 489 1.185 -9.106 2.559 1.00 53.31 H new ATOM 0 HD2 PHE A 489 3.306 -6.057 0.543 1.00 24.23 H new ATOM 0 HE1 PHE A 489 3.155 -9.496 4.045 1.00 73.24 H new ATOM 0 HE2 PHE A 489 5.276 -6.442 2.032 1.00 44.31 H new ATOM 0 HZ PHE A 489 5.178 -8.157 3.766 1.00 13.43 H new ATOM 1498 N LEU A 490 0.770 -10.351 0.560 1.00 5.31 N ATOM 1499 CA LEU A 490 0.174 -11.593 1.025 1.00 11.02 C ATOM 1500 C LEU A 490 0.862 -12.032 2.319 1.00 13.43 C ATOM 1501 O LEU A 490 1.977 -12.549 2.287 1.00 51.32 O ATOM 1502 CB LEU A 490 0.209 -12.650 -0.080 1.00 33.13 C ATOM 1503 CG LEU A 490 -0.726 -13.847 0.104 1.00 40.14 C ATOM 1504 CD1 LEU A 490 -0.498 -14.895 -0.986 1.00 10.22 C ATOM 1505 CD2 LEU A 490 -0.586 -14.439 1.509 1.00 32.32 C ATOM 0 H LEU A 490 1.716 -10.178 0.901 1.00 5.31 H new ATOM 0 HA LEU A 490 -0.880 -11.445 1.260 1.00 11.02 H new ATOM 0 HB2 LEU A 490 -0.035 -12.166 -1.026 1.00 33.13 H new ATOM 0 HB3 LEU A 490 1.230 -13.022 -0.167 1.00 33.13 H new ATOM 0 HG LEU A 490 -1.753 -13.498 0.002 1.00 40.14 H new ATOM 0 HD11 LEU A 490 -1.176 -15.735 -0.831 1.00 10.22 H new ATOM 0 HD12 LEU A 490 -0.688 -14.451 -1.963 1.00 10.22 H new ATOM 0 HD13 LEU A 490 0.532 -15.247 -0.942 1.00 10.22 H new ATOM 0 HD21 LEU A 490 -1.261 -15.288 1.615 1.00 32.32 H new ATOM 0 HD22 LEU A 490 0.441 -14.770 1.664 1.00 32.32 H new ATOM 0 HD23 LEU A 490 -0.838 -13.681 2.250 1.00 32.32 H new ATOM 1516 N PRO A 491 0.150 -11.804 3.454 1.00 40.35 N ATOM 1517 CA PRO A 491 0.681 -12.171 4.756 1.00 52.11 C ATOM 1518 C PRO A 491 0.607 -13.684 4.973 1.00 71.14 C ATOM 1519 O PRO A 491 0.047 -14.404 4.149 1.00 25.04 O ATOM 1520 CB PRO A 491 -0.152 -11.385 5.756 1.00 15.04 C ATOM 1521 CG PRO A 491 -1.413 -10.972 5.014 1.00 23.23 C ATOM 1522 CD PRO A 491 -1.174 -11.193 3.529 1.00 74.43 C ATOM 0 HA PRO A 491 1.739 -11.930 4.862 1.00 52.11 H new ATOM 0 HB2 PRO A 491 -0.393 -11.994 6.627 1.00 15.04 H new ATOM 0 HB3 PRO A 491 0.392 -10.512 6.117 1.00 15.04 H new ATOM 0 HG2 PRO A 491 -2.266 -11.559 5.355 1.00 23.23 H new ATOM 0 HG3 PRO A 491 -1.647 -9.926 5.211 1.00 23.23 H new ATOM 0 HD2 PRO A 491 -1.935 -11.843 3.098 1.00 74.43 H new ATOM 0 HD3 PRO A 491 -1.208 -10.253 2.978 1.00 74.43 H new ATOM 1527 N LEU A 492 1.182 -14.118 6.085 1.00 34.12 N ATOM 1528 CA LEU A 492 1.188 -15.531 6.419 1.00 4.34 C ATOM 1529 C LEU A 492 -0.171 -15.918 7.010 1.00 32.51 C ATOM 1530 O LEU A 492 -0.578 -17.075 6.933 1.00 11.23 O ATOM 1531 CB LEU A 492 2.370 -15.861 7.333 1.00 30.44 C ATOM 1532 CG LEU A 492 3.759 -15.553 6.768 1.00 1.31 C ATOM 1533 CD1 LEU A 492 3.929 -14.054 6.519 1.00 23.23 C ATOM 1534 CD2 LEU A 492 4.856 -16.112 7.677 1.00 44.23 C ATOM 0 H LEU A 492 1.646 -13.516 6.765 1.00 34.12 H new ATOM 0 HA LEU A 492 1.330 -16.133 5.521 1.00 4.34 H new ATOM 0 HB2 LEU A 492 2.248 -15.310 8.265 1.00 30.44 H new ATOM 0 HB3 LEU A 492 2.327 -16.921 7.581 1.00 30.44 H new ATOM 0 HG LEU A 492 3.855 -16.052 5.804 1.00 1.31 H new ATOM 0 HD11 LEU A 492 4.924 -13.862 6.118 1.00 23.23 H new ATOM 0 HD12 LEU A 492 3.178 -13.716 5.804 1.00 23.23 H new ATOM 0 HD13 LEU A 492 3.806 -13.513 7.457 1.00 23.23 H new ATOM 0 HD21 LEU A 492 5.833 -15.880 7.253 1.00 44.23 H new ATOM 0 HD22 LEU A 492 4.773 -15.662 8.666 1.00 44.23 H new ATOM 0 HD23 LEU A 492 4.744 -17.193 7.760 1.00 44.23 H new ATOM 1545 N GLU A 493 -0.833 -14.925 7.585 1.00 1.33 N ATOM 1546 CA GLU A 493 -2.136 -15.147 8.187 1.00 41.44 C ATOM 1547 C GLU A 493 -3.148 -15.577 7.124 1.00 33.24 C ATOM 1548 O GLU A 493 -4.048 -16.366 7.402 1.00 15.52 O ATOM 1549 CB GLU A 493 -2.619 -13.896 8.926 1.00 25.24 C ATOM 1550 CG GLU A 493 -2.115 -13.885 10.372 1.00 20.32 C ATOM 1551 CD GLU A 493 -3.228 -14.280 11.343 1.00 2.45 C ATOM 1552 OE1 GLU A 493 -4.320 -13.691 11.309 1.00 53.34 O ATOM 1553 OE2 GLU A 493 -2.931 -15.238 12.155 1.00 55.25 O ATOM 0 H GLU A 493 -0.492 -13.966 7.647 1.00 1.33 H new ATOM 0 HA GLU A 493 -2.043 -15.950 8.918 1.00 41.44 H new ATOM 0 HB2 GLU A 493 -2.267 -13.004 8.407 1.00 25.24 H new ATOM 0 HB3 GLU A 493 -3.708 -13.861 8.916 1.00 25.24 H new ATOM 0 HG2 GLU A 493 -1.277 -14.574 10.474 1.00 20.32 H new ATOM 0 HG3 GLU A 493 -1.743 -12.892 10.624 1.00 20.32 H new ATOM 1559 N SER A 494 -2.963 -15.041 5.925 1.00 44.10 N ATOM 1560 CA SER A 494 -3.848 -15.360 4.819 1.00 34.13 C ATOM 1561 C SER A 494 -3.096 -16.180 3.767 1.00 2.31 C ATOM 1562 O SER A 494 -1.915 -16.480 3.939 1.00 21.03 O ATOM 1563 CB SER A 494 -4.422 -14.090 4.188 1.00 42.22 C ATOM 1564 OG SER A 494 -5.772 -13.859 4.587 1.00 32.21 O ATOM 0 H SER A 494 -2.213 -14.388 5.697 1.00 44.10 H new ATOM 0 HA SER A 494 -4.679 -15.949 5.206 1.00 34.13 H new ATOM 0 HB2 SER A 494 -3.809 -13.235 4.472 1.00 42.22 H new ATOM 0 HB3 SER A 494 -4.374 -14.171 3.102 1.00 42.22 H new ATOM 0 HG SER A 494 -6.279 -14.695 4.526 1.00 32.21 H new ATOM 1569 N SER A 495 -3.811 -16.519 2.706 1.00 54.33 N ATOM 1570 CA SER A 495 -3.226 -17.298 1.627 1.00 12.41 C ATOM 1571 C SER A 495 -3.852 -16.894 0.291 1.00 0.24 C ATOM 1572 O SER A 495 -4.919 -16.284 0.260 1.00 42.31 O ATOM 1573 CB SER A 495 -3.411 -18.797 1.869 1.00 70.03 C ATOM 1574 OG SER A 495 -2.223 -19.408 2.367 1.00 54.54 O ATOM 0 H SER A 495 -4.790 -16.269 2.569 1.00 54.33 H new ATOM 0 HA SER A 495 -2.156 -17.092 1.596 1.00 12.41 H new ATOM 0 HB2 SER A 495 -4.223 -18.952 2.579 1.00 70.03 H new ATOM 0 HB3 SER A 495 -3.705 -19.281 0.938 1.00 70.03 H new ATOM 0 HG SER A 495 -2.382 -20.364 2.510 1.00 54.54 H new ATOM 1579 N PRO A 496 -3.144 -17.262 -0.811 1.00 64.03 N ATOM 1580 CA PRO A 496 -3.618 -16.945 -2.147 1.00 44.15 C ATOM 1581 C PRO A 496 -4.778 -17.858 -2.548 1.00 45.32 C ATOM 1582 O PRO A 496 -5.604 -17.489 -3.382 1.00 51.21 O ATOM 1583 CB PRO A 496 -2.401 -17.103 -3.044 1.00 51.25 C ATOM 1584 CG PRO A 496 -1.411 -17.947 -2.259 1.00 31.13 C ATOM 1585 CD PRO A 496 -1.875 -17.986 -0.813 1.00 25.32 C ATOM 0 HA PRO A 496 -4.023 -15.936 -2.221 1.00 44.15 H new ATOM 0 HB2 PRO A 496 -2.668 -17.587 -3.983 1.00 51.25 H new ATOM 0 HB3 PRO A 496 -1.973 -16.133 -3.296 1.00 51.25 H new ATOM 0 HG2 PRO A 496 -1.359 -18.955 -2.670 1.00 31.13 H new ATOM 0 HG3 PRO A 496 -0.409 -17.522 -2.327 1.00 31.13 H new ATOM 0 HD2 PRO A 496 -2.003 -19.011 -0.466 1.00 25.32 H new ATOM 0 HD3 PRO A 496 -1.149 -17.514 -0.151 1.00 25.32 H new ATOM 1590 N ALA A 497 -4.806 -19.031 -1.932 1.00 1.11 N ATOM 1591 CA ALA A 497 -5.851 -20.000 -2.215 1.00 42.44 C ATOM 1592 C ALA A 497 -7.169 -19.512 -1.606 1.00 60.43 C ATOM 1593 O ALA A 497 -8.245 -19.890 -2.065 1.00 11.14 O ATOM 1594 CB ALA A 497 -5.435 -21.372 -1.680 1.00 54.33 C ATOM 0 H ALA A 497 -4.122 -19.332 -1.238 1.00 1.11 H new ATOM 0 HA ALA A 497 -6.000 -20.101 -3.290 1.00 42.44 H new ATOM 0 HB1 ALA A 497 -6.219 -22.098 -1.893 1.00 54.33 H new ATOM 0 HB2 ALA A 497 -4.509 -21.685 -2.163 1.00 54.33 H new ATOM 0 HB3 ALA A 497 -5.280 -21.311 -0.603 1.00 54.33 H new ATOM 1600 N GLN A 498 -7.039 -18.681 -0.583 1.00 31.21 N ATOM 1601 CA GLN A 498 -8.206 -18.139 0.093 1.00 11.21 C ATOM 1602 C GLN A 498 -8.880 -17.077 -0.781 1.00 63.31 C ATOM 1603 O GLN A 498 -9.967 -16.603 -0.459 1.00 71.14 O ATOM 1604 CB GLN A 498 -7.830 -17.565 1.459 1.00 4.33 C ATOM 1605 CG GLN A 498 -6.670 -18.345 2.082 1.00 14.22 C ATOM 1606 CD GLN A 498 -6.752 -18.327 3.609 1.00 30.13 C ATOM 1607 OE1 GLN A 498 -6.568 -17.308 4.255 1.00 52.13 O ATOM 1608 NE2 GLN A 498 -7.041 -19.507 4.150 1.00 61.44 N ATOM 0 H GLN A 498 -6.144 -18.370 -0.206 1.00 31.21 H new ATOM 0 HA GLN A 498 -8.915 -18.950 0.259 1.00 11.21 H new ATOM 0 HB2 GLN A 498 -7.552 -16.516 1.353 1.00 4.33 H new ATOM 0 HB3 GLN A 498 -8.694 -17.600 2.122 1.00 4.33 H new ATOM 0 HG2 GLN A 498 -6.687 -19.375 1.726 1.00 14.22 H new ATOM 0 HG3 GLN A 498 -5.723 -17.913 1.760 1.00 14.22 H new ATOM 0 HE21 GLN A 498 -7.183 -20.321 3.552 1.00 61.44 H new ATOM 0 HE22 GLN A 498 -7.120 -19.598 5.163 1.00 61.44 H new ATOM 1615 N LEU A 499 -8.203 -16.736 -1.868 1.00 14.53 N ATOM 1616 CA LEU A 499 -8.722 -15.740 -2.790 1.00 11.12 C ATOM 1617 C LEU A 499 -9.354 -16.444 -3.993 1.00 30.11 C ATOM 1618 O LEU A 499 -9.112 -17.628 -4.220 1.00 20.13 O ATOM 1619 CB LEU A 499 -7.629 -14.738 -3.168 1.00 70.02 C ATOM 1620 CG LEU A 499 -6.614 -14.408 -2.072 1.00 42.12 C ATOM 1621 CD1 LEU A 499 -5.740 -13.219 -2.474 1.00 41.31 C ATOM 1622 CD2 LEU A 499 -7.311 -14.179 -0.730 1.00 41.43 C ATOM 0 H LEU A 499 -7.300 -17.131 -2.131 1.00 14.53 H new ATOM 0 HA LEU A 499 -9.508 -15.154 -2.314 1.00 11.12 H new ATOM 0 HB2 LEU A 499 -7.089 -15.128 -4.031 1.00 70.02 H new ATOM 0 HB3 LEU A 499 -8.107 -13.811 -3.484 1.00 70.02 H new ATOM 0 HG LEU A 499 -5.953 -15.266 -1.949 1.00 42.12 H new ATOM 0 HD11 LEU A 499 -5.027 -13.005 -1.677 1.00 41.31 H new ATOM 0 HD12 LEU A 499 -5.200 -13.458 -3.390 1.00 41.31 H new ATOM 0 HD13 LEU A 499 -6.369 -12.345 -2.642 1.00 41.31 H new ATOM 0 HD21 LEU A 499 -6.567 -13.946 0.032 1.00 41.43 H new ATOM 0 HD22 LEU A 499 -8.010 -13.348 -0.820 1.00 41.43 H new ATOM 0 HD23 LEU A 499 -7.854 -15.080 -0.443 1.00 41.43 H new ATOM 1633 N SER A 500 -10.151 -15.684 -4.731 1.00 11.04 N ATOM 1634 CA SER A 500 -10.819 -16.221 -5.904 1.00 72.01 C ATOM 1635 C SER A 500 -9.815 -16.388 -7.047 1.00 71.12 C ATOM 1636 O SER A 500 -8.744 -15.782 -7.031 1.00 12.13 O ATOM 1637 CB SER A 500 -11.976 -15.319 -6.340 1.00 21.34 C ATOM 1638 OG SER A 500 -12.994 -16.049 -7.018 1.00 41.42 O ATOM 0 H SER A 500 -10.349 -14.702 -4.539 1.00 11.04 H new ATOM 0 HA SER A 500 -11.232 -17.196 -5.647 1.00 72.01 H new ATOM 0 HB2 SER A 500 -12.403 -14.828 -5.465 1.00 21.34 H new ATOM 0 HB3 SER A 500 -11.597 -14.533 -6.993 1.00 21.34 H new ATOM 0 HG SER A 500 -13.715 -15.439 -7.279 1.00 41.42 H new ATOM 1643 N SER A 501 -10.197 -17.211 -8.013 1.00 41.31 N ATOM 1644 CA SER A 501 -9.344 -17.464 -9.162 1.00 2.40 C ATOM 1645 C SER A 501 -9.236 -16.203 -10.021 1.00 23.03 C ATOM 1646 O SER A 501 -8.437 -16.150 -10.954 1.00 62.20 O ATOM 1647 CB SER A 501 -9.877 -18.631 -9.995 1.00 34.43 C ATOM 1648 OG SER A 501 -9.831 -19.863 -9.280 1.00 54.31 O ATOM 0 H SER A 501 -11.086 -17.711 -8.023 1.00 41.31 H new ATOM 0 HA SER A 501 -8.352 -17.734 -8.800 1.00 2.40 H new ATOM 0 HB2 SER A 501 -10.905 -18.423 -10.294 1.00 34.43 H new ATOM 0 HB3 SER A 501 -9.291 -18.721 -10.910 1.00 34.43 H new ATOM 0 HG SER A 501 -10.181 -20.583 -9.845 1.00 54.31 H new ATOM 1653 N ASP A 502 -10.053 -15.219 -9.676 1.00 61.44 N ATOM 1654 CA ASP A 502 -10.058 -13.960 -10.405 1.00 25.14 C ATOM 1655 C ASP A 502 -8.952 -13.055 -9.859 1.00 44.40 C ATOM 1656 O ASP A 502 -8.344 -12.292 -10.608 1.00 5.11 O ATOM 1657 CB ASP A 502 -11.393 -13.233 -10.235 1.00 64.41 C ATOM 1658 CG ASP A 502 -12.552 -13.810 -11.050 1.00 42.43 C ATOM 1659 OD1 ASP A 502 -13.384 -14.567 -10.530 1.00 23.34 O ATOM 1660 OD2 ASP A 502 -12.584 -13.445 -12.287 1.00 20.33 O ATOM 0 H ASP A 502 -10.716 -15.267 -8.902 1.00 61.44 H new ATOM 0 HA ASP A 502 -9.899 -14.179 -11.461 1.00 25.14 H new ATOM 0 HB2 ASP A 502 -11.667 -13.250 -9.180 1.00 64.41 H new ATOM 0 HB3 ASP A 502 -11.258 -12.188 -10.513 1.00 64.41 H new ATOM 1665 N THR A 503 -8.726 -13.170 -8.558 1.00 2.50 N ATOM 1666 CA THR A 503 -7.704 -12.370 -7.903 1.00 32.34 C ATOM 1667 C THR A 503 -6.424 -12.351 -8.740 1.00 11.44 C ATOM 1668 O THR A 503 -5.849 -11.290 -8.978 1.00 21.34 O ATOM 1669 CB THR A 503 -7.500 -12.927 -6.494 1.00 64.41 C ATOM 1670 OG1 THR A 503 -8.676 -12.531 -5.791 1.00 24.33 O ATOM 1671 CG2 THR A 503 -6.365 -12.226 -5.745 1.00 54.55 C ATOM 0 H THR A 503 -9.232 -13.804 -7.940 1.00 2.50 H new ATOM 0 HA THR A 503 -8.013 -11.328 -7.815 1.00 32.34 H new ATOM 0 HB THR A 503 -7.290 -13.995 -6.553 1.00 64.41 H new ATOM 0 HG1 THR A 503 -8.586 -11.599 -5.502 1.00 24.33 H new ATOM 0 HG21 THR A 503 -6.263 -12.660 -4.750 1.00 54.55 H new ATOM 0 HG22 THR A 503 -5.432 -12.355 -6.294 1.00 54.55 H new ATOM 0 HG23 THR A 503 -6.590 -11.163 -5.656 1.00 54.55 H new ATOM 1679 N ALA A 504 -6.015 -13.538 -9.167 1.00 3.22 N ATOM 1680 CA ALA A 504 -4.813 -13.671 -9.972 1.00 14.35 C ATOM 1681 C ALA A 504 -4.933 -12.776 -11.208 1.00 22.45 C ATOM 1682 O ALA A 504 -3.942 -12.209 -11.665 1.00 21.33 O ATOM 1683 CB ALA A 504 -4.602 -15.142 -10.335 1.00 1.53 C ATOM 0 H ALA A 504 -6.495 -14.416 -8.970 1.00 3.22 H new ATOM 0 HA ALA A 504 -3.936 -13.345 -9.412 1.00 14.35 H new ATOM 0 HB1 ALA A 504 -3.700 -15.242 -10.939 1.00 1.53 H new ATOM 0 HB2 ALA A 504 -4.495 -15.730 -9.423 1.00 1.53 H new ATOM 0 HB3 ALA A 504 -5.460 -15.504 -10.902 1.00 1.53 H new ATOM 1689 N SER A 505 -6.153 -12.681 -11.715 1.00 65.34 N ATOM 1690 CA SER A 505 -6.413 -11.865 -12.888 1.00 51.30 C ATOM 1691 C SER A 505 -6.626 -10.407 -12.476 1.00 43.23 C ATOM 1692 O SER A 505 -6.461 -9.498 -13.289 1.00 2.12 O ATOM 1693 CB SER A 505 -7.630 -12.382 -13.658 1.00 31.04 C ATOM 1694 OG SER A 505 -7.332 -13.563 -14.398 1.00 42.11 O ATOM 0 H SER A 505 -6.972 -13.156 -11.335 1.00 65.34 H new ATOM 0 HA SER A 505 -5.546 -11.926 -13.546 1.00 51.30 H new ATOM 0 HB2 SER A 505 -8.441 -12.587 -12.959 1.00 31.04 H new ATOM 0 HB3 SER A 505 -7.984 -11.608 -14.338 1.00 31.04 H new ATOM 0 HG SER A 505 -8.135 -13.862 -14.874 1.00 42.11 H new ATOM 1699 N LEU A 506 -6.990 -10.229 -11.214 1.00 34.10 N ATOM 1700 CA LEU A 506 -7.227 -8.898 -10.685 1.00 40.31 C ATOM 1701 C LEU A 506 -5.912 -8.117 -10.670 1.00 63.43 C ATOM 1702 O LEU A 506 -5.888 -6.926 -10.975 1.00 20.15 O ATOM 1703 CB LEU A 506 -7.909 -8.978 -9.318 1.00 22.10 C ATOM 1704 CG LEU A 506 -9.331 -9.544 -9.310 1.00 53.24 C ATOM 1705 CD1 LEU A 506 -9.831 -9.752 -7.879 1.00 55.43 C ATOM 1706 CD2 LEU A 506 -10.277 -8.659 -10.124 1.00 55.52 C ATOM 0 H LEU A 506 -7.126 -10.985 -10.543 1.00 34.10 H new ATOM 0 HA LEU A 506 -7.916 -8.351 -11.328 1.00 40.31 H new ATOM 0 HB2 LEU A 506 -7.292 -9.591 -8.661 1.00 22.10 H new ATOM 0 HB3 LEU A 506 -7.935 -7.977 -8.888 1.00 22.10 H new ATOM 0 HG LEU A 506 -9.312 -10.523 -9.790 1.00 53.24 H new ATOM 0 HD11 LEU A 506 -10.844 -10.155 -7.902 1.00 55.43 H new ATOM 0 HD12 LEU A 506 -9.174 -10.451 -7.362 1.00 55.43 H new ATOM 0 HD13 LEU A 506 -9.832 -8.798 -7.352 1.00 55.43 H new ATOM 0 HD21 LEU A 506 -11.281 -9.083 -10.102 1.00 55.52 H new ATOM 0 HD22 LEU A 506 -10.297 -7.657 -9.695 1.00 55.52 H new ATOM 0 HD23 LEU A 506 -9.928 -8.605 -11.155 1.00 55.52 H new ATOM 1717 N LEU A 507 -4.847 -8.821 -10.311 1.00 34.33 N ATOM 1718 CA LEU A 507 -3.531 -8.209 -10.253 1.00 74.33 C ATOM 1719 C LEU A 507 -2.581 -8.963 -11.186 1.00 65.10 C ATOM 1720 O LEU A 507 -1.366 -8.938 -10.992 1.00 75.32 O ATOM 1721 CB LEU A 507 -3.040 -8.132 -8.805 1.00 74.55 C ATOM 1722 CG LEU A 507 -3.026 -9.452 -8.031 1.00 73.25 C ATOM 1723 CD1 LEU A 507 -4.401 -9.750 -7.433 1.00 32.52 C ATOM 1724 CD2 LEU A 507 -2.521 -10.597 -8.911 1.00 22.25 C ATOM 0 H LEU A 507 -4.870 -9.809 -10.058 1.00 34.33 H new ATOM 0 HA LEU A 507 -3.573 -7.179 -10.606 1.00 74.33 H new ATOM 0 HB2 LEU A 507 -2.029 -7.723 -8.806 1.00 74.55 H new ATOM 0 HB3 LEU A 507 -3.669 -7.424 -8.266 1.00 74.55 H new ATOM 0 HG LEU A 507 -2.328 -9.355 -7.199 1.00 73.25 H new ATOM 0 HD11 LEU A 507 -4.364 -10.693 -6.888 1.00 32.52 H new ATOM 0 HD12 LEU A 507 -4.683 -8.948 -6.751 1.00 32.52 H new ATOM 0 HD13 LEU A 507 -5.138 -9.822 -8.233 1.00 32.52 H new ATOM 0 HD21 LEU A 507 -2.521 -11.524 -8.337 1.00 22.25 H new ATOM 0 HD22 LEU A 507 -3.174 -10.706 -9.777 1.00 22.25 H new ATOM 0 HD23 LEU A 507 -1.507 -10.378 -9.247 1.00 22.25 H new ATOM 1735 N SER A 508 -3.170 -9.616 -12.177 1.00 4.30 N ATOM 1736 CA SER A 508 -2.392 -10.376 -13.140 1.00 63.34 C ATOM 1737 C SER A 508 -1.406 -9.453 -13.862 1.00 4.10 C ATOM 1738 O SER A 508 -1.781 -8.752 -14.800 1.00 3.34 O ATOM 1739 CB SER A 508 -3.300 -11.077 -14.152 1.00 1.12 C ATOM 1740 OG SER A 508 -2.726 -11.105 -15.456 1.00 42.53 O ATOM 0 H SER A 508 -4.178 -9.634 -12.334 1.00 4.30 H new ATOM 0 HA SER A 508 -1.835 -11.142 -12.601 1.00 63.34 H new ATOM 0 HB2 SER A 508 -3.494 -12.097 -13.819 1.00 1.12 H new ATOM 0 HB3 SER A 508 -4.262 -10.566 -14.190 1.00 1.12 H new ATOM 0 HG SER A 508 -2.548 -10.189 -15.755 1.00 42.53 H new ATOM 1745 N GLY A 509 -0.167 -9.484 -13.395 1.00 44.15 N ATOM 1746 CA GLY A 509 0.875 -8.659 -13.983 1.00 0.43 C ATOM 1747 C GLY A 509 1.655 -7.905 -12.904 1.00 2.45 C ATOM 1748 O GLY A 509 2.804 -7.524 -13.116 1.00 44.24 O ATOM 0 H GLY A 509 0.139 -10.067 -12.616 1.00 44.15 H new ATOM 0 HA2 GLY A 509 1.557 -9.285 -14.559 1.00 0.43 H new ATOM 0 HA3 GLY A 509 0.431 -7.948 -14.679 1.00 0.43 H new ATOM 1752 N LEU A 510 0.996 -7.714 -11.769 1.00 32.50 N ATOM 1753 CA LEU A 510 1.613 -7.014 -10.656 1.00 0.40 C ATOM 1754 C LEU A 510 2.631 -7.935 -9.981 1.00 65.05 C ATOM 1755 O LEU A 510 2.811 -9.078 -10.396 1.00 24.13 O ATOM 1756 CB LEU A 510 0.544 -6.475 -9.703 1.00 13.21 C ATOM 1757 CG LEU A 510 -0.171 -5.199 -10.151 1.00 11.54 C ATOM 1758 CD1 LEU A 510 -1.363 -4.890 -9.242 1.00 62.23 C ATOM 1759 CD2 LEU A 510 0.805 -4.023 -10.236 1.00 1.43 C ATOM 0 H LEU A 510 0.042 -8.032 -11.597 1.00 32.50 H new ATOM 0 HA LEU A 510 2.160 -6.141 -11.011 1.00 0.40 H new ATOM 0 HB2 LEU A 510 -0.204 -7.253 -9.551 1.00 13.21 H new ATOM 0 HB3 LEU A 510 1.009 -6.287 -8.736 1.00 13.21 H new ATOM 0 HG LEU A 510 -0.565 -5.363 -11.154 1.00 11.54 H new ATOM 0 HD11 LEU A 510 -1.854 -3.978 -9.583 1.00 62.23 H new ATOM 0 HD12 LEU A 510 -2.071 -5.718 -9.277 1.00 62.23 H new ATOM 0 HD13 LEU A 510 -1.014 -4.754 -8.218 1.00 62.23 H new ATOM 0 HD21 LEU A 510 0.270 -3.129 -10.557 1.00 1.43 H new ATOM 0 HD22 LEU A 510 1.250 -3.848 -9.256 1.00 1.43 H new ATOM 0 HD23 LEU A 510 1.591 -4.254 -10.955 1.00 1.43 H new ATOM 1770 N VAL A 511 3.269 -7.402 -8.949 1.00 20.21 N ATOM 1771 CA VAL A 511 4.265 -8.163 -8.212 1.00 43.33 C ATOM 1772 C VAL A 511 3.716 -8.504 -6.824 1.00 53.15 C ATOM 1773 O VAL A 511 3.699 -7.654 -5.935 1.00 11.25 O ATOM 1774 CB VAL A 511 5.583 -7.387 -8.159 1.00 2.41 C ATOM 1775 CG1 VAL A 511 6.560 -8.035 -7.176 1.00 72.53 C ATOM 1776 CG2 VAL A 511 6.204 -7.266 -9.551 1.00 75.51 C ATOM 0 H VAL A 511 3.116 -6.454 -8.606 1.00 20.21 H new ATOM 0 HA VAL A 511 4.478 -9.105 -8.718 1.00 43.33 H new ATOM 0 HB VAL A 511 5.366 -6.380 -7.801 1.00 2.41 H new ATOM 0 HG11 VAL A 511 7.489 -7.465 -7.157 1.00 72.53 H new ATOM 0 HG12 VAL A 511 6.120 -8.045 -6.179 1.00 72.53 H new ATOM 0 HG13 VAL A 511 6.769 -9.057 -7.491 1.00 72.53 H new ATOM 0 HG21 VAL A 511 7.139 -6.710 -9.485 1.00 75.51 H new ATOM 0 HG22 VAL A 511 6.400 -8.261 -9.950 1.00 75.51 H new ATOM 0 HG23 VAL A 511 5.515 -6.740 -10.212 1.00 75.51 H new ATOM 1786 N ARG A 512 3.280 -9.746 -6.685 1.00 43.42 N ATOM 1787 CA ARG A 512 2.731 -10.209 -5.420 1.00 12.12 C ATOM 1788 C ARG A 512 3.811 -10.197 -4.338 1.00 43.43 C ATOM 1789 O ARG A 512 4.872 -10.793 -4.506 1.00 20.42 O ATOM 1790 CB ARG A 512 2.167 -11.625 -5.552 1.00 42.51 C ATOM 1791 CG ARG A 512 1.007 -11.844 -4.578 1.00 13.21 C ATOM 1792 CD ARG A 512 0.420 -13.250 -4.731 1.00 52.34 C ATOM 1793 NE ARG A 512 1.511 -14.245 -4.829 1.00 54.34 N ATOM 1794 CZ ARG A 512 1.373 -15.465 -5.389 1.00 31.22 C ATOM 1795 NH1 ARG A 512 0.188 -15.851 -5.908 1.00 73.00 N ATOM 1796 NH2 ARG A 512 2.415 -16.276 -5.423 1.00 53.52 N ATOM 0 H ARG A 512 3.295 -10.447 -7.426 1.00 43.42 H new ATOM 0 HA ARG A 512 1.924 -9.532 -5.140 1.00 12.12 H new ATOM 0 HB2 ARG A 512 1.825 -11.791 -6.574 1.00 42.51 H new ATOM 0 HB3 ARG A 512 2.954 -12.354 -5.357 1.00 42.51 H new ATOM 0 HG2 ARG A 512 1.354 -11.700 -3.555 1.00 13.21 H new ATOM 0 HG3 ARG A 512 0.231 -11.100 -4.758 1.00 13.21 H new ATOM 0 HD2 ARG A 512 -0.219 -13.481 -3.879 1.00 52.34 H new ATOM 0 HD3 ARG A 512 -0.207 -13.297 -5.621 1.00 52.34 H new ATOM 0 HE ARG A 512 2.424 -13.993 -4.450 1.00 54.34 H new ATOM 0 HH11 ARG A 512 -0.612 -15.219 -5.879 1.00 73.00 H new ATOM 0 HH12 ARG A 512 0.093 -16.775 -6.329 1.00 73.00 H new ATOM 0 HH21 ARG A 512 3.307 -15.977 -5.030 1.00 53.52 H new ATOM 0 HH22 ARG A 512 2.327 -17.202 -5.843 1.00 53.52 H new ATOM 1806 N LEU A 513 3.503 -9.509 -3.248 1.00 44.11 N ATOM 1807 CA LEU A 513 4.433 -9.410 -2.136 1.00 70.00 C ATOM 1808 C LEU A 513 4.084 -10.469 -1.089 1.00 50.15 C ATOM 1809 O LEU A 513 2.932 -10.576 -0.669 1.00 3.14 O ATOM 1810 CB LEU A 513 4.459 -7.984 -1.584 1.00 21.31 C ATOM 1811 CG LEU A 513 5.719 -7.170 -1.888 1.00 40.21 C ATOM 1812 CD1 LEU A 513 6.165 -7.370 -3.337 1.00 31.04 C ATOM 1813 CD2 LEU A 513 5.512 -5.692 -1.549 1.00 34.12 C ATOM 0 H LEU A 513 2.621 -9.014 -3.111 1.00 44.11 H new ATOM 0 HA LEU A 513 5.450 -9.615 -2.471 1.00 70.00 H new ATOM 0 HB2 LEU A 513 3.598 -7.446 -1.981 1.00 21.31 H new ATOM 0 HB3 LEU A 513 4.334 -8.032 -0.502 1.00 21.31 H new ATOM 0 HG LEU A 513 6.524 -7.536 -1.251 1.00 40.21 H new ATOM 0 HD11 LEU A 513 7.062 -6.781 -3.526 1.00 31.04 H new ATOM 0 HD12 LEU A 513 6.381 -8.424 -3.509 1.00 31.04 H new ATOM 0 HD13 LEU A 513 5.370 -7.048 -4.010 1.00 31.04 H new ATOM 0 HD21 LEU A 513 6.422 -5.136 -1.774 1.00 34.12 H new ATOM 0 HD22 LEU A 513 4.688 -5.295 -2.142 1.00 34.12 H new ATOM 0 HD23 LEU A 513 5.278 -5.591 -0.489 1.00 34.12 H new ATOM 1824 N ASP A 514 5.098 -11.224 -0.695 1.00 32.51 N ATOM 1825 CA ASP A 514 4.913 -12.270 0.296 1.00 2.34 C ATOM 1826 C ASP A 514 5.921 -12.078 1.430 1.00 13.05 C ATOM 1827 O ASP A 514 7.105 -11.855 1.181 1.00 13.31 O ATOM 1828 CB ASP A 514 5.144 -13.655 -0.314 1.00 72.34 C ATOM 1829 CG ASP A 514 5.225 -13.682 -1.842 1.00 52.52 C ATOM 1830 OD1 ASP A 514 4.200 -13.768 -2.534 1.00 33.02 O ATOM 1831 OD2 ASP A 514 6.418 -13.612 -2.326 1.00 33.32 O ATOM 0 H ASP A 514 6.052 -11.132 -1.045 1.00 32.51 H new ATOM 0 HA ASP A 514 3.890 -12.205 0.666 1.00 2.34 H new ATOM 0 HB2 ASP A 514 6.069 -14.065 0.091 1.00 72.34 H new ATOM 0 HB3 ASP A 514 4.337 -14.315 0.004 1.00 72.34 H new ATOM 1836 N GLU A 515 5.417 -12.174 2.651 1.00 50.11 N ATOM 1837 CA GLU A 515 6.258 -12.013 3.824 1.00 62.32 C ATOM 1838 C GLU A 515 6.988 -13.321 4.136 1.00 44.31 C ATOM 1839 O GLU A 515 8.033 -13.314 4.785 1.00 22.23 O ATOM 1840 CB GLU A 515 5.440 -11.540 5.027 1.00 35.15 C ATOM 1841 CG GLU A 515 6.300 -11.492 6.291 1.00 34.14 C ATOM 1842 CD GLU A 515 7.647 -10.822 6.013 1.00 33.32 C ATOM 1843 OE1 GLU A 515 7.687 -9.739 5.410 1.00 22.42 O ATOM 1844 OE2 GLU A 515 8.677 -11.467 6.446 1.00 41.54 O ATOM 0 H GLU A 515 4.435 -12.362 2.853 1.00 50.11 H new ATOM 0 HA GLU A 515 7.002 -11.246 3.611 1.00 62.32 H new ATOM 0 HB2 GLU A 515 5.029 -10.551 4.825 1.00 35.15 H new ATOM 0 HB3 GLU A 515 4.595 -12.211 5.183 1.00 35.15 H new ATOM 0 HG2 GLU A 515 5.773 -10.946 7.073 1.00 34.14 H new ATOM 0 HG3 GLU A 515 6.463 -12.504 6.663 1.00 34.14 H new ATOM 1850 N HIS A 516 6.408 -14.414 3.662 1.00 55.44 N ATOM 1851 CA HIS A 516 6.989 -15.726 3.883 1.00 31.24 C ATOM 1852 C HIS A 516 7.922 -16.076 2.722 1.00 73.43 C ATOM 1853 O HIS A 516 8.443 -17.188 2.653 1.00 33.34 O ATOM 1854 CB HIS A 516 5.895 -16.774 4.101 1.00 23.55 C ATOM 1855 CG HIS A 516 4.682 -16.589 3.222 1.00 72.15 C ATOM 1856 ND1 HIS A 516 3.404 -16.937 3.623 1.00 30.34 N ATOM 1857 CD2 HIS A 516 4.566 -16.088 1.958 1.00 2.35 C ATOM 1858 CE1 HIS A 516 2.566 -16.654 2.638 1.00 1.24 C ATOM 1859 NE2 HIS A 516 3.286 -16.129 1.607 1.00 11.14 N ATOM 0 H HIS A 516 5.541 -14.417 3.125 1.00 55.44 H new ATOM 0 HA HIS A 516 7.588 -15.714 4.794 1.00 31.24 H new ATOM 0 HB2 HIS A 516 6.314 -17.764 3.921 1.00 23.55 H new ATOM 0 HB3 HIS A 516 5.582 -16.746 5.145 1.00 23.55 H new ATOM 0 HD2 HIS A 516 5.377 -15.721 1.347 1.00 2.35 H new ATOM 0 HE1 HIS A 516 1.498 -16.812 2.650 1.00 1.24 H new ATOM 0 HE2 HIS A 516 2.905 -15.819 0.713 1.00 11.14 H new ATOM 1866 N SER A 517 8.106 -15.106 1.840 1.00 64.44 N ATOM 1867 CA SER A 517 8.969 -15.296 0.686 1.00 31.23 C ATOM 1868 C SER A 517 10.404 -14.894 1.033 1.00 10.01 C ATOM 1869 O SER A 517 10.622 -14.012 1.860 1.00 54.34 O ATOM 1870 CB SER A 517 8.469 -14.491 -0.515 1.00 12.25 C ATOM 1871 OG SER A 517 9.454 -14.390 -1.537 1.00 74.10 O ATOM 0 H SER A 517 7.672 -14.185 1.901 1.00 64.44 H new ATOM 0 HA SER A 517 8.949 -16.352 0.415 1.00 31.23 H new ATOM 0 HB2 SER A 517 7.574 -14.963 -0.920 1.00 12.25 H new ATOM 0 HB3 SER A 517 8.183 -13.492 -0.188 1.00 12.25 H new ATOM 0 HG SER A 517 9.096 -13.870 -2.287 1.00 74.10 H new ATOM 1876 N GLN A 518 11.344 -15.562 0.382 1.00 63.43 N ATOM 1877 CA GLN A 518 12.753 -15.287 0.612 1.00 52.23 C ATOM 1878 C GLN A 518 13.283 -14.314 -0.444 1.00 2.50 C ATOM 1879 O GLN A 518 14.410 -13.834 -0.342 1.00 53.41 O ATOM 1880 CB GLN A 518 13.570 -16.579 0.625 1.00 23.43 C ATOM 1881 CG GLN A 518 13.703 -17.159 -0.786 1.00 51.14 C ATOM 1882 CD GLN A 518 14.820 -16.459 -1.563 1.00 41.20 C ATOM 1883 OE1 GLN A 518 14.625 -15.943 -2.651 1.00 2.25 O ATOM 1884 NE2 GLN A 518 15.998 -16.469 -0.946 1.00 70.12 N ATOM 0 H GLN A 518 11.159 -16.293 -0.305 1.00 63.43 H new ATOM 0 HA GLN A 518 12.856 -14.822 1.592 1.00 52.23 H new ATOM 0 HB2 GLN A 518 14.560 -16.383 1.036 1.00 23.43 H new ATOM 0 HB3 GLN A 518 13.092 -17.309 1.278 1.00 23.43 H new ATOM 0 HG2 GLN A 518 13.911 -18.227 -0.726 1.00 51.14 H new ATOM 0 HG3 GLN A 518 12.759 -17.048 -1.319 1.00 51.14 H new ATOM 0 HE21 GLN A 518 16.093 -16.919 -0.035 1.00 70.12 H new ATOM 0 HE22 GLN A 518 16.806 -16.027 -1.383 1.00 70.12 H new ATOM 1891 N ILE A 519 12.443 -14.052 -1.434 1.00 52.12 N ATOM 1892 CA ILE A 519 12.811 -13.146 -2.509 1.00 2.23 C ATOM 1893 C ILE A 519 12.016 -11.845 -2.368 1.00 11.22 C ATOM 1894 O ILE A 519 12.454 -10.793 -2.831 1.00 15.24 O ATOM 1895 CB ILE A 519 12.641 -13.827 -3.868 1.00 4.34 C ATOM 1896 CG1 ILE A 519 12.003 -12.875 -4.883 1.00 3.32 C ATOM 1897 CG2 ILE A 519 11.853 -15.131 -3.732 1.00 11.11 C ATOM 1898 CD1 ILE A 519 12.984 -11.775 -5.294 1.00 30.23 C ATOM 0 H ILE A 519 11.508 -14.451 -1.515 1.00 52.12 H new ATOM 0 HA ILE A 519 13.867 -12.884 -2.441 1.00 2.23 H new ATOM 0 HB ILE A 519 13.630 -14.086 -4.247 1.00 4.34 H new ATOM 0 HG12 ILE A 519 11.688 -13.434 -5.764 1.00 3.32 H new ATOM 0 HG13 ILE A 519 11.107 -12.427 -4.453 1.00 3.32 H new ATOM 0 HG21 ILE A 519 11.746 -15.595 -4.712 1.00 11.11 H new ATOM 0 HG22 ILE A 519 12.385 -15.810 -3.065 1.00 11.11 H new ATOM 0 HG23 ILE A 519 10.866 -14.918 -3.322 1.00 11.11 H new ATOM 0 HD11 ILE A 519 12.506 -11.112 -6.016 1.00 30.23 H new ATOM 0 HD12 ILE A 519 13.278 -11.202 -4.414 1.00 30.23 H new ATOM 0 HD13 ILE A 519 13.868 -12.226 -5.745 1.00 30.23 H new ATOM 1909 N PHE A 520 10.862 -11.961 -1.728 1.00 2.14 N ATOM 1910 CA PHE A 520 10.002 -10.809 -1.521 1.00 64.51 C ATOM 1911 C PHE A 520 10.824 -9.568 -1.167 1.00 5.42 C ATOM 1912 O PHE A 520 10.478 -8.455 -1.562 1.00 24.15 O ATOM 1913 CB PHE A 520 9.077 -11.145 -0.350 1.00 62.33 C ATOM 1914 CG PHE A 520 8.728 -9.945 0.533 1.00 11.21 C ATOM 1915 CD1 PHE A 520 7.675 -9.148 0.210 1.00 40.25 C ATOM 1916 CD2 PHE A 520 9.471 -9.675 1.639 1.00 42.12 C ATOM 1917 CE1 PHE A 520 7.351 -8.032 1.030 1.00 35.55 C ATOM 1918 CE2 PHE A 520 9.148 -8.562 2.459 1.00 52.43 C ATOM 1919 CZ PHE A 520 8.096 -7.764 2.136 1.00 11.51 C ATOM 0 H PHE A 520 10.502 -12.836 -1.346 1.00 2.14 H new ATOM 0 HA PHE A 520 9.443 -10.594 -2.432 1.00 64.51 H new ATOM 0 HB2 PHE A 520 8.155 -11.576 -0.741 1.00 62.33 H new ATOM 0 HB3 PHE A 520 9.550 -11.910 0.265 1.00 62.33 H new ATOM 0 HD1 PHE A 520 7.085 -9.362 -0.669 1.00 40.25 H new ATOM 0 HD2 PHE A 520 10.308 -10.308 1.894 1.00 42.12 H new ATOM 0 HE1 PHE A 520 6.515 -7.398 0.775 1.00 35.55 H new ATOM 0 HE2 PHE A 520 9.738 -8.350 3.339 1.00 52.43 H new ATOM 0 HZ PHE A 520 7.851 -6.916 2.758 1.00 11.51 H new ATOM 1928 N ALA A 521 11.896 -9.800 -0.424 1.00 10.05 N ATOM 1929 CA ALA A 521 12.770 -8.715 -0.012 1.00 75.13 C ATOM 1930 C ALA A 521 13.236 -7.943 -1.248 1.00 20.33 C ATOM 1931 O ALA A 521 13.196 -6.714 -1.268 1.00 52.00 O ATOM 1932 CB ALA A 521 13.940 -9.280 0.797 1.00 12.55 C ATOM 0 H ALA A 521 12.179 -10.724 -0.097 1.00 10.05 H new ATOM 0 HA ALA A 521 12.236 -8.016 0.631 1.00 75.13 H new ATOM 0 HB1 ALA A 521 14.596 -8.466 1.106 1.00 12.55 H new ATOM 0 HB2 ALA A 521 13.558 -9.793 1.680 1.00 12.55 H new ATOM 0 HB3 ALA A 521 14.501 -9.984 0.182 1.00 12.55 H new ATOM 1938 N ARG A 522 13.667 -8.696 -2.249 1.00 61.20 N ATOM 1939 CA ARG A 522 14.141 -8.098 -3.485 1.00 11.24 C ATOM 1940 C ARG A 522 12.959 -7.584 -4.311 1.00 34.21 C ATOM 1941 O ARG A 522 13.134 -6.745 -5.195 1.00 21.04 O ATOM 1942 CB ARG A 522 14.935 -9.107 -4.317 1.00 32.12 C ATOM 1943 CG ARG A 522 16.276 -9.427 -3.655 1.00 70.30 C ATOM 1944 CD ARG A 522 16.090 -10.378 -2.471 1.00 32.05 C ATOM 1945 NE ARG A 522 17.407 -10.847 -1.984 1.00 73.54 N ATOM 1946 CZ ARG A 522 17.573 -11.735 -0.982 1.00 50.23 C ATOM 1947 NH1 ARG A 522 16.502 -12.261 -0.349 1.00 33.43 N ATOM 1948 NH2 ARG A 522 18.796 -12.082 -0.630 1.00 54.10 N ATOM 0 H ARG A 522 13.698 -9.715 -2.229 1.00 61.20 H new ATOM 0 HA ARG A 522 14.796 -7.267 -3.222 1.00 11.24 H new ATOM 0 HB2 ARG A 522 14.356 -10.023 -4.435 1.00 32.12 H new ATOM 0 HB3 ARG A 522 15.105 -8.706 -5.316 1.00 32.12 H new ATOM 0 HG2 ARG A 522 16.948 -9.877 -4.386 1.00 70.30 H new ATOM 0 HG3 ARG A 522 16.747 -8.505 -3.315 1.00 70.30 H new ATOM 0 HD2 ARG A 522 15.556 -9.871 -1.667 1.00 32.05 H new ATOM 0 HD3 ARG A 522 15.480 -11.230 -2.771 1.00 32.05 H new ATOM 0 HE ARG A 522 18.243 -10.475 -2.435 1.00 73.54 H new ATOM 0 HH11 ARG A 522 15.560 -11.987 -0.628 1.00 33.43 H new ATOM 0 HH12 ARG A 522 16.636 -12.932 0.408 1.00 33.43 H new ATOM 0 HH21 ARG A 522 19.599 -11.680 -1.113 1.00 54.10 H new ATOM 0 HH22 ARG A 522 18.938 -12.752 0.126 1.00 54.10 H new ATOM 1958 N LYS A 523 11.785 -8.108 -3.995 1.00 14.05 N ATOM 1959 CA LYS A 523 10.575 -7.713 -4.699 1.00 64.44 C ATOM 1960 C LYS A 523 10.135 -6.332 -4.209 1.00 60.25 C ATOM 1961 O LYS A 523 9.703 -5.497 -5.003 1.00 42.42 O ATOM 1962 CB LYS A 523 9.496 -8.788 -4.555 1.00 64.51 C ATOM 1963 CG LYS A 523 10.043 -10.166 -4.934 1.00 14.40 C ATOM 1964 CD LYS A 523 10.677 -10.140 -6.328 1.00 4.13 C ATOM 1965 CE LYS A 523 9.659 -9.707 -7.385 1.00 40.41 C ATOM 1966 NZ LYS A 523 9.913 -10.405 -8.664 1.00 75.30 N ATOM 0 H LYS A 523 11.644 -8.803 -3.261 1.00 14.05 H new ATOM 0 HA LYS A 523 10.767 -7.628 -5.769 1.00 64.44 H new ATOM 0 HB2 LYS A 523 9.131 -8.807 -3.528 1.00 64.51 H new ATOM 0 HB3 LYS A 523 8.645 -8.543 -5.191 1.00 64.51 H new ATOM 0 HG2 LYS A 523 10.784 -10.482 -4.199 1.00 14.40 H new ATOM 0 HG3 LYS A 523 9.238 -10.900 -4.910 1.00 14.40 H new ATOM 0 HD2 LYS A 523 11.525 -9.456 -6.333 1.00 4.13 H new ATOM 0 HD3 LYS A 523 11.064 -11.129 -6.574 1.00 4.13 H new ATOM 0 HE2 LYS A 523 8.649 -9.927 -7.038 1.00 40.41 H new ATOM 0 HE3 LYS A 523 9.717 -8.629 -7.534 1.00 40.41 H new ATOM 0 HZ1 LYS A 523 9.214 -10.100 -9.371 1.00 75.30 H new ATOM 0 HZ2 LYS A 523 10.869 -10.174 -9.001 1.00 75.30 H new ATOM 0 HZ3 LYS A 523 9.835 -11.432 -8.520 1.00 75.30 H new ATOM 1975 N VAL A 524 10.262 -6.132 -2.906 1.00 3.52 N ATOM 1976 CA VAL A 524 9.882 -4.867 -2.300 1.00 31.51 C ATOM 1977 C VAL A 524 11.003 -3.848 -2.516 1.00 31.21 C ATOM 1978 O VAL A 524 10.744 -2.702 -2.882 1.00 55.22 O ATOM 1979 CB VAL A 524 9.539 -5.074 -0.824 1.00 44.14 C ATOM 1980 CG1 VAL A 524 10.797 -5.023 0.044 1.00 73.25 C ATOM 1981 CG2 VAL A 524 8.504 -4.049 -0.353 1.00 65.24 C ATOM 0 H VAL A 524 10.623 -6.826 -2.252 1.00 3.52 H new ATOM 0 HA VAL A 524 8.984 -4.471 -2.775 1.00 31.51 H new ATOM 0 HB VAL A 524 9.100 -6.066 -0.718 1.00 44.14 H new ATOM 0 HG11 VAL A 524 10.525 -5.173 1.089 1.00 73.25 H new ATOM 0 HG12 VAL A 524 11.486 -5.808 -0.268 1.00 73.25 H new ATOM 0 HG13 VAL A 524 11.278 -4.052 -0.070 1.00 73.25 H new ATOM 0 HG21 VAL A 524 8.277 -4.218 0.700 1.00 65.24 H new ATOM 0 HG22 VAL A 524 8.904 -3.043 -0.481 1.00 65.24 H new ATOM 0 HG23 VAL A 524 7.593 -4.155 -0.942 1.00 65.24 H new ATOM 1991 N ALA A 525 12.225 -4.301 -2.281 1.00 65.42 N ATOM 1992 CA ALA A 525 13.387 -3.443 -2.445 1.00 73.52 C ATOM 1993 C ALA A 525 13.535 -3.069 -3.921 1.00 35.23 C ATOM 1994 O ALA A 525 14.320 -2.187 -4.266 1.00 13.13 O ATOM 1995 CB ALA A 525 14.627 -4.152 -1.896 1.00 40.53 C ATOM 0 H ALA A 525 12.437 -5.252 -1.978 1.00 65.42 H new ATOM 0 HA ALA A 525 13.264 -2.518 -1.881 1.00 73.52 H new ATOM 0 HB1 ALA A 525 15.498 -3.509 -2.019 1.00 40.53 H new ATOM 0 HB2 ALA A 525 14.483 -4.370 -0.838 1.00 40.53 H new ATOM 0 HB3 ALA A 525 14.784 -5.084 -2.440 1.00 40.53 H new ATOM 2001 N ASN A 526 12.768 -3.760 -4.753 1.00 61.24 N ATOM 2002 CA ASN A 526 12.805 -3.512 -6.185 1.00 44.31 C ATOM 2003 C ASN A 526 11.790 -2.420 -6.534 1.00 73.24 C ATOM 2004 O ASN A 526 12.151 -1.394 -7.109 1.00 72.33 O ATOM 2005 CB ASN A 526 12.434 -4.770 -6.971 1.00 31.12 C ATOM 2006 CG ASN A 526 13.687 -5.525 -7.421 1.00 71.23 C ATOM 2007 OD1 ASN A 526 14.769 -4.973 -7.530 1.00 42.02 O ATOM 2008 ND2 ASN A 526 13.480 -6.813 -7.676 1.00 64.34 N ATOM 0 H ASN A 526 12.118 -4.491 -4.463 1.00 61.24 H new ATOM 0 HA ASN A 526 13.818 -3.207 -6.449 1.00 44.31 H new ATOM 0 HB2 ASN A 526 11.816 -5.420 -6.352 1.00 31.12 H new ATOM 0 HB3 ASN A 526 11.838 -4.497 -7.841 1.00 31.12 H new ATOM 0 HD21 ASN A 526 14.253 -7.403 -7.984 1.00 64.34 H new ATOM 0 HD22 ASN A 526 12.548 -7.212 -7.564 1.00 64.34 H new ATOM 2014 N THR A 527 10.543 -2.678 -6.173 1.00 50.12 N ATOM 2015 CA THR A 527 9.475 -1.730 -6.441 1.00 45.02 C ATOM 2016 C THR A 527 9.629 -0.489 -5.558 1.00 33.44 C ATOM 2017 O THR A 527 9.671 0.632 -6.061 1.00 71.10 O ATOM 2018 CB THR A 527 8.141 -2.454 -6.244 1.00 53.20 C ATOM 2019 OG1 THR A 527 7.162 -1.441 -6.461 1.00 14.21 O ATOM 2020 CG2 THR A 527 7.916 -2.884 -4.794 1.00 63.42 C ATOM 0 H THR A 527 10.247 -3.530 -5.697 1.00 50.12 H new ATOM 0 HA THR A 527 9.516 -1.367 -7.468 1.00 45.02 H new ATOM 0 HB THR A 527 8.105 -3.330 -6.892 1.00 53.20 H new ATOM 0 HG1 THR A 527 6.493 -1.764 -7.099 1.00 14.21 H new ATOM 0 HG21 THR A 527 6.956 -3.393 -4.710 1.00 63.42 H new ATOM 0 HG22 THR A 527 8.713 -3.561 -4.487 1.00 63.42 H new ATOM 0 HG23 THR A 527 7.919 -2.005 -4.149 1.00 63.42 H new ATOM 2028 N PHE A 528 9.708 -0.733 -4.259 1.00 31.13 N ATOM 2029 CA PHE A 528 9.857 0.350 -3.302 1.00 53.24 C ATOM 2030 C PHE A 528 11.330 0.708 -3.104 1.00 65.02 C ATOM 2031 O PHE A 528 11.769 0.945 -1.979 1.00 60.11 O ATOM 2032 CB PHE A 528 9.280 -0.143 -1.974 1.00 4.53 C ATOM 2033 CG PHE A 528 7.751 -0.123 -1.912 1.00 31.51 C ATOM 2034 CD1 PHE A 528 7.082 1.054 -2.029 1.00 60.21 C ATOM 2035 CD2 PHE A 528 7.062 -1.284 -1.741 1.00 40.43 C ATOM 2036 CE1 PHE A 528 5.663 1.072 -1.973 1.00 44.53 C ATOM 2037 CE2 PHE A 528 5.644 -1.265 -1.685 1.00 25.05 C ATOM 2038 CZ PHE A 528 4.975 -0.087 -1.800 1.00 15.33 C ATOM 0 H PHE A 528 9.672 -1.665 -3.846 1.00 31.13 H new ATOM 0 HA PHE A 528 9.341 1.239 -3.664 1.00 53.24 H new ATOM 0 HB2 PHE A 528 9.627 -1.161 -1.795 1.00 4.53 H new ATOM 0 HB3 PHE A 528 9.674 0.475 -1.167 1.00 4.53 H new ATOM 0 HD1 PHE A 528 7.629 1.975 -2.165 1.00 60.21 H new ATOM 0 HD2 PHE A 528 7.594 -2.219 -1.648 1.00 40.43 H new ATOM 0 HE1 PHE A 528 5.131 2.007 -2.068 1.00 44.53 H new ATOM 0 HE2 PHE A 528 5.096 -2.186 -1.551 1.00 25.05 H new ATOM 0 HZ PHE A 528 3.896 -0.072 -1.754 1.00 15.33 H new ATOM 2047 N LYS A 529 12.054 0.736 -4.212 1.00 34.21 N ATOM 2048 CA LYS A 529 13.470 1.062 -4.174 1.00 53.52 C ATOM 2049 C LYS A 529 13.700 2.203 -3.182 1.00 31.13 C ATOM 2050 O LYS A 529 12.795 2.992 -2.916 1.00 4.25 O ATOM 2051 CB LYS A 529 13.990 1.357 -5.583 1.00 3.22 C ATOM 2052 CG LYS A 529 14.443 0.073 -6.281 1.00 1.21 C ATOM 2053 CD LYS A 529 14.247 0.172 -7.795 1.00 42.45 C ATOM 2054 CE LYS A 529 14.708 -1.107 -8.492 1.00 12.23 C ATOM 2055 NZ LYS A 529 16.173 -1.086 -8.701 1.00 74.34 N ATOM 0 H LYS A 529 11.687 0.538 -5.143 1.00 34.21 H new ATOM 0 HA LYS A 529 14.048 0.209 -3.818 1.00 53.52 H new ATOM 0 HB2 LYS A 529 13.207 1.837 -6.170 1.00 3.22 H new ATOM 0 HB3 LYS A 529 14.823 2.058 -5.528 1.00 3.22 H new ATOM 0 HG2 LYS A 529 15.493 -0.115 -6.058 1.00 1.21 H new ATOM 0 HG3 LYS A 529 13.878 -0.775 -5.893 1.00 1.21 H new ATOM 0 HD2 LYS A 529 13.196 0.353 -8.018 1.00 42.45 H new ATOM 0 HD3 LYS A 529 14.806 1.023 -8.183 1.00 42.45 H new ATOM 0 HE2 LYS A 529 14.433 -1.974 -7.892 1.00 12.23 H new ATOM 0 HE3 LYS A 529 14.200 -1.209 -9.451 1.00 12.23 H new ATOM 0 HZ1 LYS A 529 16.469 -1.963 -9.176 1.00 74.34 H new ATOM 0 HZ2 LYS A 529 16.428 -0.269 -9.292 1.00 74.34 H new ATOM 0 HZ3 LYS A 529 16.654 -1.011 -7.782 1.00 74.34 H new ATOM 2064 N PRO A 530 14.949 2.256 -2.646 1.00 31.35 N ATOM 2065 CA PRO A 530 15.310 3.288 -1.689 1.00 2.13 C ATOM 2066 C PRO A 530 15.514 4.635 -2.384 1.00 15.43 C ATOM 2067 O PRO A 530 14.874 5.625 -2.030 1.00 22.43 O ATOM 2068 CB PRO A 530 16.569 2.772 -1.012 1.00 63.43 C ATOM 2069 CG PRO A 530 17.127 1.699 -1.931 1.00 34.44 C ATOM 2070 CD PRO A 530 16.047 1.338 -2.938 1.00 52.55 C ATOM 0 HA PRO A 530 14.526 3.474 -0.955 1.00 2.13 H new ATOM 0 HB2 PRO A 530 17.291 3.575 -0.866 1.00 63.43 H new ATOM 0 HB3 PRO A 530 16.343 2.364 -0.027 1.00 63.43 H new ATOM 0 HG2 PRO A 530 18.019 2.061 -2.442 1.00 34.44 H new ATOM 0 HG3 PRO A 530 17.422 0.821 -1.357 1.00 34.44 H new ATOM 0 HD2 PRO A 530 16.403 1.458 -3.961 1.00 52.55 H new ATOM 0 HD3 PRO A 530 15.735 0.299 -2.829 1.00 52.55 H new ATOM 2075 N HIS A 531 16.407 4.631 -3.364 1.00 10.45 N ATOM 2076 CA HIS A 531 16.701 5.840 -4.114 1.00 24.11 C ATOM 2077 C HIS A 531 15.425 6.353 -4.784 1.00 23.14 C ATOM 2078 O HIS A 531 15.368 7.501 -5.221 1.00 54.11 O ATOM 2079 CB HIS A 531 17.838 5.598 -5.108 1.00 11.02 C ATOM 2080 CG HIS A 531 17.802 4.238 -5.764 1.00 53.12 C ATOM 2081 ND1 HIS A 531 16.623 3.554 -6.005 1.00 34.24 N ATOM 2082 CD2 HIS A 531 18.809 3.445 -6.227 1.00 64.41 C ATOM 2083 CE1 HIS A 531 16.921 2.401 -6.587 1.00 52.24 C ATOM 2084 NE2 HIS A 531 18.276 2.335 -6.722 1.00 72.24 N ATOM 0 H HIS A 531 16.936 3.809 -3.655 1.00 10.45 H new ATOM 0 HA HIS A 531 17.049 6.618 -3.435 1.00 24.11 H new ATOM 0 HB2 HIS A 531 17.799 6.364 -5.882 1.00 11.02 H new ATOM 0 HB3 HIS A 531 18.790 5.715 -4.591 1.00 11.02 H new ATOM 0 HD2 HIS A 531 19.863 3.680 -6.196 1.00 64.41 H new ATOM 0 HE1 HIS A 531 16.214 1.646 -6.899 1.00 52.24 H new ATOM 0 HE2 HIS A 531 18.795 1.560 -7.135 1.00 72.24 H new ATOM 2091 N ARG A 532 14.432 5.477 -4.843 1.00 34.44 N ATOM 2092 CA ARG A 532 13.161 5.826 -5.453 1.00 64.43 C ATOM 2093 C ARG A 532 12.204 6.387 -4.399 1.00 72.31 C ATOM 2094 O ARG A 532 11.512 7.373 -4.646 1.00 11.21 O ATOM 2095 CB ARG A 532 12.518 4.610 -6.121 1.00 12.24 C ATOM 2096 CG ARG A 532 12.924 4.514 -7.592 1.00 70.51 C ATOM 2097 CD ARG A 532 14.442 4.389 -7.735 1.00 32.44 C ATOM 2098 NE ARG A 532 14.841 4.625 -9.140 1.00 75.11 N ATOM 2099 CZ ARG A 532 14.581 3.773 -10.154 1.00 25.41 C ATOM 2100 NH1 ARG A 532 13.922 2.617 -9.926 1.00 62.23 N ATOM 2101 NH2 ARG A 532 14.984 4.084 -11.372 1.00 52.20 N ATOM 0 H ARG A 532 14.483 4.526 -4.478 1.00 34.44 H new ATOM 0 HA ARG A 532 13.354 6.583 -6.213 1.00 64.43 H new ATOM 0 HB2 ARG A 532 12.818 3.702 -5.597 1.00 12.24 H new ATOM 0 HB3 ARG A 532 11.433 4.679 -6.043 1.00 12.24 H new ATOM 0 HG2 ARG A 532 12.440 3.652 -8.051 1.00 70.51 H new ATOM 0 HG3 ARG A 532 12.576 5.398 -8.127 1.00 70.51 H new ATOM 0 HD2 ARG A 532 14.937 5.108 -7.082 1.00 32.44 H new ATOM 0 HD3 ARG A 532 14.764 3.397 -7.419 1.00 32.44 H new ATOM 0 HE ARG A 532 15.344 5.486 -9.356 1.00 75.11 H new ATOM 0 HH11 ARG A 532 13.616 2.382 -8.982 1.00 62.23 H new ATOM 0 HH12 ARG A 532 13.730 1.979 -10.698 1.00 62.23 H new ATOM 0 HH21 ARG A 532 15.484 4.958 -11.536 1.00 52.20 H new ATOM 0 HH22 ARG A 532 14.795 3.451 -12.149 1.00 52.20 H new ATOM 2111 N LEU A 533 12.196 5.734 -3.246 1.00 44.23 N ATOM 2112 CA LEU A 533 11.335 6.154 -2.153 1.00 33.34 C ATOM 2113 C LEU A 533 11.594 7.629 -1.844 1.00 62.34 C ATOM 2114 O LEU A 533 10.657 8.413 -1.704 1.00 55.01 O ATOM 2115 CB LEU A 533 11.512 5.232 -0.946 1.00 62.53 C ATOM 2116 CG LEU A 533 10.524 4.068 -0.840 1.00 23.32 C ATOM 2117 CD1 LEU A 533 9.341 4.433 0.058 1.00 13.05 C ATOM 2118 CD2 LEU A 533 10.072 3.604 -2.226 1.00 74.23 C ATOM 0 H LEU A 533 12.772 4.917 -3.045 1.00 44.23 H new ATOM 0 HA LEU A 533 10.287 6.067 -2.439 1.00 33.34 H new ATOM 0 HB2 LEU A 533 12.522 4.824 -0.971 1.00 62.53 H new ATOM 0 HB3 LEU A 533 11.433 5.833 -0.040 1.00 62.53 H new ATOM 0 HG LEU A 533 11.035 3.227 -0.371 1.00 23.32 H new ATOM 0 HD11 LEU A 533 8.654 3.589 0.116 1.00 13.05 H new ATOM 0 HD12 LEU A 533 9.704 4.675 1.057 1.00 13.05 H new ATOM 0 HD13 LEU A 533 8.821 5.296 -0.358 1.00 13.05 H new ATOM 0 HD21 LEU A 533 9.371 2.776 -2.122 1.00 74.23 H new ATOM 0 HD22 LEU A 533 9.585 4.429 -2.745 1.00 74.23 H new ATOM 0 HD23 LEU A 533 10.938 3.275 -2.800 1.00 74.23 H new ATOM 2129 N GLN A 534 12.872 7.965 -1.745 1.00 35.01 N ATOM 2130 CA GLN A 534 13.268 9.332 -1.455 1.00 54.31 C ATOM 2131 C GLN A 534 13.054 10.219 -2.684 1.00 42.31 C ATOM 2132 O GLN A 534 12.524 11.324 -2.571 1.00 31.45 O ATOM 2133 CB GLN A 534 14.720 9.394 -0.982 1.00 62.55 C ATOM 2134 CG GLN A 534 14.986 8.355 0.108 1.00 25.42 C ATOM 2135 CD GLN A 534 16.464 7.955 0.136 1.00 2.22 C ATOM 2136 OE1 GLN A 534 17.131 8.015 1.156 1.00 64.23 O ATOM 2137 NE2 GLN A 534 16.936 7.544 -1.037 1.00 13.14 N ATOM 0 H GLN A 534 13.647 7.313 -1.861 1.00 35.01 H new ATOM 0 HA GLN A 534 12.641 9.707 -0.646 1.00 54.31 H new ATOM 0 HB2 GLN A 534 15.389 9.221 -1.825 1.00 62.55 H new ATOM 0 HB3 GLN A 534 14.940 10.391 -0.600 1.00 62.55 H new ATOM 0 HG2 GLN A 534 14.696 8.758 1.078 1.00 25.42 H new ATOM 0 HG3 GLN A 534 14.370 7.473 -0.067 1.00 25.42 H new ATOM 0 HE21 GLN A 534 16.324 7.518 -1.852 1.00 13.14 H new ATOM 0 HE22 GLN A 534 17.910 7.255 -1.122 1.00 13.14 H new ATOM 2144 N ALA A 535 13.475 9.702 -3.828 1.00 61.32 N ATOM 2145 CA ALA A 535 13.337 10.433 -5.077 1.00 2.53 C ATOM 2146 C ALA A 535 11.852 10.558 -5.426 1.00 35.04 C ATOM 2147 O ALA A 535 11.487 11.296 -6.341 1.00 44.12 O ATOM 2148 CB ALA A 535 14.137 9.727 -6.173 1.00 54.51 C ATOM 0 H ALA A 535 13.912 8.785 -3.917 1.00 61.32 H new ATOM 0 HA ALA A 535 13.739 11.441 -4.979 1.00 2.53 H new ATOM 0 HB1 ALA A 535 14.033 10.275 -7.109 1.00 54.51 H new ATOM 0 HB2 ALA A 535 15.189 9.689 -5.889 1.00 54.51 H new ATOM 0 HB3 ALA A 535 13.760 8.713 -6.303 1.00 54.51 H new ATOM 2154 N ARG A 536 11.038 9.826 -4.682 1.00 43.22 N ATOM 2155 CA ARG A 536 9.601 9.846 -4.902 1.00 62.14 C ATOM 2156 C ARG A 536 9.070 11.277 -4.806 1.00 44.53 C ATOM 2157 O ARG A 536 8.323 11.725 -5.675 1.00 25.12 O ATOM 2158 CB ARG A 536 8.875 8.970 -3.878 1.00 0.24 C ATOM 2159 CG ARG A 536 7.403 8.793 -4.255 1.00 32.44 C ATOM 2160 CD ARG A 536 7.255 7.861 -5.461 1.00 55.23 C ATOM 2161 NE ARG A 536 5.878 7.942 -5.996 1.00 13.14 N ATOM 2162 CZ ARG A 536 5.488 7.401 -7.169 1.00 12.25 C ATOM 2163 NH1 ARG A 536 6.372 6.733 -7.943 1.00 43.15 N ATOM 2164 NH2 ARG A 536 4.231 7.532 -7.551 1.00 42.33 N ATOM 0 H ARG A 536 11.345 9.215 -3.926 1.00 43.22 H new ATOM 0 HA ARG A 536 9.412 9.451 -5.900 1.00 62.14 H new ATOM 0 HB2 ARG A 536 9.359 7.995 -3.820 1.00 0.24 H new ATOM 0 HB3 ARG A 536 8.949 9.422 -2.889 1.00 0.24 H new ATOM 0 HG2 ARG A 536 6.853 8.386 -3.407 1.00 32.44 H new ATOM 0 HG3 ARG A 536 6.963 9.764 -4.484 1.00 32.44 H new ATOM 0 HD2 ARG A 536 7.972 8.137 -6.235 1.00 55.23 H new ATOM 0 HD3 ARG A 536 7.481 6.836 -5.169 1.00 55.23 H new ATOM 0 HE ARG A 536 5.179 8.438 -5.443 1.00 13.14 H new ATOM 0 HH11 ARG A 536 7.342 6.635 -7.642 1.00 43.15 H new ATOM 0 HH12 ARG A 536 6.070 6.327 -8.828 1.00 43.15 H new ATOM 0 HH21 ARG A 536 3.569 8.037 -6.962 1.00 42.33 H new ATOM 0 HH22 ARG A 536 3.922 7.128 -8.435 1.00 42.33 H new ATOM 2174 N LYS A 537 9.475 11.955 -3.742 1.00 53.03 N ATOM 2175 CA LYS A 537 9.049 13.327 -3.522 1.00 63.31 C ATOM 2176 C LYS A 537 10.165 14.279 -3.955 1.00 71.33 C ATOM 2177 O LYS A 537 9.984 15.496 -3.951 1.00 34.31 O ATOM 2178 CB LYS A 537 8.602 13.523 -2.072 1.00 5.14 C ATOM 2179 CG LYS A 537 7.997 12.236 -1.506 1.00 1.24 C ATOM 2180 CD LYS A 537 8.996 11.512 -0.600 1.00 50.10 C ATOM 2181 CE LYS A 537 8.828 11.943 0.857 1.00 43.14 C ATOM 2182 NZ LYS A 537 7.508 11.519 1.374 1.00 70.22 N ATOM 0 H LYS A 537 10.094 11.580 -3.023 1.00 53.03 H new ATOM 0 HA LYS A 537 8.177 13.558 -4.134 1.00 63.31 H new ATOM 0 HB2 LYS A 537 9.453 13.827 -1.463 1.00 5.14 H new ATOM 0 HB3 LYS A 537 7.869 14.328 -2.019 1.00 5.14 H new ATOM 0 HG2 LYS A 537 7.094 12.472 -0.943 1.00 1.24 H new ATOM 0 HG3 LYS A 537 7.700 11.579 -2.324 1.00 1.24 H new ATOM 0 HD2 LYS A 537 8.853 10.435 -0.683 1.00 50.10 H new ATOM 0 HD3 LYS A 537 10.013 11.725 -0.931 1.00 50.10 H new ATOM 0 HE2 LYS A 537 9.620 11.507 1.465 1.00 43.14 H new ATOM 0 HE3 LYS A 537 8.925 13.026 0.936 1.00 43.14 H new ATOM 0 HZ1 LYS A 537 7.022 12.335 1.797 1.00 70.22 H new ATOM 0 HZ2 LYS A 537 6.934 11.141 0.593 1.00 70.22 H new ATOM 0 HZ3 LYS A 537 7.638 10.782 2.096 1.00 70.22 H new ATOM 2191 N ALA A 538 11.295 13.689 -4.319 1.00 13.21 N ATOM 2192 CA ALA A 538 12.440 14.470 -4.754 1.00 70.35 C ATOM 2193 C ALA A 538 12.522 14.439 -6.281 1.00 52.05 C ATOM 2194 O ALA A 538 13.413 15.049 -6.871 1.00 41.13 O ATOM 2195 CB ALA A 538 13.709 13.930 -4.091 1.00 23.04 C ATOM 0 H ALA A 538 11.441 12.680 -4.321 1.00 13.21 H new ATOM 0 HA ALA A 538 12.332 15.511 -4.450 1.00 70.35 H new ATOM 0 HB1 ALA A 538 14.568 14.516 -4.418 1.00 23.04 H new ATOM 0 HB2 ALA A 538 13.612 14.001 -3.008 1.00 23.04 H new ATOM 0 HB3 ALA A 538 13.852 12.887 -4.375 1.00 23.04 H new ATOM 2201 N MET A 539 11.580 13.726 -6.879 1.00 41.20 N ATOM 2202 CA MET A 539 11.532 13.608 -8.325 1.00 71.54 C ATOM 2203 C MET A 539 11.289 14.969 -8.979 1.00 41.14 C ATOM 2204 O MET A 539 11.847 15.265 -10.035 1.00 44.24 O ATOM 2205 CB MET A 539 10.415 12.642 -8.724 1.00 51.34 C ATOM 2206 CG MET A 539 9.058 13.137 -8.218 1.00 4.25 C ATOM 2207 SD MET A 539 7.761 12.053 -8.794 1.00 41.34 S ATOM 2208 CE MET A 539 8.239 10.538 -7.981 1.00 14.03 C ATOM 0 H MET A 539 10.842 13.223 -6.386 1.00 41.20 H new ATOM 0 HA MET A 539 12.493 13.227 -8.670 1.00 71.54 H new ATOM 0 HB2 MET A 539 10.388 12.539 -9.809 1.00 51.34 H new ATOM 0 HB3 MET A 539 10.621 11.653 -8.315 1.00 51.34 H new ATOM 0 HG2 MET A 539 9.057 13.172 -7.129 1.00 4.25 H new ATOM 0 HG3 MET A 539 8.878 14.153 -8.570 1.00 4.25 H new ATOM 0 HE1 MET A 539 8.327 9.741 -8.719 1.00 14.03 H new ATOM 0 HE2 MET A 539 9.198 10.679 -7.483 1.00 14.03 H new ATOM 0 HE3 MET A 539 7.484 10.267 -7.243 1.00 14.03 H new ATOM 2216 N TRP A 540 10.456 15.764 -8.324 1.00 1.24 N ATOM 2217 CA TRP A 540 10.130 17.088 -8.828 1.00 64.33 C ATOM 2218 C TRP A 540 11.301 18.017 -8.501 1.00 50.12 C ATOM 2219 O TRP A 540 11.672 18.863 -9.314 1.00 44.43 O ATOM 2220 CB TRP A 540 8.799 17.579 -8.259 1.00 52.53 C ATOM 2221 CG TRP A 540 7.576 17.142 -9.070 1.00 72.23 C ATOM 2222 CD1 TRP A 540 6.589 16.318 -8.693 1.00 10.50 C ATOM 2223 CD2 TRP A 540 7.251 17.543 -10.417 1.00 2.52 C ATOM 2224 NE1 TRP A 540 5.653 16.159 -9.696 1.00 64.24 N ATOM 2225 CE2 TRP A 540 6.069 16.927 -10.777 1.00 32.40 C ATOM 2226 CE3 TRP A 540 7.932 18.396 -11.302 1.00 42.13 C ATOM 2227 CZ2 TRP A 540 5.465 17.100 -12.028 1.00 21.43 C ATOM 2228 CZ3 TRP A 540 7.316 18.558 -12.548 1.00 54.21 C ATOM 2229 CH2 TRP A 540 6.125 17.947 -12.928 1.00 23.53 C ATOM 0 H TRP A 540 9.996 15.517 -7.448 1.00 1.24 H new ATOM 0 HA TRP A 540 9.992 17.068 -9.909 1.00 64.33 H new ATOM 0 HB2 TRP A 540 8.695 17.212 -7.238 1.00 52.53 H new ATOM 0 HB3 TRP A 540 8.817 18.668 -8.207 1.00 52.53 H new ATOM 0 HD1 TRP A 540 6.533 15.839 -7.727 1.00 10.50 H new ATOM 0 HE1 TRP A 540 4.812 15.584 -9.652 1.00 64.24 H new ATOM 0 HE3 TRP A 540 8.858 18.888 -11.041 1.00 42.13 H new ATOM 0 HZ2 TRP A 540 4.539 16.607 -12.286 1.00 21.43 H new ATOM 0 HZ3 TRP A 540 7.800 19.204 -13.266 1.00 54.21 H new ATOM 0 HH2 TRP A 540 5.712 18.124 -13.910 1.00 23.53 H new ATOM 2239 N ARG A 541 11.849 17.830 -7.309 1.00 55.20 N ATOM 2240 CA ARG A 541 12.968 18.642 -6.865 1.00 62.34 C ATOM 2241 C ARG A 541 13.924 18.911 -8.029 1.00 63.41 C ATOM 2242 O ARG A 541 14.384 20.037 -8.212 1.00 71.02 O ATOM 2243 CB ARG A 541 13.734 17.953 -5.733 1.00 73.20 C ATOM 2244 CG ARG A 541 12.860 17.816 -4.484 1.00 34.24 C ATOM 2245 CD ARG A 541 12.699 19.162 -3.777 1.00 73.20 C ATOM 2246 NE ARG A 541 11.512 19.130 -2.893 1.00 53.40 N ATOM 2247 CZ ARG A 541 11.241 20.066 -1.958 1.00 12.31 C ATOM 2248 NH1 ARG A 541 12.069 21.117 -1.778 1.00 33.32 N ATOM 2249 NH2 ARG A 541 10.152 19.938 -1.222 1.00 34.21 N ATOM 0 H ARG A 541 11.538 17.128 -6.637 1.00 55.20 H new ATOM 0 HA ARG A 541 12.567 19.585 -6.495 1.00 62.34 H new ATOM 0 HB2 ARG A 541 14.064 16.967 -6.060 1.00 73.20 H new ATOM 0 HB3 ARG A 541 14.630 18.526 -5.494 1.00 73.20 H new ATOM 0 HG2 ARG A 541 11.880 17.428 -4.762 1.00 34.24 H new ATOM 0 HG3 ARG A 541 13.307 17.094 -3.801 1.00 34.24 H new ATOM 0 HD2 ARG A 541 13.592 19.385 -3.193 1.00 73.20 H new ATOM 0 HD3 ARG A 541 12.593 19.959 -4.513 1.00 73.20 H new ATOM 0 HE ARG A 541 10.859 18.353 -2.996 1.00 53.40 H new ATOM 0 HH11 ARG A 541 12.908 21.209 -2.351 1.00 33.32 H new ATOM 0 HH12 ARG A 541 11.856 21.819 -1.069 1.00 33.32 H new ATOM 0 HH21 ARG A 541 9.531 19.141 -1.364 1.00 34.21 H new ATOM 0 HH22 ARG A 541 9.932 20.636 -0.511 1.00 34.21 H new ATOM 2259 N LYS A 542 14.196 17.858 -8.785 1.00 11.43 N ATOM 2260 CA LYS A 542 15.089 17.965 -9.926 1.00 23.23 C ATOM 2261 C LYS A 542 14.636 19.124 -10.815 1.00 2.10 C ATOM 2262 O LYS A 542 15.343 20.123 -10.948 1.00 24.34 O ATOM 2263 CB LYS A 542 15.183 16.626 -10.661 1.00 23.21 C ATOM 2264 CG LYS A 542 16.414 15.837 -10.210 1.00 73.34 C ATOM 2265 CD LYS A 542 16.286 15.406 -8.749 1.00 1.43 C ATOM 2266 CE LYS A 542 17.412 15.997 -7.900 1.00 71.14 C ATOM 2267 NZ LYS A 542 16.898 17.092 -7.048 1.00 42.42 N ATOM 0 H LYS A 542 13.813 16.925 -8.630 1.00 11.43 H new ATOM 0 HA LYS A 542 16.103 18.193 -9.596 1.00 23.23 H new ATOM 0 HB2 LYS A 542 14.283 16.041 -10.474 1.00 23.21 H new ATOM 0 HB3 LYS A 542 15.232 16.800 -11.736 1.00 23.21 H new ATOM 0 HG2 LYS A 542 16.538 14.958 -10.842 1.00 73.34 H new ATOM 0 HG3 LYS A 542 17.308 16.448 -10.335 1.00 73.34 H new ATOM 0 HD2 LYS A 542 15.322 15.728 -8.355 1.00 1.43 H new ATOM 0 HD3 LYS A 542 16.310 14.318 -8.684 1.00 1.43 H new ATOM 0 HE2 LYS A 542 17.852 15.219 -7.276 1.00 71.14 H new ATOM 0 HE3 LYS A 542 18.204 16.373 -8.547 1.00 71.14 H new ATOM 0 HZ1 LYS A 542 17.679 17.494 -6.490 1.00 42.42 H new ATOM 0 HZ2 LYS A 542 16.484 17.834 -7.648 1.00 42.42 H new ATOM 0 HZ3 LYS A 542 16.170 16.719 -6.406 1.00 42.42 H new ATOM 2276 N GLU A 543 13.461 18.954 -11.401 1.00 33.02 N ATOM 2277 CA GLU A 543 12.905 19.974 -12.274 1.00 53.51 C ATOM 2278 C GLU A 543 12.807 21.310 -11.534 1.00 30.11 C ATOM 2279 O GLU A 543 12.864 22.372 -12.153 1.00 63.32 O ATOM 2280 CB GLU A 543 11.540 19.547 -12.817 1.00 61.32 C ATOM 2281 CG GLU A 543 11.692 18.721 -14.097 1.00 61.32 C ATOM 2282 CD GLU A 543 11.843 19.628 -15.320 1.00 42.40 C ATOM 2283 OE1 GLU A 543 11.571 20.836 -15.234 1.00 60.11 O ATOM 2284 OE2 GLU A 543 12.258 19.039 -16.389 1.00 33.04 O ATOM 0 H GLU A 543 12.878 18.125 -11.289 1.00 33.02 H new ATOM 0 HA GLU A 543 13.574 20.100 -13.125 1.00 53.51 H new ATOM 0 HB2 GLU A 543 11.012 18.963 -12.064 1.00 61.32 H new ATOM 0 HB3 GLU A 543 10.933 20.429 -13.019 1.00 61.32 H new ATOM 0 HG2 GLU A 543 12.562 18.070 -14.013 1.00 61.32 H new ATOM 0 HG3 GLU A 543 10.822 18.076 -14.223 1.00 61.32 H new ATOM 2290 N GLN A 544 12.662 21.213 -10.221 1.00 2.01 N ATOM 2291 CA GLN A 544 12.556 22.402 -9.390 1.00 2.24 C ATOM 2292 C GLN A 544 13.905 23.119 -9.315 1.00 3.23 C ATOM 2293 O GLN A 544 13.956 24.339 -9.176 1.00 43.14 O ATOM 2294 CB GLN A 544 12.042 22.049 -7.992 1.00 34.24 C ATOM 2295 CG GLN A 544 10.718 21.285 -8.072 1.00 21.42 C ATOM 2296 CD GLN A 544 9.529 22.227 -7.875 1.00 64.12 C ATOM 2297 OE1 GLN A 544 9.521 23.084 -7.007 1.00 3.31 O ATOM 2298 NE2 GLN A 544 8.530 22.022 -8.727 1.00 3.43 N ATOM 0 H GLN A 544 12.615 20.331 -9.711 1.00 2.01 H new ATOM 0 HA GLN A 544 11.833 23.078 -9.846 1.00 2.24 H new ATOM 0 HB2 GLN A 544 12.784 21.445 -7.470 1.00 34.24 H new ATOM 0 HB3 GLN A 544 11.906 22.960 -7.410 1.00 34.24 H new ATOM 0 HG2 GLN A 544 10.638 20.790 -9.040 1.00 21.42 H new ATOM 0 HG3 GLN A 544 10.698 20.504 -7.312 1.00 21.42 H new ATOM 0 HE21 GLN A 544 8.602 21.286 -9.430 1.00 3.43 H new ATOM 0 HE22 GLN A 544 7.691 22.600 -8.678 1.00 3.43 H new ATOM 2305 N ASP A 545 14.964 22.328 -9.408 1.00 41.21 N ATOM 2306 CA ASP A 545 16.311 22.873 -9.351 1.00 34.01 C ATOM 2307 C ASP A 545 16.591 23.662 -10.631 1.00 74.13 C ATOM 2308 O ASP A 545 17.570 24.403 -10.705 1.00 3.11 O ATOM 2309 CB ASP A 545 17.352 21.757 -9.247 1.00 22.04 C ATOM 2310 CG ASP A 545 18.728 22.201 -8.748 1.00 2.41 C ATOM 2311 OD1 ASP A 545 18.876 22.660 -7.605 1.00 72.32 O ATOM 2312 OD2 ASP A 545 19.688 22.058 -9.597 1.00 35.50 O ATOM 0 H ASP A 545 14.917 21.315 -9.522 1.00 41.21 H new ATOM 0 HA ASP A 545 16.379 23.513 -8.472 1.00 34.01 H new ATOM 0 HB2 ASP A 545 16.971 20.986 -8.577 1.00 22.04 H new ATOM 0 HB3 ASP A 545 17.469 21.297 -10.228 1.00 22.04 H new TER 2317 ASP A 545