USER MOD reduce.3.24.130724 H: found=0, std=0, add=1256, rem=0, adj=40 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 :FLIP amide:sc= 0.763 F(o=-7.3,f=-6.4) USER MOD Set 1.2: A 475 SER OG : rot -138:sc= 0.866 USER MOD Set 1.3: A 476 ASN : amide:sc= -3.88 K(o=-6.4,f=-8.2!) USER MOD Set 1.4: A 480 GLN :FLIP amide:sc= -4.18 F(o=-8.2!,f=-6.4) USER MOD Set 2.1: A 401 HIS : no HD1:sc= -13.4! C(o=-13!,f=-14!) USER MOD Set 2.2: A 426 THR OG1 : rot -8:sc= 0.687! USER MOD Single : A 386 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 388 SER OG : rot 42:sc= 0.886 USER MOD Single : A 389 SER OG : rot 49:sc= -0.0973 USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD Single : A 392 GLN :FLIP amide:sc= -0.122 F(o=-0.69,f=-0.12) 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= -8.67! C(o=-8.7!,f=-9.1!) USER MOD Single : A 407 HIS : no HD1:sc= -1.54 X(o=-1.5,f=-1.6) USER MOD Single : A 415 LYS NZ :NH3+ 150:sc= -3.22! (180deg=-3.82!) USER MOD Single : A 428 CYS SG : rot -141:sc= -3.18 USER MOD Single : A 432 GLN : amide:sc= -0.0136 X(o=-0.014,f=-0.17) USER MOD Single : A 434 HIS :FLIP no HE2:sc= -4.74! C(o=-8.3!,f=-4.7!) USER MOD Single : A 440 SER OG : rot -73:sc= -0.153 USER MOD Single : A 441 CYS SG : rot 38:sc= 0.7 USER MOD Single : A 448 HIS : no HD1:sc= -1.81 K(o=-1.8,f=-3!) USER MOD Single : A 449 SER OG : rot -130:sc= -5.83! USER MOD Single : A 457 THR OG1 : rot 170:sc= -1.21 USER MOD Single : A 458 SER OG : rot -133:sc= -2.99! USER MOD Single : A 459 ASN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 462 CYS SG : rot 110:sc= -2.71 USER MOD Single : A 465 SER OG : rot -56:sc= -3.16! USER MOD Single : A 467 HIS : no HD1:sc= -0.0882 X(o=-0.088,f=-0.2) USER MOD Single : A 468 GLN :FLIP amide:sc= -3.71! C(o=-5.1!,f=-3.7!) USER MOD Single : A 470 ASN :FLIP amide:sc= -2.72 F(o=-6!,f=-2.7) USER MOD Single : A 471 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.035) USER MOD Single : A 473 MET CE :methyl -157:sc= -8.08! (180deg=-9.63!) USER MOD Single : A 474 MET CE :methyl 169:sc= -0.619 (180deg=-0.922) USER MOD Single : A 478 THR OG1 : rot -24:sc= 0.0948 USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 485 CYS SG : rot -23:sc= -3.04! USER MOD Single : A 494 SER OG : rot 70:sc= -0.659 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 498 GLN : amide:sc= -0.577 K(o=-0.58,f=-3!) USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot -21:sc= 0.382 USER MOD Single : A 503 THR OG1 : rot -120:sc= 0.0114 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 29:sc= 0.558 USER MOD Single : A 516 HIS : no HD1:sc= -1.77 X(o=-1.8,f=-1.8!) USER MOD Single : A 517 SER OG : rot -30:sc= -1.38 USER MOD Single : A 518 GLN : amide:sc= -2.06 K(o=-2.1,f=-3.6!) USER MOD Single : A 523 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00193) USER MOD Single : A 526 ASN : amide:sc= -3.3! C(o=-3.3!,f=-4.3!) USER MOD Single : A 527 THR OG1 : rot 130:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HE2:sc= -5.62! C(o=-5.6!,f=-9.6!) USER MOD Single : A 534 GLN :FLIP amide:sc= -1.15 F(o=-2.5!,f=-1.1) USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 539 MET CE :methyl -162:sc= -1.87! (180deg=-2.28!) USER MOD Single : A 542 LYS NZ :NH3+ 137:sc= -0.92 (180deg=-2.91!) USER MOD Single : A 544 GLN : amide:sc= -0.0284 X(o=-0.028,f=-0.019) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 386 -7.544 17.527 11.718 1.00 11.00 N ATOM 2 CA MET A 386 -7.130 18.390 12.812 1.00 3.05 C ATOM 3 C MET A 386 -5.695 18.078 13.241 1.00 65.32 C ATOM 4 O MET A 386 -5.298 16.914 13.298 1.00 50.34 O ATOM 5 CB MET A 386 -8.072 18.195 14.001 1.00 13.30 C ATOM 6 CG MET A 386 -9.516 18.006 13.530 1.00 64.22 C ATOM 7 SD MET A 386 -10.647 18.608 14.774 1.00 13.25 S ATOM 8 CE MET A 386 -12.142 18.715 13.805 1.00 45.33 C ATOM 0 HA MET A 386 -7.172 19.424 12.471 1.00 3.05 H new ATOM 0 HB2 MET A 386 -7.758 17.327 14.580 1.00 13.30 H new ATOM 0 HB3 MET A 386 -8.012 19.059 14.663 1.00 13.30 H new ATOM 0 HG2 MET A 386 -9.675 18.540 12.593 1.00 64.22 H new ATOM 0 HG3 MET A 386 -9.708 16.951 13.332 1.00 64.22 H new ATOM 0 HE1 MET A 386 -12.957 19.078 14.432 1.00 45.33 H new ATOM 0 HE2 MET A 386 -11.989 19.404 12.974 1.00 45.33 H new ATOM 0 HE3 MET A 386 -12.395 17.729 13.416 1.00 45.33 H new ATOM 16 N GLU A 387 -4.954 19.137 13.533 1.00 42.33 N ATOM 17 CA GLU A 387 -3.572 18.992 13.956 1.00 2.15 C ATOM 18 C GLU A 387 -3.032 20.326 14.472 1.00 63.42 C ATOM 19 O GLU A 387 -3.237 21.367 13.849 1.00 65.24 O ATOM 20 CB GLU A 387 -2.704 18.452 12.817 1.00 52.15 C ATOM 21 CG GLU A 387 -3.159 19.014 11.468 1.00 22.11 C ATOM 22 CD GLU A 387 -2.026 18.961 10.442 1.00 54.31 C ATOM 23 OE1 GLU A 387 -1.503 17.875 10.151 1.00 71.15 O ATOM 24 OE2 GLU A 387 -1.693 20.102 9.939 1.00 24.10 O ATOM 0 H GLU A 387 -5.286 20.100 13.485 1.00 42.33 H new ATOM 0 HA GLU A 387 -3.536 18.269 14.771 1.00 2.15 H new ATOM 0 HB2 GLU A 387 -1.661 18.717 12.992 1.00 52.15 H new ATOM 0 HB3 GLU A 387 -2.758 17.363 12.798 1.00 52.15 H new ATOM 0 HG2 GLU A 387 -4.013 18.444 11.102 1.00 22.11 H new ATOM 0 HG3 GLU A 387 -3.493 20.044 11.593 1.00 22.11 H new ATOM 30 N SER A 388 -2.352 20.253 15.607 1.00 64.22 N ATOM 31 CA SER A 388 -1.780 21.443 16.216 1.00 53.11 C ATOM 32 C SER A 388 -0.296 21.551 15.860 1.00 32.35 C ATOM 33 O SER A 388 0.544 20.894 16.474 1.00 4.55 O ATOM 34 CB SER A 388 -1.961 21.427 17.734 1.00 4.23 C ATOM 35 OG SER A 388 -1.298 20.321 18.340 1.00 11.44 O ATOM 0 H SER A 388 -2.184 19.388 16.121 1.00 64.22 H new ATOM 0 HA SER A 388 -2.306 22.314 15.824 1.00 53.11 H new ATOM 0 HB2 SER A 388 -1.575 22.356 18.155 1.00 4.23 H new ATOM 0 HB3 SER A 388 -3.024 21.387 17.972 1.00 4.23 H new ATOM 0 HG SER A 388 -0.417 20.202 17.928 1.00 11.44 H new ATOM 40 N SER A 389 -0.016 22.383 14.868 1.00 55.41 N ATOM 41 CA SER A 389 1.351 22.586 14.422 1.00 5.02 C ATOM 42 C SER A 389 2.091 21.248 14.382 1.00 33.43 C ATOM 43 O SER A 389 3.221 21.144 14.858 1.00 53.01 O ATOM 44 CB SER A 389 2.087 23.571 15.333 1.00 14.40 C ATOM 45 OG SER A 389 1.993 23.201 16.707 1.00 73.50 O ATOM 0 H SER A 389 -0.715 22.925 14.360 1.00 55.41 H new ATOM 0 HA SER A 389 1.324 23.011 13.419 1.00 5.02 H new ATOM 0 HB2 SER A 389 3.136 23.620 15.042 1.00 14.40 H new ATOM 0 HB3 SER A 389 1.672 24.570 15.197 1.00 14.40 H new ATOM 0 HG SER A 389 2.222 22.253 16.807 1.00 73.50 H new ATOM 50 N SER A 390 1.425 20.257 13.807 1.00 63.43 N ATOM 51 CA SER A 390 2.006 18.929 13.697 1.00 3.42 C ATOM 52 C SER A 390 3.121 18.931 12.650 1.00 75.21 C ATOM 53 O SER A 390 3.045 19.655 11.659 1.00 33.21 O ATOM 54 CB SER A 390 0.941 17.891 13.337 1.00 61.25 C ATOM 55 OG SER A 390 1.507 16.604 13.108 1.00 62.11 O ATOM 0 H SER A 390 0.489 20.347 13.412 1.00 63.43 H new ATOM 0 HA SER A 390 2.427 18.658 14.665 1.00 3.42 H new ATOM 0 HB2 SER A 390 0.210 17.827 14.143 1.00 61.25 H new ATOM 0 HB3 SER A 390 0.405 18.215 12.445 1.00 61.25 H new ATOM 0 HG SER A 390 0.795 15.969 12.883 1.00 62.11 H new ATOM 60 N GLU A 391 4.131 18.112 12.906 1.00 43.51 N ATOM 61 CA GLU A 391 5.260 18.009 11.998 1.00 74.10 C ATOM 62 C GLU A 391 4.801 17.476 10.639 1.00 71.54 C ATOM 63 O GLU A 391 3.615 17.232 10.432 1.00 50.32 O ATOM 64 CB GLU A 391 6.362 17.128 12.590 1.00 12.14 C ATOM 65 CG GLU A 391 6.022 15.644 12.429 1.00 12.24 C ATOM 66 CD GLU A 391 6.624 14.818 13.567 1.00 11.34 C ATOM 67 OE1 GLU A 391 7.773 14.365 13.464 1.00 73.30 O ATOM 68 OE2 GLU A 391 5.853 14.653 14.588 1.00 22.13 O ATOM 0 H GLU A 391 4.190 17.514 13.730 1.00 43.51 H new ATOM 0 HA GLU A 391 5.677 19.006 11.853 1.00 74.10 H new ATOM 0 HB2 GLU A 391 7.310 17.344 12.096 1.00 12.14 H new ATOM 0 HB3 GLU A 391 6.492 17.363 13.646 1.00 12.14 H new ATOM 0 HG2 GLU A 391 4.940 15.515 12.414 1.00 12.24 H new ATOM 0 HG3 GLU A 391 6.400 15.282 11.473 1.00 12.24 H new ATOM 74 N GLN A 392 5.768 17.312 9.747 1.00 30.04 N ATOM 75 CA GLN A 392 5.479 16.812 8.413 1.00 45.44 C ATOM 76 C GLN A 392 5.410 15.284 8.423 1.00 34.30 C ATOM 77 O GLN A 392 6.410 14.616 8.683 1.00 70.31 O ATOM 78 CB GLN A 392 6.516 17.308 7.406 1.00 34.34 C ATOM 79 CG GLN A 392 5.985 17.203 5.974 1.00 71.00 C ATOM 80 CD GLN A 392 5.073 18.388 5.640 1.00 72.51 C ATOM 81 OE1 GLN A 392 5.680 19.569 5.698 1.00 54.41 O flip ATOM 82 NE2 GLN A 392 3.900 18.236 5.349 1.00 42.23 N flip ATOM 0 H GLN A 392 6.752 17.516 9.922 1.00 30.04 H new ATOM 0 HA GLN A 392 4.508 17.198 8.103 1.00 45.44 H new ATOM 0 HB2 GLN A 392 6.776 18.343 7.626 1.00 34.34 H new ATOM 0 HB3 GLN A 392 7.430 16.723 7.502 1.00 34.34 H new ATOM 0 HG2 GLN A 392 6.820 17.173 5.274 1.00 71.00 H new ATOM 0 HG3 GLN A 392 5.434 16.270 5.854 1.00 71.00 H new ATOM 0 HE21 GLN A 392 3.498 17.299 5.324 1.00 42.23 H new ATOM 0 HE22 GLN A 392 3.320 19.046 5.131 1.00 42.23 H new ATOM 89 N LYS A 393 4.221 14.774 8.136 1.00 54.25 N ATOM 90 CA LYS A 393 4.010 13.337 8.108 1.00 11.13 C ATOM 91 C LYS A 393 3.615 12.912 6.693 1.00 55.31 C ATOM 92 O LYS A 393 2.779 13.553 6.057 1.00 45.33 O ATOM 93 CB LYS A 393 2.998 12.924 9.179 1.00 12.15 C ATOM 94 CG LYS A 393 2.886 11.400 9.268 1.00 45.15 C ATOM 95 CD LYS A 393 4.087 10.806 10.007 1.00 33.14 C ATOM 96 CE LYS A 393 3.969 11.029 11.516 1.00 1.43 C ATOM 97 NZ LYS A 393 4.803 10.052 12.251 1.00 12.54 N ATOM 0 H LYS A 393 3.394 15.331 7.921 1.00 54.25 H new ATOM 0 HA LYS A 393 4.933 12.811 8.354 1.00 11.13 H new ATOM 0 HB2 LYS A 393 3.301 13.327 10.145 1.00 12.15 H new ATOM 0 HB3 LYS A 393 2.022 13.351 8.947 1.00 12.15 H new ATOM 0 HG2 LYS A 393 1.965 11.129 9.785 1.00 45.15 H new ATOM 0 HG3 LYS A 393 2.825 10.977 8.265 1.00 45.15 H new ATOM 0 HD2 LYS A 393 4.155 9.738 9.798 1.00 33.14 H new ATOM 0 HD3 LYS A 393 5.006 11.262 9.639 1.00 33.14 H new ATOM 0 HE2 LYS A 393 4.281 12.043 11.765 1.00 1.43 H new ATOM 0 HE3 LYS A 393 2.928 10.932 11.824 1.00 1.43 H new ATOM 0 HZ1 LYS A 393 4.711 10.217 13.274 1.00 12.54 H new ATOM 0 HZ2 LYS A 393 4.487 9.087 12.027 1.00 12.54 H new ATOM 0 HZ3 LYS A 393 5.798 10.164 11.970 1.00 12.54 H new ATOM 106 N PHE A 394 4.235 11.833 6.238 1.00 24.11 N ATOM 107 CA PHE A 394 3.960 11.314 4.909 1.00 44.31 C ATOM 108 C PHE A 394 4.342 9.837 4.807 1.00 10.44 C ATOM 109 O PHE A 394 5.350 9.413 5.369 1.00 21.43 O ATOM 110 CB PHE A 394 4.814 12.121 3.929 1.00 31.42 C ATOM 111 CG PHE A 394 6.299 12.168 4.292 1.00 22.31 C ATOM 112 CD1 PHE A 394 6.757 13.111 5.159 1.00 60.30 C ATOM 113 CD2 PHE A 394 7.163 11.268 3.748 1.00 1.42 C ATOM 114 CE1 PHE A 394 8.135 13.156 5.498 1.00 30.42 C ATOM 115 CE2 PHE A 394 8.542 11.313 4.087 1.00 11.44 C ATOM 116 CZ PHE A 394 8.999 12.256 4.954 1.00 12.32 C ATOM 0 H PHE A 394 4.928 11.303 6.767 1.00 24.11 H new ATOM 0 HA PHE A 394 2.896 11.401 4.688 1.00 44.31 H new ATOM 0 HB2 PHE A 394 4.707 11.693 2.932 1.00 31.42 H new ATOM 0 HB3 PHE A 394 4.430 13.140 3.881 1.00 31.42 H new ATOM 0 HD1 PHE A 394 6.072 13.826 5.590 1.00 60.30 H new ATOM 0 HD2 PHE A 394 6.800 10.520 3.059 1.00 1.42 H new ATOM 0 HE1 PHE A 394 8.498 13.904 6.187 1.00 30.42 H new ATOM 0 HE2 PHE A 394 9.227 10.598 3.656 1.00 11.44 H new ATOM 0 HZ PHE A 394 10.047 12.291 5.211 1.00 12.32 H new ATOM 125 N TYR A 395 3.516 9.093 4.086 1.00 34.41 N ATOM 126 CA TYR A 395 3.757 7.671 3.902 1.00 15.41 C ATOM 127 C TYR A 395 4.350 7.389 2.521 1.00 3.12 C ATOM 128 O TYR A 395 4.382 8.270 1.663 1.00 1.14 O ATOM 129 CB TYR A 395 2.387 6.997 4.003 1.00 0.04 C ATOM 130 CG TYR A 395 1.486 7.576 5.097 1.00 32.45 C ATOM 131 CD1 TYR A 395 2.035 7.989 6.294 1.00 22.10 C ATOM 132 CD2 TYR A 395 0.127 7.684 4.886 1.00 10.44 C ATOM 133 CE1 TYR A 395 1.188 8.533 7.324 1.00 13.12 C ATOM 134 CE2 TYR A 395 -0.720 8.228 5.915 1.00 65.34 C ATOM 135 CZ TYR A 395 -0.147 8.626 7.084 1.00 0.33 C ATOM 136 OH TYR A 395 -0.947 9.140 8.056 1.00 62.13 O ATOM 0 H TYR A 395 2.679 9.448 3.622 1.00 34.41 H new ATOM 0 HA TYR A 395 4.462 7.301 4.646 1.00 15.41 H new ATOM 0 HB2 TYR A 395 1.878 7.086 3.043 1.00 0.04 H new ATOM 0 HB3 TYR A 395 2.530 5.933 4.190 1.00 0.04 H new ATOM 0 HD1 TYR A 395 3.099 7.904 6.458 1.00 22.10 H new ATOM 0 HD2 TYR A 395 -0.301 7.360 3.949 1.00 10.44 H new ATOM 0 HE1 TYR A 395 1.604 8.860 8.266 1.00 13.12 H new ATOM 0 HE2 TYR A 395 -1.785 8.318 5.763 1.00 65.34 H new ATOM 0 HH TYR A 395 -1.876 9.147 7.745 1.00 62.13 H new ATOM 145 N ASN A 396 4.807 6.158 2.349 1.00 53.01 N ATOM 146 CA ASN A 396 5.398 5.748 1.086 1.00 74.22 C ATOM 147 C ASN A 396 4.489 4.719 0.412 1.00 72.31 C ATOM 148 O ASN A 396 4.647 4.428 -0.773 1.00 24.21 O ATOM 149 CB ASN A 396 6.767 5.099 1.304 1.00 64.03 C ATOM 150 CG ASN A 396 7.874 6.155 1.348 1.00 12.42 C ATOM 151 OD1 ASN A 396 8.482 6.495 0.346 1.00 62.25 O ATOM 152 ND2 ASN A 396 8.099 6.653 2.559 1.00 51.32 N ATOM 0 H ASN A 396 4.780 5.430 3.063 1.00 53.01 H new ATOM 0 HA ASN A 396 5.514 6.636 0.464 1.00 74.22 H new ATOM 0 HB2 ASN A 396 6.761 4.534 2.236 1.00 64.03 H new ATOM 0 HB3 ASN A 396 6.969 4.389 0.502 1.00 64.03 H new ATOM 0 HD21 ASN A 396 8.817 7.365 2.692 1.00 51.32 H new ATOM 0 HD22 ASN A 396 7.553 6.324 3.355 1.00 51.32 H new ATOM 158 N PHE A 397 3.557 4.197 1.195 1.00 64.40 N ATOM 159 CA PHE A 397 2.622 3.206 0.689 1.00 72.12 C ATOM 160 C PHE A 397 1.433 3.039 1.638 1.00 35.44 C ATOM 161 O PHE A 397 1.553 3.279 2.837 1.00 21.21 O ATOM 162 CB PHE A 397 3.380 1.880 0.602 1.00 22.03 C ATOM 163 CG PHE A 397 4.019 1.440 1.922 1.00 51.31 C ATOM 164 CD1 PHE A 397 5.085 2.119 2.421 1.00 55.34 C ATOM 165 CD2 PHE A 397 3.519 0.369 2.595 1.00 13.12 C ATOM 166 CE1 PHE A 397 5.676 1.712 3.646 1.00 33.14 C ATOM 167 CE2 PHE A 397 4.110 -0.039 3.819 1.00 71.51 C ATOM 168 CZ PHE A 397 5.177 0.640 4.319 1.00 75.54 C ATOM 0 H PHE A 397 3.429 4.442 2.177 1.00 64.40 H new ATOM 0 HA PHE A 397 2.237 3.519 -0.281 1.00 72.12 H new ATOM 0 HB2 PHE A 397 2.694 1.103 0.265 1.00 22.03 H new ATOM 0 HB3 PHE A 397 4.159 1.968 -0.155 1.00 22.03 H new ATOM 0 HD1 PHE A 397 5.483 2.968 1.886 1.00 55.34 H new ATOM 0 HD2 PHE A 397 2.672 -0.171 2.198 1.00 13.12 H new ATOM 0 HE1 PHE A 397 6.522 2.253 4.044 1.00 33.14 H new ATOM 0 HE2 PHE A 397 3.712 -0.889 4.354 1.00 71.51 H new ATOM 0 HZ PHE A 397 5.628 0.328 5.250 1.00 75.54 H new ATOM 177 N VAL A 398 0.313 2.630 1.062 1.00 50.42 N ATOM 178 CA VAL A 398 -0.898 2.430 1.840 1.00 2.44 C ATOM 179 C VAL A 398 -1.198 0.932 1.931 1.00 23.34 C ATOM 180 O VAL A 398 -1.470 0.287 0.919 1.00 1.14 O ATOM 181 CB VAL A 398 -2.050 3.233 1.235 1.00 51.10 C ATOM 182 CG1 VAL A 398 -2.855 2.383 0.249 1.00 71.03 C ATOM 183 CG2 VAL A 398 -2.953 3.806 2.328 1.00 64.53 C ATOM 0 H VAL A 398 0.218 2.432 0.066 1.00 50.42 H new ATOM 0 HA VAL A 398 -0.763 2.799 2.857 1.00 2.44 H new ATOM 0 HB VAL A 398 -1.620 4.069 0.683 1.00 51.10 H new ATOM 0 HG11 VAL A 398 -3.668 2.979 -0.166 1.00 71.03 H new ATOM 0 HG12 VAL A 398 -2.204 2.046 -0.557 1.00 71.03 H new ATOM 0 HG13 VAL A 398 -3.268 1.518 0.767 1.00 71.03 H new ATOM 0 HG21 VAL A 398 -3.764 4.372 1.870 1.00 64.53 H new ATOM 0 HG22 VAL A 398 -3.369 2.991 2.921 1.00 64.53 H new ATOM 0 HG23 VAL A 398 -2.371 4.463 2.974 1.00 64.53 H new ATOM 193 N ILE A 399 -1.137 0.420 3.152 1.00 70.23 N ATOM 194 CA ILE A 399 -1.397 -0.989 3.388 1.00 12.23 C ATOM 195 C ILE A 399 -2.901 -1.200 3.578 1.00 53.35 C ATOM 196 O ILE A 399 -3.423 -1.019 4.675 1.00 43.23 O ATOM 197 CB ILE A 399 -0.553 -1.503 4.555 1.00 41.33 C ATOM 198 CG1 ILE A 399 0.937 -1.271 4.297 1.00 60.15 C ATOM 199 CG2 ILE A 399 -0.862 -2.973 4.851 1.00 15.31 C ATOM 200 CD1 ILE A 399 1.784 -1.811 5.451 1.00 1.04 C ATOM 0 H ILE A 399 -0.911 0.957 3.989 1.00 70.23 H new ATOM 0 HA ILE A 399 -1.097 -1.581 2.523 1.00 12.23 H new ATOM 0 HB ILE A 399 -0.819 -0.933 5.446 1.00 41.33 H new ATOM 0 HG12 ILE A 399 1.229 -1.759 3.367 1.00 60.15 H new ATOM 0 HG13 ILE A 399 1.126 -0.205 4.170 1.00 60.15 H new ATOM 0 HG21 ILE A 399 -0.248 -3.313 5.685 1.00 15.31 H new ATOM 0 HG22 ILE A 399 -1.916 -3.078 5.109 1.00 15.31 H new ATOM 0 HG23 ILE A 399 -0.642 -3.576 3.970 1.00 15.31 H new ATOM 0 HD11 ILE A 399 2.839 -1.633 5.242 1.00 1.04 H new ATOM 0 HD12 ILE A 399 1.506 -1.303 6.375 1.00 1.04 H new ATOM 0 HD13 ILE A 399 1.611 -2.882 5.559 1.00 1.04 H new ATOM 211 N LEU A 400 -3.556 -1.579 2.489 1.00 34.32 N ATOM 212 CA LEU A 400 -4.989 -1.816 2.522 1.00 51.41 C ATOM 213 C LEU A 400 -5.258 -3.209 3.094 1.00 63.12 C ATOM 214 O LEU A 400 -4.828 -4.211 2.525 1.00 61.13 O ATOM 215 CB LEU A 400 -5.600 -1.591 1.138 1.00 15.23 C ATOM 216 CG LEU A 400 -5.994 -0.150 0.804 1.00 63.55 C ATOM 217 CD1 LEU A 400 -5.928 0.100 -0.704 1.00 13.44 C ATOM 218 CD2 LEU A 400 -7.367 0.192 1.383 1.00 41.12 C ATOM 0 H LEU A 400 -3.120 -1.728 1.579 1.00 34.32 H new ATOM 0 HA LEU A 400 -5.479 -1.100 3.182 1.00 51.41 H new ATOM 0 HB2 LEU A 400 -4.888 -1.935 0.388 1.00 15.23 H new ATOM 0 HB3 LEU A 400 -6.486 -2.219 1.048 1.00 15.23 H new ATOM 0 HG LEU A 400 -5.273 0.519 1.273 1.00 63.55 H new ATOM 0 HD11 LEU A 400 -6.213 1.131 -0.915 1.00 13.44 H new ATOM 0 HD12 LEU A 400 -4.912 -0.076 -1.058 1.00 13.44 H new ATOM 0 HD13 LEU A 400 -6.612 -0.577 -1.215 1.00 13.44 H new ATOM 0 HD21 LEU A 400 -7.622 1.221 1.131 1.00 41.12 H new ATOM 0 HD22 LEU A 400 -8.116 -0.480 0.965 1.00 41.12 H new ATOM 0 HD23 LEU A 400 -7.343 0.079 2.467 1.00 41.12 H new ATOM 229 N HIS A 401 -5.968 -3.227 4.212 1.00 11.44 N ATOM 230 CA HIS A 401 -6.301 -4.482 4.867 1.00 62.30 C ATOM 231 C HIS A 401 -7.568 -4.303 5.704 1.00 64.10 C ATOM 232 O HIS A 401 -7.918 -3.185 6.077 1.00 62.34 O ATOM 233 CB HIS A 401 -5.115 -4.996 5.687 1.00 23.33 C ATOM 234 CG HIS A 401 -4.978 -4.345 7.043 1.00 5.24 C ATOM 235 ND1 HIS A 401 -5.749 -4.713 8.133 1.00 34.44 N ATOM 236 CD2 HIS A 401 -4.152 -3.350 7.473 1.00 43.02 C ATOM 237 CE1 HIS A 401 -5.395 -3.964 9.166 1.00 35.23 C ATOM 238 NE2 HIS A 401 -4.405 -3.120 8.756 1.00 42.43 N ATOM 0 H HIS A 401 -6.322 -2.394 4.681 1.00 11.44 H new ATOM 0 HA HIS A 401 -6.509 -5.245 4.117 1.00 62.30 H new ATOM 0 HB2 HIS A 401 -5.218 -6.073 5.821 1.00 23.33 H new ATOM 0 HB3 HIS A 401 -4.197 -4.832 5.122 1.00 23.33 H new ATOM 0 HD2 HIS A 401 -3.416 -2.836 6.872 1.00 43.02 H new ATOM 0 HE1 HIS A 401 -5.816 -4.013 10.159 1.00 35.23 H new ATOM 0 HE2 HIS A 401 -3.936 -2.427 9.339 1.00 42.43 H new ATOM 246 N ALA A 402 -8.221 -5.423 5.975 1.00 3.55 N ATOM 247 CA ALA A 402 -9.444 -5.405 6.762 1.00 70.10 C ATOM 248 C ALA A 402 -9.163 -4.750 8.116 1.00 34.35 C ATOM 249 O ALA A 402 -8.129 -4.109 8.298 1.00 0.32 O ATOM 250 CB ALA A 402 -9.982 -6.831 6.903 1.00 71.33 C ATOM 0 H ALA A 402 -7.927 -6.349 5.664 1.00 3.55 H new ATOM 0 HA ALA A 402 -10.213 -4.815 6.264 1.00 70.10 H new ATOM 0 HB1 ALA A 402 -10.899 -6.817 7.493 1.00 71.33 H new ATOM 0 HB2 ALA A 402 -10.192 -7.240 5.915 1.00 71.33 H new ATOM 0 HB3 ALA A 402 -9.239 -7.453 7.402 1.00 71.33 H new ATOM 256 N ARG A 403 -10.103 -4.936 9.032 1.00 55.24 N ATOM 257 CA ARG A 403 -9.970 -4.370 10.364 1.00 23.40 C ATOM 258 C ARG A 403 -9.485 -5.438 11.347 1.00 61.40 C ATOM 259 O ARG A 403 -9.147 -5.129 12.489 1.00 10.44 O ATOM 260 CB ARG A 403 -11.302 -3.801 10.857 1.00 71.10 C ATOM 261 CG ARG A 403 -11.204 -3.365 12.321 1.00 74.11 C ATOM 262 CD ARG A 403 -11.712 -4.463 13.256 1.00 14.44 C ATOM 263 NE ARG A 403 -10.941 -4.451 14.518 1.00 42.11 N ATOM 264 CZ ARG A 403 -11.388 -4.966 15.683 1.00 14.14 C ATOM 265 NH1 ARG A 403 -12.608 -5.540 15.755 1.00 54.32 N ATOM 266 NH2 ARG A 403 -10.613 -4.902 16.750 1.00 51.22 N ATOM 0 H ARG A 403 -10.958 -5.470 8.878 1.00 55.24 H new ATOM 0 HA ARG A 403 -9.241 -3.562 10.310 1.00 23.40 H new ATOM 0 HB2 ARG A 403 -11.589 -2.950 10.239 1.00 71.10 H new ATOM 0 HB3 ARG A 403 -12.085 -4.552 10.749 1.00 71.10 H new ATOM 0 HG2 ARG A 403 -10.169 -3.126 12.564 1.00 74.11 H new ATOM 0 HG3 ARG A 403 -11.785 -2.456 12.473 1.00 74.11 H new ATOM 0 HD2 ARG A 403 -12.771 -4.312 13.466 1.00 14.44 H new ATOM 0 HD3 ARG A 403 -11.619 -5.435 12.773 1.00 14.44 H new ATOM 0 HE ARG A 403 -10.013 -4.027 14.507 1.00 42.11 H new ATOM 0 HH11 ARG A 403 -13.199 -5.587 14.925 1.00 54.32 H new ATOM 0 HH12 ARG A 403 -12.938 -5.927 16.639 1.00 54.32 H new ATOM 0 HH21 ARG A 403 -9.692 -4.468 16.686 1.00 51.22 H new ATOM 0 HH22 ARG A 403 -10.935 -5.286 17.638 1.00 51.22 H new ATOM 276 N ALA A 404 -9.465 -6.673 10.868 1.00 62.22 N ATOM 277 CA ALA A 404 -9.026 -7.788 11.689 1.00 24.03 C ATOM 278 C ALA A 404 -7.653 -8.261 11.209 1.00 5.14 C ATOM 279 O ALA A 404 -7.223 -9.365 11.540 1.00 33.34 O ATOM 280 CB ALA A 404 -10.075 -8.901 11.642 1.00 2.23 C ATOM 0 H ALA A 404 -9.746 -6.926 9.921 1.00 62.22 H new ATOM 0 HA ALA A 404 -8.923 -7.480 12.730 1.00 24.03 H new ATOM 0 HB1 ALA A 404 -9.746 -9.738 12.258 1.00 2.23 H new ATOM 0 HB2 ALA A 404 -11.024 -8.523 12.021 1.00 2.23 H new ATOM 0 HB3 ALA A 404 -10.204 -9.237 10.613 1.00 2.23 H new ATOM 286 N ASP A 405 -7.003 -7.402 10.438 1.00 1.42 N ATOM 287 CA ASP A 405 -5.688 -7.719 9.910 1.00 72.34 C ATOM 288 C ASP A 405 -4.717 -6.588 10.259 1.00 60.41 C ATOM 289 O ASP A 405 -3.833 -6.258 9.469 1.00 34.01 O ATOM 290 CB ASP A 405 -5.723 -7.857 8.387 1.00 51.30 C ATOM 291 CG ASP A 405 -7.117 -8.069 7.790 1.00 1.23 C ATOM 292 OD1 ASP A 405 -8.041 -8.533 8.474 1.00 1.21 O ATOM 293 OD2 ASP A 405 -7.236 -7.731 6.551 1.00 51.05 O ATOM 0 H ASP A 405 -7.363 -6.487 10.167 1.00 1.42 H new ATOM 0 HA ASP A 405 -5.367 -8.663 10.350 1.00 72.34 H new ATOM 0 HB2 ASP A 405 -5.287 -6.961 7.946 1.00 51.30 H new ATOM 0 HB3 ASP A 405 -5.089 -8.695 8.098 1.00 51.30 H new ATOM 298 N GLU A 406 -4.915 -6.026 11.441 1.00 60.32 N ATOM 299 CA GLU A 406 -4.068 -4.940 11.904 1.00 63.25 C ATOM 300 C GLU A 406 -2.641 -5.440 12.137 1.00 51.03 C ATOM 301 O GLU A 406 -1.751 -5.190 11.325 1.00 11.20 O ATOM 302 CB GLU A 406 -4.639 -4.302 13.173 1.00 33.41 C ATOM 303 CG GLU A 406 -3.601 -3.405 13.851 1.00 43.21 C ATOM 304 CD GLU A 406 -4.216 -2.649 15.029 1.00 65.41 C ATOM 305 OE1 GLU A 406 -4.939 -3.246 15.841 1.00 14.34 O ATOM 306 OE2 GLU A 406 -3.918 -1.394 15.088 1.00 23.12 O ATOM 0 H GLU A 406 -5.650 -6.302 12.093 1.00 60.32 H new ATOM 0 HA GLU A 406 -4.041 -4.172 11.131 1.00 63.25 H new ATOM 0 HB2 GLU A 406 -5.524 -3.716 12.923 1.00 33.41 H new ATOM 0 HB3 GLU A 406 -4.958 -5.082 13.864 1.00 33.41 H new ATOM 0 HG2 GLU A 406 -2.764 -4.010 14.200 1.00 43.21 H new ATOM 0 HG3 GLU A 406 -3.201 -2.695 13.127 1.00 43.21 H new ATOM 312 N HIS A 407 -2.467 -6.138 13.250 1.00 34.40 N ATOM 313 CA HIS A 407 -1.163 -6.677 13.599 1.00 74.23 C ATOM 314 C HIS A 407 -0.458 -7.174 12.336 1.00 43.10 C ATOM 315 O HIS A 407 0.761 -7.059 12.214 1.00 1.30 O ATOM 316 CB HIS A 407 -1.292 -7.759 14.672 1.00 64.01 C ATOM 317 CG HIS A 407 -2.049 -8.985 14.219 1.00 64.22 C ATOM 318 ND1 HIS A 407 -3.315 -8.922 13.662 1.00 65.01 N ATOM 319 CD2 HIS A 407 -1.706 -10.305 14.246 1.00 72.33 C ATOM 320 CE1 HIS A 407 -3.705 -10.154 13.372 1.00 14.10 C ATOM 321 NE2 HIS A 407 -2.707 -11.010 13.736 1.00 73.33 N ATOM 0 H HIS A 407 -3.207 -6.343 13.922 1.00 34.40 H new ATOM 0 HA HIS A 407 -0.544 -5.891 14.032 1.00 74.23 H new ATOM 0 HB2 HIS A 407 -0.294 -8.058 14.993 1.00 64.01 H new ATOM 0 HB3 HIS A 407 -1.794 -7.336 15.542 1.00 64.01 H new ATOM 0 HD2 HIS A 407 -0.776 -10.708 14.620 1.00 72.33 H new ATOM 0 HE1 HIS A 407 -4.648 -10.432 12.925 1.00 14.10 H new ATOM 0 HE2 HIS A 407 -2.727 -12.025 13.633 1.00 73.33 H new ATOM 328 N ILE A 408 -1.255 -7.718 11.428 1.00 75.11 N ATOM 329 CA ILE A 408 -0.722 -8.235 10.178 1.00 42.33 C ATOM 330 C ILE A 408 0.007 -7.112 9.436 1.00 5.21 C ATOM 331 O ILE A 408 1.178 -7.253 9.087 1.00 3.42 O ATOM 332 CB ILE A 408 -1.831 -8.895 9.356 1.00 75.22 C ATOM 333 CG1 ILE A 408 -2.472 -10.051 10.127 1.00 51.24 C ATOM 334 CG2 ILE A 408 -1.308 -9.341 7.989 1.00 52.44 C ATOM 335 CD1 ILE A 408 -3.523 -10.762 9.276 1.00 30.04 C ATOM 0 H ILE A 408 -2.265 -7.812 11.532 1.00 75.11 H new ATOM 0 HA ILE A 408 0.011 -9.019 10.371 1.00 42.33 H new ATOM 0 HB ILE A 408 -2.611 -8.154 9.178 1.00 75.22 H new ATOM 0 HG12 ILE A 408 -1.703 -10.762 10.430 1.00 51.24 H new ATOM 0 HG13 ILE A 408 -2.933 -9.673 11.039 1.00 51.24 H new ATOM 0 HG21 ILE A 408 -2.116 -9.807 7.425 1.00 52.44 H new ATOM 0 HG22 ILE A 408 -0.936 -8.475 7.442 1.00 52.44 H new ATOM 0 HG23 ILE A 408 -0.500 -10.059 8.125 1.00 52.44 H new ATOM 0 HD11 ILE A 408 -3.962 -11.579 9.848 1.00 30.04 H new ATOM 0 HD12 ILE A 408 -4.303 -10.055 8.995 1.00 30.04 H new ATOM 0 HD13 ILE A 408 -3.054 -11.160 8.376 1.00 30.04 H new ATOM 346 N ALA A 409 -0.715 -6.023 9.219 1.00 5.30 N ATOM 347 CA ALA A 409 -0.151 -4.877 8.526 1.00 32.34 C ATOM 348 C ALA A 409 0.969 -4.274 9.375 1.00 63.32 C ATOM 349 O ALA A 409 2.050 -3.981 8.865 1.00 72.13 O ATOM 350 CB ALA A 409 -1.261 -3.868 8.221 1.00 60.22 C ATOM 0 H ALA A 409 -1.686 -5.910 9.511 1.00 5.30 H new ATOM 0 HA ALA A 409 0.285 -5.180 7.574 1.00 32.34 H new ATOM 0 HB1 ALA A 409 -0.838 -3.008 7.701 1.00 60.22 H new ATOM 0 HB2 ALA A 409 -2.016 -4.338 7.591 1.00 60.22 H new ATOM 0 HB3 ALA A 409 -1.720 -3.539 9.153 1.00 60.22 H new ATOM 356 N LEU A 410 0.673 -4.106 10.656 1.00 41.34 N ATOM 357 CA LEU A 410 1.643 -3.542 11.580 1.00 5.15 C ATOM 358 C LEU A 410 2.915 -4.391 11.558 1.00 62.44 C ATOM 359 O LEU A 410 4.000 -3.898 11.861 1.00 45.14 O ATOM 360 CB LEU A 410 1.028 -3.392 12.973 1.00 63.43 C ATOM 361 CG LEU A 410 -0.268 -2.583 13.051 1.00 74.45 C ATOM 362 CD1 LEU A 410 -0.347 -1.798 14.362 1.00 24.12 C ATOM 363 CD2 LEU A 410 -0.421 -1.673 11.830 1.00 61.35 C ATOM 0 H LEU A 410 -0.224 -4.350 11.075 1.00 41.34 H new ATOM 0 HA LEU A 410 1.926 -2.536 11.270 1.00 5.15 H new ATOM 0 HB2 LEU A 410 0.836 -4.388 13.373 1.00 63.43 H new ATOM 0 HB3 LEU A 410 1.765 -2.924 13.625 1.00 63.43 H new ATOM 0 HG LEU A 410 -1.106 -3.280 13.041 1.00 74.45 H new ATOM 0 HD11 LEU A 410 -1.278 -1.232 14.392 1.00 24.12 H new ATOM 0 HD12 LEU A 410 -0.317 -2.491 15.203 1.00 24.12 H new ATOM 0 HD13 LEU A 410 0.497 -1.112 14.427 1.00 24.12 H new ATOM 0 HD21 LEU A 410 -1.350 -1.109 11.911 1.00 61.35 H new ATOM 0 HD22 LEU A 410 0.420 -0.981 11.784 1.00 61.35 H new ATOM 0 HD23 LEU A 410 -0.442 -2.279 10.925 1.00 61.35 H new ATOM 374 N ARG A 411 2.740 -5.653 11.195 1.00 24.43 N ATOM 375 CA ARG A 411 3.861 -6.575 11.128 1.00 31.25 C ATOM 376 C ARG A 411 4.626 -6.388 9.817 1.00 14.30 C ATOM 377 O ARG A 411 5.794 -6.760 9.716 1.00 21.22 O ATOM 378 CB ARG A 411 3.387 -8.026 11.231 1.00 24.35 C ATOM 379 CG ARG A 411 3.324 -8.481 12.691 1.00 73.34 C ATOM 380 CD ARG A 411 2.328 -9.628 12.866 1.00 13.11 C ATOM 381 NE ARG A 411 2.860 -10.861 12.242 1.00 54.04 N ATOM 382 CZ ARG A 411 3.727 -11.701 12.846 1.00 35.52 C ATOM 383 NH1 ARG A 411 4.169 -11.448 14.096 1.00 55.53 N ATOM 384 NH2 ARG A 411 4.137 -12.773 12.195 1.00 74.23 N ATOM 0 H ARG A 411 1.838 -6.059 10.944 1.00 24.43 H new ATOM 0 HA ARG A 411 4.519 -6.358 11.970 1.00 31.25 H new ATOM 0 HB2 ARG A 411 2.403 -8.124 10.773 1.00 24.35 H new ATOM 0 HB3 ARG A 411 4.064 -8.674 10.674 1.00 24.35 H new ATOM 0 HG2 ARG A 411 4.313 -8.801 13.019 1.00 73.34 H new ATOM 0 HG3 ARG A 411 3.034 -7.643 13.324 1.00 73.34 H new ATOM 0 HD2 ARG A 411 2.140 -9.799 13.926 1.00 13.11 H new ATOM 0 HD3 ARG A 411 1.373 -9.364 12.412 1.00 13.11 H new ATOM 0 HE ARG A 411 2.552 -11.090 11.297 1.00 54.04 H new ATOM 0 HH11 ARG A 411 3.848 -10.617 14.592 1.00 55.53 H new ATOM 0 HH12 ARG A 411 4.824 -12.088 14.545 1.00 55.53 H new ATOM 0 HH21 ARG A 411 3.799 -12.956 11.250 1.00 74.23 H new ATOM 0 HH22 ARG A 411 4.792 -13.418 12.636 1.00 74.23 H new ATOM 394 N VAL A 412 3.937 -5.809 8.843 1.00 44.10 N ATOM 395 CA VAL A 412 4.537 -5.568 7.543 1.00 74.41 C ATOM 396 C VAL A 412 5.320 -4.254 7.583 1.00 1.21 C ATOM 397 O VAL A 412 6.495 -4.217 7.224 1.00 72.35 O ATOM 398 CB VAL A 412 3.459 -5.588 6.458 1.00 52.42 C ATOM 399 CG1 VAL A 412 3.922 -4.832 5.211 1.00 63.11 C ATOM 400 CG2 VAL A 412 3.056 -7.023 6.111 1.00 71.33 C ATOM 0 H VAL A 412 2.969 -5.500 8.930 1.00 44.10 H new ATOM 0 HA VAL A 412 5.244 -6.360 7.296 1.00 74.41 H new ATOM 0 HB VAL A 412 2.579 -5.079 6.851 1.00 52.42 H new ATOM 0 HG11 VAL A 412 3.137 -4.862 4.455 1.00 63.11 H new ATOM 0 HG12 VAL A 412 4.135 -3.796 5.472 1.00 63.11 H new ATOM 0 HG13 VAL A 412 4.824 -5.300 4.816 1.00 63.11 H new ATOM 0 HG21 VAL A 412 2.288 -7.008 5.337 1.00 71.33 H new ATOM 0 HG22 VAL A 412 3.927 -7.568 5.748 1.00 71.33 H new ATOM 0 HG23 VAL A 412 2.665 -7.516 7.001 1.00 71.33 H new ATOM 410 N ARG A 413 4.636 -3.208 8.025 1.00 23.35 N ATOM 411 CA ARG A 413 5.254 -1.896 8.117 1.00 0.32 C ATOM 412 C ARG A 413 6.705 -2.023 8.584 1.00 35.11 C ATOM 413 O ARG A 413 7.613 -1.480 7.955 1.00 12.45 O ATOM 414 CB ARG A 413 4.489 -0.996 9.090 1.00 64.43 C ATOM 415 CG ARG A 413 2.980 -1.088 8.853 1.00 42.03 C ATOM 416 CD ARG A 413 2.293 0.239 9.177 1.00 54.31 C ATOM 417 NE ARG A 413 2.889 0.836 10.393 1.00 55.20 N ATOM 418 CZ ARG A 413 2.229 1.662 11.232 1.00 35.11 C ATOM 419 NH1 ARG A 413 0.944 1.999 10.993 1.00 4.03 N ATOM 420 NH2 ARG A 413 2.860 2.139 12.289 1.00 21.51 N ATOM 0 H ARG A 413 3.661 -3.243 8.323 1.00 23.35 H new ATOM 0 HA ARG A 413 5.227 -1.446 7.124 1.00 0.32 H new ATOM 0 HB2 ARG A 413 4.718 -1.286 10.115 1.00 64.43 H new ATOM 0 HB3 ARG A 413 4.817 0.037 8.970 1.00 64.43 H new ATOM 0 HG2 ARG A 413 2.787 -1.358 7.815 1.00 42.03 H new ATOM 0 HG3 ARG A 413 2.559 -1.880 9.472 1.00 42.03 H new ATOM 0 HD2 ARG A 413 2.397 0.926 8.337 1.00 54.31 H new ATOM 0 HD3 ARG A 413 1.226 0.078 9.327 1.00 54.31 H new ATOM 0 HE ARG A 413 3.859 0.609 10.611 1.00 55.20 H new ATOM 0 HH11 ARG A 413 0.464 1.629 10.173 1.00 4.03 H new ATOM 0 HH12 ARG A 413 0.453 2.624 11.633 1.00 4.03 H new ATOM 0 HH21 ARG A 413 3.832 1.882 12.462 1.00 21.51 H new ATOM 0 HH22 ARG A 413 2.376 2.764 12.933 1.00 21.51 H new ATOM 430 N GLU A 414 6.879 -2.743 9.683 1.00 71.01 N ATOM 431 CA GLU A 414 8.205 -2.949 10.240 1.00 52.32 C ATOM 432 C GLU A 414 9.050 -3.807 9.298 1.00 20.01 C ATOM 433 O GLU A 414 10.168 -3.433 8.944 1.00 41.51 O ATOM 434 CB GLU A 414 8.123 -3.580 11.631 1.00 43.30 C ATOM 435 CG GLU A 414 7.531 -2.598 12.646 1.00 75.21 C ATOM 436 CD GLU A 414 7.641 -3.146 14.069 1.00 3.04 C ATOM 437 OE1 GLU A 414 7.400 -4.343 14.292 1.00 53.52 O ATOM 438 OE2 GLU A 414 7.992 -2.284 14.961 1.00 53.15 O ATOM 0 H GLU A 414 6.124 -3.191 10.202 1.00 71.01 H new ATOM 0 HA GLU A 414 8.688 -1.978 10.345 1.00 52.32 H new ATOM 0 HB2 GLU A 414 7.509 -4.480 11.590 1.00 43.30 H new ATOM 0 HB3 GLU A 414 9.118 -3.887 11.954 1.00 43.30 H new ATOM 0 HG2 GLU A 414 8.052 -1.643 12.579 1.00 75.21 H new ATOM 0 HG3 GLU A 414 6.485 -2.408 12.406 1.00 75.21 H new ATOM 444 N LYS A 415 8.485 -4.944 8.918 1.00 14.13 N ATOM 445 CA LYS A 415 9.172 -5.859 8.022 1.00 31.32 C ATOM 446 C LYS A 415 9.686 -5.087 6.806 1.00 60.41 C ATOM 447 O LYS A 415 10.673 -5.483 6.187 1.00 53.41 O ATOM 448 CB LYS A 415 8.267 -7.039 7.664 1.00 24.44 C ATOM 449 CG LYS A 415 8.615 -8.272 8.501 1.00 70.34 C ATOM 450 CD LYS A 415 9.496 -9.241 7.709 1.00 32.02 C ATOM 451 CE LYS A 415 10.681 -8.512 7.075 1.00 74.53 C ATOM 452 NZ LYS A 415 11.664 -8.119 8.111 1.00 11.43 N ATOM 0 H LYS A 415 7.559 -5.252 9.214 1.00 14.13 H new ATOM 0 HA LYS A 415 10.042 -6.293 8.515 1.00 31.32 H new ATOM 0 HB2 LYS A 415 7.225 -6.766 7.829 1.00 24.44 H new ATOM 0 HB3 LYS A 415 8.371 -7.273 6.605 1.00 24.44 H new ATOM 0 HG2 LYS A 415 9.132 -7.965 9.410 1.00 70.34 H new ATOM 0 HG3 LYS A 415 7.700 -8.777 8.810 1.00 70.34 H new ATOM 0 HD2 LYS A 415 9.860 -10.029 8.368 1.00 32.02 H new ATOM 0 HD3 LYS A 415 8.904 -9.724 6.932 1.00 32.02 H new ATOM 0 HE2 LYS A 415 11.159 -9.156 6.337 1.00 74.53 H new ATOM 0 HE3 LYS A 415 10.329 -7.627 6.545 1.00 74.53 H new ATOM 0 HZ1 LYS A 415 12.618 -8.107 7.697 1.00 11.43 H new ATOM 0 HZ2 LYS A 415 11.430 -7.171 8.470 1.00 11.43 H new ATOM 0 HZ3 LYS A 415 11.635 -8.803 8.894 1.00 11.43 H new ATOM 461 N LEU A 416 8.995 -3.999 6.501 1.00 2.41 N ATOM 462 CA LEU A 416 9.370 -3.167 5.369 1.00 5.34 C ATOM 463 C LEU A 416 10.581 -2.314 5.748 1.00 23.40 C ATOM 464 O LEU A 416 11.432 -2.030 4.907 1.00 35.42 O ATOM 465 CB LEU A 416 8.169 -2.350 4.886 1.00 35.52 C ATOM 466 CG LEU A 416 6.999 -3.153 4.315 1.00 14.22 C ATOM 467 CD1 LEU A 416 5.744 -2.284 4.196 1.00 62.34 C ATOM 468 CD2 LEU A 416 7.376 -3.799 2.980 1.00 43.34 C ATOM 0 H LEU A 416 8.178 -3.674 7.017 1.00 2.41 H new ATOM 0 HA LEU A 416 9.668 -3.786 4.522 1.00 5.34 H new ATOM 0 HB2 LEU A 416 7.801 -1.753 5.721 1.00 35.52 H new ATOM 0 HB3 LEU A 416 8.513 -1.653 4.122 1.00 35.52 H new ATOM 0 HG LEU A 416 6.768 -3.960 5.010 1.00 14.22 H new ATOM 0 HD11 LEU A 416 4.927 -2.879 3.788 1.00 62.34 H new ATOM 0 HD12 LEU A 416 5.464 -1.912 5.182 1.00 62.34 H new ATOM 0 HD13 LEU A 416 5.946 -1.442 3.534 1.00 62.34 H new ATOM 0 HD21 LEU A 416 6.526 -4.364 2.596 1.00 43.34 H new ATOM 0 HD22 LEU A 416 7.649 -3.023 2.265 1.00 43.34 H new ATOM 0 HD23 LEU A 416 8.222 -4.471 3.127 1.00 43.34 H new ATOM 479 N GLU A 417 10.622 -1.929 7.016 1.00 10.54 N ATOM 480 CA GLU A 417 11.715 -1.114 7.515 1.00 21.32 C ATOM 481 C GLU A 417 12.968 -1.971 7.713 1.00 61.12 C ATOM 482 O GLU A 417 14.047 -1.445 7.987 1.00 14.11 O ATOM 483 CB GLU A 417 11.323 -0.408 8.815 1.00 34.21 C ATOM 484 CG GLU A 417 9.969 0.289 8.673 1.00 43.11 C ATOM 485 CD GLU A 417 9.939 1.596 9.468 1.00 2.14 C ATOM 486 OE1 GLU A 417 10.112 2.678 8.887 1.00 2.44 O ATOM 487 OE2 GLU A 417 9.726 1.460 10.733 1.00 70.35 O ATOM 0 H GLU A 417 9.915 -2.167 7.712 1.00 10.54 H new ATOM 0 HA GLU A 417 11.937 -0.345 6.775 1.00 21.32 H new ATOM 0 HB2 GLU A 417 11.279 -1.133 9.628 1.00 34.21 H new ATOM 0 HB3 GLU A 417 12.086 0.323 9.080 1.00 34.21 H new ATOM 0 HG2 GLU A 417 9.770 0.494 7.621 1.00 43.11 H new ATOM 0 HG3 GLU A 417 9.177 -0.372 9.024 1.00 43.11 H new ATOM 493 N ALA A 418 12.784 -3.274 7.566 1.00 30.34 N ATOM 494 CA ALA A 418 13.886 -4.208 7.726 1.00 0.32 C ATOM 495 C ALA A 418 14.560 -4.431 6.370 1.00 33.14 C ATOM 496 O ALA A 418 15.621 -5.047 6.294 1.00 13.21 O ATOM 497 CB ALA A 418 13.367 -5.510 8.338 1.00 63.30 C ATOM 0 H ALA A 418 11.889 -3.706 7.338 1.00 30.34 H new ATOM 0 HA ALA A 418 14.636 -3.804 8.406 1.00 0.32 H new ATOM 0 HB1 ALA A 418 14.193 -6.210 8.458 1.00 63.30 H new ATOM 0 HB2 ALA A 418 12.923 -5.303 9.312 1.00 63.30 H new ATOM 0 HB3 ALA A 418 12.614 -5.946 7.681 1.00 63.30 H new ATOM 503 N LEU A 419 13.916 -3.915 5.333 1.00 11.33 N ATOM 504 CA LEU A 419 14.439 -4.049 3.984 1.00 73.01 C ATOM 505 C LEU A 419 14.773 -2.663 3.431 1.00 72.23 C ATOM 506 O LEU A 419 15.833 -2.466 2.838 1.00 42.25 O ATOM 507 CB LEU A 419 13.467 -4.843 3.109 1.00 42.51 C ATOM 508 CG LEU A 419 12.766 -6.024 3.785 1.00 53.22 C ATOM 509 CD1 LEU A 419 11.362 -6.227 3.214 1.00 10.40 C ATOM 510 CD2 LEU A 419 13.614 -7.293 3.688 1.00 41.43 C ATOM 0 H LEU A 419 13.036 -3.403 5.400 1.00 11.33 H new ATOM 0 HA LEU A 419 15.366 -4.622 3.990 1.00 73.01 H new ATOM 0 HB2 LEU A 419 12.705 -4.159 2.735 1.00 42.51 H new ATOM 0 HB3 LEU A 419 14.012 -5.217 2.243 1.00 42.51 H new ATOM 0 HG LEU A 419 12.652 -5.794 4.844 1.00 53.22 H new ATOM 0 HD11 LEU A 419 10.886 -7.072 3.711 1.00 10.40 H new ATOM 0 HD12 LEU A 419 10.769 -5.328 3.379 1.00 10.40 H new ATOM 0 HD13 LEU A 419 11.429 -6.426 2.145 1.00 10.40 H new ATOM 0 HD21 LEU A 419 13.093 -8.117 4.176 1.00 41.43 H new ATOM 0 HD22 LEU A 419 13.781 -7.540 2.640 1.00 41.43 H new ATOM 0 HD23 LEU A 419 14.573 -7.128 4.179 1.00 41.43 H new ATOM 521 N GLY A 420 13.850 -1.737 3.645 1.00 55.40 N ATOM 522 CA GLY A 420 14.032 -0.374 3.174 1.00 22.21 C ATOM 523 C GLY A 420 12.802 0.481 3.482 1.00 53.10 C ATOM 524 O GLY A 420 12.819 1.290 4.409 1.00 33.11 O ATOM 0 H GLY A 420 12.973 -1.904 4.139 1.00 55.40 H new ATOM 0 HA2 GLY A 420 14.911 0.064 3.647 1.00 22.21 H new ATOM 0 HA3 GLY A 420 14.217 -0.378 2.100 1.00 22.21 H new ATOM 528 N VAL A 421 11.762 0.275 2.685 1.00 31.32 N ATOM 529 CA VAL A 421 10.527 1.017 2.861 1.00 72.34 C ATOM 530 C VAL A 421 10.225 1.152 4.354 1.00 53.43 C ATOM 531 O VAL A 421 10.391 0.198 5.113 1.00 52.33 O ATOM 532 CB VAL A 421 9.396 0.343 2.081 1.00 3.35 C ATOM 533 CG1 VAL A 421 9.583 -1.176 2.047 1.00 74.22 C ATOM 534 CG2 VAL A 421 8.031 0.715 2.664 1.00 32.42 C ATOM 0 H VAL A 421 11.751 -0.395 1.916 1.00 31.32 H new ATOM 0 HA VAL A 421 10.627 2.025 2.458 1.00 72.34 H new ATOM 0 HB VAL A 421 9.432 0.708 1.055 1.00 3.35 H new ATOM 0 HG11 VAL A 421 8.766 -1.631 1.487 1.00 74.22 H new ATOM 0 HG12 VAL A 421 10.531 -1.415 1.565 1.00 74.22 H new ATOM 0 HG13 VAL A 421 9.585 -1.565 3.065 1.00 74.22 H new ATOM 0 HG21 VAL A 421 7.245 0.223 2.092 1.00 32.42 H new ATOM 0 HG22 VAL A 421 7.979 0.392 3.704 1.00 32.42 H new ATOM 0 HG23 VAL A 421 7.896 1.795 2.612 1.00 32.42 H new ATOM 544 N PRO A 422 9.775 2.376 4.741 1.00 2.10 N ATOM 545 CA PRO A 422 9.448 2.648 6.131 1.00 63.32 C ATOM 546 C PRO A 422 8.120 1.998 6.520 1.00 33.10 C ATOM 547 O PRO A 422 7.602 1.152 5.792 1.00 23.31 O ATOM 548 CB PRO A 422 9.424 4.164 6.240 1.00 63.15 C ATOM 549 CG PRO A 422 9.276 4.681 4.818 1.00 64.33 C ATOM 550 CD PRO A 422 9.567 3.529 3.870 1.00 44.44 C ATOM 0 HA PRO A 422 10.174 2.224 6.825 1.00 63.32 H new ATOM 0 HB2 PRO A 422 8.596 4.498 6.865 1.00 63.15 H new ATOM 0 HB3 PRO A 422 10.340 4.537 6.698 1.00 63.15 H new ATOM 0 HG2 PRO A 422 8.269 5.065 4.654 1.00 64.33 H new ATOM 0 HG3 PRO A 422 9.965 5.506 4.638 1.00 64.33 H new ATOM 0 HD2 PRO A 422 8.737 3.362 3.183 1.00 44.44 H new ATOM 0 HD3 PRO A 422 10.449 3.730 3.262 1.00 44.44 H new ATOM 555 N ASP A 423 7.604 2.419 7.665 1.00 10.30 N ATOM 556 CA ASP A 423 6.345 1.889 8.159 1.00 14.23 C ATOM 557 C ASP A 423 5.244 2.159 7.130 1.00 71.10 C ATOM 558 O ASP A 423 4.437 1.280 6.835 1.00 25.13 O ATOM 559 CB ASP A 423 5.940 2.563 9.471 1.00 44.24 C ATOM 560 CG ASP A 423 6.131 4.081 9.505 1.00 71.11 C ATOM 561 OD1 ASP A 423 7.263 4.581 9.588 1.00 24.33 O ATOM 562 OD2 ASP A 423 5.041 4.769 9.441 1.00 2.01 O ATOM 0 H ASP A 423 8.035 3.122 8.265 1.00 10.30 H new ATOM 0 HA ASP A 423 6.473 0.820 8.327 1.00 14.23 H new ATOM 0 HB2 ASP A 423 4.892 2.339 9.668 1.00 44.24 H new ATOM 0 HB3 ASP A 423 6.518 2.121 10.282 1.00 44.24 H new ATOM 567 N GLY A 424 5.248 3.378 6.614 1.00 33.51 N ATOM 568 CA GLY A 424 4.261 3.775 5.624 1.00 43.35 C ATOM 569 C GLY A 424 2.911 4.066 6.282 1.00 40.13 C ATOM 570 O GLY A 424 2.661 5.186 6.724 1.00 42.54 O ATOM 0 H GLY A 424 5.919 4.105 6.862 1.00 33.51 H new ATOM 0 HA2 GLY A 424 4.609 4.661 5.093 1.00 43.35 H new ATOM 0 HA3 GLY A 424 4.145 2.984 4.883 1.00 43.35 H new ATOM 574 N ALA A 425 2.077 3.039 6.327 1.00 2.35 N ATOM 575 CA ALA A 425 0.759 3.171 6.925 1.00 32.44 C ATOM 576 C ALA A 425 -0.125 2.010 6.460 1.00 70.21 C ATOM 577 O ALA A 425 0.342 1.109 5.766 1.00 3.41 O ATOM 578 CB ALA A 425 0.168 4.535 6.563 1.00 4.44 C ATOM 0 H ALA A 425 2.288 2.111 5.959 1.00 2.35 H new ATOM 0 HA ALA A 425 0.824 3.122 8.012 1.00 32.44 H new ATOM 0 HB1 ALA A 425 -0.821 4.634 7.012 1.00 4.44 H new ATOM 0 HB2 ALA A 425 0.818 5.325 6.940 1.00 4.44 H new ATOM 0 HB3 ALA A 425 0.085 4.620 5.479 1.00 4.44 H new ATOM 584 N THR A 426 -1.386 2.072 6.861 1.00 42.23 N ATOM 585 CA THR A 426 -2.340 1.038 6.493 1.00 64.13 C ATOM 586 C THR A 426 -3.757 1.614 6.445 1.00 72.11 C ATOM 587 O THR A 426 -4.262 2.118 7.446 1.00 62.51 O ATOM 588 CB THR A 426 -2.187 -0.117 7.485 1.00 34.14 C ATOM 589 OG1 THR A 426 -2.974 0.278 8.604 1.00 55.45 O ATOM 590 CG2 THR A 426 -0.768 -0.225 8.045 1.00 13.01 C ATOM 0 H THR A 426 -1.770 2.821 7.437 1.00 42.23 H new ATOM 0 HA THR A 426 -2.144 0.655 5.491 1.00 64.13 H new ATOM 0 HB THR A 426 -2.455 -1.053 6.995 1.00 34.14 H new ATOM 0 HG1 THR A 426 -3.277 1.202 8.481 1.00 55.45 H new ATOM 0 HG21 THR A 426 -0.715 -1.060 8.743 1.00 13.01 H new ATOM 0 HG22 THR A 426 -0.066 -0.390 7.228 1.00 13.01 H new ATOM 0 HG23 THR A 426 -0.510 0.698 8.564 1.00 13.01 H new ATOM 598 N PHE A 427 -4.359 1.519 5.269 1.00 15.03 N ATOM 599 CA PHE A 427 -5.708 2.023 5.075 1.00 13.41 C ATOM 600 C PHE A 427 -6.744 0.926 5.325 1.00 50.22 C ATOM 601 O PHE A 427 -6.790 -0.066 4.599 1.00 21.03 O ATOM 602 CB PHE A 427 -5.809 2.482 3.619 1.00 13.44 C ATOM 603 CG PHE A 427 -7.150 3.127 3.261 1.00 2.13 C ATOM 604 CD1 PHE A 427 -7.976 3.571 4.246 1.00 24.21 C ATOM 605 CD2 PHE A 427 -7.517 3.255 1.957 1.00 62.41 C ATOM 606 CE1 PHE A 427 -9.220 4.169 3.916 1.00 74.43 C ATOM 607 CE2 PHE A 427 -8.761 3.853 1.627 1.00 55.34 C ATOM 608 CZ PHE A 427 -9.585 4.298 2.612 1.00 14.14 C ATOM 0 H PHE A 427 -3.937 1.100 4.440 1.00 15.03 H new ATOM 0 HA PHE A 427 -5.905 2.837 5.773 1.00 13.41 H new ATOM 0 HB2 PHE A 427 -5.009 3.195 3.417 1.00 13.44 H new ATOM 0 HB3 PHE A 427 -5.644 1.625 2.966 1.00 13.44 H new ATOM 0 HD1 PHE A 427 -7.685 3.468 5.281 1.00 24.21 H new ATOM 0 HD2 PHE A 427 -6.862 2.902 1.174 1.00 62.41 H new ATOM 0 HE1 PHE A 427 -9.876 4.521 4.699 1.00 74.43 H new ATOM 0 HE2 PHE A 427 -9.053 3.955 0.592 1.00 55.34 H new ATOM 0 HZ PHE A 427 -10.531 4.755 2.359 1.00 14.14 H new ATOM 617 N CYS A 428 -7.552 1.142 6.353 1.00 32.44 N ATOM 618 CA CYS A 428 -8.585 0.183 6.707 1.00 60.53 C ATOM 619 C CYS A 428 -9.929 0.914 6.732 1.00 13.43 C ATOM 620 O CYS A 428 -10.024 2.031 7.238 1.00 20.25 O ATOM 621 CB CYS A 428 -8.285 -0.504 8.040 1.00 23.41 C ATOM 622 SG CYS A 428 -9.650 -1.642 8.480 1.00 31.24 S ATOM 0 H CYS A 428 -7.512 1.967 6.952 1.00 32.44 H new ATOM 0 HA CYS A 428 -8.618 -0.612 5.962 1.00 60.53 H new ATOM 0 HB2 CYS A 428 -7.348 -1.057 7.971 1.00 23.41 H new ATOM 0 HB3 CYS A 428 -8.157 0.243 8.823 1.00 23.41 H new ATOM 0 HG CYS A 428 -9.870 -1.581 9.760 1.00 31.24 H new ATOM 627 N GLU A 429 -10.935 0.253 6.178 1.00 4.32 N ATOM 628 CA GLU A 429 -12.270 0.825 6.130 1.00 34.40 C ATOM 629 C GLU A 429 -13.091 0.357 7.332 1.00 14.44 C ATOM 630 O GLU A 429 -13.265 -0.843 7.540 1.00 44.40 O ATOM 631 CB GLU A 429 -12.970 0.472 4.816 1.00 35.10 C ATOM 632 CG GLU A 429 -14.190 1.367 4.587 1.00 71.33 C ATOM 633 CD GLU A 429 -13.777 2.713 3.987 1.00 14.43 C ATOM 634 OE1 GLU A 429 -12.581 2.956 3.773 1.00 61.03 O ATOM 635 OE2 GLU A 429 -14.753 3.521 3.740 1.00 15.04 O ATOM 0 H GLU A 429 -10.852 -0.673 5.759 1.00 4.32 H new ATOM 0 HA GLU A 429 -12.182 1.910 6.176 1.00 34.40 H new ATOM 0 HB2 GLU A 429 -12.272 0.584 3.986 1.00 35.10 H new ATOM 0 HB3 GLU A 429 -13.279 -0.573 4.834 1.00 35.10 H new ATOM 0 HG2 GLU A 429 -14.892 0.867 3.920 1.00 71.33 H new ATOM 0 HG3 GLU A 429 -14.709 1.530 5.532 1.00 71.33 H new ATOM 641 N ASP A 430 -13.577 1.329 8.092 1.00 32.11 N ATOM 642 CA ASP A 430 -14.377 1.031 9.266 1.00 63.24 C ATOM 643 C ASP A 430 -15.774 1.629 9.093 1.00 63.13 C ATOM 644 O ASP A 430 -15.912 2.790 8.708 1.00 3.45 O ATOM 645 CB ASP A 430 -13.754 1.640 10.525 1.00 3.11 C ATOM 646 CG ASP A 430 -12.229 1.544 10.604 1.00 4.43 C ATOM 647 OD1 ASP A 430 -11.546 1.379 9.582 1.00 52.44 O ATOM 648 OD2 ASP A 430 -11.738 1.646 11.793 1.00 30.42 O ATOM 0 H ASP A 430 -13.431 2.323 7.916 1.00 32.11 H new ATOM 0 HA ASP A 430 -14.426 -0.052 9.375 1.00 63.24 H new ATOM 0 HB2 ASP A 430 -14.040 2.690 10.582 1.00 3.11 H new ATOM 0 HB3 ASP A 430 -14.180 1.146 11.398 1.00 3.11 H new ATOM 653 N PHE A 431 -16.774 0.811 9.385 1.00 23.01 N ATOM 654 CA PHE A 431 -18.155 1.246 9.266 1.00 24.25 C ATOM 655 C PHE A 431 -18.616 1.963 10.536 1.00 1.13 C ATOM 656 O PHE A 431 -19.773 2.364 10.641 1.00 2.32 O ATOM 657 CB PHE A 431 -19.004 -0.013 9.069 1.00 62.33 C ATOM 658 CG PHE A 431 -19.310 -0.767 10.365 1.00 61.52 C ATOM 659 CD1 PHE A 431 -20.368 -0.396 11.134 1.00 1.05 C ATOM 660 CD2 PHE A 431 -18.522 -1.806 10.748 1.00 30.33 C ATOM 661 CE1 PHE A 431 -20.652 -1.097 12.336 1.00 42.52 C ATOM 662 CE2 PHE A 431 -18.806 -2.507 11.950 1.00 50.24 C ATOM 663 CZ PHE A 431 -19.864 -2.136 12.719 1.00 21.33 C ATOM 0 H PHE A 431 -16.656 -0.151 9.704 1.00 23.01 H new ATOM 0 HA PHE A 431 -18.256 1.941 8.432 1.00 24.25 H new ATOM 0 HB2 PHE A 431 -19.944 0.266 8.593 1.00 62.33 H new ATOM 0 HB3 PHE A 431 -18.486 -0.684 8.384 1.00 62.33 H new ATOM 0 HD1 PHE A 431 -20.992 0.432 10.831 1.00 1.05 H new ATOM 0 HD2 PHE A 431 -17.680 -2.099 10.138 1.00 30.33 H new ATOM 0 HE1 PHE A 431 -21.494 -0.804 12.946 1.00 42.52 H new ATOM 0 HE2 PHE A 431 -18.182 -3.335 12.253 1.00 50.24 H new ATOM 0 HZ PHE A 431 -20.078 -2.667 13.635 1.00 21.33 H new ATOM 672 N GLN A 432 -17.687 2.102 11.470 1.00 35.21 N ATOM 673 CA GLN A 432 -17.982 2.764 12.728 1.00 14.13 C ATOM 674 C GLN A 432 -17.973 4.283 12.543 1.00 61.33 C ATOM 675 O GLN A 432 -18.785 4.989 13.141 1.00 34.30 O ATOM 676 CB GLN A 432 -16.996 2.339 13.817 1.00 22.01 C ATOM 677 CG GLN A 432 -16.898 0.815 13.903 1.00 24.32 C ATOM 678 CD GLN A 432 -15.803 0.389 14.884 1.00 41.40 C ATOM 679 OE1 GLN A 432 -14.686 0.878 14.858 1.00 54.13 O ATOM 680 NE2 GLN A 432 -16.185 -0.546 15.749 1.00 21.23 N ATOM 0 H GLN A 432 -16.728 1.767 11.380 1.00 35.21 H new ATOM 0 HA GLN A 432 -18.979 2.462 13.049 1.00 14.13 H new ATOM 0 HB2 GLN A 432 -16.012 2.759 13.606 1.00 22.01 H new ATOM 0 HB3 GLN A 432 -17.315 2.741 14.779 1.00 22.01 H new ATOM 0 HG2 GLN A 432 -17.856 0.403 14.221 1.00 24.32 H new ATOM 0 HG3 GLN A 432 -16.686 0.405 12.916 1.00 24.32 H new ATOM 0 HE21 GLN A 432 -17.136 -0.913 15.716 1.00 21.23 H new ATOM 0 HE22 GLN A 432 -15.527 -0.896 16.445 1.00 21.23 H new ATOM 687 N VAL A 433 -17.046 4.741 11.715 1.00 50.33 N ATOM 688 CA VAL A 433 -16.923 6.163 11.444 1.00 63.54 C ATOM 689 C VAL A 433 -17.900 6.555 10.335 1.00 3.14 C ATOM 690 O VAL A 433 -18.610 5.705 9.799 1.00 45.41 O ATOM 691 CB VAL A 433 -15.469 6.505 11.108 1.00 42.43 C ATOM 692 CG1 VAL A 433 -14.587 6.436 12.356 1.00 31.44 C ATOM 693 CG2 VAL A 433 -14.932 5.594 10.004 1.00 13.40 C ATOM 0 H VAL A 433 -16.373 4.153 11.223 1.00 50.33 H new ATOM 0 HA VAL A 433 -17.186 6.745 12.327 1.00 63.54 H new ATOM 0 HB VAL A 433 -15.443 7.530 10.737 1.00 42.43 H new ATOM 0 HG11 VAL A 433 -13.559 6.683 12.089 1.00 31.44 H new ATOM 0 HG12 VAL A 433 -14.950 7.147 13.098 1.00 31.44 H new ATOM 0 HG13 VAL A 433 -14.622 5.429 12.771 1.00 31.44 H new ATOM 0 HG21 VAL A 433 -13.898 5.859 9.785 1.00 13.40 H new ATOM 0 HG22 VAL A 433 -14.979 4.556 10.334 1.00 13.40 H new ATOM 0 HG23 VAL A 433 -15.536 5.717 9.105 1.00 13.40 H new ATOM 703 N HIS A 434 -17.908 7.842 10.025 1.00 53.34 N ATOM 704 CA HIS A 434 -18.788 8.357 8.989 1.00 54.42 C ATOM 705 C HIS A 434 -18.292 7.896 7.618 1.00 22.55 C ATOM 706 O HIS A 434 -19.085 7.714 6.695 1.00 15.41 O ATOM 707 CB HIS A 434 -18.915 9.879 9.091 1.00 10.42 C ATOM 708 CG HIS A 434 -17.610 10.587 9.368 1.00 52.12 C ATOM 709 ND1 HIS A 434 -16.974 10.857 10.544 1.00 42.23 N flip ATOM 710 CD2 HIS A 434 -16.812 11.107 8.364 1.00 50.32 C flip ATOM 711 CE1 HIS A 434 -15.849 11.505 10.273 1.00 2.13 C flip ATOM 712 NE2 HIS A 434 -15.746 11.662 8.922 1.00 61.20 N flip ATOM 0 H HIS A 434 -17.319 8.544 10.473 1.00 53.34 H new ATOM 0 HA HIS A 434 -19.792 7.956 9.128 1.00 54.42 H new ATOM 0 HB2 HIS A 434 -19.334 10.262 8.160 1.00 10.42 H new ATOM 0 HB3 HIS A 434 -19.624 10.122 9.883 1.00 10.42 H new ATOM 0 HD1 HIS A 434 -17.307 10.604 11.474 1.00 42.23 H new ATOM 0 HD2 HIS A 434 -17.022 11.067 7.305 1.00 50.32 H new ATOM 0 HE1 HIS A 434 -15.132 11.852 11.002 1.00 2.13 H new ATOM 719 N GLY A 435 -16.982 7.717 7.526 1.00 42.10 N ATOM 720 CA GLY A 435 -16.372 7.280 6.283 1.00 60.34 C ATOM 721 C GLY A 435 -15.120 8.102 5.968 1.00 13.45 C ATOM 722 O GLY A 435 -14.013 7.565 5.932 1.00 71.10 O ATOM 0 H GLY A 435 -16.327 7.867 8.293 1.00 42.10 H new ATOM 0 HA2 GLY A 435 -16.110 6.224 6.354 1.00 60.34 H new ATOM 0 HA3 GLY A 435 -17.089 7.376 5.468 1.00 60.34 H new ATOM 726 N ARG A 436 -15.337 9.390 5.747 1.00 34.41 N ATOM 727 CA ARG A 436 -14.240 10.292 5.437 1.00 13.24 C ATOM 728 C ARG A 436 -13.715 10.948 6.716 1.00 75.32 C ATOM 729 O ARG A 436 -13.437 12.146 6.732 1.00 21.11 O ATOM 730 CB ARG A 436 -14.683 11.379 4.457 1.00 70.22 C ATOM 731 CG ARG A 436 -15.386 10.771 3.242 1.00 31.12 C ATOM 732 CD ARG A 436 -14.376 10.398 2.154 1.00 41.12 C ATOM 733 NE ARG A 436 -13.657 11.609 1.695 1.00 45.14 N ATOM 734 CZ ARG A 436 -14.107 12.434 0.727 1.00 63.50 C ATOM 735 NH1 ARG A 436 -15.280 12.188 0.107 1.00 50.31 N ATOM 736 NH2 ARG A 436 -13.382 13.488 0.396 1.00 4.31 N ATOM 0 H ARG A 436 -16.256 9.831 5.776 1.00 34.41 H new ATOM 0 HA ARG A 436 -13.446 9.705 4.975 1.00 13.24 H new ATOM 0 HB2 ARG A 436 -15.355 12.074 4.960 1.00 70.22 H new ATOM 0 HB3 ARG A 436 -13.816 11.953 4.130 1.00 70.22 H new ATOM 0 HG2 ARG A 436 -15.943 9.885 3.545 1.00 31.12 H new ATOM 0 HG3 ARG A 436 -16.110 11.481 2.843 1.00 31.12 H new ATOM 0 HD2 ARG A 436 -13.665 9.668 2.541 1.00 41.12 H new ATOM 0 HD3 ARG A 436 -14.890 9.930 1.314 1.00 41.12 H new ATOM 0 HE ARG A 436 -12.766 11.833 2.138 1.00 45.14 H new ATOM 0 HH11 ARG A 436 -15.834 11.373 0.369 1.00 50.31 H new ATOM 0 HH12 ARG A 436 -15.612 12.817 -0.624 1.00 50.31 H new ATOM 0 HH21 ARG A 436 -12.497 13.668 0.870 1.00 4.31 H new ATOM 0 HH22 ARG A 436 -13.707 14.122 -0.334 1.00 4.31 H new ATOM 746 N GLY A 437 -13.593 10.134 7.753 1.00 61.32 N ATOM 747 CA GLY A 437 -13.104 10.620 9.032 1.00 12.50 C ATOM 748 C GLY A 437 -11.757 9.987 9.383 1.00 34.10 C ATOM 749 O GLY A 437 -11.198 10.257 10.445 1.00 71.51 O ATOM 0 H GLY A 437 -13.824 9.141 7.734 1.00 61.32 H new ATOM 0 HA2 GLY A 437 -13.002 11.705 8.997 1.00 12.50 H new ATOM 0 HA3 GLY A 437 -13.830 10.393 9.812 1.00 12.50 H new ATOM 753 N GLU A 438 -11.275 9.156 8.470 1.00 23.11 N ATOM 754 CA GLU A 438 -10.004 8.481 8.670 1.00 23.10 C ATOM 755 C GLU A 438 -8.923 9.113 7.791 1.00 13.32 C ATOM 756 O GLU A 438 -8.020 9.778 8.295 1.00 72.41 O ATOM 757 CB GLU A 438 -10.130 6.982 8.391 1.00 62.01 C ATOM 758 CG GLU A 438 -11.532 6.476 8.730 1.00 53.44 C ATOM 759 CD GLU A 438 -11.658 4.977 8.453 1.00 30.00 C ATOM 760 OE1 GLU A 438 -12.325 4.578 7.487 1.00 21.40 O ATOM 761 OE2 GLU A 438 -11.030 4.215 9.283 1.00 65.01 O ATOM 0 H GLU A 438 -11.742 8.935 7.590 1.00 23.11 H new ATOM 0 HA GLU A 438 -9.712 8.600 9.713 1.00 23.10 H new ATOM 0 HB2 GLU A 438 -9.913 6.785 7.341 1.00 62.01 H new ATOM 0 HB3 GLU A 438 -9.391 6.436 8.978 1.00 62.01 H new ATOM 0 HG2 GLU A 438 -11.750 6.675 9.779 1.00 53.44 H new ATOM 0 HG3 GLU A 438 -12.271 7.021 8.142 1.00 53.44 H new ATOM 767 N LEU A 439 -9.053 8.885 6.492 1.00 42.42 N ATOM 768 CA LEU A 439 -8.099 9.425 5.539 1.00 13.13 C ATOM 769 C LEU A 439 -8.850 10.207 4.459 1.00 43.43 C ATOM 770 O LEU A 439 -10.080 10.230 4.448 1.00 41.31 O ATOM 771 CB LEU A 439 -7.209 8.311 4.982 1.00 23.02 C ATOM 772 CG LEU A 439 -7.869 7.360 3.982 1.00 4.33 C ATOM 773 CD1 LEU A 439 -8.231 8.091 2.688 1.00 61.11 C ATOM 774 CD2 LEU A 439 -6.987 6.138 3.722 1.00 11.01 C ATOM 0 H LEU A 439 -9.805 8.334 6.078 1.00 42.42 H new ATOM 0 HA LEU A 439 -7.425 10.126 6.031 1.00 13.13 H new ATOM 0 HB2 LEU A 439 -6.345 8.770 4.501 1.00 23.02 H new ATOM 0 HB3 LEU A 439 -6.832 7.722 5.818 1.00 23.02 H new ATOM 0 HG LEU A 439 -8.800 6.998 4.419 1.00 4.33 H new ATOM 0 HD11 LEU A 439 -8.699 7.392 1.994 1.00 61.11 H new ATOM 0 HD12 LEU A 439 -8.925 8.901 2.910 1.00 61.11 H new ATOM 0 HD13 LEU A 439 -7.327 8.501 2.237 1.00 61.11 H new ATOM 0 HD21 LEU A 439 -7.480 5.479 3.008 1.00 11.01 H new ATOM 0 HD22 LEU A 439 -6.028 6.461 3.316 1.00 11.01 H new ATOM 0 HD23 LEU A 439 -6.823 5.602 4.657 1.00 11.01 H new ATOM 785 N SER A 440 -8.078 10.828 3.580 1.00 52.45 N ATOM 786 CA SER A 440 -8.655 11.610 2.499 1.00 15.44 C ATOM 787 C SER A 440 -9.393 10.690 1.523 1.00 41.24 C ATOM 788 O SER A 440 -10.622 10.679 1.484 1.00 44.44 O ATOM 789 CB SER A 440 -7.580 12.411 1.763 1.00 43.13 C ATOM 790 OG SER A 440 -8.056 12.932 0.525 1.00 73.10 O ATOM 0 H SER A 440 -7.058 10.806 3.594 1.00 52.45 H new ATOM 0 HA SER A 440 -9.364 12.316 2.930 1.00 15.44 H new ATOM 0 HB2 SER A 440 -7.243 13.232 2.396 1.00 43.13 H new ATOM 0 HB3 SER A 440 -6.715 11.774 1.579 1.00 43.13 H new ATOM 0 HG SER A 440 -8.145 12.203 -0.124 1.00 73.10 H new ATOM 795 N CYS A 441 -8.611 9.942 0.761 1.00 34.33 N ATOM 796 CA CYS A 441 -9.175 9.021 -0.212 1.00 63.32 C ATOM 797 C CYS A 441 -8.132 7.942 -0.513 1.00 0.22 C ATOM 798 O CYS A 441 -7.049 7.943 0.070 1.00 32.54 O ATOM 799 CB CYS A 441 -9.628 9.746 -1.480 1.00 34.15 C ATOM 800 SG CYS A 441 -11.377 10.256 -1.318 1.00 53.42 S ATOM 0 H CYS A 441 -7.592 9.954 0.797 1.00 34.33 H new ATOM 0 HA CYS A 441 -10.070 8.555 0.201 1.00 63.32 H new ATOM 0 HB2 CYS A 441 -9.000 10.620 -1.653 1.00 34.15 H new ATOM 0 HB3 CYS A 441 -9.510 9.093 -2.344 1.00 34.15 H new ATOM 0 HG CYS A 441 -11.607 10.635 -0.096 1.00 53.42 H new ATOM 805 N LEU A 442 -8.495 7.048 -1.421 1.00 12.51 N ATOM 806 CA LEU A 442 -7.605 5.968 -1.805 1.00 31.14 C ATOM 807 C LEU A 442 -6.618 6.475 -2.858 1.00 44.23 C ATOM 808 O LEU A 442 -5.465 6.046 -2.891 1.00 3.35 O ATOM 809 CB LEU A 442 -8.409 4.746 -2.257 1.00 2.15 C ATOM 810 CG LEU A 442 -7.702 3.797 -3.227 1.00 62.02 C ATOM 811 CD1 LEU A 442 -7.568 4.430 -4.614 1.00 65.31 C ATOM 812 CD2 LEU A 442 -6.348 3.351 -2.667 1.00 51.22 C ATOM 0 H LEU A 442 -9.395 7.050 -1.902 1.00 12.51 H new ATOM 0 HA LEU A 442 -7.017 5.637 -0.948 1.00 31.14 H new ATOM 0 HB2 LEU A 442 -8.699 4.179 -1.372 1.00 2.15 H new ATOM 0 HB3 LEU A 442 -9.328 5.095 -2.727 1.00 2.15 H new ATOM 0 HG LEU A 442 -8.315 2.903 -3.339 1.00 62.02 H new ATOM 0 HD11 LEU A 442 -7.062 3.735 -5.284 1.00 65.31 H new ATOM 0 HD12 LEU A 442 -8.559 4.657 -5.008 1.00 65.31 H new ATOM 0 HD13 LEU A 442 -6.988 5.350 -4.540 1.00 65.31 H new ATOM 0 HD21 LEU A 442 -5.866 2.677 -3.375 1.00 51.22 H new ATOM 0 HD22 LEU A 442 -5.715 4.224 -2.508 1.00 51.22 H new ATOM 0 HD23 LEU A 442 -6.499 2.834 -1.719 1.00 51.22 H new ATOM 823 N GLN A 443 -7.105 7.383 -3.691 1.00 30.15 N ATOM 824 CA GLN A 443 -6.279 7.955 -4.741 1.00 53.41 C ATOM 825 C GLN A 443 -5.264 8.932 -4.146 1.00 61.33 C ATOM 826 O GLN A 443 -4.401 9.446 -4.856 1.00 64.50 O ATOM 827 CB GLN A 443 -7.140 8.640 -5.804 1.00 33.45 C ATOM 828 CG GLN A 443 -7.550 10.044 -5.357 1.00 33.30 C ATOM 829 CD GLN A 443 -8.436 10.717 -6.408 1.00 4.42 C ATOM 830 OE1 GLN A 443 -7.907 10.739 -7.627 1.00 24.14 O flip ATOM 831 NE2 GLN A 443 -9.527 11.186 -6.128 1.00 75.03 N flip ATOM 0 H GLN A 443 -8.061 7.737 -3.660 1.00 30.15 H new ATOM 0 HA GLN A 443 -5.733 7.146 -5.227 1.00 53.41 H new ATOM 0 HB2 GLN A 443 -6.587 8.700 -6.741 1.00 33.45 H new ATOM 0 HB3 GLN A 443 -8.030 8.042 -5.997 1.00 33.45 H new ATOM 0 HG2 GLN A 443 -8.084 9.986 -4.409 1.00 33.30 H new ATOM 0 HG3 GLN A 443 -6.660 10.649 -5.185 1.00 33.30 H new ATOM 0 HE21 GLN A 443 -9.873 11.135 -5.170 1.00 75.03 H new ATOM 0 HE22 GLN A 443 -10.093 11.629 -6.852 1.00 75.03 H new ATOM 838 N ASP A 444 -5.400 9.159 -2.847 1.00 70.02 N ATOM 839 CA ASP A 444 -4.506 10.066 -2.148 1.00 72.03 C ATOM 840 C ASP A 444 -3.139 9.398 -1.980 1.00 52.43 C ATOM 841 O ASP A 444 -2.109 10.004 -2.270 1.00 42.05 O ATOM 842 CB ASP A 444 -5.042 10.404 -0.755 1.00 71.21 C ATOM 843 CG ASP A 444 -5.946 11.637 -0.692 1.00 31.02 C ATOM 844 OD1 ASP A 444 -7.052 11.648 -1.250 1.00 5.44 O ATOM 845 OD2 ASP A 444 -5.465 12.631 -0.025 1.00 70.43 O ATOM 0 H ASP A 444 -6.116 8.730 -2.261 1.00 70.02 H new ATOM 0 HA ASP A 444 -4.427 10.981 -2.735 1.00 72.03 H new ATOM 0 HB2 ASP A 444 -5.597 9.545 -0.377 1.00 71.21 H new ATOM 0 HB3 ASP A 444 -4.197 10.557 -0.084 1.00 71.21 H new ATOM 850 N ALA A 445 -3.175 8.160 -1.512 1.00 72.11 N ATOM 851 CA ALA A 445 -1.953 7.403 -1.301 1.00 34.45 C ATOM 852 C ALA A 445 -1.301 7.111 -2.654 1.00 22.42 C ATOM 853 O ALA A 445 -0.136 6.722 -2.714 1.00 62.52 O ATOM 854 CB ALA A 445 -2.270 6.128 -0.519 1.00 5.35 C ATOM 0 H ALA A 445 -4.032 7.661 -1.273 1.00 72.11 H new ATOM 0 HA ALA A 445 -1.242 7.979 -0.709 1.00 34.45 H new ATOM 0 HB1 ALA A 445 -1.353 5.561 -0.361 1.00 5.35 H new ATOM 0 HB2 ALA A 445 -2.704 6.391 0.445 1.00 5.35 H new ATOM 0 HB3 ALA A 445 -2.979 5.522 -1.083 1.00 5.35 H new ATOM 860 N ILE A 446 -2.080 7.308 -3.707 1.00 52.05 N ATOM 861 CA ILE A 446 -1.593 7.071 -5.055 1.00 41.33 C ATOM 862 C ILE A 446 -0.754 8.269 -5.508 1.00 24.24 C ATOM 863 O ILE A 446 0.193 8.111 -6.277 1.00 55.02 O ATOM 864 CB ILE A 446 -2.754 6.743 -5.995 1.00 4.11 C ATOM 865 CG1 ILE A 446 -3.137 5.264 -5.899 1.00 71.33 C ATOM 866 CG2 ILE A 446 -2.433 7.160 -7.431 1.00 70.35 C ATOM 867 CD1 ILE A 446 -4.264 4.926 -6.876 1.00 3.54 C ATOM 0 H ILE A 446 -3.047 7.630 -3.654 1.00 52.05 H new ATOM 0 HA ILE A 446 -0.941 6.198 -5.076 1.00 41.33 H new ATOM 0 HB ILE A 446 -3.622 7.322 -5.679 1.00 4.11 H new ATOM 0 HG12 ILE A 446 -2.266 4.644 -6.114 1.00 71.33 H new ATOM 0 HG13 ILE A 446 -3.451 5.031 -4.881 1.00 71.33 H new ATOM 0 HG21 ILE A 446 -3.275 6.915 -8.078 1.00 70.35 H new ATOM 0 HG22 ILE A 446 -2.249 8.234 -7.466 1.00 70.35 H new ATOM 0 HG23 ILE A 446 -1.545 6.629 -7.774 1.00 70.35 H new ATOM 0 HD11 ILE A 446 -4.517 3.869 -6.788 1.00 3.54 H new ATOM 0 HD12 ILE A 446 -5.141 5.530 -6.643 1.00 3.54 H new ATOM 0 HD13 ILE A 446 -3.938 5.137 -7.894 1.00 3.54 H new ATOM 878 N ASP A 447 -1.132 9.436 -5.010 1.00 52.14 N ATOM 879 CA ASP A 447 -0.426 10.660 -5.355 1.00 4.32 C ATOM 880 C ASP A 447 0.460 11.079 -4.181 1.00 23.03 C ATOM 881 O ASP A 447 1.310 11.955 -4.323 1.00 61.24 O ATOM 882 CB ASP A 447 -1.407 11.799 -5.638 1.00 45.22 C ATOM 883 CG ASP A 447 -2.543 11.942 -4.624 1.00 43.41 C ATOM 884 OD1 ASP A 447 -3.729 11.851 -4.975 1.00 54.13 O ATOM 885 OD2 ASP A 447 -2.167 12.159 -3.408 1.00 73.22 O ATOM 0 H ASP A 447 -1.917 9.561 -4.371 1.00 52.14 H new ATOM 0 HA ASP A 447 0.170 10.467 -6.247 1.00 4.32 H new ATOM 0 HB2 ASP A 447 -0.852 12.736 -5.673 1.00 45.22 H new ATOM 0 HB3 ASP A 447 -1.840 11.648 -6.627 1.00 45.22 H new ATOM 890 N HIS A 448 0.230 10.433 -3.047 1.00 64.11 N ATOM 891 CA HIS A 448 0.998 10.728 -1.849 1.00 10.51 C ATOM 892 C HIS A 448 1.985 9.591 -1.580 1.00 65.04 C ATOM 893 O HIS A 448 3.190 9.822 -1.475 1.00 4.52 O ATOM 894 CB HIS A 448 0.071 11.001 -0.663 1.00 11.33 C ATOM 895 CG HIS A 448 -0.771 12.246 -0.815 1.00 31.32 C ATOM 896 ND1 HIS A 448 -0.457 13.259 -1.704 1.00 34.42 N ATOM 897 CD2 HIS A 448 -1.919 12.629 -0.185 1.00 65.20 C ATOM 898 CE1 HIS A 448 -1.380 14.205 -1.603 1.00 73.44 C ATOM 899 NE2 HIS A 448 -2.284 13.812 -0.662 1.00 4.30 N ATOM 0 H HIS A 448 -0.477 9.707 -2.933 1.00 64.11 H new ATOM 0 HA HIS A 448 1.578 11.639 -1.999 1.00 10.51 H new ATOM 0 HB2 HIS A 448 -0.588 10.144 -0.525 1.00 11.33 H new ATOM 0 HB3 HIS A 448 0.672 11.090 0.242 1.00 11.33 H new ATOM 0 HD2 HIS A 448 -2.442 12.065 0.573 1.00 65.20 H new ATOM 0 HE1 HIS A 448 -1.410 15.125 -2.167 1.00 73.44 H new ATOM 0 HE2 HIS A 448 -3.107 14.341 -0.372 1.00 4.30 H new ATOM 906 N SER A 449 1.440 8.388 -1.475 1.00 64.33 N ATOM 907 CA SER A 449 2.259 7.216 -1.220 1.00 5.22 C ATOM 908 C SER A 449 2.917 6.745 -2.518 1.00 65.41 C ATOM 909 O SER A 449 2.311 6.810 -3.585 1.00 5.24 O ATOM 910 CB SER A 449 1.426 6.086 -0.606 1.00 72.02 C ATOM 911 OG SER A 449 0.261 6.578 0.050 1.00 35.41 O ATOM 0 H SER A 449 0.441 8.200 -1.562 1.00 64.33 H new ATOM 0 HA SER A 449 3.035 7.489 -0.505 1.00 5.22 H new ATOM 0 HB2 SER A 449 1.133 5.385 -1.388 1.00 72.02 H new ATOM 0 HB3 SER A 449 2.037 5.531 0.107 1.00 72.02 H new ATOM 0 HG SER A 449 0.205 6.194 0.950 1.00 35.41 H new ATOM 916 N ALA A 450 4.152 6.282 -2.382 1.00 41.24 N ATOM 917 CA ALA A 450 4.901 5.801 -3.530 1.00 14.32 C ATOM 918 C ALA A 450 4.072 4.749 -4.269 1.00 43.02 C ATOM 919 O ALA A 450 3.500 5.030 -5.322 1.00 13.30 O ATOM 920 CB ALA A 450 6.254 5.258 -3.068 1.00 71.23 C ATOM 0 H ALA A 450 4.652 6.230 -1.494 1.00 41.24 H new ATOM 0 HA ALA A 450 5.099 6.615 -4.227 1.00 14.32 H new ATOM 0 HB1 ALA A 450 6.815 4.897 -3.930 1.00 71.23 H new ATOM 0 HB2 ALA A 450 6.816 6.052 -2.576 1.00 71.23 H new ATOM 0 HB3 ALA A 450 6.097 4.437 -2.368 1.00 71.23 H new ATOM 926 N PHE A 451 4.035 3.558 -3.690 1.00 42.42 N ATOM 927 CA PHE A 451 3.286 2.462 -4.280 1.00 14.20 C ATOM 928 C PHE A 451 2.226 1.936 -3.310 1.00 23.41 C ATOM 929 O PHE A 451 2.524 1.661 -2.147 1.00 72.45 O ATOM 930 CB PHE A 451 4.288 1.344 -4.577 1.00 74.04 C ATOM 931 CG PHE A 451 5.600 1.834 -5.193 1.00 21.21 C ATOM 932 CD1 PHE A 451 6.517 2.473 -4.420 1.00 22.04 C ATOM 933 CD2 PHE A 451 5.850 1.629 -6.515 1.00 20.11 C ATOM 934 CE1 PHE A 451 7.735 2.927 -4.990 1.00 72.43 C ATOM 935 CE2 PHE A 451 7.068 2.083 -7.086 1.00 13.43 C ATOM 936 CZ PHE A 451 7.984 2.721 -6.312 1.00 73.34 C ATOM 0 H PHE A 451 4.512 3.328 -2.818 1.00 42.42 H new ATOM 0 HA PHE A 451 2.777 2.803 -5.182 1.00 14.20 H new ATOM 0 HB2 PHE A 451 4.509 0.812 -3.651 1.00 74.04 H new ATOM 0 HB3 PHE A 451 3.826 0.626 -5.255 1.00 74.04 H new ATOM 0 HD1 PHE A 451 6.319 2.636 -3.371 1.00 22.04 H new ATOM 0 HD2 PHE A 451 5.122 1.121 -7.130 1.00 20.11 H new ATOM 0 HE1 PHE A 451 8.463 3.435 -4.375 1.00 72.43 H new ATOM 0 HE2 PHE A 451 7.266 1.921 -8.135 1.00 13.43 H new ATOM 0 HZ PHE A 451 8.911 3.065 -6.746 1.00 73.34 H new ATOM 945 N ILE A 452 1.010 1.810 -3.821 1.00 61.53 N ATOM 946 CA ILE A 452 -0.095 1.323 -3.013 1.00 11.11 C ATOM 947 C ILE A 452 0.094 -0.172 -2.750 1.00 2.24 C ATOM 948 O ILE A 452 0.334 -0.944 -3.678 1.00 20.45 O ATOM 949 CB ILE A 452 -1.432 1.668 -3.670 1.00 34.12 C ATOM 950 CG1 ILE A 452 -1.469 3.136 -4.100 1.00 44.12 C ATOM 951 CG2 ILE A 452 -2.603 1.309 -2.753 1.00 35.13 C ATOM 952 CD1 ILE A 452 -1.313 4.064 -2.892 1.00 72.54 C ATOM 0 H ILE A 452 0.766 2.037 -4.785 1.00 61.53 H new ATOM 0 HA ILE A 452 -0.107 1.820 -2.043 1.00 11.11 H new ATOM 0 HB ILE A 452 -1.534 1.066 -4.573 1.00 34.12 H new ATOM 0 HG12 ILE A 452 -0.671 3.329 -4.817 1.00 44.12 H new ATOM 0 HG13 ILE A 452 -2.411 3.347 -4.606 1.00 44.12 H new ATOM 0 HG21 ILE A 452 -3.542 1.565 -3.245 1.00 35.13 H new ATOM 0 HG22 ILE A 452 -2.584 0.240 -2.540 1.00 35.13 H new ATOM 0 HG23 ILE A 452 -2.519 1.866 -1.820 1.00 35.13 H new ATOM 0 HD11 ILE A 452 -1.343 5.102 -3.224 1.00 72.54 H new ATOM 0 HD12 ILE A 452 -2.126 3.885 -2.188 1.00 72.54 H new ATOM 0 HD13 ILE A 452 -0.359 3.867 -2.402 1.00 72.54 H new ATOM 963 N ILE A 453 -0.023 -0.537 -1.482 1.00 1.11 N ATOM 964 CA ILE A 453 0.131 -1.927 -1.086 1.00 53.14 C ATOM 965 C ILE A 453 -1.242 -2.510 -0.745 1.00 21.24 C ATOM 966 O ILE A 453 -1.864 -2.112 0.237 1.00 65.23 O ATOM 967 CB ILE A 453 1.150 -2.050 0.050 1.00 33.31 C ATOM 968 CG1 ILE A 453 2.574 -2.154 -0.503 1.00 53.44 C ATOM 969 CG2 ILE A 453 0.805 -3.223 0.970 1.00 51.14 C ATOM 970 CD1 ILE A 453 3.599 -1.702 0.541 1.00 34.50 C ATOM 0 H ILE A 453 -0.223 0.105 -0.715 1.00 1.11 H new ATOM 0 HA ILE A 453 0.533 -2.516 -1.910 1.00 53.14 H new ATOM 0 HB ILE A 453 1.103 -1.143 0.653 1.00 33.31 H new ATOM 0 HG12 ILE A 453 2.779 -3.183 -0.799 1.00 53.44 H new ATOM 0 HG13 ILE A 453 2.666 -1.540 -1.399 1.00 53.44 H new ATOM 0 HG21 ILE A 453 1.544 -3.289 1.769 1.00 51.14 H new ATOM 0 HG22 ILE A 453 -0.184 -3.068 1.402 1.00 51.14 H new ATOM 0 HG23 ILE A 453 0.808 -4.149 0.395 1.00 51.14 H new ATOM 0 HD11 ILE A 453 4.603 -1.785 0.125 1.00 34.50 H new ATOM 0 HD12 ILE A 453 3.405 -0.665 0.816 1.00 34.50 H new ATOM 0 HD13 ILE A 453 3.520 -2.333 1.426 1.00 34.50 H new ATOM 981 N LEU A 454 -1.674 -3.446 -1.577 1.00 21.11 N ATOM 982 CA LEU A 454 -2.961 -4.090 -1.376 1.00 51.42 C ATOM 983 C LEU A 454 -2.760 -5.399 -0.610 1.00 43.33 C ATOM 984 O LEU A 454 -2.251 -6.373 -1.162 1.00 52.04 O ATOM 985 CB LEU A 454 -3.687 -4.264 -2.712 1.00 2.33 C ATOM 986 CG LEU A 454 -4.183 -2.981 -3.379 1.00 71.22 C ATOM 987 CD1 LEU A 454 -3.166 -1.849 -3.218 1.00 60.21 C ATOM 988 CD2 LEU A 454 -4.537 -3.227 -4.847 1.00 51.53 C ATOM 0 H LEU A 454 -1.156 -3.774 -2.392 1.00 21.11 H new ATOM 0 HA LEU A 454 -3.610 -3.461 -0.766 1.00 51.42 H new ATOM 0 HB2 LEU A 454 -3.016 -4.773 -3.404 1.00 2.33 H new ATOM 0 HB3 LEU A 454 -4.542 -4.922 -2.555 1.00 2.33 H new ATOM 0 HG LEU A 454 -5.097 -2.667 -2.875 1.00 71.22 H new ATOM 0 HD11 LEU A 454 -3.544 -0.948 -3.702 1.00 60.21 H new ATOM 0 HD12 LEU A 454 -3.006 -1.652 -2.158 1.00 60.21 H new ATOM 0 HD13 LEU A 454 -2.222 -2.139 -3.679 1.00 60.21 H new ATOM 0 HD21 LEU A 454 -4.887 -2.298 -5.297 1.00 51.53 H new ATOM 0 HD22 LEU A 454 -3.654 -3.579 -5.380 1.00 51.53 H new ATOM 0 HD23 LEU A 454 -5.323 -3.980 -4.911 1.00 51.53 H new ATOM 999 N LEU A 455 -3.169 -5.378 0.650 1.00 13.24 N ATOM 1000 CA LEU A 455 -3.039 -6.552 1.497 1.00 50.21 C ATOM 1001 C LEU A 455 -4.086 -7.590 1.087 1.00 52.44 C ATOM 1002 O LEU A 455 -5.124 -7.719 1.734 1.00 33.34 O ATOM 1003 CB LEU A 455 -3.111 -6.156 2.973 1.00 24.42 C ATOM 1004 CG LEU A 455 -2.316 -7.035 3.942 1.00 63.34 C ATOM 1005 CD1 LEU A 455 -0.913 -7.316 3.402 1.00 11.02 C ATOM 1006 CD2 LEU A 455 -2.278 -6.414 5.339 1.00 42.53 C ATOM 0 H LEU A 455 -3.590 -4.568 1.105 1.00 13.24 H new ATOM 0 HA LEU A 455 -2.061 -7.014 1.361 1.00 50.21 H new ATOM 0 HB2 LEU A 455 -2.758 -5.130 3.071 1.00 24.42 H new ATOM 0 HB3 LEU A 455 -4.157 -6.164 3.280 1.00 24.42 H new ATOM 0 HG LEU A 455 -2.826 -7.995 4.029 1.00 63.34 H new ATOM 0 HD11 LEU A 455 -0.370 -7.942 4.109 1.00 11.02 H new ATOM 0 HD12 LEU A 455 -0.988 -7.831 2.444 1.00 11.02 H new ATOM 0 HD13 LEU A 455 -0.380 -6.375 3.267 1.00 11.02 H new ATOM 0 HD21 LEU A 455 -1.707 -7.058 6.008 1.00 42.53 H new ATOM 0 HD22 LEU A 455 -1.805 -5.433 5.288 1.00 42.53 H new ATOM 0 HD23 LEU A 455 -3.295 -6.307 5.718 1.00 42.53 H new ATOM 1017 N LEU A 456 -3.776 -8.304 0.015 1.00 54.15 N ATOM 1018 CA LEU A 456 -4.677 -9.327 -0.489 1.00 74.15 C ATOM 1019 C LEU A 456 -4.780 -10.458 0.534 1.00 42.12 C ATOM 1020 O LEU A 456 -3.986 -11.397 0.510 1.00 60.00 O ATOM 1021 CB LEU A 456 -4.235 -9.792 -1.878 1.00 61.13 C ATOM 1022 CG LEU A 456 -3.869 -8.686 -2.871 1.00 25.05 C ATOM 1023 CD1 LEU A 456 -3.945 -9.197 -4.312 1.00 11.32 C ATOM 1024 CD2 LEU A 456 -4.736 -7.446 -2.655 1.00 11.53 C ATOM 0 H LEU A 456 -2.914 -8.195 -0.519 1.00 54.15 H new ATOM 0 HA LEU A 456 -5.681 -8.922 -0.618 1.00 74.15 H new ATOM 0 HB2 LEU A 456 -3.373 -10.449 -1.762 1.00 61.13 H new ATOM 0 HB3 LEU A 456 -5.036 -10.391 -2.311 1.00 61.13 H new ATOM 0 HG LEU A 456 -2.836 -8.390 -2.688 1.00 25.05 H new ATOM 0 HD11 LEU A 456 -3.680 -8.392 -4.998 1.00 11.32 H new ATOM 0 HD12 LEU A 456 -3.250 -10.027 -4.441 1.00 11.32 H new ATOM 0 HD13 LEU A 456 -4.959 -9.536 -4.525 1.00 11.32 H new ATOM 0 HD21 LEU A 456 -4.455 -6.676 -3.373 1.00 11.53 H new ATOM 0 HD22 LEU A 456 -5.785 -7.707 -2.794 1.00 11.53 H new ATOM 0 HD23 LEU A 456 -4.587 -7.070 -1.643 1.00 11.53 H new ATOM 1035 N THR A 457 -5.765 -10.331 1.411 1.00 65.52 N ATOM 1036 CA THR A 457 -5.983 -11.332 2.443 1.00 61.22 C ATOM 1037 C THR A 457 -7.449 -11.768 2.461 1.00 51.35 C ATOM 1038 O THR A 457 -8.338 -10.986 2.130 1.00 54.23 O ATOM 1039 CB THR A 457 -5.504 -10.751 3.775 1.00 53.20 C ATOM 1040 OG1 THR A 457 -6.538 -9.844 4.149 1.00 23.25 O ATOM 1041 CG2 THR A 457 -4.269 -9.862 3.615 1.00 1.23 C ATOM 0 H THR A 457 -6.421 -9.550 1.429 1.00 65.52 H new ATOM 0 HA THR A 457 -5.410 -12.238 2.243 1.00 61.22 H new ATOM 0 HB THR A 457 -5.280 -11.563 4.466 1.00 53.20 H new ATOM 0 HG1 THR A 457 -6.392 -9.544 5.071 1.00 23.25 H new ATOM 0 HG21 THR A 457 -3.970 -9.475 4.589 1.00 1.23 H new ATOM 0 HG22 THR A 457 -3.453 -10.446 3.191 1.00 1.23 H new ATOM 0 HG23 THR A 457 -4.503 -9.030 2.951 1.00 1.23 H new ATOM 1049 N SER A 458 -7.657 -13.016 2.854 1.00 0.15 N ATOM 1050 CA SER A 458 -9.000 -13.566 2.920 1.00 41.30 C ATOM 1051 C SER A 458 -9.874 -12.706 3.837 1.00 74.24 C ATOM 1052 O SER A 458 -11.099 -12.787 3.787 1.00 45.42 O ATOM 1053 CB SER A 458 -8.980 -15.013 3.414 1.00 64.10 C ATOM 1054 OG SER A 458 -9.140 -15.945 2.347 1.00 4.42 O ATOM 0 H SER A 458 -6.918 -13.662 3.130 1.00 0.15 H new ATOM 0 HA SER A 458 -9.421 -13.559 1.914 1.00 41.30 H new ATOM 0 HB2 SER A 458 -8.038 -15.208 3.927 1.00 64.10 H new ATOM 0 HB3 SER A 458 -9.776 -15.158 4.144 1.00 64.10 H new ATOM 0 HG SER A 458 -9.808 -16.617 2.597 1.00 4.42 H new ATOM 1059 N ASN A 459 -9.206 -11.900 4.650 1.00 40.22 N ATOM 1060 CA ASN A 459 -9.905 -11.025 5.576 1.00 71.11 C ATOM 1061 C ASN A 459 -10.136 -9.667 4.912 1.00 55.14 C ATOM 1062 O ASN A 459 -11.037 -8.926 5.302 1.00 73.30 O ATOM 1063 CB ASN A 459 -9.083 -10.797 6.846 1.00 11.02 C ATOM 1064 CG ASN A 459 -9.190 -11.996 7.791 1.00 34.20 C ATOM 1065 OD1 ASN A 459 -9.410 -13.123 7.383 1.00 21.50 O ATOM 1066 ND2 ASN A 459 -9.022 -11.689 9.075 1.00 52.13 N ATOM 0 H ASN A 459 -8.189 -11.835 4.686 1.00 40.22 H new ATOM 0 HA ASN A 459 -10.851 -11.499 5.839 1.00 71.11 H new ATOM 0 HB2 ASN A 459 -8.039 -10.629 6.582 1.00 11.02 H new ATOM 0 HB3 ASN A 459 -9.432 -9.897 7.353 1.00 11.02 H new ATOM 0 HD21 ASN A 459 -9.075 -12.419 9.785 1.00 52.13 H new ATOM 0 HD22 ASN A 459 -8.840 -10.723 9.349 1.00 52.13 H new ATOM 1072 N PHE A 460 -9.306 -9.381 3.919 1.00 71.04 N ATOM 1073 CA PHE A 460 -9.408 -8.124 3.197 1.00 4.12 C ATOM 1074 C PHE A 460 -10.046 -8.333 1.821 1.00 3.02 C ATOM 1075 O PHE A 460 -10.146 -9.463 1.345 1.00 2.44 O ATOM 1076 CB PHE A 460 -7.983 -7.598 3.011 1.00 41.22 C ATOM 1077 CG PHE A 460 -7.870 -6.457 1.998 1.00 70.34 C ATOM 1078 CD1 PHE A 460 -8.321 -5.215 2.321 1.00 73.42 C ATOM 1079 CD2 PHE A 460 -7.316 -6.684 0.777 1.00 72.12 C ATOM 1080 CE1 PHE A 460 -8.214 -4.155 1.382 1.00 32.11 C ATOM 1081 CE2 PHE A 460 -7.209 -5.624 -0.162 1.00 11.31 C ATOM 1082 CZ PHE A 460 -7.660 -4.382 0.160 1.00 14.23 C ATOM 0 H PHE A 460 -8.560 -9.998 3.598 1.00 71.04 H new ATOM 0 HA PHE A 460 -10.030 -7.424 3.754 1.00 4.12 H new ATOM 0 HB2 PHE A 460 -7.605 -7.255 3.974 1.00 41.22 H new ATOM 0 HB3 PHE A 460 -7.342 -8.419 2.691 1.00 41.22 H new ATOM 0 HD1 PHE A 460 -8.760 -5.035 3.291 1.00 73.42 H new ATOM 0 HD2 PHE A 460 -6.957 -7.670 0.521 1.00 72.12 H new ATOM 0 HE1 PHE A 460 -8.572 -3.169 1.638 1.00 32.11 H new ATOM 0 HE2 PHE A 460 -6.769 -5.804 -1.132 1.00 11.31 H new ATOM 0 HZ PHE A 460 -7.578 -3.576 -0.554 1.00 14.23 H new ATOM 1091 N ASP A 461 -10.458 -7.225 1.221 1.00 24.41 N ATOM 1092 CA ASP A 461 -11.082 -7.274 -0.090 1.00 41.43 C ATOM 1093 C ASP A 461 -10.100 -6.741 -1.137 1.00 11.31 C ATOM 1094 O ASP A 461 -9.609 -5.619 -1.018 1.00 14.11 O ATOM 1095 CB ASP A 461 -12.338 -6.402 -0.133 1.00 55.10 C ATOM 1096 CG ASP A 461 -12.223 -5.064 0.601 1.00 20.22 C ATOM 1097 OD1 ASP A 461 -11.686 -4.084 0.062 1.00 2.54 O ATOM 1098 OD2 ASP A 461 -12.719 -5.052 1.791 1.00 43.41 O ATOM 0 H ASP A 461 -10.372 -6.290 1.618 1.00 24.41 H new ATOM 0 HA ASP A 461 -11.354 -8.309 -0.297 1.00 41.43 H new ATOM 0 HB2 ASP A 461 -12.591 -6.207 -1.175 1.00 55.10 H new ATOM 0 HB3 ASP A 461 -13.167 -6.964 0.296 1.00 55.10 H new ATOM 1103 N CYS A 462 -9.844 -7.570 -2.137 1.00 25.12 N ATOM 1104 CA CYS A 462 -8.930 -7.198 -3.203 1.00 12.44 C ATOM 1105 C CYS A 462 -9.744 -6.559 -4.332 1.00 64.02 C ATOM 1106 O CYS A 462 -9.431 -5.456 -4.780 1.00 24.25 O ATOM 1107 CB CYS A 462 -8.117 -8.396 -3.695 1.00 34.53 C ATOM 1108 SG CYS A 462 -7.670 -9.471 -2.285 1.00 23.14 S ATOM 0 H CYS A 462 -10.254 -8.499 -2.232 1.00 25.12 H new ATOM 0 HA CYS A 462 -8.203 -6.478 -2.827 1.00 12.44 H new ATOM 0 HB2 CYS A 462 -8.694 -8.962 -4.426 1.00 34.53 H new ATOM 0 HB3 CYS A 462 -7.215 -8.051 -4.200 1.00 34.53 H new ATOM 0 HG CYS A 462 -8.338 -10.584 -2.359 1.00 23.14 H new ATOM 1113 N ARG A 463 -10.773 -7.278 -4.756 1.00 34.02 N ATOM 1114 CA ARG A 463 -11.633 -6.794 -5.823 1.00 5.40 C ATOM 1115 C ARG A 463 -11.862 -5.288 -5.679 1.00 20.43 C ATOM 1116 O ARG A 463 -11.526 -4.517 -6.576 1.00 24.51 O ATOM 1117 CB ARG A 463 -12.984 -7.512 -5.809 1.00 25.41 C ATOM 1118 CG ARG A 463 -12.797 -9.031 -5.801 1.00 15.42 C ATOM 1119 CD ARG A 463 -13.978 -9.732 -6.477 1.00 54.25 C ATOM 1120 NE ARG A 463 -13.726 -9.862 -7.930 1.00 24.33 N ATOM 1121 CZ ARG A 463 -14.620 -10.354 -8.812 1.00 11.32 C ATOM 1122 NH1 ARG A 463 -15.836 -10.768 -8.397 1.00 44.23 N ATOM 1123 NH2 ARG A 463 -14.288 -10.426 -10.088 1.00 2.22 N ATOM 0 H ARG A 463 -11.030 -8.191 -4.381 1.00 34.02 H new ATOM 0 HA ARG A 463 -11.134 -7.000 -6.770 1.00 5.40 H new ATOM 0 HB2 ARG A 463 -13.553 -7.207 -4.931 1.00 25.41 H new ATOM 0 HB3 ARG A 463 -13.565 -7.218 -6.683 1.00 25.41 H new ATOM 0 HG2 ARG A 463 -11.872 -9.290 -6.316 1.00 15.42 H new ATOM 0 HG3 ARG A 463 -12.699 -9.384 -4.774 1.00 15.42 H new ATOM 0 HD2 ARG A 463 -14.127 -10.718 -6.036 1.00 54.25 H new ATOM 0 HD3 ARG A 463 -14.893 -9.165 -6.308 1.00 54.25 H new ATOM 0 HE ARG A 463 -12.819 -9.561 -8.287 1.00 24.33 H new ATOM 0 HH11 ARG A 463 -16.085 -10.710 -7.410 1.00 44.23 H new ATOM 0 HH12 ARG A 463 -16.506 -11.139 -9.071 1.00 44.23 H new ATOM 0 HH21 ARG A 463 -13.367 -10.112 -10.394 1.00 2.22 H new ATOM 0 HH22 ARG A 463 -14.953 -10.796 -10.768 1.00 2.22 H new ATOM 1133 N LEU A 464 -12.435 -4.915 -4.543 1.00 73.30 N ATOM 1134 CA LEU A 464 -12.712 -3.515 -4.271 1.00 51.03 C ATOM 1135 C LEU A 464 -11.439 -2.695 -4.490 1.00 0.14 C ATOM 1136 O LEU A 464 -11.405 -1.812 -5.346 1.00 4.13 O ATOM 1137 CB LEU A 464 -13.316 -3.351 -2.875 1.00 44.54 C ATOM 1138 CG LEU A 464 -13.455 -1.914 -2.369 1.00 42.25 C ATOM 1139 CD1 LEU A 464 -12.084 -1.304 -2.069 1.00 44.44 C ATOM 1140 CD2 LEU A 464 -14.260 -1.062 -3.352 1.00 75.25 C ATOM 0 H LEU A 464 -12.714 -5.558 -3.802 1.00 73.30 H new ATOM 0 HA LEU A 464 -13.461 -3.133 -4.965 1.00 51.03 H new ATOM 0 HB2 LEU A 464 -14.303 -3.814 -2.871 1.00 44.54 H new ATOM 0 HB3 LEU A 464 -12.701 -3.907 -2.167 1.00 44.54 H new ATOM 0 HG LEU A 464 -14.011 -1.934 -1.431 1.00 42.25 H new ATOM 0 HD11 LEU A 464 -12.211 -0.282 -1.711 1.00 44.44 H new ATOM 0 HD12 LEU A 464 -11.581 -1.897 -1.305 1.00 44.44 H new ATOM 0 HD13 LEU A 464 -11.482 -1.298 -2.978 1.00 44.44 H new ATOM 0 HD21 LEU A 464 -14.344 -0.045 -2.968 1.00 75.25 H new ATOM 0 HD22 LEU A 464 -13.754 -1.045 -4.317 1.00 75.25 H new ATOM 0 HD23 LEU A 464 -15.256 -1.488 -3.472 1.00 75.25 H new ATOM 1151 N SER A 465 -10.424 -3.015 -3.703 1.00 43.04 N ATOM 1152 CA SER A 465 -9.153 -2.319 -3.799 1.00 73.22 C ATOM 1153 C SER A 465 -8.819 -2.040 -5.267 1.00 64.40 C ATOM 1154 O SER A 465 -8.413 -0.934 -5.615 1.00 70.15 O ATOM 1155 CB SER A 465 -8.030 -3.126 -3.143 1.00 21.23 C ATOM 1156 OG SER A 465 -7.195 -2.313 -2.324 1.00 70.32 O ATOM 0 H SER A 465 -10.456 -3.748 -2.995 1.00 43.04 H new ATOM 0 HA SER A 465 -9.241 -1.372 -3.266 1.00 73.22 H new ATOM 0 HB2 SER A 465 -8.462 -3.924 -2.540 1.00 21.23 H new ATOM 0 HB3 SER A 465 -7.427 -3.602 -3.916 1.00 21.23 H new ATOM 0 HG SER A 465 -6.835 -1.573 -2.856 1.00 70.32 H new ATOM 1161 N LEU A 466 -9.002 -3.065 -6.086 1.00 21.14 N ATOM 1162 CA LEU A 466 -8.726 -2.946 -7.508 1.00 41.14 C ATOM 1163 C LEU A 466 -9.607 -1.846 -8.103 1.00 54.24 C ATOM 1164 O LEU A 466 -9.118 -0.976 -8.824 1.00 61.14 O ATOM 1165 CB LEU A 466 -8.883 -4.300 -8.200 1.00 42.42 C ATOM 1166 CG LEU A 466 -8.183 -4.447 -9.553 1.00 11.35 C ATOM 1167 CD1 LEU A 466 -8.995 -3.781 -10.665 1.00 21.13 C ATOM 1168 CD2 LEU A 466 -6.751 -3.914 -9.490 1.00 72.44 C ATOM 0 H LEU A 466 -9.338 -3.982 -5.792 1.00 21.14 H new ATOM 0 HA LEU A 466 -7.690 -2.649 -7.671 1.00 41.14 H new ATOM 0 HB2 LEU A 466 -8.505 -5.073 -7.532 1.00 42.42 H new ATOM 0 HB3 LEU A 466 -9.947 -4.493 -8.341 1.00 42.42 H new ATOM 0 HG LEU A 466 -8.120 -5.509 -9.792 1.00 11.35 H new ATOM 0 HD11 LEU A 466 -8.476 -3.900 -11.616 1.00 21.13 H new ATOM 0 HD12 LEU A 466 -9.978 -4.248 -10.728 1.00 21.13 H new ATOM 0 HD13 LEU A 466 -9.111 -2.720 -10.445 1.00 21.13 H new ATOM 0 HD21 LEU A 466 -6.276 -4.030 -10.464 1.00 72.44 H new ATOM 0 HD22 LEU A 466 -6.767 -2.859 -9.218 1.00 72.44 H new ATOM 0 HD23 LEU A 466 -6.187 -4.473 -8.743 1.00 72.44 H new ATOM 1179 N HIS A 467 -10.889 -1.917 -7.778 1.00 72.13 N ATOM 1180 CA HIS A 467 -11.843 -0.938 -8.273 1.00 42.45 C ATOM 1181 C HIS A 467 -11.392 0.467 -7.866 1.00 71.12 C ATOM 1182 O HIS A 467 -11.221 1.338 -8.719 1.00 2.41 O ATOM 1183 CB HIS A 467 -13.257 -1.268 -7.793 1.00 42.30 C ATOM 1184 CG HIS A 467 -14.000 -2.231 -8.687 1.00 43.21 C ATOM 1185 ND1 HIS A 467 -14.168 -2.017 -10.044 1.00 0.33 N ATOM 1186 CD2 HIS A 467 -14.616 -3.416 -8.404 1.00 55.11 C ATOM 1187 CE1 HIS A 467 -14.856 -3.032 -10.545 1.00 31.11 C ATOM 1188 NE2 HIS A 467 -15.133 -3.898 -9.528 1.00 45.11 N ATOM 0 H HIS A 467 -11.290 -2.637 -7.178 1.00 72.13 H new ATOM 0 HA HIS A 467 -11.874 -0.972 -9.362 1.00 42.45 H new ATOM 0 HB2 HIS A 467 -13.200 -1.690 -6.790 1.00 42.30 H new ATOM 0 HB3 HIS A 467 -13.829 -0.343 -7.718 1.00 42.30 H new ATOM 0 HD2 HIS A 467 -14.673 -3.882 -7.431 1.00 55.11 H new ATOM 0 HE1 HIS A 467 -15.147 -3.153 -11.578 1.00 31.11 H new ATOM 0 HE2 HIS A 467 -15.652 -4.772 -9.616 1.00 45.11 H new ATOM 1195 N GLN A 468 -11.210 0.644 -6.566 1.00 24.13 N ATOM 1196 CA GLN A 468 -10.782 1.927 -6.038 1.00 3.12 C ATOM 1197 C GLN A 468 -9.459 2.350 -6.678 1.00 73.43 C ATOM 1198 O GLN A 468 -9.420 3.298 -7.463 1.00 24.32 O ATOM 1199 CB GLN A 468 -10.663 1.881 -4.513 1.00 65.14 C ATOM 1200 CG GLN A 468 -12.030 1.665 -3.862 1.00 13.52 C ATOM 1201 CD GLN A 468 -11.960 1.891 -2.352 1.00 42.35 C ATOM 1202 OE1 GLN A 468 -10.911 1.318 -1.766 1.00 1.42 O flip ATOM 1203 NE2 GLN A 468 -12.801 2.542 -1.755 1.00 51.10 N flip ATOM 0 H GLN A 468 -11.351 -0.081 -5.862 1.00 24.13 H new ATOM 0 HA GLN A 468 -11.539 2.671 -6.288 1.00 3.12 H new ATOM 0 HB2 GLN A 468 -9.987 1.077 -4.222 1.00 65.14 H new ATOM 0 HB3 GLN A 468 -10.227 2.812 -4.151 1.00 65.14 H new ATOM 0 HG2 GLN A 468 -12.758 2.347 -4.302 1.00 13.52 H new ATOM 0 HG3 GLN A 468 -12.378 0.652 -4.066 1.00 13.52 H new ATOM 0 HE21 GLN A 468 -13.582 2.956 -2.264 1.00 51.10 H new ATOM 0 HE22 GLN A 468 -12.723 2.673 -0.746 1.00 51.10 H new ATOM 1210 N VAL A 469 -8.407 1.628 -6.321 1.00 3.22 N ATOM 1211 CA VAL A 469 -7.086 1.916 -6.851 1.00 74.45 C ATOM 1212 C VAL A 469 -7.203 2.279 -8.334 1.00 20.14 C ATOM 1213 O VAL A 469 -6.599 3.247 -8.789 1.00 71.13 O ATOM 1214 CB VAL A 469 -6.149 0.733 -6.598 1.00 53.14 C ATOM 1215 CG1 VAL A 469 -6.209 -0.270 -7.752 1.00 65.12 C ATOM 1216 CG2 VAL A 469 -4.715 1.210 -6.358 1.00 1.41 C ATOM 0 H VAL A 469 -8.443 0.843 -5.670 1.00 3.22 H new ATOM 0 HA VAL A 469 -6.650 2.774 -6.339 1.00 74.45 H new ATOM 0 HB VAL A 469 -6.487 0.225 -5.695 1.00 53.14 H new ATOM 0 HG11 VAL A 469 -5.534 -1.101 -7.547 1.00 65.12 H new ATOM 0 HG12 VAL A 469 -7.227 -0.646 -7.855 1.00 65.12 H new ATOM 0 HG13 VAL A 469 -5.909 0.222 -8.677 1.00 65.12 H new ATOM 0 HG21 VAL A 469 -4.070 0.349 -6.181 1.00 1.41 H new ATOM 0 HG22 VAL A 469 -4.361 1.754 -7.234 1.00 1.41 H new ATOM 0 HG23 VAL A 469 -4.691 1.867 -5.488 1.00 1.41 H new ATOM 1226 N ASN A 470 -7.985 1.479 -9.045 1.00 65.13 N ATOM 1227 CA ASN A 470 -8.190 1.703 -10.465 1.00 73.34 C ATOM 1228 C ASN A 470 -8.727 3.120 -10.682 1.00 20.33 C ATOM 1229 O ASN A 470 -8.030 3.975 -11.226 1.00 53.25 O ATOM 1230 CB ASN A 470 -9.211 0.718 -11.036 1.00 32.31 C ATOM 1231 CG ASN A 470 -8.523 -0.548 -11.551 1.00 5.21 C ATOM 1232 OD1 ASN A 470 -7.538 -0.982 -10.770 1.00 13.22 O flip ATOM 1233 ND2 ASN A 470 -8.864 -1.095 -12.585 1.00 4.15 N flip ATOM 0 H ASN A 470 -8.484 0.675 -8.663 1.00 65.13 H new ATOM 0 HA ASN A 470 -7.234 1.564 -10.969 1.00 73.34 H new ATOM 0 HB2 ASN A 470 -9.937 0.454 -10.267 1.00 32.31 H new ATOM 0 HB3 ASN A 470 -9.764 1.191 -11.847 1.00 32.31 H new ATOM 0 HD21 ASN A 470 -9.629 -0.709 -13.138 1.00 4.15 H new ATOM 0 HD22 ASN A 470 -8.384 -1.939 -12.898 1.00 4.15 H new ATOM 1239 N GLN A 471 -9.961 3.323 -10.246 1.00 21.21 N ATOM 1240 CA GLN A 471 -10.600 4.621 -10.385 1.00 30.24 C ATOM 1241 C GLN A 471 -9.601 5.740 -10.082 1.00 22.34 C ATOM 1242 O GLN A 471 -9.516 6.717 -10.824 1.00 61.54 O ATOM 1243 CB GLN A 471 -11.831 4.726 -9.481 1.00 74.42 C ATOM 1244 CG GLN A 471 -12.880 3.680 -9.863 1.00 34.11 C ATOM 1245 CD GLN A 471 -13.905 4.263 -10.837 1.00 0.44 C ATOM 1246 OE1 GLN A 471 -14.089 3.783 -11.945 1.00 74.32 O ATOM 1247 NE2 GLN A 471 -14.564 5.317 -10.365 1.00 40.35 N ATOM 0 H GLN A 471 -10.536 2.611 -9.796 1.00 21.21 H new ATOM 0 HA GLN A 471 -10.936 4.730 -11.416 1.00 30.24 H new ATOM 0 HB2 GLN A 471 -11.536 4.588 -8.441 1.00 74.42 H new ATOM 0 HB3 GLN A 471 -12.261 5.724 -9.560 1.00 74.42 H new ATOM 0 HG2 GLN A 471 -12.391 2.818 -10.317 1.00 34.11 H new ATOM 0 HG3 GLN A 471 -13.387 3.323 -8.966 1.00 34.11 H new ATOM 0 HE21 GLN A 471 -14.361 5.668 -9.429 1.00 40.35 H new ATOM 0 HE22 GLN A 471 -15.272 5.775 -10.939 1.00 40.35 H new ATOM 1254 N ALA A 472 -8.870 5.557 -8.993 1.00 4.42 N ATOM 1255 CA ALA A 472 -7.880 6.540 -8.581 1.00 12.14 C ATOM 1256 C ALA A 472 -6.878 6.752 -9.718 1.00 22.02 C ATOM 1257 O ALA A 472 -6.544 7.886 -10.052 1.00 50.42 O ATOM 1258 CB ALA A 472 -7.207 6.076 -7.289 1.00 43.32 C ATOM 0 H ALA A 472 -8.943 4.743 -8.383 1.00 4.42 H new ATOM 0 HA ALA A 472 -8.353 7.500 -8.374 1.00 12.14 H new ATOM 0 HB1 ALA A 472 -6.465 6.813 -6.980 1.00 43.32 H new ATOM 0 HB2 ALA A 472 -7.958 5.967 -6.506 1.00 43.32 H new ATOM 0 HB3 ALA A 472 -6.717 5.117 -7.458 1.00 43.32 H new ATOM 1264 N MET A 473 -6.426 5.640 -10.280 1.00 15.31 N ATOM 1265 CA MET A 473 -5.469 5.690 -11.373 1.00 22.43 C ATOM 1266 C MET A 473 -6.080 6.354 -12.608 1.00 54.10 C ATOM 1267 O MET A 473 -5.559 7.352 -13.103 1.00 71.22 O ATOM 1268 CB MET A 473 -5.022 4.270 -11.724 1.00 74.54 C ATOM 1269 CG MET A 473 -4.175 3.667 -10.602 1.00 62.25 C ATOM 1270 SD MET A 473 -4.003 1.906 -10.844 1.00 41.45 S ATOM 1271 CE MET A 473 -2.552 1.598 -9.853 1.00 62.45 C ATOM 0 H MET A 473 -6.704 4.700 -9.999 1.00 15.31 H new ATOM 0 HA MET A 473 -4.611 6.282 -11.054 1.00 22.43 H new ATOM 0 HB2 MET A 473 -5.896 3.643 -11.901 1.00 74.54 H new ATOM 0 HB3 MET A 473 -4.447 4.285 -12.650 1.00 74.54 H new ATOM 0 HG2 MET A 473 -3.192 4.138 -10.585 1.00 62.25 H new ATOM 0 HG3 MET A 473 -4.641 3.866 -9.637 1.00 62.25 H new ATOM 0 HE1 MET A 473 -2.066 0.684 -10.194 1.00 62.45 H new ATOM 0 HE2 MET A 473 -1.860 2.435 -9.951 1.00 62.45 H new ATOM 0 HE3 MET A 473 -2.842 1.487 -8.808 1.00 62.45 H new ATOM 1279 N MET A 474 -7.177 5.773 -13.072 1.00 45.01 N ATOM 1280 CA MET A 474 -7.864 6.297 -14.240 1.00 2.13 C ATOM 1281 C MET A 474 -8.484 7.663 -13.944 1.00 14.34 C ATOM 1282 O MET A 474 -8.973 8.336 -14.851 1.00 22.12 O ATOM 1283 CB MET A 474 -8.961 5.319 -14.667 1.00 0.33 C ATOM 1284 CG MET A 474 -10.192 5.449 -13.767 1.00 61.31 C ATOM 1285 SD MET A 474 -11.328 6.641 -14.454 1.00 3.32 S ATOM 1286 CE MET A 474 -11.969 7.362 -12.952 1.00 22.34 C ATOM 0 H MET A 474 -7.607 4.945 -12.660 1.00 45.01 H new ATOM 0 HA MET A 474 -7.137 6.416 -15.044 1.00 2.13 H new ATOM 0 HB2 MET A 474 -9.241 5.511 -15.703 1.00 0.33 H new ATOM 0 HB3 MET A 474 -8.580 4.299 -14.624 1.00 0.33 H new ATOM 0 HG2 MET A 474 -10.684 4.481 -13.668 1.00 61.31 H new ATOM 0 HG3 MET A 474 -9.890 5.757 -12.766 1.00 61.31 H new ATOM 0 HE1 MET A 474 -12.545 8.255 -13.194 1.00 22.34 H new ATOM 0 HE2 MET A 474 -12.613 6.641 -12.448 1.00 22.34 H new ATOM 0 HE3 MET A 474 -11.141 7.631 -12.295 1.00 22.34 H new ATOM 1294 N SER A 475 -8.444 8.034 -12.674 1.00 25.05 N ATOM 1295 CA SER A 475 -8.996 9.309 -12.248 1.00 23.51 C ATOM 1296 C SER A 475 -8.026 10.441 -12.595 1.00 61.10 C ATOM 1297 O SER A 475 -8.410 11.415 -13.238 1.00 3.23 O ATOM 1298 CB SER A 475 -9.294 9.305 -10.747 1.00 75.45 C ATOM 1299 OG SER A 475 -9.184 10.609 -10.178 1.00 15.55 O ATOM 0 H SER A 475 -8.038 7.474 -11.925 1.00 25.05 H new ATOM 0 HA SER A 475 -9.935 9.470 -12.777 1.00 23.51 H new ATOM 0 HB2 SER A 475 -10.299 8.919 -10.578 1.00 75.45 H new ATOM 0 HB3 SER A 475 -8.604 8.629 -10.242 1.00 75.45 H new ATOM 0 HG SER A 475 -8.722 10.552 -9.316 1.00 15.55 H new ATOM 1304 N ASN A 476 -6.789 10.273 -12.151 1.00 15.31 N ATOM 1305 CA ASN A 476 -5.762 11.268 -12.408 1.00 54.22 C ATOM 1306 C ASN A 476 -4.494 10.571 -12.904 1.00 63.20 C ATOM 1307 O ASN A 476 -3.676 10.118 -12.104 1.00 2.24 O ATOM 1308 CB ASN A 476 -5.410 12.037 -11.132 1.00 32.42 C ATOM 1309 CG ASN A 476 -5.026 11.079 -10.003 1.00 32.22 C ATOM 1310 OD1 ASN A 476 -5.710 10.112 -9.714 1.00 13.10 O ATOM 1311 ND2 ASN A 476 -3.895 11.401 -9.382 1.00 43.12 N ATOM 0 H ASN A 476 -6.475 9.464 -11.615 1.00 15.31 H new ATOM 0 HA ASN A 476 -6.145 11.963 -13.155 1.00 54.22 H new ATOM 0 HB2 ASN A 476 -4.584 12.720 -11.331 1.00 32.42 H new ATOM 0 HB3 ASN A 476 -6.260 12.646 -10.824 1.00 32.42 H new ATOM 0 HD21 ASN A 476 -3.553 10.824 -8.614 1.00 43.12 H new ATOM 0 HD22 ASN A 476 -3.370 12.225 -9.674 1.00 43.12 H new ATOM 1317 N LEU A 477 -4.369 10.507 -14.221 1.00 32.34 N ATOM 1318 CA LEU A 477 -3.214 9.872 -14.834 1.00 23.53 C ATOM 1319 C LEU A 477 -2.142 10.929 -15.108 1.00 23.13 C ATOM 1320 O LEU A 477 -0.950 10.661 -14.964 1.00 4.41 O ATOM 1321 CB LEU A 477 -3.633 9.082 -16.076 1.00 74.35 C ATOM 1322 CG LEU A 477 -4.751 8.058 -15.876 1.00 42.44 C ATOM 1323 CD1 LEU A 477 -5.492 7.792 -17.187 1.00 20.05 C ATOM 1324 CD2 LEU A 477 -4.209 6.771 -15.251 1.00 33.13 C ATOM 0 H LEU A 477 -5.049 10.884 -14.881 1.00 32.34 H new ATOM 0 HA LEU A 477 -2.775 9.142 -14.154 1.00 23.53 H new ATOM 0 HB2 LEU A 477 -3.949 9.790 -16.842 1.00 74.35 H new ATOM 0 HB3 LEU A 477 -2.757 8.562 -16.464 1.00 74.35 H new ATOM 0 HG LEU A 477 -5.476 8.475 -15.177 1.00 42.44 H new ATOM 0 HD11 LEU A 477 -6.282 7.060 -17.017 1.00 20.05 H new ATOM 0 HD12 LEU A 477 -5.930 8.721 -17.552 1.00 20.05 H new ATOM 0 HD13 LEU A 477 -4.793 7.405 -17.928 1.00 20.05 H new ATOM 0 HD21 LEU A 477 -5.024 6.059 -15.119 1.00 33.13 H new ATOM 0 HD22 LEU A 477 -3.452 6.339 -15.906 1.00 33.13 H new ATOM 0 HD23 LEU A 477 -3.764 6.997 -14.282 1.00 33.13 H new ATOM 1335 N THR A 478 -2.605 12.107 -15.499 1.00 32.44 N ATOM 1336 CA THR A 478 -1.700 13.205 -15.795 1.00 43.22 C ATOM 1337 C THR A 478 -0.810 13.502 -14.588 1.00 64.35 C ATOM 1338 O THR A 478 0.220 14.161 -14.718 1.00 34.40 O ATOM 1339 CB THR A 478 -2.542 14.403 -16.239 1.00 71.31 C ATOM 1340 OG1 THR A 478 -1.598 15.286 -16.840 1.00 11.21 O ATOM 1341 CG2 THR A 478 -3.096 15.201 -15.056 1.00 3.04 C ATOM 0 H THR A 478 -3.594 12.325 -15.618 1.00 32.44 H new ATOM 0 HA THR A 478 -1.018 12.949 -16.606 1.00 43.22 H new ATOM 0 HB THR A 478 -3.367 14.056 -16.861 1.00 71.31 H new ATOM 0 HG1 THR A 478 -0.705 15.104 -16.481 1.00 11.21 H new ATOM 0 HG21 THR A 478 -3.686 16.039 -15.427 1.00 3.04 H new ATOM 0 HG22 THR A 478 -3.727 14.555 -14.445 1.00 3.04 H new ATOM 0 HG23 THR A 478 -2.270 15.577 -14.452 1.00 3.04 H new ATOM 1349 N ARG A 479 -1.238 13.001 -13.439 1.00 31.01 N ATOM 1350 CA ARG A 479 -0.492 13.204 -12.209 1.00 21.24 C ATOM 1351 C ARG A 479 0.729 12.281 -12.169 1.00 73.23 C ATOM 1352 O ARG A 479 1.849 12.719 -12.427 1.00 25.24 O ATOM 1353 CB ARG A 479 -1.366 12.933 -10.982 1.00 34.42 C ATOM 1354 CG ARG A 479 -1.924 14.236 -10.409 1.00 14.12 C ATOM 1355 CD ARG A 479 -2.759 14.982 -11.453 1.00 64.52 C ATOM 1356 NE ARG A 479 -3.422 16.150 -10.830 1.00 45.32 N ATOM 1357 CZ ARG A 479 -4.409 16.061 -9.915 1.00 51.33 C ATOM 1358 NH1 ARG A 479 -4.858 14.854 -9.506 1.00 54.40 N ATOM 1359 NH2 ARG A 479 -4.930 17.170 -9.424 1.00 72.03 N ATOM 0 H ARG A 479 -2.093 12.454 -13.334 1.00 31.01 H new ATOM 0 HA ARG A 479 -0.167 14.244 -12.188 1.00 21.24 H new ATOM 0 HB2 ARG A 479 -2.187 12.270 -11.255 1.00 34.42 H new ATOM 0 HB3 ARG A 479 -0.781 12.418 -10.220 1.00 34.42 H new ATOM 0 HG2 ARG A 479 -2.538 14.019 -9.535 1.00 14.12 H new ATOM 0 HG3 ARG A 479 -1.104 14.870 -10.073 1.00 14.12 H new ATOM 0 HD2 ARG A 479 -2.121 15.310 -12.274 1.00 64.52 H new ATOM 0 HD3 ARG A 479 -3.507 14.313 -11.878 1.00 64.52 H new ATOM 0 HE ARG A 479 -3.113 17.081 -11.110 1.00 45.32 H new ATOM 0 HH11 ARG A 479 -4.450 14.001 -9.890 1.00 54.40 H new ATOM 0 HH12 ARG A 479 -5.605 14.795 -8.814 1.00 54.40 H new ATOM 0 HH21 ARG A 479 -4.586 18.078 -9.737 1.00 72.03 H new ATOM 0 HH22 ARG A 479 -5.677 17.119 -8.731 1.00 72.03 H new ATOM 1369 N GLN A 480 0.471 11.024 -11.845 1.00 33.03 N ATOM 1370 CA GLN A 480 1.533 10.036 -11.771 1.00 44.34 C ATOM 1371 C GLN A 480 1.388 9.013 -12.896 1.00 34.24 C ATOM 1372 O GLN A 480 2.362 8.369 -13.286 1.00 74.43 O ATOM 1373 CB GLN A 480 1.548 9.349 -10.403 1.00 2.31 C ATOM 1374 CG GLN A 480 0.233 8.606 -10.150 1.00 72.51 C ATOM 1375 CD GLN A 480 -0.836 9.555 -9.603 1.00 32.23 C ATOM 1376 OE1 GLN A 480 -1.822 9.808 -10.460 1.00 74.23 O flip ATOM 1377 NE2 GLN A 480 -0.770 10.024 -8.478 1.00 64.04 N flip ATOM 0 H GLN A 480 -0.460 10.666 -11.630 1.00 33.03 H new ATOM 0 HA GLN A 480 2.487 10.548 -11.895 1.00 44.34 H new ATOM 0 HB2 GLN A 480 2.382 8.649 -10.353 1.00 2.31 H new ATOM 0 HB3 GLN A 480 1.707 10.091 -9.621 1.00 2.31 H new ATOM 0 HG2 GLN A 480 -0.118 8.153 -11.078 1.00 72.51 H new ATOM 0 HG3 GLN A 480 0.400 7.794 -9.442 1.00 72.51 H new ATOM 0 HE21 GLN A 480 0.016 9.787 -7.872 1.00 64.04 H new ATOM 0 HE22 GLN A 480 -1.501 10.653 -8.144 1.00 64.04 H new ATOM 1384 N GLY A 481 0.164 8.892 -13.389 1.00 34.53 N ATOM 1385 CA GLY A 481 -0.121 7.957 -14.464 1.00 33.21 C ATOM 1386 C GLY A 481 0.668 6.658 -14.285 1.00 11.24 C ATOM 1387 O GLY A 481 1.229 6.130 -15.245 1.00 42.31 O ATOM 0 H GLY A 481 -0.642 9.426 -13.064 1.00 34.53 H new ATOM 0 HA2 GLY A 481 -1.189 7.738 -14.487 1.00 33.21 H new ATOM 0 HA3 GLY A 481 0.132 8.411 -15.422 1.00 33.21 H new ATOM 1391 N SER A 482 0.684 6.179 -13.050 1.00 3.12 N ATOM 1392 CA SER A 482 1.394 4.952 -12.733 1.00 43.14 C ATOM 1393 C SER A 482 0.411 3.894 -12.228 1.00 62.20 C ATOM 1394 O SER A 482 0.276 3.691 -11.022 1.00 1.24 O ATOM 1395 CB SER A 482 2.486 5.202 -11.689 1.00 30.23 C ATOM 1396 OG SER A 482 3.588 4.312 -11.847 1.00 52.42 O ATOM 0 H SER A 482 0.217 6.619 -12.257 1.00 3.12 H new ATOM 0 HA SER A 482 1.873 4.589 -13.642 1.00 43.14 H new ATOM 0 HB2 SER A 482 2.836 6.231 -11.770 1.00 30.23 H new ATOM 0 HB3 SER A 482 2.066 5.086 -10.690 1.00 30.23 H new ATOM 0 HG SER A 482 4.264 4.504 -11.164 1.00 52.42 H new ATOM 1401 N PRO A 483 -0.268 3.229 -13.202 1.00 51.41 N ATOM 1402 CA PRO A 483 -1.234 2.197 -12.869 1.00 3.41 C ATOM 1403 C PRO A 483 -0.533 0.910 -12.431 1.00 51.03 C ATOM 1404 O PRO A 483 -1.189 -0.081 -12.114 1.00 70.02 O ATOM 1405 CB PRO A 483 -2.070 2.021 -14.126 1.00 51.10 C ATOM 1406 CG PRO A 483 -1.251 2.621 -15.258 1.00 22.31 C ATOM 1407 CD PRO A 483 -0.133 3.443 -14.639 1.00 13.33 C ATOM 0 HA PRO A 483 -1.865 2.468 -12.022 1.00 3.41 H new ATOM 0 HB2 PRO A 483 -2.280 0.968 -14.311 1.00 51.10 H new ATOM 0 HB3 PRO A 483 -3.031 2.525 -14.030 1.00 51.10 H new ATOM 0 HG2 PRO A 483 -0.841 1.834 -15.891 1.00 22.31 H new ATOM 0 HG3 PRO A 483 -1.878 3.247 -15.893 1.00 22.31 H new ATOM 0 HD2 PRO A 483 0.843 3.117 -14.998 1.00 13.33 H new ATOM 0 HD3 PRO A 483 -0.230 4.499 -14.893 1.00 13.33 H new ATOM 1412 N ASP A 484 0.791 0.967 -12.428 1.00 2.13 N ATOM 1413 CA ASP A 484 1.588 -0.183 -12.034 1.00 41.44 C ATOM 1414 C ASP A 484 2.357 0.150 -10.754 1.00 50.52 C ATOM 1415 O ASP A 484 3.479 -0.314 -10.561 1.00 33.23 O ATOM 1416 CB ASP A 484 2.606 -0.542 -13.117 1.00 21.33 C ATOM 1417 CG ASP A 484 2.004 -1.023 -14.438 1.00 1.22 C ATOM 1418 OD1 ASP A 484 1.959 -2.231 -14.718 1.00 14.43 O ATOM 1419 OD2 ASP A 484 1.561 -0.088 -15.209 1.00 42.00 O ATOM 0 H ASP A 484 1.332 1.791 -12.692 1.00 2.13 H new ATOM 0 HA ASP A 484 0.913 -1.025 -11.879 1.00 41.44 H new ATOM 0 HB2 ASP A 484 3.226 0.332 -13.315 1.00 21.33 H new ATOM 0 HB3 ASP A 484 3.265 -1.320 -12.731 1.00 21.33 H new ATOM 1424 N CYS A 485 1.721 0.951 -9.912 1.00 43.23 N ATOM 1425 CA CYS A 485 2.332 1.350 -8.655 1.00 42.31 C ATOM 1426 C CYS A 485 1.634 0.597 -7.521 1.00 32.13 C ATOM 1427 O CYS A 485 1.695 1.012 -6.364 1.00 35.42 O ATOM 1428 CB CYS A 485 2.271 2.866 -8.453 1.00 15.22 C ATOM 1429 SG CYS A 485 3.797 3.449 -7.629 1.00 45.44 S ATOM 0 H CYS A 485 0.790 1.334 -10.075 1.00 43.23 H new ATOM 0 HA CYS A 485 3.391 1.092 -8.665 1.00 42.31 H new ATOM 0 HB2 CYS A 485 2.154 3.365 -9.415 1.00 15.22 H new ATOM 0 HB3 CYS A 485 1.400 3.126 -7.851 1.00 15.22 H new ATOM 0 HG CYS A 485 4.338 2.466 -6.973 1.00 45.44 H new ATOM 1434 N VAL A 486 0.987 -0.499 -7.892 1.00 41.53 N ATOM 1435 CA VAL A 486 0.278 -1.314 -6.919 1.00 14.02 C ATOM 1436 C VAL A 486 1.210 -2.415 -6.410 1.00 10.13 C ATOM 1437 O VAL A 486 2.119 -2.843 -7.120 1.00 51.02 O ATOM 1438 CB VAL A 486 -1.012 -1.861 -7.536 1.00 15.40 C ATOM 1439 CG1 VAL A 486 -1.984 -2.323 -6.450 1.00 62.13 C ATOM 1440 CG2 VAL A 486 -1.665 -0.822 -8.451 1.00 31.51 C ATOM 0 H VAL A 486 0.939 -0.841 -8.852 1.00 41.53 H new ATOM 0 HA VAL A 486 -0.018 -0.713 -6.059 1.00 14.02 H new ATOM 0 HB VAL A 486 -0.753 -2.727 -8.145 1.00 15.40 H new ATOM 0 HG11 VAL A 486 -2.892 -2.707 -6.914 1.00 62.13 H new ATOM 0 HG12 VAL A 486 -1.519 -3.110 -5.856 1.00 62.13 H new ATOM 0 HG13 VAL A 486 -2.235 -1.482 -5.804 1.00 62.13 H new ATOM 0 HG21 VAL A 486 -2.579 -1.235 -8.877 1.00 31.51 H new ATOM 0 HG22 VAL A 486 -1.905 0.071 -7.874 1.00 31.51 H new ATOM 0 HG23 VAL A 486 -0.976 -0.561 -9.255 1.00 31.51 H new ATOM 1450 N ILE A 487 0.952 -2.843 -5.182 1.00 70.01 N ATOM 1451 CA ILE A 487 1.755 -3.885 -4.569 1.00 25.31 C ATOM 1452 C ILE A 487 0.844 -4.832 -3.785 1.00 44.11 C ATOM 1453 O ILE A 487 0.511 -4.565 -2.632 1.00 53.53 O ATOM 1454 CB ILE A 487 2.875 -3.273 -3.726 1.00 73.21 C ATOM 1455 CG1 ILE A 487 3.420 -2.000 -4.379 1.00 65.54 C ATOM 1456 CG2 ILE A 487 3.982 -4.295 -3.456 1.00 3.35 C ATOM 1457 CD1 ILE A 487 4.209 -2.329 -5.648 1.00 12.43 C ATOM 0 H ILE A 487 0.197 -2.486 -4.596 1.00 70.01 H new ATOM 0 HA ILE A 487 2.252 -4.481 -5.334 1.00 25.31 H new ATOM 0 HB ILE A 487 2.457 -2.988 -2.760 1.00 73.21 H new ATOM 0 HG12 ILE A 487 2.595 -1.330 -4.623 1.00 65.54 H new ATOM 0 HG13 ILE A 487 4.062 -1.472 -3.674 1.00 65.54 H new ATOM 0 HG21 ILE A 487 4.765 -3.833 -2.855 1.00 3.35 H new ATOM 0 HG22 ILE A 487 3.567 -5.147 -2.918 1.00 3.35 H new ATOM 0 HG23 ILE A 487 4.403 -4.633 -4.403 1.00 3.35 H new ATOM 0 HD11 ILE A 487 4.585 -1.407 -6.092 1.00 12.43 H new ATOM 0 HD12 ILE A 487 5.047 -2.979 -5.397 1.00 12.43 H new ATOM 0 HD13 ILE A 487 3.558 -2.835 -6.360 1.00 12.43 H new ATOM 1468 N PRO A 488 0.457 -5.947 -4.460 1.00 2.21 N ATOM 1469 CA PRO A 488 -0.410 -6.935 -3.840 1.00 4.40 C ATOM 1470 C PRO A 488 0.360 -7.777 -2.820 1.00 53.24 C ATOM 1471 O PRO A 488 0.984 -8.774 -3.178 1.00 32.23 O ATOM 1472 CB PRO A 488 -0.960 -7.755 -4.993 1.00 20.03 C ATOM 1473 CG PRO A 488 -0.028 -7.501 -6.168 1.00 3.53 C ATOM 1474 CD PRO A 488 0.832 -6.296 -5.827 1.00 10.14 C ATOM 0 HA PRO A 488 -1.221 -6.483 -3.268 1.00 4.40 H new ATOM 0 HB2 PRO A 488 -0.989 -8.815 -4.740 1.00 20.03 H new ATOM 0 HB3 PRO A 488 -1.981 -7.457 -5.233 1.00 20.03 H new ATOM 0 HG2 PRO A 488 0.596 -8.375 -6.356 1.00 3.53 H new ATOM 0 HG3 PRO A 488 -0.601 -7.317 -7.077 1.00 3.53 H new ATOM 0 HD2 PRO A 488 1.893 -6.534 -5.898 1.00 10.14 H new ATOM 0 HD3 PRO A 488 0.645 -5.469 -6.512 1.00 10.14 H new ATOM 1479 N PHE A 489 0.291 -7.344 -1.569 1.00 52.10 N ATOM 1480 CA PHE A 489 0.973 -8.046 -0.496 1.00 42.31 C ATOM 1481 C PHE A 489 0.163 -9.257 -0.030 1.00 35.24 C ATOM 1482 O PHE A 489 -1.067 -9.230 -0.051 1.00 64.13 O ATOM 1483 CB PHE A 489 1.110 -7.061 0.666 1.00 41.33 C ATOM 1484 CG PHE A 489 2.294 -7.350 1.591 1.00 2.13 C ATOM 1485 CD1 PHE A 489 3.527 -6.858 1.293 1.00 12.22 C ATOM 1486 CD2 PHE A 489 2.114 -8.100 2.712 1.00 73.52 C ATOM 1487 CE1 PHE A 489 4.626 -7.126 2.153 1.00 15.33 C ATOM 1488 CE2 PHE A 489 3.213 -8.368 3.570 1.00 23.40 C ATOM 1489 CZ PHE A 489 4.445 -7.875 3.273 1.00 60.32 C ATOM 0 H PHE A 489 -0.227 -6.516 -1.275 1.00 52.10 H new ATOM 0 HA PHE A 489 1.942 -8.404 -0.843 1.00 42.31 H new ATOM 0 HB2 PHE A 489 1.214 -6.053 0.264 1.00 41.33 H new ATOM 0 HB3 PHE A 489 0.191 -7.077 1.253 1.00 41.33 H new ATOM 0 HD1 PHE A 489 3.670 -6.264 0.403 1.00 12.22 H new ATOM 0 HD2 PHE A 489 1.136 -8.491 2.949 1.00 73.52 H new ATOM 0 HE1 PHE A 489 5.605 -6.735 1.917 1.00 15.33 H new ATOM 0 HE2 PHE A 489 3.070 -8.964 4.459 1.00 23.40 H new ATOM 0 HZ PHE A 489 5.280 -8.079 3.927 1.00 60.32 H new ATOM 1498 N LEU A 490 0.884 -10.290 0.379 1.00 64.13 N ATOM 1499 CA LEU A 490 0.247 -11.508 0.850 1.00 75.53 C ATOM 1500 C LEU A 490 0.910 -11.954 2.155 1.00 43.30 C ATOM 1501 O LEU A 490 2.012 -12.502 2.140 1.00 50.05 O ATOM 1502 CB LEU A 490 0.262 -12.578 -0.244 1.00 75.32 C ATOM 1503 CG LEU A 490 -0.485 -13.874 0.074 1.00 63.21 C ATOM 1504 CD1 LEU A 490 0.433 -14.878 0.772 1.00 4.10 C ATOM 1505 CD2 LEU A 490 -1.750 -13.592 0.887 1.00 12.31 C ATOM 0 H LEU A 490 1.904 -10.309 0.394 1.00 64.13 H new ATOM 0 HA LEU A 490 -0.805 -11.326 1.072 1.00 75.53 H new ATOM 0 HB2 LEU A 490 -0.166 -12.149 -1.150 1.00 75.32 H new ATOM 0 HB3 LEU A 490 1.300 -12.826 -0.468 1.00 75.32 H new ATOM 0 HG LEU A 490 -0.801 -14.326 -0.866 1.00 63.21 H new ATOM 0 HD11 LEU A 490 -0.123 -15.791 0.987 1.00 4.10 H new ATOM 0 HD12 LEU A 490 1.277 -15.111 0.123 1.00 4.10 H new ATOM 0 HD13 LEU A 490 0.800 -14.449 1.704 1.00 4.10 H new ATOM 0 HD21 LEU A 490 -2.262 -14.530 1.100 1.00 12.31 H new ATOM 0 HD22 LEU A 490 -1.479 -13.106 1.824 1.00 12.31 H new ATOM 0 HD23 LEU A 490 -2.411 -12.939 0.317 1.00 12.31 H new ATOM 1516 N PRO A 491 0.194 -11.697 3.281 1.00 3.50 N ATOM 1517 CA PRO A 491 0.700 -12.065 4.592 1.00 33.14 C ATOM 1518 C PRO A 491 0.583 -13.574 4.821 1.00 52.12 C ATOM 1519 O PRO A 491 0.000 -14.286 4.004 1.00 74.45 O ATOM 1520 CB PRO A 491 -0.123 -11.250 5.575 1.00 23.22 C ATOM 1521 CG PRO A 491 -1.364 -10.809 4.816 1.00 63.52 C ATOM 1522 CD PRO A 491 -1.115 -11.050 3.336 1.00 63.43 C ATOM 0 HA PRO A 491 1.762 -11.850 4.708 1.00 33.14 H new ATOM 0 HB2 PRO A 491 -0.390 -11.845 6.448 1.00 23.22 H new ATOM 0 HB3 PRO A 491 0.440 -10.389 5.936 1.00 23.22 H new ATOM 0 HG2 PRO A 491 -2.236 -11.369 5.153 1.00 63.52 H new ATOM 0 HG3 PRO A 491 -1.571 -9.755 5.002 1.00 63.52 H new ATOM 0 HD2 PRO A 491 -1.889 -11.684 2.902 1.00 63.43 H new ATOM 0 HD3 PRO A 491 -1.118 -10.115 2.776 1.00 63.43 H new ATOM 1527 N LEU A 492 1.145 -14.017 5.936 1.00 51.13 N ATOM 1528 CA LEU A 492 1.112 -15.427 6.283 1.00 3.12 C ATOM 1529 C LEU A 492 -0.282 -15.785 6.806 1.00 25.10 C ATOM 1530 O LEU A 492 -0.736 -16.917 6.647 1.00 10.14 O ATOM 1531 CB LEU A 492 2.241 -15.767 7.257 1.00 42.40 C ATOM 1532 CG LEU A 492 3.662 -15.520 6.748 1.00 21.54 C ATOM 1533 CD1 LEU A 492 3.877 -14.044 6.414 1.00 63.34 C ATOM 1534 CD2 LEU A 492 4.699 -16.039 7.746 1.00 73.31 C ATOM 0 H LEU A 492 1.626 -13.423 6.611 1.00 51.13 H new ATOM 0 HA LEU A 492 1.290 -16.041 5.400 1.00 3.12 H new ATOM 0 HB2 LEU A 492 2.096 -15.185 8.167 1.00 42.40 H new ATOM 0 HB3 LEU A 492 2.152 -16.818 7.532 1.00 42.40 H new ATOM 0 HG LEU A 492 3.795 -16.081 5.823 1.00 21.54 H new ATOM 0 HD11 LEU A 492 4.895 -13.897 6.055 1.00 63.34 H new ATOM 0 HD12 LEU A 492 3.172 -13.739 5.641 1.00 63.34 H new ATOM 0 HD13 LEU A 492 3.717 -13.442 7.308 1.00 63.34 H new ATOM 0 HD21 LEU A 492 5.701 -15.851 7.360 1.00 73.31 H new ATOM 0 HD22 LEU A 492 4.575 -15.526 8.700 1.00 73.31 H new ATOM 0 HD23 LEU A 492 4.561 -17.111 7.890 1.00 73.31 H new ATOM 1545 N GLU A 493 -0.920 -14.799 7.420 1.00 74.42 N ATOM 1546 CA GLU A 493 -2.251 -14.996 7.967 1.00 2.15 C ATOM 1547 C GLU A 493 -3.221 -15.423 6.865 1.00 30.04 C ATOM 1548 O GLU A 493 -4.111 -16.239 7.097 1.00 3.04 O ATOM 1549 CB GLU A 493 -2.746 -13.734 8.674 1.00 50.12 C ATOM 1550 CG GLU A 493 -2.334 -13.732 10.148 1.00 74.44 C ATOM 1551 CD GLU A 493 -3.428 -14.344 11.024 1.00 35.31 C ATOM 1552 OE1 GLU A 493 -4.405 -13.660 11.364 1.00 3.41 O ATOM 1553 OE2 GLU A 493 -3.240 -15.577 11.350 1.00 64.31 O ATOM 0 H GLU A 493 -0.540 -13.862 7.550 1.00 74.42 H new ATOM 0 HA GLU A 493 -2.202 -15.793 8.709 1.00 2.15 H new ATOM 0 HB2 GLU A 493 -2.340 -12.852 8.178 1.00 50.12 H new ATOM 0 HB3 GLU A 493 -3.831 -13.672 8.596 1.00 50.12 H new ATOM 0 HG2 GLU A 493 -1.408 -14.294 10.271 1.00 74.44 H new ATOM 0 HG3 GLU A 493 -2.133 -12.711 10.472 1.00 74.44 H new ATOM 1559 N SER A 494 -3.015 -14.852 5.686 1.00 3.45 N ATOM 1560 CA SER A 494 -3.862 -15.164 4.546 1.00 71.14 C ATOM 1561 C SER A 494 -3.015 -15.739 3.409 1.00 11.22 C ATOM 1562 O SER A 494 -1.791 -15.805 3.513 1.00 42.35 O ATOM 1563 CB SER A 494 -4.620 -13.923 4.069 1.00 33.35 C ATOM 1564 OG SER A 494 -5.768 -13.659 4.869 1.00 14.53 O ATOM 0 H SER A 494 -2.275 -14.176 5.496 1.00 3.45 H new ATOM 0 HA SER A 494 -4.596 -15.908 4.856 1.00 71.14 H new ATOM 0 HB2 SER A 494 -3.955 -13.060 4.094 1.00 33.35 H new ATOM 0 HB3 SER A 494 -4.925 -14.061 3.032 1.00 33.35 H new ATOM 0 HG SER A 494 -5.485 -13.357 5.757 1.00 14.53 H new ATOM 1569 N SER A 495 -3.701 -16.143 2.350 1.00 1.30 N ATOM 1570 CA SER A 495 -3.027 -16.710 1.194 1.00 23.41 C ATOM 1571 C SER A 495 -3.779 -16.338 -0.086 1.00 43.24 C ATOM 1572 O SER A 495 -4.918 -15.875 -0.029 1.00 12.25 O ATOM 1573 CB SER A 495 -2.912 -18.231 1.317 1.00 1.05 C ATOM 1574 OG SER A 495 -1.624 -18.633 1.774 1.00 25.12 O ATOM 0 H SER A 495 -4.716 -16.089 2.268 1.00 1.30 H new ATOM 0 HA SER A 495 -2.019 -16.297 1.149 1.00 23.41 H new ATOM 0 HB2 SER A 495 -3.672 -18.598 2.007 1.00 1.05 H new ATOM 0 HB3 SER A 495 -3.113 -18.689 0.349 1.00 1.05 H new ATOM 0 HG SER A 495 -1.591 -19.610 1.841 1.00 25.12 H new ATOM 1579 N PRO A 496 -3.094 -16.556 -1.239 1.00 64.20 N ATOM 1580 CA PRO A 496 -3.684 -16.248 -2.530 1.00 43.01 C ATOM 1581 C PRO A 496 -4.734 -17.292 -2.916 1.00 4.35 C ATOM 1582 O PRO A 496 -5.729 -16.966 -3.562 1.00 52.22 O ATOM 1583 CB PRO A 496 -2.512 -16.200 -3.497 1.00 0.24 C ATOM 1584 CG PRO A 496 -1.374 -16.938 -2.810 1.00 53.25 C ATOM 1585 CD PRO A 496 -1.743 -17.102 -1.344 1.00 73.22 C ATOM 0 HA PRO A 496 -4.223 -15.301 -2.531 1.00 43.01 H new ATOM 0 HB2 PRO A 496 -2.768 -16.673 -4.445 1.00 0.24 H new ATOM 0 HB3 PRO A 496 -2.232 -15.171 -3.720 1.00 0.24 H new ATOM 0 HG2 PRO A 496 -1.214 -17.911 -3.275 1.00 53.25 H new ATOM 0 HG3 PRO A 496 -0.443 -16.381 -2.909 1.00 53.25 H new ATOM 0 HD2 PRO A 496 -1.715 -18.149 -1.043 1.00 73.22 H new ATOM 0 HD3 PRO A 496 -1.048 -16.566 -0.698 1.00 73.22 H new ATOM 1590 N ALA A 497 -4.478 -18.524 -2.503 1.00 35.10 N ATOM 1591 CA ALA A 497 -5.390 -19.617 -2.797 1.00 72.31 C ATOM 1592 C ALA A 497 -6.744 -19.336 -2.143 1.00 65.02 C ATOM 1593 O ALA A 497 -7.774 -19.827 -2.603 1.00 2.50 O ATOM 1594 CB ALA A 497 -4.775 -20.935 -2.325 1.00 5.44 C ATOM 0 H ALA A 497 -3.652 -18.790 -1.967 1.00 35.10 H new ATOM 0 HA ALA A 497 -5.555 -19.701 -3.871 1.00 72.31 H new ATOM 0 HB1 ALA A 497 -5.459 -21.755 -2.545 1.00 5.44 H new ATOM 0 HB2 ALA A 497 -3.830 -21.101 -2.842 1.00 5.44 H new ATOM 0 HB3 ALA A 497 -4.597 -20.889 -1.251 1.00 5.44 H new ATOM 1600 N GLN A 498 -6.698 -18.548 -1.078 1.00 0.13 N ATOM 1601 CA GLN A 498 -7.909 -18.196 -0.356 1.00 70.31 C ATOM 1602 C GLN A 498 -8.703 -17.144 -1.131 1.00 41.22 C ATOM 1603 O GLN A 498 -9.835 -16.824 -0.769 1.00 74.22 O ATOM 1604 CB GLN A 498 -7.581 -17.704 1.057 1.00 34.33 C ATOM 1605 CG GLN A 498 -6.308 -18.368 1.585 1.00 62.14 C ATOM 1606 CD GLN A 498 -6.274 -18.348 3.115 1.00 44.33 C ATOM 1607 OE1 GLN A 498 -6.048 -17.325 3.743 1.00 63.32 O ATOM 1608 NE2 GLN A 498 -6.514 -19.528 3.678 1.00 24.32 N ATOM 0 H GLN A 498 -5.842 -18.144 -0.698 1.00 0.13 H new ATOM 0 HA GLN A 498 -8.525 -19.090 -0.261 1.00 70.31 H new ATOM 0 HB2 GLN A 498 -7.455 -16.621 1.049 1.00 34.33 H new ATOM 0 HB3 GLN A 498 -8.414 -17.923 1.725 1.00 34.33 H new ATOM 0 HG2 GLN A 498 -6.256 -19.397 1.230 1.00 62.14 H new ATOM 0 HG3 GLN A 498 -5.433 -17.850 1.191 1.00 62.14 H new ATOM 0 HE21 GLN A 498 -6.696 -20.344 3.094 1.00 24.32 H new ATOM 0 HE22 GLN A 498 -6.517 -19.617 4.694 1.00 24.32 H new ATOM 1615 N LEU A 499 -8.080 -16.634 -2.183 1.00 33.34 N ATOM 1616 CA LEU A 499 -8.714 -15.625 -3.014 1.00 3.32 C ATOM 1617 C LEU A 499 -9.333 -16.295 -4.243 1.00 25.35 C ATOM 1618 O LEU A 499 -8.980 -17.425 -4.581 1.00 5.23 O ATOM 1619 CB LEU A 499 -7.723 -14.511 -3.355 1.00 73.23 C ATOM 1620 CG LEU A 499 -6.799 -14.064 -2.220 1.00 33.14 C ATOM 1621 CD1 LEU A 499 -6.000 -12.824 -2.620 1.00 72.52 C ATOM 1622 CD2 LEU A 499 -7.584 -13.848 -0.926 1.00 54.03 C ATOM 0 H LEU A 499 -7.141 -16.901 -2.479 1.00 33.34 H new ATOM 0 HA LEU A 499 -9.527 -15.142 -2.471 1.00 3.32 H new ATOM 0 HB2 LEU A 499 -7.106 -14.844 -4.189 1.00 73.23 H new ATOM 0 HB3 LEU A 499 -8.286 -13.644 -3.701 1.00 73.23 H new ATOM 0 HG LEU A 499 -6.081 -14.862 -2.030 1.00 33.14 H new ATOM 0 HD11 LEU A 499 -5.352 -12.527 -1.796 1.00 72.52 H new ATOM 0 HD12 LEU A 499 -5.393 -13.050 -3.496 1.00 72.52 H new ATOM 0 HD13 LEU A 499 -6.685 -12.009 -2.854 1.00 72.52 H new ATOM 0 HD21 LEU A 499 -6.903 -13.531 -0.136 1.00 54.03 H new ATOM 0 HD22 LEU A 499 -8.340 -13.079 -1.083 1.00 54.03 H new ATOM 0 HD23 LEU A 499 -8.069 -14.780 -0.635 1.00 54.03 H new ATOM 1633 N SER A 500 -10.243 -15.572 -4.875 1.00 14.24 N ATOM 1634 CA SER A 500 -10.914 -16.083 -6.060 1.00 2.02 C ATOM 1635 C SER A 500 -9.892 -16.349 -7.167 1.00 22.02 C ATOM 1636 O SER A 500 -8.772 -15.840 -7.118 1.00 0.02 O ATOM 1637 CB SER A 500 -11.985 -15.107 -6.550 1.00 31.35 C ATOM 1638 OG SER A 500 -13.227 -15.294 -5.875 1.00 33.22 O ATOM 0 H SER A 500 -10.533 -14.636 -4.591 1.00 14.24 H new ATOM 0 HA SER A 500 -11.407 -17.019 -5.797 1.00 2.02 H new ATOM 0 HB2 SER A 500 -11.640 -14.084 -6.398 1.00 31.35 H new ATOM 0 HB3 SER A 500 -12.132 -15.238 -7.622 1.00 31.35 H new ATOM 0 HG SER A 500 -13.884 -14.651 -6.215 1.00 33.22 H new ATOM 1643 N SER A 501 -10.313 -17.146 -8.138 1.00 71.12 N ATOM 1644 CA SER A 501 -9.448 -17.485 -9.254 1.00 33.15 C ATOM 1645 C SER A 501 -9.247 -16.263 -10.153 1.00 53.14 C ATOM 1646 O SER A 501 -8.452 -16.300 -11.090 1.00 55.25 O ATOM 1647 CB SER A 501 -10.024 -18.649 -10.064 1.00 60.41 C ATOM 1648 OG SER A 501 -9.155 -19.047 -11.121 1.00 75.14 O ATOM 0 H SER A 501 -11.242 -17.566 -8.175 1.00 71.12 H new ATOM 0 HA SER A 501 -8.483 -17.797 -8.854 1.00 33.15 H new ATOM 0 HB2 SER A 501 -10.202 -19.497 -9.403 1.00 60.41 H new ATOM 0 HB3 SER A 501 -10.990 -18.359 -10.478 1.00 60.41 H new ATOM 0 HG SER A 501 -8.542 -18.313 -11.335 1.00 75.14 H new ATOM 1653 N ASP A 502 -9.983 -15.208 -9.834 1.00 31.32 N ATOM 1654 CA ASP A 502 -9.897 -13.975 -10.601 1.00 24.14 C ATOM 1655 C ASP A 502 -8.711 -13.150 -10.096 1.00 53.40 C ATOM 1656 O ASP A 502 -8.033 -12.489 -10.882 1.00 41.11 O ATOM 1657 CB ASP A 502 -11.164 -13.134 -10.435 1.00 43.11 C ATOM 1658 CG ASP A 502 -12.443 -13.780 -10.969 1.00 53.51 C ATOM 1659 OD1 ASP A 502 -13.554 -13.456 -10.527 1.00 13.51 O ATOM 1660 OD2 ASP A 502 -12.264 -14.662 -11.894 1.00 65.01 O ATOM 0 H ASP A 502 -10.641 -15.181 -9.055 1.00 31.32 H new ATOM 0 HA ASP A 502 -9.775 -14.237 -11.652 1.00 24.14 H new ATOM 0 HB2 ASP A 502 -11.300 -12.915 -9.376 1.00 43.11 H new ATOM 0 HB3 ASP A 502 -11.018 -12.180 -10.942 1.00 43.11 H new ATOM 1665 N THR A 503 -8.498 -13.215 -8.790 1.00 70.14 N ATOM 1666 CA THR A 503 -7.406 -12.481 -8.172 1.00 14.42 C ATOM 1667 C THR A 503 -6.141 -12.591 -9.025 1.00 33.21 C ATOM 1668 O THR A 503 -5.480 -11.589 -9.295 1.00 25.43 O ATOM 1669 CB THR A 503 -7.227 -13.009 -6.748 1.00 11.43 C ATOM 1670 OG1 THR A 503 -8.506 -12.829 -6.148 1.00 13.24 O ATOM 1671 CG2 THR A 503 -6.296 -12.131 -5.911 1.00 62.13 C ATOM 0 H THR A 503 -9.063 -13.765 -8.142 1.00 70.14 H new ATOM 0 HA THR A 503 -7.629 -11.416 -8.112 1.00 14.42 H new ATOM 0 HB THR A 503 -6.833 -14.024 -6.784 1.00 11.43 H new ATOM 0 HG1 THR A 503 -8.423 -12.238 -5.371 1.00 13.24 H new ATOM 0 HG21 THR A 503 -6.203 -12.550 -4.909 1.00 62.13 H new ATOM 0 HG22 THR A 503 -5.313 -12.092 -6.380 1.00 62.13 H new ATOM 0 HG23 THR A 503 -6.707 -11.124 -5.846 1.00 62.13 H new ATOM 1679 N ALA A 504 -5.841 -13.817 -9.426 1.00 34.22 N ATOM 1680 CA ALA A 504 -4.666 -14.072 -10.244 1.00 62.14 C ATOM 1681 C ALA A 504 -4.633 -13.076 -11.405 1.00 5.04 C ATOM 1682 O ALA A 504 -3.575 -12.542 -11.739 1.00 12.32 O ATOM 1683 CB ALA A 504 -4.681 -15.524 -10.721 1.00 35.22 C ATOM 0 H ALA A 504 -6.391 -14.646 -9.200 1.00 34.22 H new ATOM 0 HA ALA A 504 -3.755 -13.930 -9.662 1.00 62.14 H new ATOM 0 HB1 ALA A 504 -3.800 -15.715 -11.334 1.00 35.22 H new ATOM 0 HB2 ALA A 504 -4.674 -16.190 -9.858 1.00 35.22 H new ATOM 0 HB3 ALA A 504 -5.580 -15.704 -11.311 1.00 35.22 H new ATOM 1689 N SER A 505 -5.801 -12.857 -11.988 1.00 42.31 N ATOM 1690 CA SER A 505 -5.918 -11.935 -13.104 1.00 12.50 C ATOM 1691 C SER A 505 -5.935 -10.493 -12.593 1.00 13.44 C ATOM 1692 O SER A 505 -5.567 -9.569 -13.317 1.00 14.04 O ATOM 1693 CB SER A 505 -7.179 -12.221 -13.925 1.00 22.33 C ATOM 1694 OG SER A 505 -7.336 -11.299 -15.001 1.00 43.12 O ATOM 0 H SER A 505 -6.675 -13.302 -11.709 1.00 42.31 H new ATOM 0 HA SER A 505 -5.054 -12.074 -13.753 1.00 12.50 H new ATOM 0 HB2 SER A 505 -7.132 -13.235 -14.321 1.00 22.33 H new ATOM 0 HB3 SER A 505 -8.053 -12.173 -13.276 1.00 22.33 H new ATOM 0 HG SER A 505 -8.150 -11.516 -15.501 1.00 43.12 H new ATOM 1699 N LEU A 506 -6.365 -10.345 -11.350 1.00 54.43 N ATOM 1700 CA LEU A 506 -6.435 -9.030 -10.732 1.00 74.20 C ATOM 1701 C LEU A 506 -5.016 -8.511 -10.489 1.00 32.34 C ATOM 1702 O LEU A 506 -4.766 -7.310 -10.584 1.00 32.42 O ATOM 1703 CB LEU A 506 -7.299 -9.076 -9.471 1.00 63.43 C ATOM 1704 CG LEU A 506 -8.737 -9.561 -9.659 1.00 71.04 C ATOM 1705 CD1 LEU A 506 -9.421 -9.789 -8.310 1.00 31.44 C ATOM 1706 CD2 LEU A 506 -9.529 -8.596 -10.547 1.00 64.41 C ATOM 0 H LEU A 506 -6.669 -11.114 -10.752 1.00 54.43 H new ATOM 0 HA LEU A 506 -6.925 -8.320 -11.398 1.00 74.20 H new ATOM 0 HB2 LEU A 506 -6.810 -9.724 -8.744 1.00 63.43 H new ATOM 0 HB3 LEU A 506 -7.328 -8.076 -9.038 1.00 63.43 H new ATOM 0 HG LEU A 506 -8.708 -10.523 -10.171 1.00 71.04 H new ATOM 0 HD11 LEU A 506 -10.442 -10.133 -8.473 1.00 31.44 H new ATOM 0 HD12 LEU A 506 -8.870 -10.541 -7.745 1.00 31.44 H new ATOM 0 HD13 LEU A 506 -9.439 -8.855 -7.749 1.00 31.44 H new ATOM 0 HD21 LEU A 506 -10.548 -8.964 -10.665 1.00 64.41 H new ATOM 0 HD22 LEU A 506 -9.550 -7.610 -10.084 1.00 64.41 H new ATOM 0 HD23 LEU A 506 -9.053 -8.527 -11.525 1.00 64.41 H new ATOM 1717 N LEU A 507 -4.125 -9.441 -10.180 1.00 41.20 N ATOM 1718 CA LEU A 507 -2.738 -9.093 -9.923 1.00 41.10 C ATOM 1719 C LEU A 507 -1.862 -9.637 -11.052 1.00 63.53 C ATOM 1720 O LEU A 507 -0.655 -9.806 -10.880 1.00 42.22 O ATOM 1721 CB LEU A 507 -2.315 -9.568 -8.532 1.00 2.32 C ATOM 1722 CG LEU A 507 -2.609 -11.035 -8.207 1.00 42.31 C ATOM 1723 CD1 LEU A 507 -1.388 -11.715 -7.587 1.00 63.11 C ATOM 1724 CD2 LEU A 507 -3.848 -11.161 -7.316 1.00 34.02 C ATOM 0 H LEU A 507 -4.337 -10.436 -10.102 1.00 41.20 H new ATOM 0 HA LEU A 507 -2.612 -8.010 -9.916 1.00 41.10 H new ATOM 0 HB2 LEU A 507 -1.244 -9.400 -8.422 1.00 2.32 H new ATOM 0 HB3 LEU A 507 -2.813 -8.945 -7.790 1.00 2.32 H new ATOM 0 HG LEU A 507 -2.828 -11.554 -9.140 1.00 42.31 H new ATOM 0 HD11 LEU A 507 -1.624 -12.756 -7.366 1.00 63.11 H new ATOM 0 HD12 LEU A 507 -0.554 -11.673 -8.287 1.00 63.11 H new ATOM 0 HD13 LEU A 507 -1.114 -11.201 -6.665 1.00 63.11 H new ATOM 0 HD21 LEU A 507 -4.035 -12.213 -7.100 1.00 34.02 H new ATOM 0 HD22 LEU A 507 -3.681 -10.623 -6.383 1.00 34.02 H new ATOM 0 HD23 LEU A 507 -4.711 -10.737 -7.830 1.00 34.02 H new ATOM 1735 N SER A 508 -2.502 -9.897 -12.183 1.00 64.53 N ATOM 1736 CA SER A 508 -1.796 -10.420 -13.339 1.00 74.32 C ATOM 1737 C SER A 508 -1.039 -9.290 -14.044 1.00 23.15 C ATOM 1738 O SER A 508 -1.298 -9.000 -15.211 1.00 60.13 O ATOM 1739 CB SER A 508 -2.760 -11.100 -14.313 1.00 5.31 C ATOM 1740 OG SER A 508 -2.840 -12.506 -14.089 1.00 32.32 O ATOM 0 H SER A 508 -3.502 -9.755 -12.323 1.00 64.53 H new ATOM 0 HA SER A 508 -1.083 -11.169 -12.994 1.00 74.32 H new ATOM 0 HB2 SER A 508 -3.751 -10.659 -14.209 1.00 5.31 H new ATOM 0 HB3 SER A 508 -2.434 -10.914 -15.336 1.00 5.31 H new ATOM 0 HG SER A 508 -2.666 -12.697 -13.144 1.00 32.32 H new ATOM 1745 N GLY A 509 -0.121 -8.686 -13.306 1.00 51.45 N ATOM 1746 CA GLY A 509 0.675 -7.596 -13.845 1.00 72.12 C ATOM 1747 C GLY A 509 1.537 -6.956 -12.756 1.00 70.04 C ATOM 1748 O GLY A 509 2.683 -6.583 -13.005 1.00 32.01 O ATOM 0 H GLY A 509 0.090 -8.930 -12.338 1.00 51.45 H new ATOM 0 HA2 GLY A 509 1.313 -7.969 -14.647 1.00 72.12 H new ATOM 0 HA3 GLY A 509 0.019 -6.844 -14.283 1.00 72.12 H new ATOM 1752 N LEU A 510 0.953 -6.847 -11.572 1.00 62.31 N ATOM 1753 CA LEU A 510 1.655 -6.258 -10.444 1.00 3.40 C ATOM 1754 C LEU A 510 2.726 -7.231 -9.950 1.00 62.52 C ATOM 1755 O LEU A 510 2.886 -8.319 -10.503 1.00 14.41 O ATOM 1756 CB LEU A 510 0.664 -5.833 -9.359 1.00 43.51 C ATOM 1757 CG LEU A 510 -0.568 -5.061 -9.840 1.00 63.11 C ATOM 1758 CD1 LEU A 510 -1.649 -5.023 -8.758 1.00 12.53 C ATOM 1759 CD2 LEU A 510 -0.184 -3.660 -10.316 1.00 73.54 C ATOM 0 H LEU A 510 0.002 -7.156 -11.369 1.00 62.31 H new ATOM 0 HA LEU A 510 2.169 -5.347 -10.750 1.00 3.40 H new ATOM 0 HB2 LEU A 510 0.326 -6.726 -8.833 1.00 43.51 H new ATOM 0 HB3 LEU A 510 1.194 -5.217 -8.632 1.00 43.51 H new ATOM 0 HG LEU A 510 -0.989 -5.588 -10.696 1.00 63.11 H new ATOM 0 HD11 LEU A 510 -2.513 -4.469 -9.126 1.00 12.53 H new ATOM 0 HD12 LEU A 510 -1.950 -6.040 -8.509 1.00 12.53 H new ATOM 0 HD13 LEU A 510 -1.256 -4.533 -7.868 1.00 12.53 H new ATOM 0 HD21 LEU A 510 -1.077 -3.133 -10.652 1.00 73.54 H new ATOM 0 HD22 LEU A 510 0.275 -3.110 -9.495 1.00 73.54 H new ATOM 0 HD23 LEU A 510 0.524 -3.737 -11.141 1.00 73.54 H new ATOM 1770 N VAL A 511 3.434 -6.807 -8.912 1.00 60.20 N ATOM 1771 CA VAL A 511 4.486 -7.627 -8.338 1.00 3.03 C ATOM 1772 C VAL A 511 3.993 -8.232 -7.022 1.00 54.03 C ATOM 1773 O VAL A 511 4.005 -7.568 -5.986 1.00 34.13 O ATOM 1774 CB VAL A 511 5.764 -6.801 -8.176 1.00 5.22 C ATOM 1775 CG1 VAL A 511 6.823 -7.578 -7.390 1.00 5.24 C ATOM 1776 CG2 VAL A 511 6.308 -6.358 -9.536 1.00 42.52 C ATOM 0 H VAL A 511 3.299 -5.906 -8.454 1.00 60.20 H new ATOM 0 HA VAL A 511 4.733 -8.454 -9.004 1.00 3.03 H new ATOM 0 HB VAL A 511 5.513 -5.905 -7.608 1.00 5.22 H new ATOM 0 HG11 VAL A 511 7.721 -6.969 -7.289 1.00 5.24 H new ATOM 0 HG12 VAL A 511 6.436 -7.821 -6.400 1.00 5.24 H new ATOM 0 HG13 VAL A 511 7.067 -8.499 -7.920 1.00 5.24 H new ATOM 0 HG21 VAL A 511 7.216 -5.773 -9.392 1.00 42.52 H new ATOM 0 HG22 VAL A 511 6.534 -7.236 -10.141 1.00 42.52 H new ATOM 0 HG23 VAL A 511 5.561 -5.749 -10.046 1.00 42.52 H new ATOM 1786 N ARG A 512 3.573 -9.486 -7.105 1.00 52.34 N ATOM 1787 CA ARG A 512 3.078 -10.188 -5.934 1.00 44.41 C ATOM 1788 C ARG A 512 4.089 -10.093 -4.789 1.00 55.23 C ATOM 1789 O ARG A 512 5.187 -10.643 -4.879 1.00 54.13 O ATOM 1790 CB ARG A 512 2.809 -11.661 -6.247 1.00 41.30 C ATOM 1791 CG ARG A 512 1.623 -12.186 -5.435 1.00 34.22 C ATOM 1792 CD ARG A 512 1.981 -12.304 -3.953 1.00 22.31 C ATOM 1793 NE ARG A 512 3.076 -13.283 -3.773 1.00 40.13 N ATOM 1794 CZ ARG A 512 2.940 -14.614 -3.956 1.00 74.32 C ATOM 1795 NH1 ARG A 512 1.752 -15.136 -4.327 1.00 42.25 N ATOM 1796 NH2 ARG A 512 3.987 -15.396 -3.768 1.00 12.54 N ATOM 0 H ARG A 512 3.566 -10.034 -7.965 1.00 52.34 H new ATOM 0 HA ARG A 512 2.142 -9.715 -5.636 1.00 44.41 H new ATOM 0 HB2 ARG A 512 2.606 -11.779 -7.311 1.00 41.30 H new ATOM 0 HB3 ARG A 512 3.697 -12.252 -6.024 1.00 41.30 H new ATOM 0 HG2 ARG A 512 0.771 -11.516 -5.555 1.00 34.22 H new ATOM 0 HG3 ARG A 512 1.319 -13.160 -5.818 1.00 34.22 H new ATOM 0 HD2 ARG A 512 2.284 -11.332 -3.565 1.00 22.31 H new ATOM 0 HD3 ARG A 512 1.106 -12.616 -3.383 1.00 22.31 H new ATOM 0 HE ARG A 512 3.991 -12.930 -3.493 1.00 40.13 H new ATOM 0 HH11 ARG A 512 0.949 -14.524 -4.471 1.00 42.25 H new ATOM 0 HH12 ARG A 512 1.657 -16.142 -4.463 1.00 42.25 H new ATOM 0 HH21 ARG A 512 4.881 -14.993 -3.489 1.00 12.54 H new ATOM 0 HH22 ARG A 512 3.902 -16.404 -3.902 1.00 12.54 H new ATOM 1806 N LEU A 513 3.686 -9.391 -3.741 1.00 73.52 N ATOM 1807 CA LEU A 513 4.544 -9.217 -2.581 1.00 14.31 C ATOM 1808 C LEU A 513 4.139 -10.217 -1.497 1.00 1.41 C ATOM 1809 O LEU A 513 2.964 -10.313 -1.145 1.00 51.32 O ATOM 1810 CB LEU A 513 4.523 -7.761 -2.113 1.00 71.24 C ATOM 1811 CG LEU A 513 5.822 -7.234 -1.500 1.00 63.13 C ATOM 1812 CD1 LEU A 513 6.989 -7.379 -2.479 1.00 43.34 C ATOM 1813 CD2 LEU A 513 5.656 -5.793 -1.015 1.00 40.31 C ATOM 0 H LEU A 513 2.776 -8.935 -3.670 1.00 73.52 H new ATOM 0 HA LEU A 513 5.581 -9.430 -2.840 1.00 14.31 H new ATOM 0 HB2 LEU A 513 4.264 -7.131 -2.964 1.00 71.24 H new ATOM 0 HB3 LEU A 513 3.726 -7.648 -1.378 1.00 71.24 H new ATOM 0 HG LEU A 513 6.057 -7.842 -0.626 1.00 63.13 H new ATOM 0 HD11 LEU A 513 7.900 -6.997 -2.018 1.00 43.34 H new ATOM 0 HD12 LEU A 513 7.124 -8.431 -2.731 1.00 43.34 H new ATOM 0 HD13 LEU A 513 6.776 -6.813 -3.386 1.00 43.34 H new ATOM 0 HD21 LEU A 513 6.594 -5.444 -0.584 1.00 40.31 H new ATOM 0 HD22 LEU A 513 5.383 -5.155 -1.856 1.00 40.31 H new ATOM 0 HD23 LEU A 513 4.872 -5.752 -0.259 1.00 40.31 H new ATOM 1824 N ASP A 514 5.132 -10.936 -0.998 1.00 14.13 N ATOM 1825 CA ASP A 514 4.894 -11.926 0.038 1.00 53.43 C ATOM 1826 C ASP A 514 5.626 -11.508 1.315 1.00 71.44 C ATOM 1827 O ASP A 514 6.465 -10.608 1.287 1.00 55.52 O ATOM 1828 CB ASP A 514 5.420 -13.300 -0.380 1.00 51.42 C ATOM 1829 CG ASP A 514 4.394 -14.205 -1.067 1.00 40.54 C ATOM 1830 OD1 ASP A 514 3.241 -13.807 -1.288 1.00 2.40 O ATOM 1831 OD2 ASP A 514 4.826 -15.378 -1.381 1.00 71.42 O ATOM 0 H ASP A 514 6.105 -10.853 -1.292 1.00 14.13 H new ATOM 0 HA ASP A 514 3.818 -11.987 0.204 1.00 53.43 H new ATOM 0 HB2 ASP A 514 6.266 -13.159 -1.053 1.00 51.42 H new ATOM 0 HB3 ASP A 514 5.799 -13.812 0.505 1.00 51.42 H new ATOM 1836 N GLU A 515 5.284 -12.181 2.402 1.00 44.42 N ATOM 1837 CA GLU A 515 5.898 -11.891 3.687 1.00 64.24 C ATOM 1838 C GLU A 515 6.566 -13.145 4.252 1.00 3.13 C ATOM 1839 O GLU A 515 7.060 -13.137 5.379 1.00 72.40 O ATOM 1840 CB GLU A 515 4.873 -11.325 4.671 1.00 51.54 C ATOM 1841 CG GLU A 515 5.527 -10.984 6.011 1.00 54.52 C ATOM 1842 CD GLU A 515 6.853 -10.250 5.802 1.00 33.32 C ATOM 1843 OE1 GLU A 515 7.840 -10.865 5.370 1.00 3.34 O ATOM 1844 OE2 GLU A 515 6.838 -8.997 6.104 1.00 45.10 O ATOM 0 H GLU A 515 4.589 -12.927 2.420 1.00 44.42 H new ATOM 0 HA GLU A 515 6.665 -11.131 3.536 1.00 64.24 H new ATOM 0 HB2 GLU A 515 4.414 -10.431 4.249 1.00 51.54 H new ATOM 0 HB3 GLU A 515 4.074 -12.050 4.827 1.00 51.54 H new ATOM 0 HG2 GLU A 515 4.853 -10.364 6.601 1.00 54.52 H new ATOM 0 HG3 GLU A 515 5.699 -11.898 6.579 1.00 54.52 H new ATOM 1850 N HIS A 516 6.557 -14.196 3.446 1.00 53.22 N ATOM 1851 CA HIS A 516 7.156 -15.457 3.851 1.00 52.00 C ATOM 1852 C HIS A 516 8.084 -15.963 2.745 1.00 63.50 C ATOM 1853 O HIS A 516 8.567 -17.093 2.805 1.00 12.43 O ATOM 1854 CB HIS A 516 6.077 -16.472 4.230 1.00 11.43 C ATOM 1855 CG HIS A 516 4.922 -16.535 3.257 1.00 4.01 C ATOM 1856 ND1 HIS A 516 3.687 -17.062 3.593 1.00 62.20 N ATOM 1857 CD2 HIS A 516 4.828 -16.131 1.959 1.00 65.11 C ATOM 1858 CE1 HIS A 516 2.894 -16.975 2.537 1.00 13.33 C ATOM 1859 NE2 HIS A 516 3.603 -16.397 1.523 1.00 64.23 N ATOM 0 H HIS A 516 6.144 -14.201 2.513 1.00 53.22 H new ATOM 0 HA HIS A 516 7.762 -15.306 4.744 1.00 52.00 H new ATOM 0 HB2 HIS A 516 6.532 -17.460 4.302 1.00 11.43 H new ATOM 0 HB3 HIS A 516 5.692 -16.225 5.219 1.00 11.43 H new ATOM 0 HD2 HIS A 516 5.617 -15.672 1.382 1.00 65.11 H new ATOM 0 HE1 HIS A 516 1.866 -17.303 2.486 1.00 13.33 H new ATOM 0 HE2 HIS A 516 3.250 -16.202 0.586 1.00 64.23 H new ATOM 1866 N SER A 517 8.306 -15.102 1.764 1.00 20.31 N ATOM 1867 CA SER A 517 9.169 -15.447 0.646 1.00 73.41 C ATOM 1868 C SER A 517 10.574 -14.888 0.877 1.00 65.21 C ATOM 1869 O SER A 517 10.729 -13.763 1.353 1.00 13.34 O ATOM 1870 CB SER A 517 8.599 -14.922 -0.672 1.00 34.13 C ATOM 1871 OG SER A 517 8.956 -15.751 -1.776 1.00 25.24 O ATOM 0 H SER A 517 7.904 -14.166 1.719 1.00 20.31 H new ATOM 0 HA SER A 517 9.224 -16.534 0.579 1.00 73.41 H new ATOM 0 HB2 SER A 517 7.513 -14.863 -0.599 1.00 34.13 H new ATOM 0 HB3 SER A 517 8.963 -13.909 -0.846 1.00 34.13 H new ATOM 0 HG SER A 517 9.823 -16.173 -1.602 1.00 25.24 H new ATOM 1876 N GLN A 518 11.564 -15.698 0.531 1.00 32.11 N ATOM 1877 CA GLN A 518 12.951 -15.298 0.694 1.00 12.13 C ATOM 1878 C GLN A 518 13.371 -14.362 -0.441 1.00 51.31 C ATOM 1879 O GLN A 518 14.525 -13.945 -0.511 1.00 75.31 O ATOM 1880 CB GLN A 518 13.869 -16.520 0.764 1.00 73.24 C ATOM 1881 CG GLN A 518 14.076 -17.132 -0.623 1.00 0.44 C ATOM 1882 CD GLN A 518 15.285 -16.508 -1.322 1.00 12.54 C ATOM 1883 OE1 GLN A 518 16.251 -16.097 -0.701 1.00 52.21 O ATOM 1884 NE2 GLN A 518 15.179 -16.464 -2.647 1.00 13.53 N ATOM 0 H GLN A 518 11.433 -16.630 0.138 1.00 32.11 H new ATOM 0 HA GLN A 518 13.045 -14.759 1.637 1.00 12.13 H new ATOM 0 HB2 GLN A 518 14.832 -16.232 1.185 1.00 73.24 H new ATOM 0 HB3 GLN A 518 13.438 -17.265 1.433 1.00 73.24 H new ATOM 0 HG2 GLN A 518 14.220 -18.209 -0.532 1.00 0.44 H new ATOM 0 HG3 GLN A 518 13.183 -16.980 -1.229 1.00 0.44 H new ATOM 0 HE21 GLN A 518 14.342 -16.826 -3.104 1.00 13.53 H new ATOM 0 HE22 GLN A 518 15.935 -16.068 -3.206 1.00 13.53 H new ATOM 1891 N ILE A 519 12.409 -14.058 -1.302 1.00 65.40 N ATOM 1892 CA ILE A 519 12.665 -13.180 -2.430 1.00 41.53 C ATOM 1893 C ILE A 519 11.952 -11.844 -2.202 1.00 64.32 C ATOM 1894 O ILE A 519 12.389 -10.810 -2.705 1.00 24.42 O ATOM 1895 CB ILE A 519 12.280 -13.866 -3.742 1.00 52.42 C ATOM 1896 CG1 ILE A 519 11.597 -12.883 -4.694 1.00 11.31 C ATOM 1897 CG2 ILE A 519 11.421 -15.103 -3.481 1.00 25.35 C ATOM 1898 CD1 ILE A 519 12.592 -11.845 -5.217 1.00 34.24 C ATOM 0 H ILE A 519 11.452 -14.405 -1.240 1.00 65.40 H new ATOM 0 HA ILE A 519 13.730 -12.965 -2.511 1.00 41.53 H new ATOM 0 HB ILE A 519 13.193 -14.206 -4.231 1.00 52.42 H new ATOM 0 HG12 ILE A 519 11.159 -13.427 -5.531 1.00 11.31 H new ATOM 0 HG13 ILE A 519 10.779 -12.380 -4.178 1.00 11.31 H new ATOM 0 HG21 ILE A 519 11.161 -15.572 -4.430 1.00 25.35 H new ATOM 0 HG22 ILE A 519 11.979 -15.810 -2.867 1.00 25.35 H new ATOM 0 HG23 ILE A 519 10.510 -14.810 -2.959 1.00 25.35 H new ATOM 0 HD11 ILE A 519 12.081 -11.158 -5.892 1.00 34.24 H new ATOM 0 HD12 ILE A 519 13.010 -11.287 -4.379 1.00 34.24 H new ATOM 0 HD13 ILE A 519 13.396 -12.349 -5.753 1.00 34.24 H new ATOM 1909 N PHE A 520 10.869 -11.911 -1.442 1.00 52.40 N ATOM 1910 CA PHE A 520 10.092 -10.720 -1.142 1.00 33.13 C ATOM 1911 C PHE A 520 11.006 -9.521 -0.879 1.00 13.20 C ATOM 1912 O PHE A 520 10.667 -8.391 -1.230 1.00 22.42 O ATOM 1913 CB PHE A 520 9.288 -11.020 0.125 1.00 11.33 C ATOM 1914 CG PHE A 520 8.900 -9.774 0.924 1.00 4.15 C ATOM 1915 CD1 PHE A 520 8.201 -8.773 0.326 1.00 41.51 C ATOM 1916 CD2 PHE A 520 9.254 -9.669 2.233 1.00 13.42 C ATOM 1917 CE1 PHE A 520 7.841 -7.617 1.068 1.00 55.53 C ATOM 1918 CE2 PHE A 520 8.894 -8.513 2.975 1.00 1.41 C ATOM 1919 CZ PHE A 520 8.195 -7.511 2.378 1.00 31.15 C ATOM 0 H PHE A 520 10.511 -12.770 -1.025 1.00 52.40 H new ATOM 0 HA PHE A 520 9.447 -10.473 -1.986 1.00 33.13 H new ATOM 0 HB2 PHE A 520 8.382 -11.559 -0.151 1.00 11.33 H new ATOM 0 HB3 PHE A 520 9.871 -11.683 0.765 1.00 11.33 H new ATOM 0 HD1 PHE A 520 7.920 -8.857 -0.713 1.00 41.51 H new ATOM 0 HD2 PHE A 520 9.809 -10.465 2.708 1.00 13.42 H new ATOM 0 HE1 PHE A 520 7.286 -6.822 0.593 1.00 55.53 H new ATOM 0 HE2 PHE A 520 9.176 -8.430 4.014 1.00 1.41 H new ATOM 0 HZ PHE A 520 7.921 -6.632 2.943 1.00 31.15 H new ATOM 1928 N ALA A 521 12.145 -9.808 -0.266 1.00 11.24 N ATOM 1929 CA ALA A 521 13.108 -8.767 0.047 1.00 34.54 C ATOM 1930 C ALA A 521 13.498 -8.035 -1.239 1.00 33.34 C ATOM 1931 O ALA A 521 13.515 -6.807 -1.278 1.00 34.31 O ATOM 1932 CB ALA A 521 14.315 -9.385 0.755 1.00 34.11 C ATOM 0 H ALA A 521 12.422 -10.746 0.022 1.00 11.24 H new ATOM 0 HA ALA A 521 12.673 -8.033 0.725 1.00 34.54 H new ATOM 0 HB1 ALA A 521 15.038 -8.604 0.990 1.00 34.11 H new ATOM 0 HB2 ALA A 521 13.989 -9.867 1.677 1.00 34.11 H new ATOM 0 HB3 ALA A 521 14.779 -10.125 0.103 1.00 34.11 H new ATOM 1938 N ARG A 522 13.803 -8.823 -2.260 1.00 33.35 N ATOM 1939 CA ARG A 522 14.191 -8.266 -3.545 1.00 33.01 C ATOM 1940 C ARG A 522 12.973 -7.676 -4.259 1.00 42.20 C ATOM 1941 O ARG A 522 13.117 -6.844 -5.153 1.00 4.12 O ATOM 1942 CB ARG A 522 14.828 -9.333 -4.437 1.00 73.41 C ATOM 1943 CG ARG A 522 16.202 -9.747 -3.904 1.00 2.23 C ATOM 1944 CD ARG A 522 16.063 -10.724 -2.736 1.00 21.25 C ATOM 1945 NE ARG A 522 17.382 -11.314 -2.411 1.00 11.23 N ATOM 1946 CZ ARG A 522 17.605 -12.140 -1.366 1.00 42.30 C ATOM 1947 NH1 ARG A 522 16.597 -12.481 -0.535 1.00 14.01 N ATOM 1948 NH2 ARG A 522 18.824 -12.607 -1.169 1.00 1.22 N ATOM 0 H ARG A 522 13.789 -9.842 -2.223 1.00 33.35 H new ATOM 0 HA ARG A 522 14.922 -7.480 -3.358 1.00 33.01 H new ATOM 0 HB2 ARG A 522 14.176 -10.205 -4.488 1.00 73.41 H new ATOM 0 HB3 ARG A 522 14.929 -8.950 -5.453 1.00 73.41 H new ATOM 0 HG2 ARG A 522 16.782 -10.209 -4.703 1.00 2.23 H new ATOM 0 HG3 ARG A 522 16.752 -8.863 -3.581 1.00 2.23 H new ATOM 0 HD2 ARG A 522 15.662 -10.207 -1.864 1.00 21.25 H new ATOM 0 HD3 ARG A 522 15.356 -11.513 -2.993 1.00 21.25 H new ATOM 0 HE ARG A 522 18.171 -11.082 -3.014 1.00 11.23 H new ATOM 0 HH11 ARG A 522 15.659 -12.114 -0.694 1.00 14.01 H new ATOM 0 HH12 ARG A 522 16.774 -13.105 0.252 1.00 14.01 H new ATOM 0 HH21 ARG A 522 19.580 -12.343 -1.801 1.00 1.22 H new ATOM 0 HH22 ARG A 522 19.010 -13.232 -0.385 1.00 1.22 H new ATOM 1958 N LYS A 523 11.802 -8.129 -3.836 1.00 62.42 N ATOM 1959 CA LYS A 523 10.560 -7.655 -4.423 1.00 61.21 C ATOM 1960 C LYS A 523 10.283 -6.230 -3.939 1.00 23.24 C ATOM 1961 O LYS A 523 9.962 -5.352 -4.736 1.00 3.41 O ATOM 1962 CB LYS A 523 9.421 -8.636 -4.132 1.00 63.32 C ATOM 1963 CG LYS A 523 9.804 -10.058 -4.548 1.00 14.33 C ATOM 1964 CD LYS A 523 10.260 -10.098 -6.007 1.00 34.33 C ATOM 1965 CE LYS A 523 9.181 -9.533 -6.935 1.00 24.13 C ATOM 1966 NZ LYS A 523 9.217 -10.217 -8.248 1.00 0.11 N ATOM 0 H LYS A 523 11.687 -8.819 -3.094 1.00 62.42 H new ATOM 0 HA LYS A 523 10.644 -7.612 -5.509 1.00 61.21 H new ATOM 0 HB2 LYS A 523 9.182 -8.616 -3.069 1.00 63.32 H new ATOM 0 HB3 LYS A 523 8.523 -8.326 -4.667 1.00 63.32 H new ATOM 0 HG2 LYS A 523 10.602 -10.427 -3.904 1.00 14.33 H new ATOM 0 HG3 LYS A 523 8.951 -10.723 -4.411 1.00 14.33 H new ATOM 0 HD2 LYS A 523 11.179 -9.523 -6.120 1.00 34.33 H new ATOM 0 HD3 LYS A 523 10.489 -11.125 -6.292 1.00 34.33 H new ATOM 0 HE2 LYS A 523 8.199 -9.659 -6.479 1.00 24.13 H new ATOM 0 HE3 LYS A 523 9.334 -8.463 -7.072 1.00 24.13 H new ATOM 0 HZ1 LYS A 523 8.513 -9.788 -8.882 1.00 0.11 H new ATOM 0 HZ2 LYS A 523 10.165 -10.119 -8.665 1.00 0.11 H new ATOM 0 HZ3 LYS A 523 8.998 -11.226 -8.120 1.00 0.11 H new ATOM 1975 N VAL A 524 10.417 -6.047 -2.633 1.00 72.43 N ATOM 1976 CA VAL A 524 10.185 -4.743 -2.034 1.00 63.12 C ATOM 1977 C VAL A 524 11.326 -3.800 -2.418 1.00 51.15 C ATOM 1978 O VAL A 524 11.088 -2.655 -2.800 1.00 10.43 O ATOM 1979 CB VAL A 524 10.012 -4.887 -0.520 1.00 32.41 C ATOM 1980 CG1 VAL A 524 11.368 -4.867 0.190 1.00 74.14 C ATOM 1981 CG2 VAL A 524 9.088 -3.802 0.032 1.00 15.41 C ATOM 0 H VAL A 524 10.683 -6.779 -1.974 1.00 72.43 H new ATOM 0 HA VAL A 524 9.261 -4.307 -2.414 1.00 63.12 H new ATOM 0 HB VAL A 524 9.546 -5.853 -0.326 1.00 32.41 H new ATOM 0 HG11 VAL A 524 11.218 -4.971 1.265 1.00 74.14 H new ATOM 0 HG12 VAL A 524 11.981 -5.693 -0.172 1.00 74.14 H new ATOM 0 HG13 VAL A 524 11.873 -3.923 -0.016 1.00 74.14 H new ATOM 0 HG21 VAL A 524 8.982 -3.928 1.110 1.00 15.41 H new ATOM 0 HG22 VAL A 524 9.513 -2.821 -0.179 1.00 15.41 H new ATOM 0 HG23 VAL A 524 8.109 -3.883 -0.440 1.00 15.41 H new ATOM 1991 N ALA A 525 12.541 -4.314 -2.304 1.00 63.32 N ATOM 1992 CA ALA A 525 13.720 -3.531 -2.636 1.00 42.44 C ATOM 1993 C ALA A 525 13.730 -3.243 -4.137 1.00 42.21 C ATOM 1994 O ALA A 525 14.525 -2.434 -4.613 1.00 52.31 O ATOM 1995 CB ALA A 525 14.974 -4.278 -2.178 1.00 43.14 C ATOM 0 H ALA A 525 12.735 -5.264 -1.986 1.00 63.32 H new ATOM 0 HA ALA A 525 13.703 -2.573 -2.117 1.00 42.44 H new ATOM 0 HB1 ALA A 525 15.858 -3.691 -2.427 1.00 43.14 H new ATOM 0 HB2 ALA A 525 14.932 -4.432 -1.100 1.00 43.14 H new ATOM 0 HB3 ALA A 525 15.026 -5.244 -2.681 1.00 43.14 H new ATOM 2001 N ASN A 526 12.836 -3.920 -4.843 1.00 14.54 N ATOM 2002 CA ASN A 526 12.731 -3.745 -6.283 1.00 25.22 C ATOM 2003 C ASN A 526 11.775 -2.590 -6.584 1.00 21.05 C ATOM 2004 O ASN A 526 12.143 -1.639 -7.272 1.00 2.35 O ATOM 2005 CB ASN A 526 12.177 -5.006 -6.951 1.00 3.21 C ATOM 2006 CG ASN A 526 13.300 -5.836 -7.576 1.00 45.22 C ATOM 2007 OD1 ASN A 526 14.332 -5.326 -7.981 1.00 53.20 O ATOM 2008 ND2 ASN A 526 13.044 -7.139 -7.630 1.00 12.22 N ATOM 0 H ASN A 526 12.178 -4.590 -4.446 1.00 14.54 H new ATOM 0 HA ASN A 526 13.728 -3.539 -6.672 1.00 25.22 H new ATOM 0 HB2 ASN A 526 11.643 -5.607 -6.215 1.00 3.21 H new ATOM 0 HB3 ASN A 526 11.455 -4.728 -7.719 1.00 3.21 H new ATOM 0 HD21 ASN A 526 13.732 -7.778 -8.029 1.00 12.22 H new ATOM 0 HD22 ASN A 526 12.159 -7.500 -7.273 1.00 12.22 H new ATOM 2014 N THR A 527 10.566 -2.711 -6.055 1.00 62.41 N ATOM 2015 CA THR A 527 9.555 -1.689 -6.259 1.00 42.34 C ATOM 2016 C THR A 527 9.824 -0.485 -5.352 1.00 54.41 C ATOM 2017 O THR A 527 9.911 0.647 -5.826 1.00 41.41 O ATOM 2018 CB THR A 527 8.184 -2.327 -6.031 1.00 24.45 C ATOM 2019 OG1 THR A 527 7.262 -1.270 -6.282 1.00 0.40 O ATOM 2020 CG2 THR A 527 7.944 -2.692 -4.564 1.00 5.31 C ATOM 0 H THR A 527 10.264 -3.502 -5.485 1.00 62.41 H new ATOM 0 HA THR A 527 9.583 -1.302 -7.278 1.00 42.34 H new ATOM 0 HB THR A 527 8.094 -3.222 -6.647 1.00 24.45 H new ATOM 0 HG1 THR A 527 6.572 -1.579 -6.905 1.00 0.40 H new ATOM 0 HG21 THR A 527 6.957 -3.141 -4.458 1.00 5.31 H new ATOM 0 HG22 THR A 527 8.703 -3.403 -4.237 1.00 5.31 H new ATOM 0 HG23 THR A 527 8.001 -1.792 -3.951 1.00 5.31 H new ATOM 2028 N PHE A 528 9.945 -0.771 -4.064 1.00 4.05 N ATOM 2029 CA PHE A 528 10.200 0.274 -3.087 1.00 44.11 C ATOM 2030 C PHE A 528 11.702 0.517 -2.924 1.00 51.04 C ATOM 2031 O PHE A 528 12.229 0.448 -1.816 1.00 54.23 O ATOM 2032 CB PHE A 528 9.627 -0.212 -1.754 1.00 43.21 C ATOM 2033 CG PHE A 528 8.099 -0.242 -1.707 1.00 40.50 C ATOM 2034 CD1 PHE A 528 7.394 0.921 -1.765 1.00 64.22 C ATOM 2035 CD2 PHE A 528 7.444 -1.429 -1.608 1.00 63.40 C ATOM 2036 CE1 PHE A 528 5.975 0.893 -1.721 1.00 12.32 C ATOM 2037 CE2 PHE A 528 6.025 -1.457 -1.564 1.00 13.24 C ATOM 2038 CZ PHE A 528 5.321 -0.296 -1.623 1.00 1.53 C ATOM 0 H PHE A 528 9.871 -1.711 -3.674 1.00 4.05 H new ATOM 0 HA PHE A 528 9.741 1.208 -3.412 1.00 44.11 H new ATOM 0 HB2 PHE A 528 10.006 -1.214 -1.551 1.00 43.21 H new ATOM 0 HB3 PHE A 528 9.992 0.435 -0.956 1.00 43.21 H new ATOM 0 HD1 PHE A 528 7.914 1.864 -1.844 1.00 64.22 H new ATOM 0 HD2 PHE A 528 8.003 -2.352 -1.563 1.00 63.40 H new ATOM 0 HE1 PHE A 528 5.415 1.815 -1.765 1.00 12.32 H new ATOM 0 HE2 PHE A 528 5.505 -2.400 -1.484 1.00 13.24 H new ATOM 0 HZ PHE A 528 4.242 -0.317 -1.592 1.00 1.53 H new ATOM 2047 N LYS A 529 12.348 0.797 -4.047 1.00 52.53 N ATOM 2048 CA LYS A 529 13.779 1.052 -4.044 1.00 2.31 C ATOM 2049 C LYS A 529 14.074 2.267 -3.163 1.00 2.10 C ATOM 2050 O LYS A 529 13.185 3.073 -2.892 1.00 52.24 O ATOM 2051 CB LYS A 529 14.302 1.188 -5.474 1.00 72.21 C ATOM 2052 CG LYS A 529 14.403 -0.179 -6.155 1.00 23.50 C ATOM 2053 CD LYS A 529 14.319 -0.042 -7.676 1.00 31.14 C ATOM 2054 CE LYS A 529 14.813 -1.314 -8.369 1.00 31.51 C ATOM 2055 NZ LYS A 529 15.066 -1.057 -9.804 1.00 10.12 N ATOM 0 H LYS A 529 11.907 0.853 -4.965 1.00 52.53 H new ATOM 0 HA LYS A 529 14.316 0.207 -3.612 1.00 2.31 H new ATOM 0 HB2 LYS A 529 13.639 1.835 -6.047 1.00 72.21 H new ATOM 0 HB3 LYS A 529 15.282 1.666 -5.463 1.00 72.21 H new ATOM 0 HG2 LYS A 529 15.343 -0.657 -5.881 1.00 23.50 H new ATOM 0 HG3 LYS A 529 13.601 -0.826 -5.800 1.00 23.50 H new ATOM 0 HD2 LYS A 529 13.289 0.160 -7.970 1.00 31.14 H new ATOM 0 HD3 LYS A 529 14.917 0.809 -8.002 1.00 31.14 H new ATOM 0 HE2 LYS A 529 15.727 -1.665 -7.890 1.00 31.51 H new ATOM 0 HE3 LYS A 529 14.072 -2.106 -8.260 1.00 31.51 H new ATOM 0 HZ1 LYS A 529 15.401 -1.930 -10.259 1.00 10.12 H new ATOM 0 HZ2 LYS A 529 14.186 -0.743 -10.261 1.00 10.12 H new ATOM 0 HZ3 LYS A 529 15.790 -0.316 -9.902 1.00 10.12 H new ATOM 2064 N PRO A 530 15.359 2.363 -2.727 1.00 34.53 N ATOM 2065 CA PRO A 530 15.783 3.467 -1.883 1.00 2.23 C ATOM 2066 C PRO A 530 15.924 4.756 -2.694 1.00 61.43 C ATOM 2067 O PRO A 530 15.702 5.848 -2.175 1.00 11.24 O ATOM 2068 CB PRO A 530 17.093 3.008 -1.264 1.00 24.10 C ATOM 2069 CG PRO A 530 17.588 1.866 -2.136 1.00 73.21 C ATOM 2070 CD PRO A 530 16.439 1.428 -3.028 1.00 3.12 C ATOM 0 HA PRO A 530 15.055 3.708 -1.109 1.00 2.23 H new ATOM 0 HB2 PRO A 530 17.818 3.821 -1.237 1.00 24.10 H new ATOM 0 HB3 PRO A 530 16.945 2.678 -0.236 1.00 24.10 H new ATOM 0 HG2 PRO A 530 18.438 2.187 -2.738 1.00 73.21 H new ATOM 0 HG3 PRO A 530 17.930 1.035 -1.519 1.00 73.21 H new ATOM 0 HD2 PRO A 530 16.717 1.470 -4.081 1.00 3.12 H new ATOM 0 HD3 PRO A 530 16.143 0.400 -2.817 1.00 3.12 H new ATOM 2075 N HIS A 531 16.294 4.586 -3.954 1.00 33.32 N ATOM 2076 CA HIS A 531 16.469 5.723 -4.843 1.00 74.40 C ATOM 2077 C HIS A 531 15.100 6.253 -5.272 1.00 32.54 C ATOM 2078 O HIS A 531 14.998 7.352 -5.815 1.00 30.04 O ATOM 2079 CB HIS A 531 17.360 5.353 -6.031 1.00 20.41 C ATOM 2080 CG HIS A 531 16.604 4.812 -7.221 1.00 52.15 C ATOM 2081 ND1 HIS A 531 16.560 3.465 -7.532 1.00 1.44 N ATOM 2082 CD2 HIS A 531 15.866 5.452 -8.172 1.00 54.12 C ATOM 2083 CE1 HIS A 531 15.824 3.312 -8.624 1.00 51.12 C ATOM 2084 NE2 HIS A 531 15.395 4.544 -9.019 1.00 52.42 N ATOM 0 H HIS A 531 16.478 3.678 -4.381 1.00 33.32 H new ATOM 0 HA HIS A 531 16.983 6.526 -4.315 1.00 74.40 H new ATOM 0 HB2 HIS A 531 17.921 6.235 -6.340 1.00 20.41 H new ATOM 0 HB3 HIS A 531 18.089 4.609 -5.708 1.00 20.41 H new ATOM 0 HD1 HIS A 531 17.016 2.717 -7.010 1.00 1.44 H new ATOM 0 HD2 HIS A 531 15.694 6.517 -8.227 1.00 54.12 H new ATOM 0 HE1 HIS A 531 15.603 2.376 -9.115 1.00 51.12 H new ATOM 2091 N ARG A 532 14.080 5.445 -5.016 1.00 63.15 N ATOM 2092 CA ARG A 532 12.722 5.819 -5.367 1.00 11.14 C ATOM 2093 C ARG A 532 11.994 6.387 -4.148 1.00 51.22 C ATOM 2094 O ARG A 532 11.281 7.384 -4.256 1.00 44.32 O ATOM 2095 CB ARG A 532 11.942 4.618 -5.905 1.00 1.00 C ATOM 2096 CG ARG A 532 12.722 3.908 -7.014 1.00 51.42 C ATOM 2097 CD ARG A 532 12.609 4.672 -8.336 1.00 24.42 C ATOM 2098 NE ARG A 532 12.944 3.777 -9.466 1.00 53.43 N ATOM 2099 CZ ARG A 532 12.868 4.137 -10.765 1.00 35.13 C ATOM 2100 NH1 ARG A 532 12.465 5.379 -11.109 1.00 12.42 N ATOM 2101 NH2 ARG A 532 13.191 3.256 -11.694 1.00 61.10 N ATOM 0 H ARG A 532 14.169 4.532 -4.569 1.00 63.15 H new ATOM 0 HA ARG A 532 12.779 6.580 -6.146 1.00 11.14 H new ATOM 0 HB2 ARG A 532 11.739 3.919 -5.094 1.00 1.00 H new ATOM 0 HB3 ARG A 532 10.977 4.949 -6.289 1.00 1.00 H new ATOM 0 HG2 ARG A 532 13.770 3.821 -6.728 1.00 51.42 H new ATOM 0 HG3 ARG A 532 12.341 2.895 -7.141 1.00 51.42 H new ATOM 0 HD2 ARG A 532 11.598 5.061 -8.456 1.00 24.42 H new ATOM 0 HD3 ARG A 532 13.281 5.530 -8.329 1.00 24.42 H new ATOM 0 HE ARG A 532 13.252 2.829 -9.250 1.00 53.43 H new ATOM 0 HH11 ARG A 532 12.215 6.053 -10.385 1.00 12.42 H new ATOM 0 HH12 ARG A 532 12.410 5.643 -12.093 1.00 12.42 H new ATOM 0 HH21 ARG A 532 13.493 2.319 -11.426 1.00 61.10 H new ATOM 0 HH22 ARG A 532 13.139 3.512 -12.680 1.00 61.10 H new ATOM 2111 N LEU A 533 12.198 5.728 -3.017 1.00 43.44 N ATOM 2112 CA LEU A 533 11.570 6.156 -1.778 1.00 11.53 C ATOM 2113 C LEU A 533 11.945 7.611 -1.496 1.00 51.23 C ATOM 2114 O LEU A 533 11.176 8.346 -0.879 1.00 14.12 O ATOM 2115 CB LEU A 533 11.925 5.197 -0.640 1.00 1.01 C ATOM 2116 CG LEU A 533 10.992 3.998 -0.455 1.00 12.12 C ATOM 2117 CD1 LEU A 533 9.916 4.296 0.590 1.00 71.14 C ATOM 2118 CD2 LEU A 533 10.387 3.565 -1.793 1.00 20.32 C ATOM 0 H LEU A 533 12.789 4.901 -2.932 1.00 43.44 H new ATOM 0 HA LEU A 533 10.484 6.120 -1.869 1.00 11.53 H new ATOM 0 HB2 LEU A 533 12.935 4.823 -0.809 1.00 1.01 H new ATOM 0 HB3 LEU A 533 11.946 5.763 0.292 1.00 1.01 H new ATOM 0 HG LEU A 533 11.581 3.161 -0.080 1.00 12.12 H new ATOM 0 HD11 LEU A 533 9.267 3.428 0.702 1.00 71.14 H new ATOM 0 HD12 LEU A 533 10.389 4.521 1.546 1.00 71.14 H new ATOM 0 HD13 LEU A 533 9.324 5.153 0.268 1.00 71.14 H new ATOM 0 HD21 LEU A 533 9.728 2.711 -1.635 1.00 20.32 H new ATOM 0 HD22 LEU A 533 9.816 4.390 -2.218 1.00 20.32 H new ATOM 0 HD23 LEU A 533 11.186 3.284 -2.480 1.00 20.32 H new ATOM 2129 N GLN A 534 13.128 7.985 -1.962 1.00 41.03 N ATOM 2130 CA GLN A 534 13.614 9.340 -1.768 1.00 34.34 C ATOM 2131 C GLN A 534 13.219 10.222 -2.955 1.00 41.30 C ATOM 2132 O GLN A 534 12.663 11.303 -2.771 1.00 22.52 O ATOM 2133 CB GLN A 534 15.130 9.354 -1.557 1.00 2.51 C ATOM 2134 CG GLN A 534 15.556 8.267 -0.568 1.00 3.45 C ATOM 2135 CD GLN A 534 17.048 7.962 -0.697 1.00 24.45 C ATOM 2136 OE1 GLN A 534 17.431 7.638 -1.929 1.00 23.10 O flip ATOM 2137 NE2 GLN A 534 17.805 8.016 0.259 1.00 14.41 N flip ATOM 0 H GLN A 534 13.764 7.373 -2.473 1.00 41.03 H new ATOM 0 HA GLN A 534 13.150 9.745 -0.869 1.00 34.34 H new ATOM 0 HB2 GLN A 534 15.635 9.201 -2.511 1.00 2.51 H new ATOM 0 HB3 GLN A 534 15.440 10.331 -1.185 1.00 2.51 H new ATOM 0 HG2 GLN A 534 15.334 8.589 0.449 1.00 3.45 H new ATOM 0 HG3 GLN A 534 14.979 7.360 -0.748 1.00 3.45 H new ATOM 0 HE21 GLN A 534 17.447 8.272 1.179 1.00 14.41 H new ATOM 0 HE22 GLN A 534 18.796 7.806 0.138 1.00 14.41 H new ATOM 2144 N ALA A 535 13.520 9.727 -4.146 1.00 20.44 N ATOM 2145 CA ALA A 535 13.204 10.455 -5.362 1.00 10.12 C ATOM 2146 C ALA A 535 11.688 10.633 -5.464 1.00 14.32 C ATOM 2147 O ALA A 535 11.206 11.459 -6.238 1.00 62.15 O ATOM 2148 CB ALA A 535 13.785 9.713 -6.568 1.00 74.44 C ATOM 0 H ALA A 535 13.980 8.829 -4.295 1.00 20.44 H new ATOM 0 HA ALA A 535 13.653 11.448 -5.342 1.00 10.12 H new ATOM 0 HB1 ALA A 535 13.548 10.260 -7.481 1.00 74.44 H new ATOM 0 HB2 ALA A 535 14.867 9.637 -6.462 1.00 74.44 H new ATOM 0 HB3 ALA A 535 13.355 8.713 -6.622 1.00 74.44 H new ATOM 2154 N ARG A 536 10.976 9.845 -4.671 1.00 51.12 N ATOM 2155 CA ARG A 536 9.525 9.906 -4.662 1.00 72.51 C ATOM 2156 C ARG A 536 9.042 10.906 -3.609 1.00 41.35 C ATOM 2157 O ARG A 536 7.972 11.496 -3.753 1.00 2.23 O ATOM 2158 CB ARG A 536 8.918 8.533 -4.365 1.00 35.05 C ATOM 2159 CG ARG A 536 7.395 8.622 -4.243 1.00 34.32 C ATOM 2160 CD ARG A 536 6.786 9.308 -5.468 1.00 11.22 C ATOM 2161 NE ARG A 536 5.313 9.372 -5.331 1.00 35.13 N ATOM 2162 CZ ARG A 536 4.461 9.488 -6.372 1.00 35.32 C ATOM 2163 NH1 ARG A 536 4.930 9.555 -7.637 1.00 23.15 N ATOM 2164 NH2 ARG A 536 3.164 9.537 -6.134 1.00 34.45 N ATOM 0 H ARG A 536 11.378 9.161 -4.030 1.00 51.12 H new ATOM 0 HA ARG A 536 9.201 10.229 -5.651 1.00 72.51 H new ATOM 0 HB2 ARG A 536 9.183 7.835 -5.159 1.00 35.05 H new ATOM 0 HB3 ARG A 536 9.338 8.138 -3.440 1.00 35.05 H new ATOM 0 HG2 ARG A 536 6.976 7.621 -4.136 1.00 34.32 H new ATOM 0 HG3 ARG A 536 7.130 9.176 -3.342 1.00 34.32 H new ATOM 0 HD2 ARG A 536 7.194 10.313 -5.573 1.00 11.22 H new ATOM 0 HD3 ARG A 536 7.052 8.760 -6.372 1.00 11.22 H new ATOM 0 HE ARG A 536 4.917 9.326 -4.392 1.00 35.13 H new ATOM 0 HH11 ARG A 536 5.934 9.518 -7.811 1.00 23.15 H new ATOM 0 HH12 ARG A 536 4.280 9.643 -8.418 1.00 23.15 H new ATOM 0 HH21 ARG A 536 2.819 9.487 -5.175 1.00 34.45 H new ATOM 0 HH22 ARG A 536 2.506 9.625 -6.909 1.00 34.45 H new ATOM 2174 N LYS A 537 9.855 11.068 -2.576 1.00 41.24 N ATOM 2175 CA LYS A 537 9.524 11.986 -1.500 1.00 73.32 C ATOM 2176 C LYS A 537 10.244 13.317 -1.732 1.00 1.34 C ATOM 2177 O LYS A 537 9.960 14.306 -1.057 1.00 62.40 O ATOM 2178 CB LYS A 537 9.828 11.352 -0.142 1.00 64.44 C ATOM 2179 CG LYS A 537 11.270 11.635 0.287 1.00 14.14 C ATOM 2180 CD LYS A 537 11.729 10.644 1.358 1.00 74.13 C ATOM 2181 CE LYS A 537 13.205 10.857 1.705 1.00 13.15 C ATOM 2182 NZ LYS A 537 13.355 11.972 2.666 1.00 34.43 N ATOM 0 H LYS A 537 10.743 10.579 -2.461 1.00 41.24 H new ATOM 0 HA LYS A 537 8.455 12.197 -1.495 1.00 73.32 H new ATOM 0 HB2 LYS A 537 9.139 11.742 0.607 1.00 64.44 H new ATOM 0 HB3 LYS A 537 9.666 10.275 -0.195 1.00 64.44 H new ATOM 0 HG2 LYS A 537 11.930 11.572 -0.578 1.00 14.14 H new ATOM 0 HG3 LYS A 537 11.346 12.652 0.672 1.00 14.14 H new ATOM 0 HD2 LYS A 537 11.120 10.763 2.254 1.00 74.13 H new ATOM 0 HD3 LYS A 537 11.578 9.624 1.004 1.00 74.13 H new ATOM 0 HE2 LYS A 537 13.620 9.944 2.131 1.00 13.15 H new ATOM 0 HE3 LYS A 537 13.771 11.072 0.798 1.00 13.15 H new ATOM 0 HZ1 LYS A 537 14.362 12.103 2.891 1.00 34.43 H new ATOM 0 HZ2 LYS A 537 12.977 12.845 2.246 1.00 34.43 H new ATOM 0 HZ3 LYS A 537 12.832 11.752 3.537 1.00 34.43 H new ATOM 2191 N ALA A 538 11.159 13.299 -2.689 1.00 73.11 N ATOM 2192 CA ALA A 538 11.920 14.491 -3.020 1.00 61.35 C ATOM 2193 C ALA A 538 10.961 15.595 -3.471 1.00 54.51 C ATOM 2194 O ALA A 538 11.336 16.765 -3.521 1.00 70.04 O ATOM 2195 CB ALA A 538 12.963 14.153 -4.087 1.00 52.43 C ATOM 0 H ALA A 538 11.391 12.477 -3.246 1.00 73.11 H new ATOM 0 HA ALA A 538 12.457 14.858 -2.145 1.00 61.35 H new ATOM 0 HB1 ALA A 538 13.533 15.048 -4.335 1.00 52.43 H new ATOM 0 HB2 ALA A 538 13.638 13.386 -3.706 1.00 52.43 H new ATOM 0 HB3 ALA A 538 12.462 13.783 -4.981 1.00 52.43 H new ATOM 2201 N MET A 539 9.742 15.183 -3.788 1.00 70.53 N ATOM 2202 CA MET A 539 8.728 16.122 -4.234 1.00 13.22 C ATOM 2203 C MET A 539 7.998 16.747 -3.043 1.00 71.24 C ATOM 2204 O MET A 539 7.384 17.805 -3.171 1.00 12.33 O ATOM 2205 CB MET A 539 7.719 15.397 -5.127 1.00 44.02 C ATOM 2206 CG MET A 539 8.390 14.873 -6.398 1.00 33.23 C ATOM 2207 SD MET A 539 7.182 14.068 -7.438 1.00 62.52 S ATOM 2208 CE MET A 539 6.934 12.561 -6.514 1.00 25.31 C ATOM 0 H MET A 539 9.434 14.211 -3.745 1.00 70.53 H new ATOM 0 HA MET A 539 9.218 16.918 -4.795 1.00 13.22 H new ATOM 0 HB2 MET A 539 7.273 14.568 -4.579 1.00 44.02 H new ATOM 0 HB3 MET A 539 6.909 16.076 -5.393 1.00 44.02 H new ATOM 0 HG2 MET A 539 8.857 15.696 -6.939 1.00 33.23 H new ATOM 0 HG3 MET A 539 9.183 14.172 -6.138 1.00 33.23 H new ATOM 0 HE1 MET A 539 6.470 11.813 -7.156 1.00 25.31 H new ATOM 0 HE2 MET A 539 7.895 12.189 -6.159 1.00 25.31 H new ATOM 0 HE3 MET A 539 6.285 12.760 -5.661 1.00 25.31 H new ATOM 2216 N TRP A 540 8.090 16.067 -1.910 1.00 31.22 N ATOM 2217 CA TRP A 540 7.447 16.542 -0.697 1.00 72.10 C ATOM 2218 C TRP A 540 8.479 17.334 0.106 1.00 64.53 C ATOM 2219 O TRP A 540 8.162 18.379 0.672 1.00 4.31 O ATOM 2220 CB TRP A 540 6.838 15.381 0.093 1.00 14.44 C ATOM 2221 CG TRP A 540 5.408 15.029 -0.321 1.00 14.00 C ATOM 2222 CD1 TRP A 540 4.963 13.890 -0.872 1.00 44.43 C ATOM 2223 CD2 TRP A 540 4.244 15.874 -0.198 1.00 4.12 C ATOM 2224 NE1 TRP A 540 3.604 13.939 -1.108 1.00 63.43 N ATOM 2225 CE2 TRP A 540 3.154 15.184 -0.685 1.00 12.14 C ATOM 2226 CE3 TRP A 540 4.118 17.179 0.312 1.00 4.12 C ATOM 2227 CZ2 TRP A 540 1.858 15.716 -0.712 1.00 73.14 C ATOM 2228 CZ3 TRP A 540 2.817 17.697 0.277 1.00 25.45 C ATOM 2229 CH2 TRP A 540 1.708 17.015 -0.211 1.00 33.44 C ATOM 0 H TRP A 540 8.601 15.190 -1.806 1.00 31.22 H new ATOM 0 HA TRP A 540 6.612 17.200 -0.936 1.00 72.10 H new ATOM 0 HB2 TRP A 540 7.468 14.500 -0.031 1.00 14.44 H new ATOM 0 HB3 TRP A 540 6.847 15.633 1.154 1.00 14.44 H new ATOM 0 HD1 TRP A 540 5.590 13.041 -1.102 1.00 44.43 H new ATOM 0 HE1 TRP A 540 3.035 13.198 -1.517 1.00 63.43 H new ATOM 0 HE3 TRP A 540 4.957 17.737 0.700 1.00 4.12 H new ATOM 0 HZ2 TRP A 540 1.020 15.155 -1.098 1.00 73.14 H new ATOM 0 HZ3 TRP A 540 2.665 18.697 0.656 1.00 25.45 H new ATOM 0 HH2 TRP A 540 0.736 17.485 -0.204 1.00 33.44 H new ATOM 2239 N ARG A 541 9.694 16.805 0.132 1.00 11.44 N ATOM 2240 CA ARG A 541 10.776 17.450 0.858 1.00 12.03 C ATOM 2241 C ARG A 541 10.993 18.871 0.333 1.00 70.14 C ATOM 2242 O ARG A 541 11.538 19.720 1.037 1.00 64.13 O ATOM 2243 CB ARG A 541 12.078 16.660 0.722 1.00 32.45 C ATOM 2244 CG ARG A 541 12.730 16.907 -0.641 1.00 20.33 C ATOM 2245 CD ARG A 541 14.004 16.075 -0.798 1.00 61.14 C ATOM 2246 NE ARG A 541 14.498 16.163 -2.191 1.00 31.34 N ATOM 2247 CZ ARG A 541 15.673 15.649 -2.612 1.00 3.42 C ATOM 2248 NH1 ARG A 541 16.486 15.005 -1.748 1.00 22.52 N ATOM 2249 NH2 ARG A 541 16.015 15.785 -3.879 1.00 42.13 N ATOM 0 H ARG A 541 9.953 15.937 -0.338 1.00 11.44 H new ATOM 0 HA ARG A 541 10.494 17.486 1.910 1.00 12.03 H new ATOM 0 HB2 ARG A 541 12.767 16.948 1.516 1.00 32.45 H new ATOM 0 HB3 ARG A 541 11.876 15.596 0.845 1.00 32.45 H new ATOM 0 HG2 ARG A 541 12.027 16.656 -1.435 1.00 20.33 H new ATOM 0 HG3 ARG A 541 12.967 17.965 -0.748 1.00 20.33 H new ATOM 0 HD2 ARG A 541 14.769 16.433 -0.109 1.00 61.14 H new ATOM 0 HD3 ARG A 541 13.803 15.035 -0.540 1.00 61.14 H new ATOM 0 HE ARG A 541 13.913 16.642 -2.876 1.00 31.34 H new ATOM 0 HH11 ARG A 541 16.214 14.904 -0.770 1.00 22.52 H new ATOM 0 HH12 ARG A 541 17.372 14.619 -2.073 1.00 22.52 H new ATOM 0 HH21 ARG A 541 15.395 16.273 -4.525 1.00 42.13 H new ATOM 0 HH22 ARG A 541 16.900 15.402 -4.212 1.00 42.13 H new ATOM 2259 N LYS A 542 10.554 19.087 -0.897 1.00 12.03 N ATOM 2260 CA LYS A 542 10.694 20.391 -1.525 1.00 43.33 C ATOM 2261 C LYS A 542 10.353 21.481 -0.505 1.00 30.15 C ATOM 2262 O LYS A 542 10.884 22.588 -0.574 1.00 10.13 O ATOM 2263 CB LYS A 542 9.859 20.463 -2.804 1.00 53.22 C ATOM 2264 CG LYS A 542 10.422 19.532 -3.880 1.00 72.35 C ATOM 2265 CD LYS A 542 10.058 20.030 -5.280 1.00 22.45 C ATOM 2266 CE LYS A 542 8.558 20.313 -5.388 1.00 11.22 C ATOM 2267 NZ LYS A 542 8.270 21.720 -5.036 1.00 44.54 N ATOM 0 H LYS A 542 10.101 18.381 -1.477 1.00 12.03 H new ATOM 0 HA LYS A 542 11.725 20.555 -1.837 1.00 43.33 H new ATOM 0 HB2 LYS A 542 8.827 20.189 -2.585 1.00 53.22 H new ATOM 0 HB3 LYS A 542 9.845 21.488 -3.176 1.00 53.22 H new ATOM 0 HG2 LYS A 542 11.506 19.471 -3.782 1.00 72.35 H new ATOM 0 HG3 LYS A 542 10.031 18.525 -3.735 1.00 72.35 H new ATOM 0 HD2 LYS A 542 10.620 20.936 -5.505 1.00 22.45 H new ATOM 0 HD3 LYS A 542 10.345 19.284 -6.021 1.00 22.45 H new ATOM 0 HE2 LYS A 542 8.215 20.108 -6.402 1.00 11.22 H new ATOM 0 HE3 LYS A 542 8.007 19.646 -4.725 1.00 11.22 H new ATOM 0 HZ1 LYS A 542 7.584 22.113 -5.711 1.00 44.54 H new ATOM 0 HZ2 LYS A 542 7.874 21.763 -4.075 1.00 44.54 H new ATOM 0 HZ3 LYS A 542 9.149 22.274 -5.074 1.00 44.54 H new ATOM 2276 N GLU A 543 9.469 21.127 0.417 1.00 72.14 N ATOM 2277 CA GLU A 543 9.052 22.062 1.449 1.00 1.54 C ATOM 2278 C GLU A 543 10.252 22.489 2.296 1.00 15.43 C ATOM 2279 O GLU A 543 10.449 23.677 2.545 1.00 5.35 O ATOM 2280 CB GLU A 543 7.951 21.456 2.323 1.00 42.33 C ATOM 2281 CG GLU A 543 6.597 21.508 1.613 1.00 42.33 C ATOM 2282 CD GLU A 543 5.518 20.805 2.440 1.00 40.31 C ATOM 2283 OE1 GLU A 543 5.758 19.712 2.972 1.00 3.14 O ATOM 2284 OE2 GLU A 543 4.396 21.437 2.522 1.00 12.41 O ATOM 0 H GLU A 543 9.031 20.208 0.471 1.00 72.14 H new ATOM 0 HA GLU A 543 8.641 22.948 0.965 1.00 1.54 H new ATOM 0 HB2 GLU A 543 8.200 20.422 2.563 1.00 42.33 H new ATOM 0 HB3 GLU A 543 7.892 21.998 3.267 1.00 42.33 H new ATOM 0 HG2 GLU A 543 6.311 22.546 1.442 1.00 42.33 H new ATOM 0 HG3 GLU A 543 6.677 21.034 0.634 1.00 42.33 H new ATOM 2290 N GLN A 544 11.023 21.497 2.716 1.00 33.41 N ATOM 2291 CA GLN A 544 12.198 21.755 3.530 1.00 23.20 C ATOM 2292 C GLN A 544 13.350 22.256 2.655 1.00 1.22 C ATOM 2293 O GLN A 544 14.051 23.197 3.025 1.00 30.34 O ATOM 2294 CB GLN A 544 12.608 20.506 4.313 1.00 72.04 C ATOM 2295 CG GLN A 544 11.395 19.851 4.976 1.00 53.32 C ATOM 2296 CD GLN A 544 10.790 20.769 6.041 1.00 24.33 C ATOM 2297 OE1 GLN A 544 11.461 21.238 6.945 1.00 70.21 O ATOM 2298 NE2 GLN A 544 9.490 20.997 5.884 1.00 11.20 N ATOM 0 H GLN A 544 10.857 20.512 2.508 1.00 33.41 H new ATOM 0 HA GLN A 544 11.951 22.532 4.253 1.00 23.20 H new ATOM 0 HB2 GLN A 544 13.089 19.794 3.642 1.00 72.04 H new ATOM 0 HB3 GLN A 544 13.342 20.774 5.073 1.00 72.04 H new ATOM 0 HG2 GLN A 544 10.644 19.620 4.221 1.00 53.32 H new ATOM 0 HG3 GLN A 544 11.691 18.906 5.431 1.00 53.32 H new ATOM 0 HE21 GLN A 544 8.988 20.572 5.104 1.00 11.20 H new ATOM 0 HE22 GLN A 544 8.994 21.597 6.543 1.00 11.20 H new ATOM 2305 N ASP A 545 13.509 21.607 1.512 1.00 13.14 N ATOM 2306 CA ASP A 545 14.562 21.974 0.582 1.00 30.41 C ATOM 2307 C ASP A 545 14.527 23.486 0.349 1.00 4.53 C ATOM 2308 O ASP A 545 15.535 24.084 -0.023 1.00 31.11 O ATOM 2309 CB ASP A 545 14.370 21.283 -0.769 1.00 33.42 C ATOM 2310 CG ASP A 545 15.646 21.119 -1.598 1.00 14.02 C ATOM 2311 OD1 ASP A 545 16.032 22.016 -2.362 1.00 65.32 O ATOM 2312 OD2 ASP A 545 16.261 19.995 -1.436 1.00 52.34 O ATOM 0 H ASP A 545 12.925 20.828 1.208 1.00 13.14 H new ATOM 0 HA ASP A 545 15.514 21.665 1.013 1.00 30.41 H new ATOM 0 HB2 ASP A 545 13.937 20.298 -0.598 1.00 33.42 H new ATOM 0 HB3 ASP A 545 13.646 21.853 -1.352 1.00 33.42 H new TER 2317 ASP A 545