USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 837 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 Single : A 448 SER OG : rot 180:sc= 0 USER MOD Single : A 449 SER OG : rot 180:sc= 0 USER MOD Single : A 451 SER OG : rot 62:sc= 1.15 USER MOD Single : A 452 SER OG : rot 16:sc= 0.699 USER MOD Single : A 454 GLN : amide:sc= -2.14! C(o=-2.1!,f=-2.6!) USER MOD Single : A 457 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 459 GLN : amide:sc= -0.078 K(o=-0.078,f=-1.4) USER MOD Single : A 460 THR OG1 : rot 180:sc= 0 USER MOD Single : A 461 THR OG1 : rot 180:sc= 0 USER MOD Single : A 462 SER OG : rot 46:sc= 0.759 USER MOD Single : A 463 LYS NZ :NH3+ -159:sc= -0.0466 (180deg=-0.367) USER MOD Single : A 468 ASN : amide:sc= 0.0027 X(o=0.0027,f=-0.035) USER MOD Single : A 472 GLN : amide:sc= -0.0425 X(o=-0.042,f=-0.32) USER MOD Single : A 474 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 475 GLN : amide:sc= -1.38 K(o=-1.4,f=-2.5!) USER MOD Single : A 483 SER OG : rot -170:sc= -1.01 USER MOD Single : A 484 THR OG1 : rot 180:sc= 0 USER MOD Single : A 489 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 490 THR OG1 : rot 180:sc= 0 USER MOD Single : A 495 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 180:sc= 0 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 503 HIS : no HE2:sc= -4.73! C(o=-4.7!,f=-6.7!) USER MOD Single : A 513 THR OG1 : rot -72:sc= 0.663 USER MOD Single : A 514 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 515 GLN : amide:sc= -0.222 X(o=-0.22,f=-0.63) USER MOD Single : A 518 LYS NZ :NH3+ -142:sc= -0.618 (180deg=-2.17!) USER MOD Single : A 519 LYS NZ :NH3+ -153:sc= 0.0402 (180deg=0) USER MOD Single : A 522 ASN : amide:sc= -0.0436 K(o=-0.044,f=-1.2!) USER MOD Single : A 525 CYS SG : rot 180:sc= 0 USER MOD Single : A 526 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 527 SER OG : rot 40:sc= 0.608 USER MOD Single : A 528 THR OG1 : rot 59:sc= 0.289 USER MOD Single : A 529 HIS : no HD1:sc= -2.68! C(o=-2.7!,f=-4.3!) USER MOD Single : A 531 TYR OH : rot 140:sc= 0.234 USER MOD Single : A 542 SER OG : rot 180:sc= 0 USER MOD Single : A 545 THR OG1 : rot 180:sc= 0 USER MOD Single : A 547 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 548 SER OG : rot 180:sc= 0 USER MOD Single : A 551 SER OG : rot 180:sc= 0 USER MOD Single : A 552 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 447 -14.461 -9.449 -10.858 1.00 0.00 N ATOM 2 CA GLY A 447 -13.719 -9.448 -12.105 1.00 0.00 C ATOM 3 C GLY A 447 -13.161 -8.080 -12.447 1.00 0.00 C ATOM 4 O GLY A 447 -13.828 -7.275 -13.097 1.00 0.00 O ATOM 0 HA2 GLY A 447 -12.900 -10.164 -12.038 1.00 0.00 H new ATOM 0 HA3 GLY A 447 -14.370 -9.783 -12.912 1.00 0.00 H new ATOM 8 N SER A 448 -11.936 -7.816 -12.006 1.00 0.00 N ATOM 9 CA SER A 448 -11.290 -6.534 -12.265 1.00 0.00 C ATOM 10 C SER A 448 -9.996 -6.726 -13.049 1.00 0.00 C ATOM 11 O SER A 448 -8.930 -6.933 -12.469 1.00 0.00 O ATOM 12 CB SER A 448 -11.000 -5.811 -10.948 1.00 0.00 C ATOM 13 OG SER A 448 -10.336 -4.580 -11.178 1.00 0.00 O ATOM 0 H SER A 448 -11.370 -8.472 -11.468 1.00 0.00 H new ATOM 0 HA SER A 448 -11.969 -5.927 -12.863 1.00 0.00 H new ATOM 0 HB2 SER A 448 -11.934 -5.630 -10.415 1.00 0.00 H new ATOM 0 HB3 SER A 448 -10.386 -6.445 -10.309 1.00 0.00 H new ATOM 0 HG SER A 448 -10.163 -4.136 -10.321 1.00 0.00 H new ATOM 19 N SER A 449 -10.098 -6.654 -14.373 1.00 0.00 N ATOM 20 CA SER A 449 -8.937 -6.823 -15.239 1.00 0.00 C ATOM 21 C SER A 449 -8.550 -5.501 -15.893 1.00 0.00 C ATOM 22 O SER A 449 -9.102 -5.120 -16.924 1.00 0.00 O ATOM 23 CB SER A 449 -9.225 -7.872 -16.314 1.00 0.00 C ATOM 24 OG SER A 449 -9.608 -9.107 -15.733 1.00 0.00 O ATOM 0 H SER A 449 -10.972 -6.480 -14.869 1.00 0.00 H new ATOM 0 HA SER A 449 -8.103 -7.162 -14.625 1.00 0.00 H new ATOM 0 HB2 SER A 449 -10.017 -7.515 -16.972 1.00 0.00 H new ATOM 0 HB3 SER A 449 -8.339 -8.017 -16.932 1.00 0.00 H new ATOM 0 HG SER A 449 -9.788 -9.760 -16.441 1.00 0.00 H new ATOM 30 N GLY A 450 -7.595 -4.803 -15.284 1.00 0.00 N ATOM 31 CA GLY A 450 -7.150 -3.530 -15.820 1.00 0.00 C ATOM 32 C GLY A 450 -5.723 -3.583 -16.329 1.00 0.00 C ATOM 33 O GLY A 450 -4.855 -2.860 -15.840 1.00 0.00 O ATOM 0 H GLY A 450 -7.122 -5.097 -14.429 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -7.812 -3.230 -16.633 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -7.229 -2.766 -15.047 1.00 0.00 H new ATOM 37 N SER A 451 -5.478 -4.444 -17.312 1.00 0.00 N ATOM 38 CA SER A 451 -4.145 -4.592 -17.884 1.00 0.00 C ATOM 39 C SER A 451 -4.029 -3.826 -19.198 1.00 0.00 C ATOM 40 O SER A 451 -4.212 -4.389 -20.277 1.00 0.00 O ATOM 41 CB SER A 451 -3.828 -6.071 -18.113 1.00 0.00 C ATOM 42 OG SER A 451 -4.598 -6.599 -19.179 1.00 0.00 O ATOM 0 H SER A 451 -6.185 -5.049 -17.729 1.00 0.00 H new ATOM 0 HA SER A 451 -3.425 -4.178 -17.178 1.00 0.00 H new ATOM 0 HB2 SER A 451 -2.767 -6.189 -18.334 1.00 0.00 H new ATOM 0 HB3 SER A 451 -4.029 -6.634 -17.202 1.00 0.00 H new ATOM 0 HG SER A 451 -4.372 -6.131 -20.009 1.00 0.00 H new ATOM 48 N SER A 452 -3.723 -2.536 -19.098 1.00 0.00 N ATOM 49 CA SER A 452 -3.585 -1.690 -20.278 1.00 0.00 C ATOM 50 C SER A 452 -2.709 -0.477 -19.977 1.00 0.00 C ATOM 51 O SER A 452 -2.387 -0.200 -18.822 1.00 0.00 O ATOM 52 CB SER A 452 -4.961 -1.230 -20.765 1.00 0.00 C ATOM 53 OG SER A 452 -5.620 -2.262 -21.478 1.00 0.00 O ATOM 0 H SER A 452 -3.566 -2.054 -18.213 1.00 0.00 H new ATOM 0 HA SER A 452 -3.107 -2.277 -21.062 1.00 0.00 H new ATOM 0 HB2 SER A 452 -5.569 -0.927 -19.913 1.00 0.00 H new ATOM 0 HB3 SER A 452 -4.850 -0.355 -21.405 1.00 0.00 H new ATOM 0 HG SER A 452 -5.179 -3.118 -21.297 1.00 0.00 H new ATOM 59 N GLY A 453 -2.325 0.242 -21.027 1.00 0.00 N ATOM 60 CA GLY A 453 -1.489 1.416 -20.856 1.00 0.00 C ATOM 61 C GLY A 453 -0.332 1.452 -21.835 1.00 0.00 C ATOM 62 O GLY A 453 0.087 0.414 -22.347 1.00 0.00 O ATOM 0 H GLY A 453 -2.578 0.033 -21.993 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -2.096 2.312 -20.983 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -1.100 1.436 -19.838 1.00 0.00 H new ATOM 66 N GLN A 454 0.184 2.648 -22.096 1.00 0.00 N ATOM 67 CA GLN A 454 1.298 2.814 -23.022 1.00 0.00 C ATOM 68 C GLN A 454 2.424 1.836 -22.700 1.00 0.00 C ATOM 69 O GLN A 454 2.332 1.060 -21.749 1.00 0.00 O ATOM 70 CB GLN A 454 1.824 4.250 -22.969 1.00 0.00 C ATOM 71 CG GLN A 454 0.872 5.268 -23.576 1.00 0.00 C ATOM 72 CD GLN A 454 -0.453 5.338 -22.843 1.00 0.00 C ATOM 73 OE1 GLN A 454 -0.506 5.693 -21.665 1.00 0.00 O ATOM 74 NE2 GLN A 454 -1.533 5.000 -23.538 1.00 0.00 N ATOM 0 H GLN A 454 -0.151 3.517 -21.679 1.00 0.00 H new ATOM 0 HA GLN A 454 0.935 2.604 -24.028 1.00 0.00 H new ATOM 0 HB2 GLN A 454 2.017 4.519 -21.931 1.00 0.00 H new ATOM 0 HB3 GLN A 454 2.778 4.299 -23.494 1.00 0.00 H new ATOM 0 HG2 GLN A 454 1.342 6.251 -23.564 1.00 0.00 H new ATOM 0 HG3 GLN A 454 0.692 5.014 -24.621 1.00 0.00 H new ATOM 0 HE21 GLN A 454 -1.443 4.712 -24.512 1.00 0.00 H new ATOM 0 HE22 GLN A 454 -2.453 5.029 -23.098 1.00 0.00 H new ATOM 83 N VAL A 455 3.485 1.879 -23.500 1.00 0.00 N ATOM 84 CA VAL A 455 4.629 0.997 -23.299 1.00 0.00 C ATOM 85 C VAL A 455 5.037 0.952 -21.831 1.00 0.00 C ATOM 86 O VAL A 455 4.911 1.930 -21.095 1.00 0.00 O ATOM 87 CB VAL A 455 5.837 1.444 -24.144 1.00 0.00 C ATOM 88 CG1 VAL A 455 5.530 1.310 -25.628 1.00 0.00 C ATOM 89 CG2 VAL A 455 6.227 2.874 -23.799 1.00 0.00 C ATOM 0 H VAL A 455 3.576 2.515 -24.293 1.00 0.00 H new ATOM 0 HA VAL A 455 4.321 0.001 -23.617 1.00 0.00 H new ATOM 0 HB VAL A 455 6.681 0.795 -23.912 1.00 0.00 H new ATOM 0 HG11 VAL A 455 6.395 1.630 -26.209 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.302 0.270 -25.860 1.00 0.00 H new ATOM 0 HG13 VAL A 455 4.672 1.934 -25.880 1.00 0.00 H new ATOM 0 HG21 VAL A 455 7.082 3.174 -24.405 1.00 0.00 H new ATOM 0 HG22 VAL A 455 5.387 3.539 -24.001 1.00 0.00 H new ATOM 0 HG23 VAL A 455 6.491 2.934 -22.743 1.00 0.00 H new ATOM 99 N PRO A 456 5.541 -0.212 -21.393 1.00 0.00 N ATOM 100 CA PRO A 456 5.980 -0.413 -20.009 1.00 0.00 C ATOM 101 C PRO A 456 7.247 0.370 -19.683 1.00 0.00 C ATOM 102 O PRO A 456 8.180 0.422 -20.484 1.00 0.00 O ATOM 103 CB PRO A 456 6.248 -1.918 -19.938 1.00 0.00 C ATOM 104 CG PRO A 456 6.554 -2.316 -21.340 1.00 0.00 C ATOM 105 CD PRO A 456 5.720 -1.420 -22.215 1.00 0.00 C ATOM 0 HA PRO A 456 5.238 -0.064 -19.291 1.00 0.00 H new ATOM 0 HB2 PRO A 456 7.082 -2.140 -19.273 1.00 0.00 H new ATOM 0 HB3 PRO A 456 5.382 -2.456 -19.554 1.00 0.00 H new ATOM 0 HG2 PRO A 456 7.615 -2.196 -21.557 1.00 0.00 H new ATOM 0 HG3 PRO A 456 6.310 -3.365 -21.510 1.00 0.00 H new ATOM 0 HD2 PRO A 456 6.223 -1.195 -23.155 1.00 0.00 H new ATOM 0 HD3 PRO A 456 4.764 -1.880 -22.467 1.00 0.00 H new ATOM 113 N LYS A 457 7.273 0.978 -18.502 1.00 0.00 N ATOM 114 CA LYS A 457 8.426 1.758 -18.068 1.00 0.00 C ATOM 115 C LYS A 457 9.386 0.901 -17.249 1.00 0.00 C ATOM 116 O LYS A 457 8.961 0.037 -16.481 1.00 0.00 O ATOM 117 CB LYS A 457 7.971 2.964 -17.244 1.00 0.00 C ATOM 118 CG LYS A 457 7.628 4.182 -18.085 1.00 0.00 C ATOM 119 CD LYS A 457 6.780 5.175 -17.308 1.00 0.00 C ATOM 120 CE LYS A 457 6.047 6.130 -18.238 1.00 0.00 C ATOM 121 NZ LYS A 457 4.857 6.738 -17.583 1.00 0.00 N ATOM 0 H LYS A 457 6.508 0.946 -17.828 1.00 0.00 H new ATOM 0 HA LYS A 457 8.950 2.110 -18.956 1.00 0.00 H new ATOM 0 HB2 LYS A 457 7.098 2.682 -16.655 1.00 0.00 H new ATOM 0 HB3 LYS A 457 8.759 3.230 -16.539 1.00 0.00 H new ATOM 0 HG2 LYS A 457 8.546 4.667 -18.416 1.00 0.00 H new ATOM 0 HG3 LYS A 457 7.093 3.868 -18.981 1.00 0.00 H new ATOM 0 HD2 LYS A 457 6.058 4.636 -16.695 1.00 0.00 H new ATOM 0 HD3 LYS A 457 7.415 5.743 -16.628 1.00 0.00 H new ATOM 0 HE2 LYS A 457 6.728 6.919 -18.558 1.00 0.00 H new ATOM 0 HE3 LYS A 457 5.734 5.595 -19.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 457 4.385 7.382 -18.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 457 4.195 5.987 -17.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 457 5.158 7.270 -16.741 1.00 0.00 H new ATOM 135 N LYS A 458 10.681 1.147 -17.415 1.00 0.00 N ATOM 136 CA LYS A 458 11.701 0.400 -16.688 1.00 0.00 C ATOM 137 C LYS A 458 11.244 0.099 -15.264 1.00 0.00 C ATOM 138 O LYS A 458 11.134 -1.062 -14.872 1.00 0.00 O ATOM 139 CB LYS A 458 13.014 1.187 -16.658 1.00 0.00 C ATOM 140 CG LYS A 458 13.812 1.087 -17.947 1.00 0.00 C ATOM 141 CD LYS A 458 15.095 1.896 -17.872 1.00 0.00 C ATOM 142 CE LYS A 458 15.659 2.178 -19.256 1.00 0.00 C ATOM 143 NZ LYS A 458 14.982 3.334 -19.906 1.00 0.00 N ATOM 0 H LYS A 458 11.049 1.858 -18.047 1.00 0.00 H new ATOM 0 HA LYS A 458 11.862 -0.545 -17.206 1.00 0.00 H new ATOM 0 HB2 LYS A 458 12.795 2.236 -16.456 1.00 0.00 H new ATOM 0 HB3 LYS A 458 13.626 0.825 -15.832 1.00 0.00 H new ATOM 0 HG2 LYS A 458 14.051 0.043 -18.148 1.00 0.00 H new ATOM 0 HG3 LYS A 458 13.205 1.442 -18.780 1.00 0.00 H new ATOM 0 HD2 LYS A 458 14.903 2.838 -17.358 1.00 0.00 H new ATOM 0 HD3 LYS A 458 15.833 1.355 -17.281 1.00 0.00 H new ATOM 0 HE2 LYS A 458 16.727 2.380 -19.179 1.00 0.00 H new ATOM 0 HE3 LYS A 458 15.546 1.292 -19.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 458 15.395 3.494 -20.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 458 13.966 3.132 -20.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 458 15.111 4.185 -19.322 1.00 0.00 H new ATOM 157 N GLN A 459 10.979 1.152 -14.498 1.00 0.00 N ATOM 158 CA GLN A 459 10.533 0.998 -13.118 1.00 0.00 C ATOM 159 C GLN A 459 9.020 0.819 -13.051 1.00 0.00 C ATOM 160 O GLN A 459 8.265 1.603 -13.628 1.00 0.00 O ATOM 161 CB GLN A 459 10.953 2.211 -12.286 1.00 0.00 C ATOM 162 CG GLN A 459 10.365 2.220 -10.884 1.00 0.00 C ATOM 163 CD GLN A 459 10.222 3.620 -10.320 1.00 0.00 C ATOM 164 OE1 GLN A 459 10.695 4.591 -10.911 1.00 0.00 O ATOM 165 NE2 GLN A 459 9.567 3.731 -9.170 1.00 0.00 N ATOM 0 H GLN A 459 11.065 2.120 -14.809 1.00 0.00 H new ATOM 0 HA GLN A 459 11.004 0.105 -12.708 1.00 0.00 H new ATOM 0 HB2 GLN A 459 12.040 2.234 -12.215 1.00 0.00 H new ATOM 0 HB3 GLN A 459 10.648 3.120 -12.805 1.00 0.00 H new ATOM 0 HG2 GLN A 459 9.388 1.738 -10.901 1.00 0.00 H new ATOM 0 HG3 GLN A 459 11.000 1.630 -10.224 1.00 0.00 H new ATOM 0 HE21 GLN A 459 9.191 2.899 -8.715 1.00 0.00 H new ATOM 0 HE22 GLN A 459 9.439 4.648 -8.742 1.00 0.00 H new ATOM 174 N THR A 460 8.582 -0.217 -12.343 1.00 0.00 N ATOM 175 CA THR A 460 7.159 -0.500 -12.202 1.00 0.00 C ATOM 176 C THR A 460 6.574 0.216 -10.991 1.00 0.00 C ATOM 177 O THR A 460 7.281 0.506 -10.025 1.00 0.00 O ATOM 178 CB THR A 460 6.898 -2.012 -12.066 1.00 0.00 C ATOM 179 OG1 THR A 460 5.497 -2.280 -12.193 1.00 0.00 O ATOM 180 CG2 THR A 460 7.399 -2.529 -10.726 1.00 0.00 C ATOM 0 H THR A 460 9.193 -0.874 -11.858 1.00 0.00 H new ATOM 0 HA THR A 460 6.673 -0.135 -13.107 1.00 0.00 H new ATOM 0 HB THR A 460 7.439 -2.525 -12.861 1.00 0.00 H new ATOM 0 HG1 THR A 460 5.339 -3.243 -12.107 1.00 0.00 H new ATOM 0 HG21 THR A 460 7.204 -3.599 -10.653 1.00 0.00 H new ATOM 0 HG22 THR A 460 8.471 -2.349 -10.644 1.00 0.00 H new ATOM 0 HG23 THR A 460 6.882 -2.010 -9.919 1.00 0.00 H new ATOM 188 N THR A 461 5.276 0.500 -11.047 1.00 0.00 N ATOM 189 CA THR A 461 4.595 1.183 -9.954 1.00 0.00 C ATOM 190 C THR A 461 4.669 0.371 -8.667 1.00 0.00 C ATOM 191 O THR A 461 4.001 -0.654 -8.528 1.00 0.00 O ATOM 192 CB THR A 461 3.117 1.452 -10.294 1.00 0.00 C ATOM 193 OG1 THR A 461 3.015 2.556 -11.200 1.00 0.00 O ATOM 194 CG2 THR A 461 2.317 1.747 -9.034 1.00 0.00 C ATOM 0 H THR A 461 4.676 0.267 -11.838 1.00 0.00 H new ATOM 0 HA THR A 461 5.106 2.135 -9.809 1.00 0.00 H new ATOM 0 HB THR A 461 2.707 0.558 -10.765 1.00 0.00 H new ATOM 0 HG1 THR A 461 2.072 2.719 -11.412 1.00 0.00 H new ATOM 0 HG21 THR A 461 1.276 1.934 -9.299 1.00 0.00 H new ATOM 0 HG22 THR A 461 2.372 0.892 -8.360 1.00 0.00 H new ATOM 0 HG23 THR A 461 2.729 2.627 -8.539 1.00 0.00 H new ATOM 202 N SER A 462 5.485 0.834 -7.726 1.00 0.00 N ATOM 203 CA SER A 462 5.649 0.148 -6.449 1.00 0.00 C ATOM 204 C SER A 462 4.813 0.817 -5.362 1.00 0.00 C ATOM 205 O SER A 462 5.286 1.713 -4.662 1.00 0.00 O ATOM 206 CB SER A 462 7.123 0.133 -6.039 1.00 0.00 C ATOM 207 OG SER A 462 7.636 1.450 -5.934 1.00 0.00 O ATOM 0 H SER A 462 6.043 1.682 -7.823 1.00 0.00 H new ATOM 0 HA SER A 462 5.303 -0.879 -6.569 1.00 0.00 H new ATOM 0 HB2 SER A 462 7.233 -0.381 -5.084 1.00 0.00 H new ATOM 0 HB3 SER A 462 7.702 -0.429 -6.772 1.00 0.00 H new ATOM 0 HG SER A 462 7.002 2.009 -5.438 1.00 0.00 H new ATOM 213 N LYS A 463 3.568 0.375 -5.226 1.00 0.00 N ATOM 214 CA LYS A 463 2.664 0.928 -4.224 1.00 0.00 C ATOM 215 C LYS A 463 1.758 -0.156 -3.651 1.00 0.00 C ATOM 216 O LYS A 463 0.898 -0.693 -4.351 1.00 0.00 O ATOM 217 CB LYS A 463 1.816 2.047 -4.834 1.00 0.00 C ATOM 218 CG LYS A 463 2.451 3.422 -4.720 1.00 0.00 C ATOM 219 CD LYS A 463 1.400 4.518 -4.657 1.00 0.00 C ATOM 220 CE LYS A 463 0.833 4.826 -6.035 1.00 0.00 C ATOM 221 NZ LYS A 463 1.851 5.446 -6.927 1.00 0.00 N ATOM 0 H LYS A 463 3.161 -0.365 -5.798 1.00 0.00 H new ATOM 0 HA LYS A 463 3.267 1.338 -3.414 1.00 0.00 H new ATOM 0 HB2 LYS A 463 1.638 1.824 -5.886 1.00 0.00 H new ATOM 0 HB3 LYS A 463 0.843 2.063 -4.343 1.00 0.00 H new ATOM 0 HG2 LYS A 463 3.075 3.463 -3.827 1.00 0.00 H new ATOM 0 HG3 LYS A 463 3.106 3.593 -5.574 1.00 0.00 H new ATOM 0 HD2 LYS A 463 0.594 4.212 -3.990 1.00 0.00 H new ATOM 0 HD3 LYS A 463 1.839 5.421 -4.233 1.00 0.00 H new ATOM 0 HE2 LYS A 463 0.463 3.907 -6.489 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -0.020 5.498 -5.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 1.373 5.956 -7.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 2.433 6.112 -6.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 2.459 4.704 -7.329 1.00 0.00 H new ATOM 235 N ILE A 464 1.955 -0.473 -2.376 1.00 0.00 N ATOM 236 CA ILE A 464 1.153 -1.491 -1.710 1.00 0.00 C ATOM 237 C ILE A 464 -0.011 -0.864 -0.949 1.00 0.00 C ATOM 238 O ILE A 464 0.185 -0.207 0.074 1.00 0.00 O ATOM 239 CB ILE A 464 2.001 -2.325 -0.731 1.00 0.00 C ATOM 240 CG1 ILE A 464 3.024 -3.166 -1.498 1.00 0.00 C ATOM 241 CG2 ILE A 464 1.108 -3.215 0.119 1.00 0.00 C ATOM 242 CD1 ILE A 464 4.050 -3.830 -0.607 1.00 0.00 C ATOM 0 H ILE A 464 2.663 -0.039 -1.784 1.00 0.00 H new ATOM 0 HA ILE A 464 0.764 -2.145 -2.490 1.00 0.00 H new ATOM 0 HB ILE A 464 2.538 -1.645 -0.070 1.00 0.00 H new ATOM 0 HG12 ILE A 464 2.498 -3.933 -2.067 1.00 0.00 H new ATOM 0 HG13 ILE A 464 3.538 -2.530 -2.219 1.00 0.00 H new ATOM 0 HG21 ILE A 464 1.722 -3.798 0.805 1.00 0.00 H new ATOM 0 HG22 ILE A 464 0.414 -2.597 0.689 1.00 0.00 H new ATOM 0 HG23 ILE A 464 0.546 -3.890 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE A 464 4.742 -4.409 -1.218 1.00 0.00 H new ATOM 0 HD12 ILE A 464 4.602 -3.068 -0.057 1.00 0.00 H new ATOM 0 HD13 ILE A 464 3.546 -4.492 0.097 1.00 0.00 H new ATOM 254 N LEU A 465 -1.222 -1.074 -1.453 1.00 0.00 N ATOM 255 CA LEU A 465 -2.418 -0.531 -0.821 1.00 0.00 C ATOM 256 C LEU A 465 -3.193 -1.624 -0.091 1.00 0.00 C ATOM 257 O LEU A 465 -3.879 -2.435 -0.715 1.00 0.00 O ATOM 258 CB LEU A 465 -3.315 0.134 -1.866 1.00 0.00 C ATOM 259 CG LEU A 465 -4.771 0.361 -1.456 1.00 0.00 C ATOM 260 CD1 LEU A 465 -4.859 1.411 -0.360 1.00 0.00 C ATOM 261 CD2 LEU A 465 -5.606 0.772 -2.659 1.00 0.00 C ATOM 0 H LEU A 465 -1.401 -1.617 -2.298 1.00 0.00 H new ATOM 0 HA LEU A 465 -2.105 0.216 -0.092 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -2.879 1.097 -2.130 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -3.304 -0.479 -2.768 1.00 0.00 H new ATOM 0 HG LEU A 465 -5.169 -0.576 -1.066 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -5.902 1.559 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -4.295 1.076 0.510 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -4.443 2.351 -0.723 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -6.639 0.929 -2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.209 1.696 -3.079 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -5.570 -0.014 -3.413 1.00 0.00 H new ATOM 273 N VAL A 466 -3.080 -1.639 1.233 1.00 0.00 N ATOM 274 CA VAL A 466 -3.772 -2.631 2.048 1.00 0.00 C ATOM 275 C VAL A 466 -5.195 -2.186 2.365 1.00 0.00 C ATOM 276 O VAL A 466 -5.406 -1.141 2.981 1.00 0.00 O ATOM 277 CB VAL A 466 -3.022 -2.895 3.367 1.00 0.00 C ATOM 278 CG1 VAL A 466 -2.620 -1.583 4.024 1.00 0.00 C ATOM 279 CG2 VAL A 466 -3.877 -3.731 4.307 1.00 0.00 C ATOM 0 H VAL A 466 -2.516 -0.976 1.764 1.00 0.00 H new ATOM 0 HA VAL A 466 -3.804 -3.552 1.466 1.00 0.00 H new ATOM 0 HB VAL A 466 -2.114 -3.455 3.143 1.00 0.00 H new ATOM 0 HG11 VAL A 466 -2.091 -1.789 4.955 1.00 0.00 H new ATOM 0 HG12 VAL A 466 -1.968 -1.024 3.352 1.00 0.00 H new ATOM 0 HG13 VAL A 466 -3.512 -0.994 4.236 1.00 0.00 H new ATOM 0 HG21 VAL A 466 -3.332 -3.908 5.234 1.00 0.00 H new ATOM 0 HG22 VAL A 466 -4.803 -3.199 4.526 1.00 0.00 H new ATOM 0 HG23 VAL A 466 -4.110 -4.686 3.835 1.00 0.00 H new ATOM 289 N ARG A 467 -6.168 -2.985 1.940 1.00 0.00 N ATOM 290 CA ARG A 467 -7.572 -2.673 2.178 1.00 0.00 C ATOM 291 C ARG A 467 -8.190 -3.663 3.161 1.00 0.00 C ATOM 292 O ARG A 467 -7.547 -4.629 3.571 1.00 0.00 O ATOM 293 CB ARG A 467 -8.351 -2.692 0.861 1.00 0.00 C ATOM 294 CG ARG A 467 -8.326 -1.365 0.120 1.00 0.00 C ATOM 295 CD ARG A 467 -8.681 -1.541 -1.348 1.00 0.00 C ATOM 296 NE ARG A 467 -8.827 -0.259 -2.033 1.00 0.00 N ATOM 297 CZ ARG A 467 -9.109 -0.145 -3.326 1.00 0.00 C ATOM 298 NH1 ARG A 467 -9.275 -1.229 -4.070 1.00 0.00 N ATOM 299 NH2 ARG A 467 -9.226 1.057 -3.877 1.00 0.00 N ATOM 0 H ARG A 467 -6.010 -3.853 1.429 1.00 0.00 H new ATOM 0 HA ARG A 467 -7.628 -1.674 2.611 1.00 0.00 H new ATOM 0 HB2 ARG A 467 -7.938 -3.467 0.215 1.00 0.00 H new ATOM 0 HB3 ARG A 467 -9.386 -2.965 1.065 1.00 0.00 H new ATOM 0 HG2 ARG A 467 -9.029 -0.674 0.585 1.00 0.00 H new ATOM 0 HG3 ARG A 467 -7.336 -0.918 0.205 1.00 0.00 H new ATOM 0 HD2 ARG A 467 -7.906 -2.129 -1.840 1.00 0.00 H new ATOM 0 HD3 ARG A 467 -9.610 -2.105 -1.431 1.00 0.00 H new ATOM 0 HE ARG A 467 -8.706 0.595 -1.489 1.00 0.00 H new ATOM 0 HH11 ARG A 467 -9.186 -2.154 -3.650 1.00 0.00 H new ATOM 0 HH12 ARG A 467 -9.491 -1.138 -5.063 1.00 0.00 H new ATOM 0 HH21 ARG A 467 -9.099 1.894 -3.307 1.00 0.00 H new ATOM 0 HH22 ARG A 467 -9.443 1.144 -4.870 1.00 0.00 H new ATOM 313 N ASN A 468 -9.441 -3.415 3.535 1.00 0.00 N ATOM 314 CA ASN A 468 -10.145 -4.283 4.471 1.00 0.00 C ATOM 315 C ASN A 468 -9.421 -4.337 5.813 1.00 0.00 C ATOM 316 O ASN A 468 -9.295 -5.402 6.419 1.00 0.00 O ATOM 317 CB ASN A 468 -10.275 -5.693 3.892 1.00 0.00 C ATOM 318 CG ASN A 468 -11.485 -6.431 4.431 1.00 0.00 C ATOM 319 OD1 ASN A 468 -12.624 -6.015 4.220 1.00 0.00 O ATOM 320 ND2 ASN A 468 -11.243 -7.533 5.132 1.00 0.00 N ATOM 0 H ASN A 468 -9.988 -2.620 3.204 1.00 0.00 H new ATOM 0 HA ASN A 468 -11.141 -3.870 4.632 1.00 0.00 H new ATOM 0 HB2 ASN A 468 -10.345 -5.632 2.806 1.00 0.00 H new ATOM 0 HB3 ASN A 468 -9.374 -6.262 4.122 1.00 0.00 H new ATOM 0 HD21 ASN A 468 -12.018 -8.071 5.520 1.00 0.00 H new ATOM 0 HD22 ASN A 468 -10.282 -7.841 5.282 1.00 0.00 H new ATOM 327 N ILE A 469 -8.949 -3.183 6.272 1.00 0.00 N ATOM 328 CA ILE A 469 -8.240 -3.099 7.542 1.00 0.00 C ATOM 329 C ILE A 469 -9.215 -2.966 8.708 1.00 0.00 C ATOM 330 O ILE A 469 -10.208 -2.241 8.640 1.00 0.00 O ATOM 331 CB ILE A 469 -7.265 -1.907 7.565 1.00 0.00 C ATOM 332 CG1 ILE A 469 -6.218 -2.056 6.460 1.00 0.00 C ATOM 333 CG2 ILE A 469 -6.595 -1.796 8.927 1.00 0.00 C ATOM 334 CD1 ILE A 469 -5.263 -0.885 6.370 1.00 0.00 C ATOM 0 H ILE A 469 -9.045 -2.293 5.783 1.00 0.00 H new ATOM 0 HA ILE A 469 -7.673 -4.024 7.649 1.00 0.00 H new ATOM 0 HB ILE A 469 -7.829 -0.992 7.384 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -5.647 -2.968 6.633 1.00 0.00 H new ATOM 0 HG13 ILE A 469 -6.726 -2.175 5.503 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -5.909 -0.949 8.927 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -7.354 -1.648 9.695 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -6.041 -2.711 9.136 1.00 0.00 H new ATOM 0 HD11 ILE A 469 -4.549 -1.059 5.565 1.00 0.00 H new ATOM 0 HD12 ILE A 469 -5.824 0.027 6.166 1.00 0.00 H new ATOM 0 HD13 ILE A 469 -4.728 -0.779 7.314 1.00 0.00 H new ATOM 346 N PRO A 470 -8.926 -3.682 9.805 1.00 0.00 N ATOM 347 CA PRO A 470 -9.763 -3.659 11.008 1.00 0.00 C ATOM 348 C PRO A 470 -9.690 -2.324 11.740 1.00 0.00 C ATOM 349 O PRO A 470 -8.673 -1.631 11.690 1.00 0.00 O ATOM 350 CB PRO A 470 -9.172 -4.776 11.872 1.00 0.00 C ATOM 351 CG PRO A 470 -7.756 -4.893 11.424 1.00 0.00 C ATOM 352 CD PRO A 470 -7.759 -4.567 9.956 1.00 0.00 C ATOM 0 HA PRO A 470 -10.818 -3.796 10.773 1.00 0.00 H new ATOM 0 HB2 PRO A 470 -9.233 -4.530 12.932 1.00 0.00 H new ATOM 0 HB3 PRO A 470 -9.711 -5.713 11.730 1.00 0.00 H new ATOM 0 HG2 PRO A 470 -7.114 -4.206 11.975 1.00 0.00 H new ATOM 0 HG3 PRO A 470 -7.373 -5.898 11.600 1.00 0.00 H new ATOM 0 HD2 PRO A 470 -6.837 -4.071 9.653 1.00 0.00 H new ATOM 0 HD3 PRO A 470 -7.854 -5.465 9.345 1.00 0.00 H new ATOM 360 N PHE A 471 -10.774 -1.967 12.421 1.00 0.00 N ATOM 361 CA PHE A 471 -10.833 -0.714 13.164 1.00 0.00 C ATOM 362 C PHE A 471 -9.802 -0.699 14.289 1.00 0.00 C ATOM 363 O PHE A 471 -9.545 0.341 14.894 1.00 0.00 O ATOM 364 CB PHE A 471 -12.235 -0.502 13.738 1.00 0.00 C ATOM 365 CG PHE A 471 -13.255 -0.120 12.704 1.00 0.00 C ATOM 366 CD1 PHE A 471 -13.927 -1.094 11.982 1.00 0.00 C ATOM 367 CD2 PHE A 471 -13.543 1.212 12.455 1.00 0.00 C ATOM 368 CE1 PHE A 471 -14.866 -0.745 11.030 1.00 0.00 C ATOM 369 CE2 PHE A 471 -14.482 1.567 11.503 1.00 0.00 C ATOM 370 CZ PHE A 471 -15.144 0.587 10.791 1.00 0.00 C ATOM 0 H PHE A 471 -11.624 -2.528 12.474 1.00 0.00 H new ATOM 0 HA PHE A 471 -10.604 0.099 12.475 1.00 0.00 H new ATOM 0 HB2 PHE A 471 -12.558 -1.417 14.234 1.00 0.00 H new ATOM 0 HB3 PHE A 471 -12.193 0.276 14.500 1.00 0.00 H new ATOM 0 HD1 PHE A 471 -13.714 -2.137 12.165 1.00 0.00 H new ATOM 0 HD2 PHE A 471 -13.029 1.982 13.010 1.00 0.00 H new ATOM 0 HE1 PHE A 471 -15.382 -1.513 10.473 1.00 0.00 H new ATOM 0 HE2 PHE A 471 -14.697 2.609 11.317 1.00 0.00 H new ATOM 0 HZ PHE A 471 -15.878 0.861 10.048 1.00 0.00 H new ATOM 380 N GLN A 472 -9.217 -1.861 14.562 1.00 0.00 N ATOM 381 CA GLN A 472 -8.216 -1.982 15.615 1.00 0.00 C ATOM 382 C GLN A 472 -6.825 -1.653 15.084 1.00 0.00 C ATOM 383 O GLN A 472 -5.941 -1.249 15.839 1.00 0.00 O ATOM 384 CB GLN A 472 -8.230 -3.395 16.201 1.00 0.00 C ATOM 385 CG GLN A 472 -9.333 -3.619 17.224 1.00 0.00 C ATOM 386 CD GLN A 472 -9.057 -2.920 18.541 1.00 0.00 C ATOM 387 OE1 GLN A 472 -7.954 -3.004 19.083 1.00 0.00 O ATOM 388 NE2 GLN A 472 -10.060 -2.225 19.065 1.00 0.00 N ATOM 0 H GLN A 472 -9.419 -2.731 14.069 1.00 0.00 H new ATOM 0 HA GLN A 472 -8.463 -1.268 16.401 1.00 0.00 H new ATOM 0 HB2 GLN A 472 -8.346 -4.114 15.390 1.00 0.00 H new ATOM 0 HB3 GLN A 472 -7.266 -3.595 16.669 1.00 0.00 H new ATOM 0 HG2 GLN A 472 -10.279 -3.260 16.818 1.00 0.00 H new ATOM 0 HG3 GLN A 472 -9.447 -4.688 17.401 1.00 0.00 H new ATOM 0 HE21 GLN A 472 -10.958 -2.182 18.582 1.00 0.00 H new ATOM 0 HE22 GLN A 472 -9.933 -1.734 19.950 1.00 0.00 H new ATOM 397 N ALA A 473 -6.638 -1.830 13.780 1.00 0.00 N ATOM 398 CA ALA A 473 -5.354 -1.551 13.148 1.00 0.00 C ATOM 399 C ALA A 473 -5.064 -0.054 13.133 1.00 0.00 C ATOM 400 O ALA A 473 -5.964 0.760 12.927 1.00 0.00 O ATOM 401 CB ALA A 473 -5.331 -2.109 11.733 1.00 0.00 C ATOM 0 H ALA A 473 -7.359 -2.165 13.141 1.00 0.00 H new ATOM 0 HA ALA A 473 -4.575 -2.040 13.733 1.00 0.00 H new ATOM 0 HB1 ALA A 473 -4.367 -1.894 11.273 1.00 0.00 H new ATOM 0 HB2 ALA A 473 -5.485 -3.188 11.765 1.00 0.00 H new ATOM 0 HB3 ALA A 473 -6.125 -1.646 11.146 1.00 0.00 H new ATOM 407 N ASN A 474 -3.803 0.302 13.354 1.00 0.00 N ATOM 408 CA ASN A 474 -3.395 1.702 13.367 1.00 0.00 C ATOM 409 C ASN A 474 -2.143 1.912 12.521 1.00 0.00 C ATOM 410 O ASN A 474 -1.510 0.951 12.083 1.00 0.00 O ATOM 411 CB ASN A 474 -3.138 2.167 14.802 1.00 0.00 C ATOM 412 CG ASN A 474 -4.388 2.116 15.658 1.00 0.00 C ATOM 413 OD1 ASN A 474 -5.453 2.578 15.250 1.00 0.00 O ATOM 414 ND2 ASN A 474 -4.263 1.552 16.854 1.00 0.00 N ATOM 0 H ASN A 474 -3.046 -0.360 13.527 1.00 0.00 H new ATOM 0 HA ASN A 474 -4.204 2.294 12.940 1.00 0.00 H new ATOM 0 HB2 ASN A 474 -2.367 1.541 15.251 1.00 0.00 H new ATOM 0 HB3 ASN A 474 -2.752 3.186 14.787 1.00 0.00 H new ATOM 0 HD21 ASN A 474 -5.070 1.489 17.475 1.00 0.00 H new ATOM 0 HD22 ASN A 474 -3.360 1.182 17.151 1.00 0.00 H new ATOM 421 N GLN A 475 -1.792 3.174 12.295 1.00 0.00 N ATOM 422 CA GLN A 475 -0.616 3.509 11.501 1.00 0.00 C ATOM 423 C GLN A 475 0.573 2.639 11.895 1.00 0.00 C ATOM 424 O GLN A 475 1.100 1.884 11.078 1.00 0.00 O ATOM 425 CB GLN A 475 -0.261 4.987 11.676 1.00 0.00 C ATOM 426 CG GLN A 475 0.909 5.437 10.816 1.00 0.00 C ATOM 427 CD GLN A 475 2.247 5.237 11.500 1.00 0.00 C ATOM 428 OE1 GLN A 475 3.061 4.420 11.069 1.00 0.00 O ATOM 429 NE2 GLN A 475 2.481 5.984 12.573 1.00 0.00 N ATOM 0 H GLN A 475 -2.305 3.981 12.650 1.00 0.00 H new ATOM 0 HA GLN A 475 -0.850 3.320 10.453 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -1.134 5.593 11.433 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -0.024 5.174 12.723 1.00 0.00 H new ATOM 0 HG2 GLN A 475 0.899 4.883 9.877 1.00 0.00 H new ATOM 0 HG3 GLN A 475 0.787 6.491 10.566 1.00 0.00 H new ATOM 0 HE21 GLN A 475 1.777 6.649 12.895 1.00 0.00 H new ATOM 0 HE22 GLN A 475 3.364 5.893 13.075 1.00 0.00 H new ATOM 438 N ARG A 476 0.990 2.749 13.152 1.00 0.00 N ATOM 439 CA ARG A 476 2.118 1.973 13.654 1.00 0.00 C ATOM 440 C ARG A 476 1.931 0.488 13.356 1.00 0.00 C ATOM 441 O ARG A 476 2.882 -0.207 12.998 1.00 0.00 O ATOM 442 CB ARG A 476 2.281 2.186 15.160 1.00 0.00 C ATOM 443 CG ARG A 476 2.460 3.643 15.553 1.00 0.00 C ATOM 444 CD ARG A 476 3.906 4.088 15.401 1.00 0.00 C ATOM 445 NE ARG A 476 4.191 5.297 16.169 1.00 0.00 N ATOM 446 CZ ARG A 476 4.333 5.311 17.489 1.00 0.00 C ATOM 447 NH1 ARG A 476 4.219 4.188 18.185 1.00 0.00 N ATOM 448 NH2 ARG A 476 4.592 6.451 18.117 1.00 0.00 N ATOM 0 H ARG A 476 0.564 3.368 13.842 1.00 0.00 H new ATOM 0 HA ARG A 476 3.019 2.317 13.146 1.00 0.00 H new ATOM 0 HB2 ARG A 476 1.406 1.785 15.672 1.00 0.00 H new ATOM 0 HB3 ARG A 476 3.143 1.616 15.508 1.00 0.00 H new ATOM 0 HG2 ARG A 476 1.818 4.269 14.933 1.00 0.00 H new ATOM 0 HG3 ARG A 476 2.142 3.784 16.586 1.00 0.00 H new ATOM 0 HD2 ARG A 476 4.568 3.286 15.728 1.00 0.00 H new ATOM 0 HD3 ARG A 476 4.121 4.269 14.348 1.00 0.00 H new ATOM 0 HE ARG A 476 4.286 6.178 15.664 1.00 0.00 H new ATOM 0 HH11 ARG A 476 4.022 3.309 17.706 1.00 0.00 H new ATOM 0 HH12 ARG A 476 4.329 4.203 19.199 1.00 0.00 H new ATOM 0 HH21 ARG A 476 4.682 7.317 17.586 1.00 0.00 H new ATOM 0 HH22 ARG A 476 4.701 6.461 19.131 1.00 0.00 H new ATOM 462 N GLU A 477 0.700 0.009 13.507 1.00 0.00 N ATOM 463 CA GLU A 477 0.390 -1.393 13.256 1.00 0.00 C ATOM 464 C GLU A 477 0.883 -1.820 11.876 1.00 0.00 C ATOM 465 O GLU A 477 1.662 -2.766 11.749 1.00 0.00 O ATOM 466 CB GLU A 477 -1.117 -1.634 13.368 1.00 0.00 C ATOM 467 CG GLU A 477 -1.490 -3.099 13.510 1.00 0.00 C ATOM 468 CD GLU A 477 -0.926 -3.726 14.770 1.00 0.00 C ATOM 469 OE1 GLU A 477 -1.429 -3.407 15.868 1.00 0.00 O ATOM 470 OE2 GLU A 477 0.020 -4.535 14.659 1.00 0.00 O ATOM 0 H GLU A 477 -0.098 0.571 13.802 1.00 0.00 H new ATOM 0 HA GLU A 477 0.903 -1.992 14.008 1.00 0.00 H new ATOM 0 HB2 GLU A 477 -1.501 -1.085 14.228 1.00 0.00 H new ATOM 0 HB3 GLU A 477 -1.608 -1.227 12.484 1.00 0.00 H new ATOM 0 HG2 GLU A 477 -2.576 -3.194 13.516 1.00 0.00 H new ATOM 0 HG3 GLU A 477 -1.127 -3.648 12.641 1.00 0.00 H new ATOM 477 N ILE A 478 0.424 -1.117 10.847 1.00 0.00 N ATOM 478 CA ILE A 478 0.818 -1.423 9.477 1.00 0.00 C ATOM 479 C ILE A 478 2.291 -1.106 9.245 1.00 0.00 C ATOM 480 O ILE A 478 3.033 -1.920 8.694 1.00 0.00 O ATOM 481 CB ILE A 478 -0.031 -0.639 8.459 1.00 0.00 C ATOM 482 CG1 ILE A 478 -1.521 -0.823 8.755 1.00 0.00 C ATOM 483 CG2 ILE A 478 0.293 -1.088 7.042 1.00 0.00 C ATOM 484 CD1 ILE A 478 -1.973 -2.265 8.702 1.00 0.00 C ATOM 0 H ILE A 478 -0.221 -0.332 10.935 1.00 0.00 H new ATOM 0 HA ILE A 478 0.651 -2.490 9.331 1.00 0.00 H new ATOM 0 HB ILE A 478 0.209 0.421 8.547 1.00 0.00 H new ATOM 0 HG12 ILE A 478 -1.740 -0.418 9.743 1.00 0.00 H new ATOM 0 HG13 ILE A 478 -2.100 -0.242 8.037 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.315 -0.525 6.334 1.00 0.00 H new ATOM 0 HG22 ILE A 478 1.348 -0.910 6.836 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.078 -2.152 6.939 1.00 0.00 H new ATOM 0 HD11 ILE A 478 -3.039 -2.320 8.922 1.00 0.00 H new ATOM 0 HD12 ILE A 478 -1.786 -2.669 7.707 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -1.420 -2.847 9.439 1.00 0.00 H new ATOM 496 N ARG A 479 2.709 0.082 9.671 1.00 0.00 N ATOM 497 CA ARG A 479 4.095 0.507 9.510 1.00 0.00 C ATOM 498 C ARG A 479 5.051 -0.663 9.728 1.00 0.00 C ATOM 499 O ARG A 479 5.755 -1.080 8.809 1.00 0.00 O ATOM 500 CB ARG A 479 4.421 1.635 10.490 1.00 0.00 C ATOM 501 CG ARG A 479 5.480 2.598 9.979 1.00 0.00 C ATOM 502 CD ARG A 479 6.742 1.863 9.553 1.00 0.00 C ATOM 503 NE ARG A 479 7.932 2.700 9.683 1.00 0.00 N ATOM 504 CZ ARG A 479 9.080 2.445 9.064 1.00 0.00 C ATOM 505 NH1 ARG A 479 9.192 1.384 8.277 1.00 0.00 N ATOM 506 NH2 ARG A 479 10.119 3.254 9.232 1.00 0.00 N ATOM 0 H ARG A 479 2.108 0.767 10.130 1.00 0.00 H new ATOM 0 HA ARG A 479 4.221 0.872 8.491 1.00 0.00 H new ATOM 0 HB2 ARG A 479 3.509 2.192 10.706 1.00 0.00 H new ATOM 0 HB3 ARG A 479 4.760 1.201 11.431 1.00 0.00 H new ATOM 0 HG2 ARG A 479 5.084 3.162 9.135 1.00 0.00 H new ATOM 0 HG3 ARG A 479 5.724 3.320 10.759 1.00 0.00 H new ATOM 0 HD2 ARG A 479 6.862 0.966 10.160 1.00 0.00 H new ATOM 0 HD3 ARG A 479 6.640 1.536 8.518 1.00 0.00 H new ATOM 0 HE ARG A 479 7.879 3.525 10.281 1.00 0.00 H new ATOM 0 HH11 ARG A 479 8.396 0.761 8.145 1.00 0.00 H new ATOM 0 HH12 ARG A 479 10.075 1.191 7.803 1.00 0.00 H new ATOM 0 HH21 ARG A 479 10.036 4.072 9.836 1.00 0.00 H new ATOM 0 HH22 ARG A 479 11.000 3.058 8.757 1.00 0.00 H new ATOM 520 N GLU A 480 5.069 -1.186 10.950 1.00 0.00 N ATOM 521 CA GLU A 480 5.940 -2.306 11.288 1.00 0.00 C ATOM 522 C GLU A 480 5.520 -3.567 10.538 1.00 0.00 C ATOM 523 O GLU A 480 6.350 -4.253 9.941 1.00 0.00 O ATOM 524 CB GLU A 480 5.914 -2.564 12.796 1.00 0.00 C ATOM 525 CG GLU A 480 6.889 -1.699 13.578 1.00 0.00 C ATOM 526 CD GLU A 480 8.329 -2.143 13.407 1.00 0.00 C ATOM 527 OE1 GLU A 480 8.689 -3.208 13.950 1.00 0.00 O ATOM 528 OE2 GLU A 480 9.094 -1.425 12.730 1.00 0.00 O ATOM 0 H GLU A 480 4.491 -0.853 11.722 1.00 0.00 H new ATOM 0 HA GLU A 480 6.955 -2.047 10.988 1.00 0.00 H new ATOM 0 HB2 GLU A 480 4.905 -2.388 13.169 1.00 0.00 H new ATOM 0 HB3 GLU A 480 6.143 -3.613 12.981 1.00 0.00 H new ATOM 0 HG2 GLU A 480 6.791 -0.663 13.253 1.00 0.00 H new ATOM 0 HG3 GLU A 480 6.627 -1.728 14.636 1.00 0.00 H new ATOM 535 N LEU A 481 4.226 -3.866 10.574 1.00 0.00 N ATOM 536 CA LEU A 481 3.694 -5.044 9.898 1.00 0.00 C ATOM 537 C LEU A 481 4.401 -5.274 8.566 1.00 0.00 C ATOM 538 O LEU A 481 4.674 -6.412 8.184 1.00 0.00 O ATOM 539 CB LEU A 481 2.190 -4.890 9.670 1.00 0.00 C ATOM 540 CG LEU A 481 1.482 -6.086 9.032 1.00 0.00 C ATOM 541 CD1 LEU A 481 1.248 -7.180 10.062 1.00 0.00 C ATOM 542 CD2 LEU A 481 0.165 -5.653 8.403 1.00 0.00 C ATOM 0 H LEU A 481 3.526 -3.309 11.064 1.00 0.00 H new ATOM 0 HA LEU A 481 3.872 -5.909 10.536 1.00 0.00 H new ATOM 0 HB2 LEU A 481 1.717 -4.683 10.630 1.00 0.00 H new ATOM 0 HB3 LEU A 481 2.026 -4.017 9.038 1.00 0.00 H new ATOM 0 HG LEU A 481 2.123 -6.486 8.246 1.00 0.00 H new ATOM 0 HD11 LEU A 481 0.743 -8.023 9.589 1.00 0.00 H new ATOM 0 HD12 LEU A 481 2.205 -7.510 10.466 1.00 0.00 H new ATOM 0 HD13 LEU A 481 0.628 -6.792 10.870 1.00 0.00 H new ATOM 0 HD21 LEU A 481 -0.325 -6.517 7.954 1.00 0.00 H new ATOM 0 HD22 LEU A 481 -0.482 -5.227 9.170 1.00 0.00 H new ATOM 0 HD23 LEU A 481 0.358 -4.905 7.634 1.00 0.00 H new ATOM 554 N PHE A 482 4.698 -4.185 7.864 1.00 0.00 N ATOM 555 CA PHE A 482 5.375 -4.267 6.575 1.00 0.00 C ATOM 556 C PHE A 482 6.870 -4.007 6.729 1.00 0.00 C ATOM 557 O PHE A 482 7.696 -4.693 6.126 1.00 0.00 O ATOM 558 CB PHE A 482 4.769 -3.263 5.592 1.00 0.00 C ATOM 559 CG PHE A 482 3.525 -3.763 4.915 1.00 0.00 C ATOM 560 CD1 PHE A 482 2.288 -3.630 5.523 1.00 0.00 C ATOM 561 CD2 PHE A 482 3.594 -4.368 3.670 1.00 0.00 C ATOM 562 CE1 PHE A 482 1.141 -4.088 4.902 1.00 0.00 C ATOM 563 CE2 PHE A 482 2.451 -4.828 3.044 1.00 0.00 C ATOM 564 CZ PHE A 482 1.223 -4.689 3.661 1.00 0.00 C ATOM 0 H PHE A 482 4.480 -3.235 8.166 1.00 0.00 H new ATOM 0 HA PHE A 482 5.238 -5.275 6.184 1.00 0.00 H new ATOM 0 HB2 PHE A 482 4.538 -2.340 6.124 1.00 0.00 H new ATOM 0 HB3 PHE A 482 5.512 -3.016 4.833 1.00 0.00 H new ATOM 0 HD1 PHE A 482 2.218 -3.163 6.494 1.00 0.00 H new ATOM 0 HD2 PHE A 482 4.552 -4.481 3.184 1.00 0.00 H new ATOM 0 HE1 PHE A 482 0.182 -3.976 5.386 1.00 0.00 H new ATOM 0 HE2 PHE A 482 2.518 -5.296 2.073 1.00 0.00 H new ATOM 0 HZ PHE A 482 0.329 -5.049 3.174 1.00 0.00 H new ATOM 574 N SER A 483 7.211 -3.010 7.540 1.00 0.00 N ATOM 575 CA SER A 483 8.607 -2.655 7.770 1.00 0.00 C ATOM 576 C SER A 483 9.446 -3.900 8.042 1.00 0.00 C ATOM 577 O SER A 483 10.543 -4.055 7.503 1.00 0.00 O ATOM 578 CB SER A 483 8.721 -1.683 8.945 1.00 0.00 C ATOM 579 OG SER A 483 9.985 -1.043 8.957 1.00 0.00 O ATOM 0 H SER A 483 6.540 -2.434 8.048 1.00 0.00 H new ATOM 0 HA SER A 483 8.986 -2.172 6.870 1.00 0.00 H new ATOM 0 HB2 SER A 483 7.932 -0.934 8.879 1.00 0.00 H new ATOM 0 HB3 SER A 483 8.573 -2.221 9.882 1.00 0.00 H new ATOM 0 HG SER A 483 10.094 -0.551 9.797 1.00 0.00 H new ATOM 585 N THR A 484 8.923 -4.787 8.883 1.00 0.00 N ATOM 586 CA THR A 484 9.623 -6.017 9.229 1.00 0.00 C ATOM 587 C THR A 484 10.201 -6.689 7.988 1.00 0.00 C ATOM 588 O THR A 484 11.259 -7.315 8.045 1.00 0.00 O ATOM 589 CB THR A 484 8.690 -7.010 9.949 1.00 0.00 C ATOM 590 OG1 THR A 484 9.390 -8.230 10.221 1.00 0.00 O ATOM 591 CG2 THR A 484 7.458 -7.304 9.106 1.00 0.00 C ATOM 0 H THR A 484 8.016 -4.676 9.337 1.00 0.00 H new ATOM 0 HA THR A 484 10.436 -5.740 9.901 1.00 0.00 H new ATOM 0 HB THR A 484 8.369 -6.558 10.887 1.00 0.00 H new ATOM 0 HG1 THR A 484 8.791 -8.855 10.680 1.00 0.00 H new ATOM 0 HG21 THR A 484 6.815 -8.007 9.635 1.00 0.00 H new ATOM 0 HG22 THR A 484 6.912 -6.378 8.925 1.00 0.00 H new ATOM 0 HG23 THR A 484 7.764 -7.738 8.154 1.00 0.00 H new ATOM 599 N PHE A 485 9.500 -6.554 6.867 1.00 0.00 N ATOM 600 CA PHE A 485 9.944 -7.148 5.612 1.00 0.00 C ATOM 601 C PHE A 485 11.051 -6.312 4.976 1.00 0.00 C ATOM 602 O PHE A 485 11.967 -6.846 4.353 1.00 0.00 O ATOM 603 CB PHE A 485 8.768 -7.280 4.642 1.00 0.00 C ATOM 604 CG PHE A 485 7.886 -8.462 4.926 1.00 0.00 C ATOM 605 CD1 PHE A 485 8.409 -9.745 4.946 1.00 0.00 C ATOM 606 CD2 PHE A 485 6.534 -8.290 5.173 1.00 0.00 C ATOM 607 CE1 PHE A 485 7.601 -10.834 5.208 1.00 0.00 C ATOM 608 CE2 PHE A 485 5.720 -9.376 5.436 1.00 0.00 C ATOM 609 CZ PHE A 485 6.254 -10.650 5.452 1.00 0.00 C ATOM 0 H PHE A 485 8.622 -6.038 6.802 1.00 0.00 H new ATOM 0 HA PHE A 485 10.341 -8.140 5.829 1.00 0.00 H new ATOM 0 HB2 PHE A 485 8.168 -6.371 4.685 1.00 0.00 H new ATOM 0 HB3 PHE A 485 9.153 -7.360 3.625 1.00 0.00 H new ATOM 0 HD1 PHE A 485 9.461 -9.895 4.754 1.00 0.00 H new ATOM 0 HD2 PHE A 485 6.111 -7.296 5.160 1.00 0.00 H new ATOM 0 HE1 PHE A 485 8.022 -11.828 5.222 1.00 0.00 H new ATOM 0 HE2 PHE A 485 4.668 -9.229 5.629 1.00 0.00 H new ATOM 0 HZ PHE A 485 5.620 -11.500 5.655 1.00 0.00 H new ATOM 619 N GLY A 486 10.958 -4.995 5.139 1.00 0.00 N ATOM 620 CA GLY A 486 11.957 -4.106 4.575 1.00 0.00 C ATOM 621 C GLY A 486 11.660 -2.647 4.859 1.00 0.00 C ATOM 622 O GLY A 486 10.605 -2.316 5.398 1.00 0.00 O ATOM 0 H GLY A 486 10.209 -4.529 5.651 1.00 0.00 H new ATOM 0 HA2 GLY A 486 12.936 -4.360 4.981 1.00 0.00 H new ATOM 0 HA3 GLY A 486 12.009 -4.260 3.497 1.00 0.00 H new ATOM 626 N GLU A 487 12.594 -1.773 4.496 1.00 0.00 N ATOM 627 CA GLU A 487 12.428 -0.342 4.718 1.00 0.00 C ATOM 628 C GLU A 487 11.223 0.192 3.948 1.00 0.00 C ATOM 629 O GLU A 487 11.060 -0.085 2.759 1.00 0.00 O ATOM 630 CB GLU A 487 13.691 0.413 4.298 1.00 0.00 C ATOM 631 CG GLU A 487 13.644 1.899 4.609 1.00 0.00 C ATOM 632 CD GLU A 487 13.328 2.180 6.065 1.00 0.00 C ATOM 633 OE1 GLU A 487 14.034 1.637 6.940 1.00 0.00 O ATOM 634 OE2 GLU A 487 12.376 2.943 6.330 1.00 0.00 O ATOM 0 H GLU A 487 13.473 -2.031 4.047 1.00 0.00 H new ATOM 0 HA GLU A 487 12.257 -0.184 5.783 1.00 0.00 H new ATOM 0 HB2 GLU A 487 14.552 -0.028 4.801 1.00 0.00 H new ATOM 0 HB3 GLU A 487 13.845 0.279 3.227 1.00 0.00 H new ATOM 0 HG2 GLU A 487 14.603 2.350 4.356 1.00 0.00 H new ATOM 0 HG3 GLU A 487 12.892 2.375 3.979 1.00 0.00 H new ATOM 641 N LEU A 488 10.381 0.957 4.635 1.00 0.00 N ATOM 642 CA LEU A 488 9.190 1.529 4.017 1.00 0.00 C ATOM 643 C LEU A 488 9.371 3.023 3.767 1.00 0.00 C ATOM 644 O LEU A 488 9.735 3.776 4.671 1.00 0.00 O ATOM 645 CB LEU A 488 7.967 1.294 4.905 1.00 0.00 C ATOM 646 CG LEU A 488 7.628 -0.167 5.205 1.00 0.00 C ATOM 647 CD1 LEU A 488 6.527 -0.254 6.252 1.00 0.00 C ATOM 648 CD2 LEU A 488 7.214 -0.891 3.932 1.00 0.00 C ATOM 0 H LEU A 488 10.501 1.195 5.619 1.00 0.00 H new ATOM 0 HA LEU A 488 9.035 1.034 3.058 1.00 0.00 H new ATOM 0 HB2 LEU A 488 8.125 1.812 5.851 1.00 0.00 H new ATOM 0 HB3 LEU A 488 7.103 1.757 4.429 1.00 0.00 H new ATOM 0 HG LEU A 488 8.519 -0.653 5.602 1.00 0.00 H new ATOM 0 HD11 LEU A 488 6.298 -1.301 6.453 1.00 0.00 H new ATOM 0 HD12 LEU A 488 6.860 0.228 7.171 1.00 0.00 H new ATOM 0 HD13 LEU A 488 5.633 0.248 5.882 1.00 0.00 H new ATOM 0 HD21 LEU A 488 6.977 -1.929 4.165 1.00 0.00 H new ATOM 0 HD22 LEU A 488 6.336 -0.405 3.506 1.00 0.00 H new ATOM 0 HD23 LEU A 488 8.032 -0.858 3.212 1.00 0.00 H new ATOM 660 N LYS A 489 9.113 3.447 2.534 1.00 0.00 N ATOM 661 CA LYS A 489 9.244 4.852 2.165 1.00 0.00 C ATOM 662 C LYS A 489 8.403 5.736 3.080 1.00 0.00 C ATOM 663 O LYS A 489 8.904 6.698 3.663 1.00 0.00 O ATOM 664 CB LYS A 489 8.820 5.059 0.709 1.00 0.00 C ATOM 665 CG LYS A 489 9.960 4.910 -0.284 1.00 0.00 C ATOM 666 CD LYS A 489 10.922 6.084 -0.207 1.00 0.00 C ATOM 667 CE LYS A 489 11.885 6.093 -1.385 1.00 0.00 C ATOM 668 NZ LYS A 489 12.641 7.373 -1.473 1.00 0.00 N ATOM 0 H LYS A 489 8.812 2.838 1.773 1.00 0.00 H new ATOM 0 HA LYS A 489 10.291 5.135 2.277 1.00 0.00 H new ATOM 0 HB2 LYS A 489 8.038 4.341 0.462 1.00 0.00 H new ATOM 0 HB3 LYS A 489 8.385 6.053 0.604 1.00 0.00 H new ATOM 0 HG2 LYS A 489 10.498 3.983 -0.085 1.00 0.00 H new ATOM 0 HG3 LYS A 489 9.557 4.834 -1.294 1.00 0.00 H new ATOM 0 HD2 LYS A 489 10.359 7.017 -0.189 1.00 0.00 H new ATOM 0 HD3 LYS A 489 11.485 6.034 0.725 1.00 0.00 H new ATOM 0 HE2 LYS A 489 12.585 5.263 -1.288 1.00 0.00 H new ATOM 0 HE3 LYS A 489 11.330 5.935 -2.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 489 13.286 7.340 -2.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 489 11.974 8.162 -1.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 489 13.191 7.512 -0.601 1.00 0.00 H new ATOM 682 N THR A 490 7.122 5.402 3.205 1.00 0.00 N ATOM 683 CA THR A 490 6.212 6.165 4.050 1.00 0.00 C ATOM 684 C THR A 490 4.885 5.437 4.227 1.00 0.00 C ATOM 685 O THR A 490 4.267 5.007 3.253 1.00 0.00 O ATOM 686 CB THR A 490 5.943 7.565 3.465 1.00 0.00 C ATOM 687 OG1 THR A 490 5.101 8.312 4.350 1.00 0.00 O ATOM 688 CG2 THR A 490 5.286 7.463 2.097 1.00 0.00 C ATOM 0 H THR A 490 6.692 4.608 2.731 1.00 0.00 H new ATOM 0 HA THR A 490 6.697 6.272 5.021 1.00 0.00 H new ATOM 0 HB THR A 490 6.898 8.078 3.354 1.00 0.00 H new ATOM 0 HG1 THR A 490 4.936 9.201 3.972 1.00 0.00 H new ATOM 0 HG21 THR A 490 5.106 8.464 1.704 1.00 0.00 H new ATOM 0 HG22 THR A 490 5.943 6.919 1.418 1.00 0.00 H new ATOM 0 HG23 THR A 490 4.338 6.933 2.187 1.00 0.00 H new ATOM 696 N VAL A 491 4.451 5.302 5.476 1.00 0.00 N ATOM 697 CA VAL A 491 3.195 4.627 5.780 1.00 0.00 C ATOM 698 C VAL A 491 2.082 5.633 6.050 1.00 0.00 C ATOM 699 O VAL A 491 2.092 6.328 7.067 1.00 0.00 O ATOM 700 CB VAL A 491 3.339 3.697 7.000 1.00 0.00 C ATOM 701 CG1 VAL A 491 1.972 3.338 7.561 1.00 0.00 C ATOM 702 CG2 VAL A 491 4.117 2.445 6.626 1.00 0.00 C ATOM 0 H VAL A 491 4.951 5.651 6.294 1.00 0.00 H new ATOM 0 HA VAL A 491 2.936 4.030 4.906 1.00 0.00 H new ATOM 0 HB VAL A 491 3.896 4.225 7.774 1.00 0.00 H new ATOM 0 HG11 VAL A 491 2.093 2.681 8.422 1.00 0.00 H new ATOM 0 HG12 VAL A 491 1.455 4.247 7.868 1.00 0.00 H new ATOM 0 HG13 VAL A 491 1.387 2.829 6.795 1.00 0.00 H new ATOM 0 HG21 VAL A 491 4.209 1.799 7.499 1.00 0.00 H new ATOM 0 HG22 VAL A 491 3.590 1.912 5.835 1.00 0.00 H new ATOM 0 HG23 VAL A 491 5.110 2.725 6.275 1.00 0.00 H new ATOM 712 N ARG A 492 1.123 5.706 5.134 1.00 0.00 N ATOM 713 CA ARG A 492 0.002 6.628 5.272 1.00 0.00 C ATOM 714 C ARG A 492 -1.256 5.891 5.722 1.00 0.00 C ATOM 715 O ARG A 492 -1.613 4.852 5.165 1.00 0.00 O ATOM 716 CB ARG A 492 -0.262 7.347 3.948 1.00 0.00 C ATOM 717 CG ARG A 492 0.721 8.470 3.659 1.00 0.00 C ATOM 718 CD ARG A 492 1.956 7.957 2.935 1.00 0.00 C ATOM 719 NE ARG A 492 1.651 7.518 1.576 1.00 0.00 N ATOM 720 CZ ARG A 492 1.442 8.353 0.564 1.00 0.00 C ATOM 721 NH1 ARG A 492 1.504 9.663 0.757 1.00 0.00 N ATOM 722 NH2 ARG A 492 1.170 7.878 -0.645 1.00 0.00 N ATOM 0 H ARG A 492 1.099 5.137 4.287 1.00 0.00 H new ATOM 0 HA ARG A 492 0.263 7.365 6.032 1.00 0.00 H new ATOM 0 HB2 ARG A 492 -0.221 6.621 3.136 1.00 0.00 H new ATOM 0 HB3 ARG A 492 -1.273 7.754 3.961 1.00 0.00 H new ATOM 0 HG2 ARG A 492 0.234 9.234 3.053 1.00 0.00 H new ATOM 0 HG3 ARG A 492 1.017 8.945 4.594 1.00 0.00 H new ATOM 0 HD2 ARG A 492 2.709 8.744 2.901 1.00 0.00 H new ATOM 0 HD3 ARG A 492 2.387 7.127 3.496 1.00 0.00 H new ATOM 0 HE ARG A 492 1.595 6.516 1.394 1.00 0.00 H new ATOM 0 HH11 ARG A 492 1.713 10.033 1.685 1.00 0.00 H new ATOM 0 HH12 ARG A 492 1.343 10.301 -0.022 1.00 0.00 H new ATOM 0 HH21 ARG A 492 1.121 6.871 -0.798 1.00 0.00 H new ATOM 0 HH22 ARG A 492 1.010 8.520 -1.421 1.00 0.00 H new ATOM 736 N LEU A 493 -1.924 6.434 6.734 1.00 0.00 N ATOM 737 CA LEU A 493 -3.142 5.828 7.260 1.00 0.00 C ATOM 738 C LEU A 493 -4.175 6.895 7.609 1.00 0.00 C ATOM 739 O LEU A 493 -3.840 8.006 8.022 1.00 0.00 O ATOM 740 CB LEU A 493 -2.824 4.986 8.497 1.00 0.00 C ATOM 741 CG LEU A 493 -2.457 3.525 8.238 1.00 0.00 C ATOM 742 CD1 LEU A 493 -0.958 3.381 8.023 1.00 0.00 C ATOM 743 CD2 LEU A 493 -2.919 2.646 9.391 1.00 0.00 C ATOM 0 H LEU A 493 -1.643 7.293 7.207 1.00 0.00 H new ATOM 0 HA LEU A 493 -3.560 5.183 6.487 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -1.999 5.458 9.031 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -3.688 5.010 9.161 1.00 0.00 H new ATOM 0 HG LEU A 493 -2.966 3.198 7.332 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -0.716 2.334 7.840 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -0.655 3.979 7.164 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -0.428 3.726 8.911 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -2.649 1.609 9.189 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -2.438 2.973 10.313 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.001 2.725 9.498 1.00 0.00 H new ATOM 755 N PRO A 494 -5.461 6.552 7.441 1.00 0.00 N ATOM 756 CA PRO A 494 -6.568 7.466 7.736 1.00 0.00 C ATOM 757 C PRO A 494 -6.729 7.720 9.231 1.00 0.00 C ATOM 758 O PRO A 494 -6.718 6.787 10.034 1.00 0.00 O ATOM 759 CB PRO A 494 -7.792 6.730 7.184 1.00 0.00 C ATOM 760 CG PRO A 494 -7.412 5.290 7.214 1.00 0.00 C ATOM 761 CD PRO A 494 -5.932 5.246 6.953 1.00 0.00 C ATOM 0 HA PRO A 494 -6.411 8.451 7.296 1.00 0.00 H new ATOM 0 HB2 PRO A 494 -8.676 6.919 7.793 1.00 0.00 H new ATOM 0 HB3 PRO A 494 -8.027 7.057 6.171 1.00 0.00 H new ATOM 0 HG2 PRO A 494 -7.651 4.843 8.179 1.00 0.00 H new ATOM 0 HG3 PRO A 494 -7.958 4.727 6.458 1.00 0.00 H new ATOM 0 HD2 PRO A 494 -5.455 4.423 7.484 1.00 0.00 H new ATOM 0 HD3 PRO A 494 -5.715 5.111 5.894 1.00 0.00 H new ATOM 769 N LYS A 495 -6.878 8.988 9.598 1.00 0.00 N ATOM 770 CA LYS A 495 -7.043 9.366 10.996 1.00 0.00 C ATOM 771 C LYS A 495 -8.430 9.952 11.242 1.00 0.00 C ATOM 772 O LYS A 495 -8.918 10.767 10.458 1.00 0.00 O ATOM 773 CB LYS A 495 -5.970 10.379 11.402 1.00 0.00 C ATOM 774 CG LYS A 495 -5.704 10.417 12.897 1.00 0.00 C ATOM 775 CD LYS A 495 -4.845 11.610 13.281 1.00 0.00 C ATOM 776 CE LYS A 495 -4.109 11.369 14.590 1.00 0.00 C ATOM 777 NZ LYS A 495 -3.264 12.533 14.973 1.00 0.00 N ATOM 0 H LYS A 495 -6.888 9.772 8.946 1.00 0.00 H new ATOM 0 HA LYS A 495 -6.935 8.468 11.604 1.00 0.00 H new ATOM 0 HB2 LYS A 495 -5.042 10.141 10.882 1.00 0.00 H new ATOM 0 HB3 LYS A 495 -6.275 11.371 11.070 1.00 0.00 H new ATOM 0 HG2 LYS A 495 -6.651 10.461 13.435 1.00 0.00 H new ATOM 0 HG3 LYS A 495 -5.207 9.496 13.202 1.00 0.00 H new ATOM 0 HD2 LYS A 495 -4.124 11.810 12.489 1.00 0.00 H new ATOM 0 HD3 LYS A 495 -5.472 12.497 13.373 1.00 0.00 H new ATOM 0 HE2 LYS A 495 -4.831 11.169 15.381 1.00 0.00 H new ATOM 0 HE3 LYS A 495 -3.484 10.481 14.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 495 -2.779 12.330 15.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 495 -2.558 12.709 14.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 495 -3.864 13.375 15.087 1.00 0.00 H new ATOM 791 N LYS A 496 -9.059 9.535 12.335 1.00 0.00 N ATOM 792 CA LYS A 496 -10.388 10.020 12.686 1.00 0.00 C ATOM 793 C LYS A 496 -10.465 11.538 12.556 1.00 0.00 C ATOM 794 O LYS A 496 -9.623 12.259 13.090 1.00 0.00 O ATOM 795 CB LYS A 496 -10.746 9.601 14.114 1.00 0.00 C ATOM 796 CG LYS A 496 -12.034 10.223 14.626 1.00 0.00 C ATOM 797 CD LYS A 496 -12.091 10.217 16.144 1.00 0.00 C ATOM 798 CE LYS A 496 -12.573 8.877 16.678 1.00 0.00 C ATOM 799 NZ LYS A 496 -12.945 8.955 18.118 1.00 0.00 N ATOM 0 H LYS A 496 -8.669 8.861 12.994 1.00 0.00 H new ATOM 0 HA LYS A 496 -11.104 9.577 11.994 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -10.836 8.515 14.153 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -9.929 9.877 14.780 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.114 11.247 14.262 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -12.888 9.675 14.227 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -11.102 10.436 16.547 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.758 11.008 16.487 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -13.434 8.543 16.098 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -11.790 8.130 16.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -13.268 8.022 18.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -12.117 9.249 18.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -13.710 9.649 18.242 1.00 0.00 H new ATOM 813 N MET A 497 -11.481 12.016 11.845 1.00 0.00 N ATOM 814 CA MET A 497 -11.668 13.448 11.648 1.00 0.00 C ATOM 815 C MET A 497 -13.084 13.869 12.028 1.00 0.00 C ATOM 816 O MET A 497 -14.028 13.087 11.910 1.00 0.00 O ATOM 817 CB MET A 497 -11.385 13.826 10.193 1.00 0.00 C ATOM 818 CG MET A 497 -11.361 15.326 9.948 1.00 0.00 C ATOM 819 SD MET A 497 -12.996 15.998 9.594 1.00 0.00 S ATOM 820 CE MET A 497 -12.614 17.738 9.406 1.00 0.00 C ATOM 0 H MET A 497 -12.187 11.433 11.396 1.00 0.00 H new ATOM 0 HA MET A 497 -10.966 13.973 12.296 1.00 0.00 H new ATOM 0 HB2 MET A 497 -10.426 13.402 9.896 1.00 0.00 H new ATOM 0 HB3 MET A 497 -12.144 13.374 9.555 1.00 0.00 H new ATOM 0 HG2 MET A 497 -10.948 15.827 10.824 1.00 0.00 H new ATOM 0 HG3 MET A 497 -10.695 15.543 9.113 1.00 0.00 H new ATOM 0 HE1 MET A 497 -13.528 18.289 9.183 1.00 0.00 H new ATOM 0 HE2 MET A 497 -12.178 18.117 10.330 1.00 0.00 H new ATOM 0 HE3 MET A 497 -11.903 17.868 8.590 1.00 0.00 H new ATOM 830 N THR A 498 -13.226 15.109 12.485 1.00 0.00 N ATOM 831 CA THR A 498 -14.527 15.632 12.884 1.00 0.00 C ATOM 832 C THR A 498 -15.622 15.171 11.929 1.00 0.00 C ATOM 833 O THR A 498 -15.851 15.786 10.889 1.00 0.00 O ATOM 834 CB THR A 498 -14.521 17.172 12.935 1.00 0.00 C ATOM 835 OG1 THR A 498 -13.430 17.631 13.741 1.00 0.00 O ATOM 836 CG2 THR A 498 -15.831 17.699 13.500 1.00 0.00 C ATOM 0 H THR A 498 -12.456 15.770 12.588 1.00 0.00 H new ATOM 0 HA THR A 498 -14.732 15.243 13.881 1.00 0.00 H new ATOM 0 HB THR A 498 -14.404 17.547 11.918 1.00 0.00 H new ATOM 0 HG1 THR A 498 -13.432 18.611 13.767 1.00 0.00 H new ATOM 0 HG21 THR A 498 -15.804 18.788 13.527 1.00 0.00 H new ATOM 0 HG22 THR A 498 -16.657 17.372 12.869 1.00 0.00 H new ATOM 0 HG23 THR A 498 -15.972 17.315 14.510 1.00 0.00 H new ATOM 844 N GLY A 499 -16.296 14.084 12.290 1.00 0.00 N ATOM 845 CA GLY A 499 -17.360 13.559 11.454 1.00 0.00 C ATOM 846 C GLY A 499 -17.554 12.066 11.632 1.00 0.00 C ATOM 847 O GLY A 499 -16.865 11.433 12.433 1.00 0.00 O ATOM 0 H GLY A 499 -16.124 13.557 13.146 1.00 0.00 H new ATOM 0 HA2 GLY A 499 -18.291 14.074 11.690 1.00 0.00 H new ATOM 0 HA3 GLY A 499 -17.135 13.771 10.409 1.00 0.00 H new ATOM 851 N THR A 500 -18.496 11.500 10.884 1.00 0.00 N ATOM 852 CA THR A 500 -18.781 10.073 10.964 1.00 0.00 C ATOM 853 C THR A 500 -17.611 9.249 10.441 1.00 0.00 C ATOM 854 O THR A 500 -16.992 9.598 9.437 1.00 0.00 O ATOM 855 CB THR A 500 -20.048 9.708 10.168 1.00 0.00 C ATOM 856 OG1 THR A 500 -19.887 10.076 8.794 1.00 0.00 O ATOM 857 CG2 THR A 500 -21.270 10.406 10.745 1.00 0.00 C ATOM 0 H THR A 500 -19.075 12.009 10.216 1.00 0.00 H new ATOM 0 HA THR A 500 -18.943 9.841 12.017 1.00 0.00 H new ATOM 0 HB THR A 500 -20.197 8.631 10.240 1.00 0.00 H new ATOM 0 HG1 THR A 500 -20.696 9.839 8.295 1.00 0.00 H new ATOM 0 HG21 THR A 500 -22.152 10.133 10.166 1.00 0.00 H new ATOM 0 HG22 THR A 500 -21.408 10.101 11.782 1.00 0.00 H new ATOM 0 HG23 THR A 500 -21.127 11.486 10.701 1.00 0.00 H new ATOM 865 N GLY A 501 -17.312 8.151 11.129 1.00 0.00 N ATOM 866 CA GLY A 501 -16.216 7.293 10.718 1.00 0.00 C ATOM 867 C GLY A 501 -14.869 7.811 11.181 1.00 0.00 C ATOM 868 O GLY A 501 -14.500 8.948 10.889 1.00 0.00 O ATOM 0 H GLY A 501 -17.809 7.841 11.964 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -16.373 6.291 11.118 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -16.214 7.206 9.631 1.00 0.00 H new ATOM 872 N ALA A 502 -14.133 6.976 11.907 1.00 0.00 N ATOM 873 CA ALA A 502 -12.819 7.356 12.411 1.00 0.00 C ATOM 874 C ALA A 502 -11.714 6.886 11.471 1.00 0.00 C ATOM 875 O ALA A 502 -11.127 7.684 10.739 1.00 0.00 O ATOM 876 CB ALA A 502 -12.605 6.788 13.806 1.00 0.00 C ATOM 0 H ALA A 502 -14.425 6.032 12.159 1.00 0.00 H new ATOM 0 HA ALA A 502 -12.777 8.444 12.463 1.00 0.00 H new ATOM 0 HB1 ALA A 502 -11.620 7.079 14.170 1.00 0.00 H new ATOM 0 HB2 ALA A 502 -13.370 7.176 14.478 1.00 0.00 H new ATOM 0 HB3 ALA A 502 -12.672 5.701 13.770 1.00 0.00 H new ATOM 882 N HIS A 503 -11.434 5.587 11.497 1.00 0.00 N ATOM 883 CA HIS A 503 -10.398 5.012 10.647 1.00 0.00 C ATOM 884 C HIS A 503 -11.002 4.047 9.631 1.00 0.00 C ATOM 885 O HIS A 503 -11.476 2.969 9.990 1.00 0.00 O ATOM 886 CB HIS A 503 -9.355 4.287 11.498 1.00 0.00 C ATOM 887 CG HIS A 503 -8.603 3.229 10.750 1.00 0.00 C ATOM 888 ND1 HIS A 503 -9.137 1.992 10.455 1.00 0.00 N ATOM 889 CD2 HIS A 503 -7.350 3.228 10.237 1.00 0.00 C ATOM 890 CE1 HIS A 503 -8.245 1.277 9.793 1.00 0.00 C ATOM 891 NE2 HIS A 503 -7.153 2.004 9.647 1.00 0.00 N ATOM 0 H HIS A 503 -11.910 4.913 12.097 1.00 0.00 H new ATOM 0 HA HIS A 503 -9.914 5.825 10.106 1.00 0.00 H new ATOM 0 HB2 HIS A 503 -8.646 5.017 11.890 1.00 0.00 H new ATOM 0 HB3 HIS A 503 -9.850 3.832 12.356 1.00 0.00 H new ATOM 0 HD1 HIS A 503 -10.074 1.678 10.708 1.00 0.00 H new ATOM 0 HD2 HIS A 503 -6.638 4.039 10.283 1.00 0.00 H new ATOM 0 HE1 HIS A 503 -8.385 0.269 9.432 1.00 0.00 H new ATOM 899 N ARG A 504 -10.983 4.443 8.362 1.00 0.00 N ATOM 900 CA ARG A 504 -11.531 3.615 7.295 1.00 0.00 C ATOM 901 C ARG A 504 -10.734 2.322 7.147 1.00 0.00 C ATOM 902 O ARG A 504 -9.785 2.077 7.890 1.00 0.00 O ATOM 903 CB ARG A 504 -11.528 4.382 5.972 1.00 0.00 C ATOM 904 CG ARG A 504 -12.435 5.602 5.973 1.00 0.00 C ATOM 905 CD ARG A 504 -13.891 5.213 5.768 1.00 0.00 C ATOM 906 NE ARG A 504 -14.807 6.217 6.303 1.00 0.00 N ATOM 907 CZ ARG A 504 -16.060 6.363 5.889 1.00 0.00 C ATOM 908 NH1 ARG A 504 -16.546 5.574 4.941 1.00 0.00 N ATOM 909 NH2 ARG A 504 -16.832 7.301 6.425 1.00 0.00 N ATOM 0 H ARG A 504 -10.594 5.332 8.048 1.00 0.00 H new ATOM 0 HA ARG A 504 -12.558 3.361 7.557 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -10.509 4.697 5.747 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -11.838 3.710 5.172 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -12.329 6.135 6.918 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -12.126 6.288 5.184 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -14.083 5.077 4.704 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -14.082 4.255 6.251 1.00 0.00 H new ATOM 0 HE ARG A 504 -14.465 6.840 7.035 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -15.957 4.852 4.527 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -17.509 5.689 4.626 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -16.462 7.910 7.155 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -17.795 7.413 6.107 1.00 0.00 H new ATOM 923 N GLY A 505 -11.128 1.497 6.181 1.00 0.00 N ATOM 924 CA GLY A 505 -10.440 0.240 5.953 1.00 0.00 C ATOM 925 C GLY A 505 -9.539 0.284 4.735 1.00 0.00 C ATOM 926 O GLY A 505 -9.735 -0.470 3.781 1.00 0.00 O ATOM 0 H GLY A 505 -11.911 1.677 5.553 1.00 0.00 H new ATOM 0 HA2 GLY A 505 -9.846 -0.010 6.832 1.00 0.00 H new ATOM 0 HA3 GLY A 505 -11.175 -0.555 5.829 1.00 0.00 H new ATOM 930 N PHE A 506 -8.550 1.170 4.764 1.00 0.00 N ATOM 931 CA PHE A 506 -7.617 1.312 3.652 1.00 0.00 C ATOM 932 C PHE A 506 -6.317 1.966 4.113 1.00 0.00 C ATOM 933 O PHE A 506 -6.332 2.937 4.868 1.00 0.00 O ATOM 934 CB PHE A 506 -8.248 2.139 2.531 1.00 0.00 C ATOM 935 CG PHE A 506 -8.167 3.621 2.761 1.00 0.00 C ATOM 936 CD1 PHE A 506 -8.807 4.204 3.842 1.00 0.00 C ATOM 937 CD2 PHE A 506 -7.450 4.432 1.895 1.00 0.00 C ATOM 938 CE1 PHE A 506 -8.734 5.568 4.057 1.00 0.00 C ATOM 939 CE2 PHE A 506 -7.373 5.795 2.105 1.00 0.00 C ATOM 940 CZ PHE A 506 -8.016 6.364 3.187 1.00 0.00 C ATOM 0 H PHE A 506 -8.373 1.801 5.546 1.00 0.00 H new ATOM 0 HA PHE A 506 -7.388 0.316 3.273 1.00 0.00 H new ATOM 0 HB2 PHE A 506 -7.754 1.898 1.590 1.00 0.00 H new ATOM 0 HB3 PHE A 506 -9.294 1.853 2.424 1.00 0.00 H new ATOM 0 HD1 PHE A 506 -9.370 3.586 4.525 1.00 0.00 H new ATOM 0 HD2 PHE A 506 -6.946 3.993 1.047 1.00 0.00 H new ATOM 0 HE1 PHE A 506 -9.238 6.010 4.904 1.00 0.00 H new ATOM 0 HE2 PHE A 506 -6.810 6.416 1.423 1.00 0.00 H new ATOM 0 HZ PHE A 506 -7.957 7.430 3.352 1.00 0.00 H new ATOM 950 N GLY A 507 -5.194 1.425 3.652 1.00 0.00 N ATOM 951 CA GLY A 507 -3.901 1.968 4.027 1.00 0.00 C ATOM 952 C GLY A 507 -2.906 1.937 2.884 1.00 0.00 C ATOM 953 O GLY A 507 -2.911 1.013 2.071 1.00 0.00 O ATOM 0 H GLY A 507 -5.156 0.621 3.026 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -4.027 2.996 4.367 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -3.502 1.400 4.868 1.00 0.00 H new ATOM 957 N PHE A 508 -2.050 2.952 2.820 1.00 0.00 N ATOM 958 CA PHE A 508 -1.046 3.040 1.766 1.00 0.00 C ATOM 959 C PHE A 508 0.349 2.762 2.319 1.00 0.00 C ATOM 960 O PHE A 508 0.776 3.379 3.296 1.00 0.00 O ATOM 961 CB PHE A 508 -1.081 4.422 1.112 1.00 0.00 C ATOM 962 CG PHE A 508 -2.208 4.594 0.134 1.00 0.00 C ATOM 963 CD1 PHE A 508 -2.055 4.222 -1.192 1.00 0.00 C ATOM 964 CD2 PHE A 508 -3.421 5.127 0.540 1.00 0.00 C ATOM 965 CE1 PHE A 508 -3.091 4.378 -2.095 1.00 0.00 C ATOM 966 CE2 PHE A 508 -4.460 5.285 -0.358 1.00 0.00 C ATOM 967 CZ PHE A 508 -4.294 4.911 -1.677 1.00 0.00 C ATOM 0 H PHE A 508 -2.032 3.725 3.485 1.00 0.00 H new ATOM 0 HA PHE A 508 -1.278 2.285 1.015 1.00 0.00 H new ATOM 0 HB2 PHE A 508 -1.166 5.181 1.890 1.00 0.00 H new ATOM 0 HB3 PHE A 508 -0.135 4.596 0.599 1.00 0.00 H new ATOM 0 HD1 PHE A 508 -1.116 3.805 -1.524 1.00 0.00 H new ATOM 0 HD2 PHE A 508 -3.556 5.422 1.570 1.00 0.00 H new ATOM 0 HE1 PHE A 508 -2.959 4.083 -3.126 1.00 0.00 H new ATOM 0 HE2 PHE A 508 -5.401 5.701 -0.028 1.00 0.00 H new ATOM 0 HZ PHE A 508 -5.104 5.035 -2.380 1.00 0.00 H new ATOM 977 N VAL A 509 1.055 1.829 1.688 1.00 0.00 N ATOM 978 CA VAL A 509 2.401 1.469 2.116 1.00 0.00 C ATOM 979 C VAL A 509 3.386 1.545 0.954 1.00 0.00 C ATOM 980 O VAL A 509 3.208 0.881 -0.067 1.00 0.00 O ATOM 981 CB VAL A 509 2.440 0.051 2.715 1.00 0.00 C ATOM 982 CG1 VAL A 509 3.817 -0.251 3.286 1.00 0.00 C ATOM 983 CG2 VAL A 509 1.366 -0.105 3.782 1.00 0.00 C ATOM 0 H VAL A 509 0.717 1.309 0.878 1.00 0.00 H new ATOM 0 HA VAL A 509 2.691 2.187 2.883 1.00 0.00 H new ATOM 0 HB VAL A 509 2.238 -0.666 1.919 1.00 0.00 H new ATOM 0 HG11 VAL A 509 3.825 -1.257 3.705 1.00 0.00 H new ATOM 0 HG12 VAL A 509 4.563 -0.182 2.494 1.00 0.00 H new ATOM 0 HG13 VAL A 509 4.052 0.470 4.069 1.00 0.00 H new ATOM 0 HG21 VAL A 509 1.407 -1.113 4.195 1.00 0.00 H new ATOM 0 HG22 VAL A 509 1.535 0.621 4.578 1.00 0.00 H new ATOM 0 HG23 VAL A 509 0.385 0.065 3.338 1.00 0.00 H new ATOM 993 N ASP A 510 4.423 2.358 1.117 1.00 0.00 N ATOM 994 CA ASP A 510 5.438 2.520 0.082 1.00 0.00 C ATOM 995 C ASP A 510 6.767 1.917 0.526 1.00 0.00 C ATOM 996 O ASP A 510 7.185 2.083 1.672 1.00 0.00 O ATOM 997 CB ASP A 510 5.622 4.000 -0.254 1.00 0.00 C ATOM 998 CG ASP A 510 6.513 4.213 -1.463 1.00 0.00 C ATOM 999 OD1 ASP A 510 7.455 3.415 -1.654 1.00 0.00 O ATOM 1000 OD2 ASP A 510 6.267 5.176 -2.218 1.00 0.00 O ATOM 0 H ASP A 510 4.584 2.916 1.956 1.00 0.00 H new ATOM 0 HA ASP A 510 5.100 1.993 -0.810 1.00 0.00 H new ATOM 0 HB2 ASP A 510 4.647 4.451 -0.441 1.00 0.00 H new ATOM 0 HB3 ASP A 510 6.052 4.514 0.606 1.00 0.00 H new ATOM 1005 N PHE A 511 7.427 1.214 -0.389 1.00 0.00 N ATOM 1006 CA PHE A 511 8.708 0.584 -0.092 1.00 0.00 C ATOM 1007 C PHE A 511 9.855 1.349 -0.747 1.00 0.00 C ATOM 1008 O PHE A 511 9.639 2.164 -1.644 1.00 0.00 O ATOM 1009 CB PHE A 511 8.710 -0.868 -0.572 1.00 0.00 C ATOM 1010 CG PHE A 511 8.190 -1.838 0.450 1.00 0.00 C ATOM 1011 CD1 PHE A 511 6.834 -1.917 0.723 1.00 0.00 C ATOM 1012 CD2 PHE A 511 9.057 -2.671 1.138 1.00 0.00 C ATOM 1013 CE1 PHE A 511 6.353 -2.807 1.664 1.00 0.00 C ATOM 1014 CE2 PHE A 511 8.582 -3.564 2.080 1.00 0.00 C ATOM 1015 CZ PHE A 511 7.228 -3.633 2.342 1.00 0.00 C ATOM 0 H PHE A 511 7.096 1.066 -1.342 1.00 0.00 H new ATOM 0 HA PHE A 511 8.852 0.603 0.988 1.00 0.00 H new ATOM 0 HB2 PHE A 511 8.104 -0.945 -1.475 1.00 0.00 H new ATOM 0 HB3 PHE A 511 9.727 -1.151 -0.845 1.00 0.00 H new ATOM 0 HD1 PHE A 511 6.145 -1.275 0.194 1.00 0.00 H new ATOM 0 HD2 PHE A 511 10.117 -2.622 0.936 1.00 0.00 H new ATOM 0 HE1 PHE A 511 5.294 -2.857 1.869 1.00 0.00 H new ATOM 0 HE2 PHE A 511 9.269 -4.207 2.610 1.00 0.00 H new ATOM 0 HZ PHE A 511 6.854 -4.332 3.076 1.00 0.00 H new ATOM 1025 N ILE A 512 11.074 1.080 -0.291 1.00 0.00 N ATOM 1026 CA ILE A 512 12.255 1.742 -0.832 1.00 0.00 C ATOM 1027 C ILE A 512 12.533 1.289 -2.261 1.00 0.00 C ATOM 1028 O ILE A 512 12.824 2.103 -3.138 1.00 0.00 O ATOM 1029 CB ILE A 512 13.499 1.468 0.033 1.00 0.00 C ATOM 1030 CG1 ILE A 512 13.271 1.959 1.464 1.00 0.00 C ATOM 1031 CG2 ILE A 512 14.723 2.138 -0.573 1.00 0.00 C ATOM 1032 CD1 ILE A 512 12.793 3.392 1.543 1.00 0.00 C ATOM 0 H ILE A 512 11.270 0.409 0.451 1.00 0.00 H new ATOM 0 HA ILE A 512 12.047 2.812 -0.827 1.00 0.00 H new ATOM 0 HB ILE A 512 13.673 0.392 0.061 1.00 0.00 H new ATOM 0 HG12 ILE A 512 12.539 1.313 1.949 1.00 0.00 H new ATOM 0 HG13 ILE A 512 14.201 1.863 2.025 1.00 0.00 H new ATOM 0 HG21 ILE A 512 15.594 1.935 0.050 1.00 0.00 H new ATOM 0 HG22 ILE A 512 14.894 1.745 -1.575 1.00 0.00 H new ATOM 0 HG23 ILE A 512 14.559 3.214 -0.628 1.00 0.00 H new ATOM 0 HD11 ILE A 512 12.653 3.672 2.587 1.00 0.00 H new ATOM 0 HD12 ILE A 512 13.535 4.049 1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 512 11.847 3.490 1.011 1.00 0.00 H new ATOM 1044 N THR A 513 12.440 -0.018 -2.490 1.00 0.00 N ATOM 1045 CA THR A 513 12.681 -0.580 -3.813 1.00 0.00 C ATOM 1046 C THR A 513 11.543 -1.504 -4.233 1.00 0.00 C ATOM 1047 O THR A 513 10.774 -1.978 -3.397 1.00 0.00 O ATOM 1048 CB THR A 513 14.006 -1.364 -3.857 1.00 0.00 C ATOM 1049 OG1 THR A 513 13.944 -2.482 -2.964 1.00 0.00 O ATOM 1050 CG2 THR A 513 15.177 -0.470 -3.478 1.00 0.00 C ATOM 0 H THR A 513 12.200 -0.706 -1.777 1.00 0.00 H new ATOM 0 HA THR A 513 12.740 0.258 -4.507 1.00 0.00 H new ATOM 0 HB THR A 513 14.157 -1.721 -4.876 1.00 0.00 H new ATOM 0 HG1 THR A 513 13.979 -2.163 -2.038 1.00 0.00 H new ATOM 0 HG21 THR A 513 16.102 -1.046 -3.516 1.00 0.00 H new ATOM 0 HG22 THR A 513 15.240 0.364 -4.177 1.00 0.00 H new ATOM 0 HG23 THR A 513 15.030 -0.086 -2.468 1.00 0.00 H new ATOM 1058 N LYS A 514 11.442 -1.756 -5.533 1.00 0.00 N ATOM 1059 CA LYS A 514 10.399 -2.625 -6.065 1.00 0.00 C ATOM 1060 C LYS A 514 10.467 -4.010 -5.429 1.00 0.00 C ATOM 1061 O LYS A 514 9.447 -4.565 -5.021 1.00 0.00 O ATOM 1062 CB LYS A 514 10.532 -2.744 -7.585 1.00 0.00 C ATOM 1063 CG LYS A 514 10.389 -1.419 -8.314 1.00 0.00 C ATOM 1064 CD LYS A 514 11.132 -1.430 -9.640 1.00 0.00 C ATOM 1065 CE LYS A 514 12.636 -1.336 -9.437 1.00 0.00 C ATOM 1066 NZ LYS A 514 13.314 -0.694 -10.597 1.00 0.00 N ATOM 0 H LYS A 514 12.070 -1.371 -6.238 1.00 0.00 H new ATOM 0 HA LYS A 514 9.433 -2.181 -5.824 1.00 0.00 H new ATOM 0 HB2 LYS A 514 11.503 -3.177 -7.823 1.00 0.00 H new ATOM 0 HB3 LYS A 514 9.775 -3.436 -7.954 1.00 0.00 H new ATOM 0 HG2 LYS A 514 9.333 -1.211 -8.489 1.00 0.00 H new ATOM 0 HG3 LYS A 514 10.773 -0.614 -7.687 1.00 0.00 H new ATOM 0 HD2 LYS A 514 10.894 -2.344 -10.184 1.00 0.00 H new ATOM 0 HD3 LYS A 514 10.794 -0.596 -10.255 1.00 0.00 H new ATOM 0 HE2 LYS A 514 12.845 -0.765 -8.533 1.00 0.00 H new ATOM 0 HE3 LYS A 514 13.045 -2.335 -9.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 514 14.338 -0.649 -10.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 514 13.136 -1.253 -11.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 514 12.943 0.269 -10.727 1.00 0.00 H new ATOM 1080 N GLN A 515 11.674 -4.560 -5.346 1.00 0.00 N ATOM 1081 CA GLN A 515 11.873 -5.879 -4.758 1.00 0.00 C ATOM 1082 C GLN A 515 11.180 -5.981 -3.403 1.00 0.00 C ATOM 1083 O GLN A 515 10.217 -6.731 -3.242 1.00 0.00 O ATOM 1084 CB GLN A 515 13.367 -6.171 -4.603 1.00 0.00 C ATOM 1085 CG GLN A 515 14.068 -6.463 -5.920 1.00 0.00 C ATOM 1086 CD GLN A 515 13.508 -7.684 -6.622 1.00 0.00 C ATOM 1087 OE1 GLN A 515 12.557 -7.586 -7.399 1.00 0.00 O ATOM 1088 NE2 GLN A 515 14.096 -8.844 -6.353 1.00 0.00 N ATOM 0 H GLN A 515 12.528 -4.113 -5.678 1.00 0.00 H new ATOM 0 HA GLN A 515 11.433 -6.618 -5.427 1.00 0.00 H new ATOM 0 HB2 GLN A 515 13.848 -5.317 -4.126 1.00 0.00 H new ATOM 0 HB3 GLN A 515 13.495 -7.023 -3.936 1.00 0.00 H new ATOM 0 HG2 GLN A 515 13.975 -5.597 -6.576 1.00 0.00 H new ATOM 0 HG3 GLN A 515 15.132 -6.611 -5.736 1.00 0.00 H new ATOM 0 HE21 GLN A 515 14.881 -8.879 -5.703 1.00 0.00 H new ATOM 0 HE22 GLN A 515 13.763 -9.700 -6.797 1.00 0.00 H new ATOM 1097 N ASP A 516 11.677 -5.222 -2.432 1.00 0.00 N ATOM 1098 CA ASP A 516 11.105 -5.227 -1.090 1.00 0.00 C ATOM 1099 C ASP A 516 9.582 -5.156 -1.148 1.00 0.00 C ATOM 1100 O ASP A 516 8.892 -5.748 -0.319 1.00 0.00 O ATOM 1101 CB ASP A 516 11.652 -4.053 -0.276 1.00 0.00 C ATOM 1102 CG ASP A 516 13.163 -3.953 -0.348 1.00 0.00 C ATOM 1103 OD1 ASP A 516 13.819 -5.002 -0.514 1.00 0.00 O ATOM 1104 OD2 ASP A 516 13.689 -2.825 -0.237 1.00 0.00 O ATOM 0 H ASP A 516 12.474 -4.596 -2.549 1.00 0.00 H new ATOM 0 HA ASP A 516 11.389 -6.160 -0.604 1.00 0.00 H new ATOM 0 HB2 ASP A 516 11.212 -3.125 -0.641 1.00 0.00 H new ATOM 0 HB3 ASP A 516 11.347 -4.163 0.765 1.00 0.00 H new ATOM 1109 N ALA A 517 9.066 -4.427 -2.132 1.00 0.00 N ATOM 1110 CA ALA A 517 7.625 -4.280 -2.298 1.00 0.00 C ATOM 1111 C ALA A 517 7.002 -5.561 -2.843 1.00 0.00 C ATOM 1112 O ALA A 517 5.886 -5.927 -2.472 1.00 0.00 O ATOM 1113 CB ALA A 517 7.317 -3.108 -3.219 1.00 0.00 C ATOM 0 H ALA A 517 9.624 -3.929 -2.826 1.00 0.00 H new ATOM 0 HA ALA A 517 7.189 -4.083 -1.319 1.00 0.00 H new ATOM 0 HB1 ALA A 517 6.238 -3.010 -3.334 1.00 0.00 H new ATOM 0 HB2 ALA A 517 7.721 -2.191 -2.789 1.00 0.00 H new ATOM 0 HB3 ALA A 517 7.772 -3.282 -4.194 1.00 0.00 H new ATOM 1119 N LYS A 518 7.728 -6.238 -3.725 1.00 0.00 N ATOM 1120 CA LYS A 518 7.248 -7.479 -4.322 1.00 0.00 C ATOM 1121 C LYS A 518 7.236 -8.607 -3.295 1.00 0.00 C ATOM 1122 O LYS A 518 6.230 -9.298 -3.128 1.00 0.00 O ATOM 1123 CB LYS A 518 8.124 -7.869 -5.514 1.00 0.00 C ATOM 1124 CG LYS A 518 7.386 -8.662 -6.578 1.00 0.00 C ATOM 1125 CD LYS A 518 6.650 -7.748 -7.544 1.00 0.00 C ATOM 1126 CE LYS A 518 7.580 -7.215 -8.624 1.00 0.00 C ATOM 1127 NZ LYS A 518 8.261 -5.960 -8.199 1.00 0.00 N ATOM 0 H LYS A 518 8.653 -5.948 -4.043 1.00 0.00 H new ATOM 0 HA LYS A 518 6.228 -7.315 -4.668 1.00 0.00 H new ATOM 0 HB2 LYS A 518 8.533 -6.965 -5.965 1.00 0.00 H new ATOM 0 HB3 LYS A 518 8.969 -8.457 -5.156 1.00 0.00 H new ATOM 0 HG2 LYS A 518 8.094 -9.281 -7.129 1.00 0.00 H new ATOM 0 HG3 LYS A 518 6.676 -9.338 -6.102 1.00 0.00 H new ATOM 0 HD2 LYS A 518 5.827 -8.293 -8.007 1.00 0.00 H new ATOM 0 HD3 LYS A 518 6.212 -6.914 -6.996 1.00 0.00 H new ATOM 0 HE2 LYS A 518 8.328 -7.971 -8.865 1.00 0.00 H new ATOM 0 HE3 LYS A 518 7.010 -7.029 -9.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 518 8.333 -5.312 -9.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 518 7.712 -5.506 -7.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 518 9.214 -6.184 -7.849 1.00 0.00 H new ATOM 1141 N LYS A 519 8.358 -8.787 -2.608 1.00 0.00 N ATOM 1142 CA LYS A 519 8.477 -9.829 -1.595 1.00 0.00 C ATOM 1143 C LYS A 519 7.469 -9.613 -0.470 1.00 0.00 C ATOM 1144 O LYS A 519 6.855 -10.561 0.017 1.00 0.00 O ATOM 1145 CB LYS A 519 9.897 -9.855 -1.024 1.00 0.00 C ATOM 1146 CG LYS A 519 10.196 -8.697 -0.087 1.00 0.00 C ATOM 1147 CD LYS A 519 11.593 -8.804 0.503 1.00 0.00 C ATOM 1148 CE LYS A 519 11.597 -9.634 1.777 1.00 0.00 C ATOM 1149 NZ LYS A 519 12.860 -9.462 2.547 1.00 0.00 N ATOM 0 H LYS A 519 9.199 -8.224 -2.734 1.00 0.00 H new ATOM 0 HA LYS A 519 8.265 -10.787 -2.069 1.00 0.00 H new ATOM 0 HB2 LYS A 519 10.048 -10.793 -0.489 1.00 0.00 H new ATOM 0 HB3 LYS A 519 10.611 -9.839 -1.847 1.00 0.00 H new ATOM 0 HG2 LYS A 519 10.100 -7.756 -0.628 1.00 0.00 H new ATOM 0 HG3 LYS A 519 9.461 -8.679 0.717 1.00 0.00 H new ATOM 0 HD2 LYS A 519 12.264 -9.254 -0.228 1.00 0.00 H new ATOM 0 HD3 LYS A 519 11.977 -7.806 0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 519 10.750 -9.347 2.400 1.00 0.00 H new ATOM 0 HE3 LYS A 519 11.466 -10.686 1.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 13.041 -10.316 3.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 13.650 -9.308 1.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 12.772 -8.641 3.180 1.00 0.00 H new ATOM 1163 N ALA A 520 7.304 -8.358 -0.064 1.00 0.00 N ATOM 1164 CA ALA A 520 6.368 -8.017 1.000 1.00 0.00 C ATOM 1165 C ALA A 520 4.924 -8.167 0.531 1.00 0.00 C ATOM 1166 O ALA A 520 4.127 -8.867 1.156 1.00 0.00 O ATOM 1167 CB ALA A 520 6.620 -6.599 1.491 1.00 0.00 C ATOM 0 H ALA A 520 7.806 -7.561 -0.456 1.00 0.00 H new ATOM 0 HA ALA A 520 6.528 -8.710 1.826 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.914 -6.358 2.285 1.00 0.00 H new ATOM 0 HB2 ALA A 520 7.637 -6.522 1.874 1.00 0.00 H new ATOM 0 HB3 ALA A 520 6.490 -5.899 0.665 1.00 0.00 H new ATOM 1173 N PHE A 521 4.594 -7.506 -0.574 1.00 0.00 N ATOM 1174 CA PHE A 521 3.246 -7.565 -1.126 1.00 0.00 C ATOM 1175 C PHE A 521 2.725 -8.999 -1.136 1.00 0.00 C ATOM 1176 O PHE A 521 1.627 -9.275 -0.653 1.00 0.00 O ATOM 1177 CB PHE A 521 3.227 -6.993 -2.545 1.00 0.00 C ATOM 1178 CG PHE A 521 1.909 -7.165 -3.243 1.00 0.00 C ATOM 1179 CD1 PHE A 521 1.642 -8.310 -3.977 1.00 0.00 C ATOM 1180 CD2 PHE A 521 0.936 -6.182 -3.165 1.00 0.00 C ATOM 1181 CE1 PHE A 521 0.430 -8.469 -4.621 1.00 0.00 C ATOM 1182 CE2 PHE A 521 -0.279 -6.336 -3.807 1.00 0.00 C ATOM 1183 CZ PHE A 521 -0.532 -7.482 -4.535 1.00 0.00 C ATOM 0 H PHE A 521 5.242 -6.923 -1.104 1.00 0.00 H new ATOM 0 HA PHE A 521 2.594 -6.965 -0.492 1.00 0.00 H new ATOM 0 HB2 PHE A 521 3.471 -5.932 -2.504 1.00 0.00 H new ATOM 0 HB3 PHE A 521 4.007 -7.477 -3.134 1.00 0.00 H new ATOM 0 HD1 PHE A 521 2.390 -9.086 -4.046 1.00 0.00 H new ATOM 0 HD2 PHE A 521 1.129 -5.285 -2.596 1.00 0.00 H new ATOM 0 HE1 PHE A 521 0.235 -9.365 -5.192 1.00 0.00 H new ATOM 0 HE2 PHE A 521 -1.029 -5.562 -3.739 1.00 0.00 H new ATOM 0 HZ PHE A 521 -1.481 -7.606 -5.036 1.00 0.00 H new ATOM 1193 N ASN A 522 3.520 -9.908 -1.691 1.00 0.00 N ATOM 1194 CA ASN A 522 3.140 -11.313 -1.766 1.00 0.00 C ATOM 1195 C ASN A 522 3.227 -11.974 -0.393 1.00 0.00 C ATOM 1196 O ASN A 522 2.326 -12.708 0.011 1.00 0.00 O ATOM 1197 CB ASN A 522 4.037 -12.054 -2.759 1.00 0.00 C ATOM 1198 CG ASN A 522 3.376 -13.299 -3.318 1.00 0.00 C ATOM 1199 OD1 ASN A 522 2.162 -13.336 -3.515 1.00 0.00 O ATOM 1200 ND2 ASN A 522 4.176 -14.328 -3.576 1.00 0.00 N ATOM 0 H ASN A 522 4.432 -9.696 -2.096 1.00 0.00 H new ATOM 0 HA ASN A 522 2.107 -11.366 -2.111 1.00 0.00 H new ATOM 0 HB2 ASN A 522 4.297 -11.385 -3.579 1.00 0.00 H new ATOM 0 HB3 ASN A 522 4.969 -12.331 -2.266 1.00 0.00 H new ATOM 0 HD21 ASN A 522 3.789 -15.193 -3.953 1.00 0.00 H new ATOM 0 HD22 ASN A 522 5.177 -14.253 -3.397 1.00 0.00 H new ATOM 1207 N ALA A 523 4.317 -11.708 0.318 1.00 0.00 N ATOM 1208 CA ALA A 523 4.521 -12.274 1.645 1.00 0.00 C ATOM 1209 C ALA A 523 3.259 -12.155 2.492 1.00 0.00 C ATOM 1210 O ALA A 523 2.950 -13.040 3.292 1.00 0.00 O ATOM 1211 CB ALA A 523 5.690 -11.590 2.337 1.00 0.00 C ATOM 0 H ALA A 523 5.073 -11.103 -0.003 1.00 0.00 H new ATOM 0 HA ALA A 523 4.751 -13.333 1.530 1.00 0.00 H new ATOM 0 HB1 ALA A 523 5.831 -12.023 3.327 1.00 0.00 H new ATOM 0 HB2 ALA A 523 6.596 -11.732 1.747 1.00 0.00 H new ATOM 0 HB3 ALA A 523 5.483 -10.524 2.433 1.00 0.00 H new ATOM 1217 N LEU A 524 2.534 -11.057 2.314 1.00 0.00 N ATOM 1218 CA LEU A 524 1.304 -10.822 3.063 1.00 0.00 C ATOM 1219 C LEU A 524 0.080 -11.180 2.227 1.00 0.00 C ATOM 1220 O LEU A 524 -0.774 -11.956 2.659 1.00 0.00 O ATOM 1221 CB LEU A 524 1.224 -9.359 3.503 1.00 0.00 C ATOM 1222 CG LEU A 524 2.300 -8.894 4.485 1.00 0.00 C ATOM 1223 CD1 LEU A 524 2.132 -7.415 4.800 1.00 0.00 C ATOM 1224 CD2 LEU A 524 2.250 -9.721 5.762 1.00 0.00 C ATOM 0 H LEU A 524 2.776 -10.315 1.658 1.00 0.00 H new ATOM 0 HA LEU A 524 1.318 -11.461 3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 524 1.275 -8.730 2.614 1.00 0.00 H new ATOM 0 HB3 LEU A 524 0.248 -9.190 3.958 1.00 0.00 H new ATOM 0 HG LEU A 524 3.275 -9.038 4.020 1.00 0.00 H new ATOM 0 HD11 LEU A 524 2.906 -7.102 5.500 1.00 0.00 H new ATOM 0 HD12 LEU A 524 2.218 -6.835 3.881 1.00 0.00 H new ATOM 0 HD13 LEU A 524 1.151 -7.247 5.245 1.00 0.00 H new ATOM 0 HD21 LEU A 524 3.023 -9.376 6.449 1.00 0.00 H new ATOM 0 HD22 LEU A 524 1.272 -9.609 6.230 1.00 0.00 H new ATOM 0 HD23 LEU A 524 2.420 -10.771 5.523 1.00 0.00 H new ATOM 1236 N CYS A 525 0.002 -10.613 1.028 1.00 0.00 N ATOM 1237 CA CYS A 525 -1.118 -10.875 0.130 1.00 0.00 C ATOM 1238 C CYS A 525 -1.596 -12.317 0.263 1.00 0.00 C ATOM 1239 O CYS A 525 -2.784 -12.572 0.464 1.00 0.00 O ATOM 1240 CB CYS A 525 -0.715 -10.590 -1.317 1.00 0.00 C ATOM 1241 SG CYS A 525 -1.990 -10.996 -2.533 1.00 0.00 S ATOM 0 H CYS A 525 0.700 -9.969 0.655 1.00 0.00 H new ATOM 0 HA CYS A 525 -1.938 -10.213 0.409 1.00 0.00 H new ATOM 0 HB2 CYS A 525 -0.462 -9.534 -1.411 1.00 0.00 H new ATOM 0 HB3 CYS A 525 0.187 -11.156 -1.550 1.00 0.00 H new ATOM 0 HG CYS A 525 -1.556 -10.718 -3.726 1.00 0.00 H new ATOM 1247 N HIS A 526 -0.664 -13.257 0.147 1.00 0.00 N ATOM 1248 CA HIS A 526 -0.990 -14.675 0.254 1.00 0.00 C ATOM 1249 C HIS A 526 -2.097 -14.902 1.279 1.00 0.00 C ATOM 1250 O HIS A 526 -3.173 -15.399 0.946 1.00 0.00 O ATOM 1251 CB HIS A 526 0.252 -15.479 0.640 1.00 0.00 C ATOM 1252 CG HIS A 526 0.018 -16.957 0.686 1.00 0.00 C ATOM 1253 ND1 HIS A 526 0.642 -17.790 1.590 1.00 0.00 N ATOM 1254 CD2 HIS A 526 -0.779 -17.752 -0.066 1.00 0.00 C ATOM 1255 CE1 HIS A 526 0.241 -19.033 1.392 1.00 0.00 C ATOM 1256 NE2 HIS A 526 -0.623 -19.037 0.392 1.00 0.00 N ATOM 0 H HIS A 526 0.323 -13.063 -0.021 1.00 0.00 H new ATOM 0 HA HIS A 526 -1.345 -15.015 -0.719 1.00 0.00 H new ATOM 0 HB2 HIS A 526 1.048 -15.268 -0.074 1.00 0.00 H new ATOM 0 HB3 HIS A 526 0.602 -15.144 1.616 1.00 0.00 H new ATOM 0 HD2 HIS A 526 -1.419 -17.434 -0.876 1.00 0.00 H new ATOM 0 HE1 HIS A 526 0.564 -19.898 1.952 1.00 0.00 H new ATOM 0 HE2 HIS A 526 -1.097 -19.861 0.021 1.00 0.00 H new ATOM 1264 N SER A 527 -1.824 -14.536 2.527 1.00 0.00 N ATOM 1265 CA SER A 527 -2.795 -14.704 3.603 1.00 0.00 C ATOM 1266 C SER A 527 -2.380 -13.911 4.838 1.00 0.00 C ATOM 1267 O SER A 527 -1.442 -14.283 5.544 1.00 0.00 O ATOM 1268 CB SER A 527 -2.942 -16.185 3.959 1.00 0.00 C ATOM 1269 OG SER A 527 -1.692 -16.750 4.316 1.00 0.00 O ATOM 0 H SER A 527 -0.939 -14.121 2.819 1.00 0.00 H new ATOM 0 HA SER A 527 -3.756 -14.324 3.255 1.00 0.00 H new ATOM 0 HB2 SER A 527 -3.644 -16.296 4.785 1.00 0.00 H new ATOM 0 HB3 SER A 527 -3.360 -16.726 3.111 1.00 0.00 H new ATOM 0 HG SER A 527 -1.183 -16.106 4.851 1.00 0.00 H new ATOM 1275 N THR A 528 -3.086 -12.814 5.094 1.00 0.00 N ATOM 1276 CA THR A 528 -2.793 -11.966 6.242 1.00 0.00 C ATOM 1277 C THR A 528 -4.032 -11.761 7.106 1.00 0.00 C ATOM 1278 O THR A 528 -5.009 -11.150 6.672 1.00 0.00 O ATOM 1279 CB THR A 528 -2.254 -10.591 5.802 1.00 0.00 C ATOM 1280 OG1 THR A 528 -1.130 -10.761 4.932 1.00 0.00 O ATOM 1281 CG2 THR A 528 -1.848 -9.758 7.009 1.00 0.00 C ATOM 0 H THR A 528 -3.866 -12.492 4.521 1.00 0.00 H new ATOM 0 HA THR A 528 -2.028 -12.478 6.826 1.00 0.00 H new ATOM 0 HB THR A 528 -3.048 -10.067 5.270 1.00 0.00 H new ATOM 0 HG1 THR A 528 -1.398 -11.288 4.150 1.00 0.00 H new ATOM 0 HG21 THR A 528 -1.471 -8.792 6.674 1.00 0.00 H new ATOM 0 HG22 THR A 528 -2.714 -9.606 7.654 1.00 0.00 H new ATOM 0 HG23 THR A 528 -1.069 -10.279 7.565 1.00 0.00 H new ATOM 1289 N HIS A 529 -3.985 -12.276 8.331 1.00 0.00 N ATOM 1290 CA HIS A 529 -5.105 -12.148 9.256 1.00 0.00 C ATOM 1291 C HIS A 529 -4.754 -11.210 10.407 1.00 0.00 C ATOM 1292 O HIS A 529 -3.803 -11.453 11.152 1.00 0.00 O ATOM 1293 CB HIS A 529 -5.501 -13.520 9.804 1.00 0.00 C ATOM 1294 CG HIS A 529 -6.181 -14.393 8.795 1.00 0.00 C ATOM 1295 ND1 HIS A 529 -5.983 -14.269 7.436 1.00 0.00 N ATOM 1296 CD2 HIS A 529 -7.060 -15.410 8.954 1.00 0.00 C ATOM 1297 CE1 HIS A 529 -6.712 -15.171 6.803 1.00 0.00 C ATOM 1298 NE2 HIS A 529 -7.375 -15.876 7.701 1.00 0.00 N ATOM 0 H HIS A 529 -3.184 -12.785 8.705 1.00 0.00 H new ATOM 0 HA HIS A 529 -5.949 -11.726 8.710 1.00 0.00 H new ATOM 0 HB2 HIS A 529 -4.608 -14.028 10.169 1.00 0.00 H new ATOM 0 HB3 HIS A 529 -6.163 -13.384 10.659 1.00 0.00 H new ATOM 0 HD2 HIS A 529 -7.442 -15.785 9.892 1.00 0.00 H new ATOM 0 HE1 HIS A 529 -6.758 -15.308 5.733 1.00 0.00 H new ATOM 0 HE2 HIS A 529 -8.017 -16.642 7.497 1.00 0.00 H new ATOM 1306 N LEU A 530 -5.526 -10.138 10.547 1.00 0.00 N ATOM 1307 CA LEU A 530 -5.296 -9.162 11.607 1.00 0.00 C ATOM 1308 C LEU A 530 -6.584 -8.877 12.373 1.00 0.00 C ATOM 1309 O LEU A 530 -7.560 -8.387 11.806 1.00 0.00 O ATOM 1310 CB LEU A 530 -4.741 -7.863 11.020 1.00 0.00 C ATOM 1311 CG LEU A 530 -4.148 -6.873 12.023 1.00 0.00 C ATOM 1312 CD1 LEU A 530 -2.793 -7.357 12.514 1.00 0.00 C ATOM 1313 CD2 LEU A 530 -4.030 -5.490 11.400 1.00 0.00 C ATOM 0 H LEU A 530 -6.317 -9.922 9.940 1.00 0.00 H new ATOM 0 HA LEU A 530 -4.567 -9.581 12.301 1.00 0.00 H new ATOM 0 HB2 LEU A 530 -3.971 -8.117 10.292 1.00 0.00 H new ATOM 0 HB3 LEU A 530 -5.542 -7.362 10.476 1.00 0.00 H new ATOM 0 HG LEU A 530 -4.818 -6.807 12.880 1.00 0.00 H new ATOM 0 HD11 LEU A 530 -2.387 -6.639 13.227 1.00 0.00 H new ATOM 0 HD12 LEU A 530 -2.907 -8.326 13.000 1.00 0.00 H new ATOM 0 HD13 LEU A 530 -2.112 -7.453 11.668 1.00 0.00 H new ATOM 0 HD21 LEU A 530 -3.606 -4.798 12.128 1.00 0.00 H new ATOM 0 HD22 LEU A 530 -3.381 -5.539 10.525 1.00 0.00 H new ATOM 0 HD23 LEU A 530 -5.018 -5.141 11.100 1.00 0.00 H new ATOM 1325 N TYR A 531 -6.578 -9.186 13.665 1.00 0.00 N ATOM 1326 CA TYR A 531 -7.745 -8.964 14.510 1.00 0.00 C ATOM 1327 C TYR A 531 -8.936 -9.782 14.020 1.00 0.00 C ATOM 1328 O TYR A 531 -10.087 -9.370 14.159 1.00 0.00 O ATOM 1329 CB TYR A 531 -8.108 -7.478 14.533 1.00 0.00 C ATOM 1330 CG TYR A 531 -7.053 -6.607 15.177 1.00 0.00 C ATOM 1331 CD1 TYR A 531 -6.785 -6.697 16.537 1.00 0.00 C ATOM 1332 CD2 TYR A 531 -6.324 -5.695 14.424 1.00 0.00 C ATOM 1333 CE1 TYR A 531 -5.822 -5.902 17.129 1.00 0.00 C ATOM 1334 CE2 TYR A 531 -5.359 -4.897 15.007 1.00 0.00 C ATOM 1335 CZ TYR A 531 -5.112 -5.004 16.360 1.00 0.00 C ATOM 1336 OH TYR A 531 -4.151 -4.212 16.946 1.00 0.00 O ATOM 0 H TYR A 531 -5.777 -9.591 14.150 1.00 0.00 H new ATOM 0 HA TYR A 531 -7.497 -9.287 15.521 1.00 0.00 H new ATOM 0 HB2 TYR A 531 -8.274 -7.137 13.511 1.00 0.00 H new ATOM 0 HB3 TYR A 531 -9.049 -7.351 15.068 1.00 0.00 H new ATOM 0 HD1 TYR A 531 -7.338 -7.400 17.142 1.00 0.00 H new ATOM 0 HD2 TYR A 531 -6.515 -5.609 13.365 1.00 0.00 H new ATOM 0 HE1 TYR A 531 -5.627 -5.984 18.188 1.00 0.00 H new ATOM 0 HE2 TYR A 531 -4.801 -4.193 14.407 1.00 0.00 H new ATOM 0 HH TYR A 531 -3.378 -4.138 16.348 1.00 0.00 H new ATOM 1346 N GLY A 532 -8.649 -10.947 13.446 1.00 0.00 N ATOM 1347 CA GLY A 532 -9.706 -11.806 12.944 1.00 0.00 C ATOM 1348 C GLY A 532 -10.263 -11.326 11.618 1.00 0.00 C ATOM 1349 O GLY A 532 -11.429 -11.567 11.304 1.00 0.00 O ATOM 0 H GLY A 532 -7.704 -11.311 13.320 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -9.322 -12.819 12.828 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -10.511 -11.853 13.677 1.00 0.00 H new ATOM 1353 N ARG A 533 -9.429 -10.644 10.840 1.00 0.00 N ATOM 1354 CA ARG A 533 -9.846 -10.127 9.542 1.00 0.00 C ATOM 1355 C ARG A 533 -8.792 -10.415 8.477 1.00 0.00 C ATOM 1356 O ARG A 533 -7.597 -10.224 8.705 1.00 0.00 O ATOM 1357 CB ARG A 533 -10.102 -8.621 9.628 1.00 0.00 C ATOM 1358 CG ARG A 533 -11.313 -8.256 10.471 1.00 0.00 C ATOM 1359 CD ARG A 533 -11.932 -6.943 10.017 1.00 0.00 C ATOM 1360 NE ARG A 533 -13.249 -6.725 10.611 1.00 0.00 N ATOM 1361 CZ ARG A 533 -13.905 -5.572 10.540 1.00 0.00 C ATOM 1362 NH1 ARG A 533 -13.369 -4.539 9.904 1.00 0.00 N ATOM 1363 NH2 ARG A 533 -15.099 -5.451 11.105 1.00 0.00 N ATOM 0 H ARG A 533 -8.461 -10.437 11.086 1.00 0.00 H new ATOM 0 HA ARG A 533 -10.770 -10.630 9.258 1.00 0.00 H new ATOM 0 HB2 ARG A 533 -9.220 -8.134 10.044 1.00 0.00 H new ATOM 0 HB3 ARG A 533 -10.238 -8.226 8.621 1.00 0.00 H new ATOM 0 HG2 ARG A 533 -12.056 -9.051 10.407 1.00 0.00 H new ATOM 0 HG3 ARG A 533 -11.019 -8.178 11.518 1.00 0.00 H new ATOM 0 HD2 ARG A 533 -11.272 -6.119 10.286 1.00 0.00 H new ATOM 0 HD3 ARG A 533 -12.019 -6.940 8.930 1.00 0.00 H new ATOM 0 HE ARG A 533 -13.689 -7.500 11.107 1.00 0.00 H new ATOM 0 HH11 ARG A 533 -12.451 -4.629 9.468 1.00 0.00 H new ATOM 0 HH12 ARG A 533 -13.875 -3.655 9.851 1.00 0.00 H new ATOM 0 HH21 ARG A 533 -15.514 -6.244 11.595 1.00 0.00 H new ATOM 0 HH22 ARG A 533 -15.602 -4.565 11.050 1.00 0.00 H new ATOM 1377 N ARG A 534 -9.243 -10.875 7.315 1.00 0.00 N ATOM 1378 CA ARG A 534 -8.338 -11.191 6.216 1.00 0.00 C ATOM 1379 C ARG A 534 -8.061 -9.953 5.367 1.00 0.00 C ATOM 1380 O ARG A 534 -8.864 -9.582 4.511 1.00 0.00 O ATOM 1381 CB ARG A 534 -8.930 -12.299 5.343 1.00 0.00 C ATOM 1382 CG ARG A 534 -7.881 -13.168 4.669 1.00 0.00 C ATOM 1383 CD ARG A 534 -7.376 -12.536 3.382 1.00 0.00 C ATOM 1384 NE ARG A 534 -8.244 -12.836 2.247 1.00 0.00 N ATOM 1385 CZ ARG A 534 -7.844 -12.781 0.981 1.00 0.00 C ATOM 1386 NH1 ARG A 534 -6.596 -12.440 0.691 1.00 0.00 N ATOM 1387 NH2 ARG A 534 -8.693 -13.069 0.003 1.00 0.00 N ATOM 0 H ARG A 534 -10.229 -11.037 7.110 1.00 0.00 H new ATOM 0 HA ARG A 534 -7.396 -11.537 6.642 1.00 0.00 H new ATOM 0 HB2 ARG A 534 -9.572 -12.930 5.957 1.00 0.00 H new ATOM 0 HB3 ARG A 534 -9.563 -11.849 4.578 1.00 0.00 H new ATOM 0 HG2 ARG A 534 -7.045 -13.325 5.351 1.00 0.00 H new ATOM 0 HG3 ARG A 534 -8.304 -14.149 4.452 1.00 0.00 H new ATOM 0 HD2 ARG A 534 -7.309 -11.456 3.511 1.00 0.00 H new ATOM 0 HD3 ARG A 534 -6.369 -12.896 3.173 1.00 0.00 H new ATOM 0 HE ARG A 534 -9.210 -13.102 2.436 1.00 0.00 H new ATOM 0 HH11 ARG A 534 -5.940 -12.219 1.441 1.00 0.00 H new ATOM 0 HH12 ARG A 534 -6.292 -12.399 -0.282 1.00 0.00 H new ATOM 0 HH21 ARG A 534 -9.653 -13.333 0.223 1.00 0.00 H new ATOM 0 HH22 ARG A 534 -8.385 -13.027 -0.969 1.00 0.00 H new ATOM 1401 N LEU A 535 -6.920 -9.318 5.611 1.00 0.00 N ATOM 1402 CA LEU A 535 -6.536 -8.122 4.870 1.00 0.00 C ATOM 1403 C LEU A 535 -6.421 -8.419 3.379 1.00 0.00 C ATOM 1404 O LEU A 535 -6.104 -9.540 2.981 1.00 0.00 O ATOM 1405 CB LEU A 535 -5.208 -7.576 5.397 1.00 0.00 C ATOM 1406 CG LEU A 535 -5.232 -7.003 6.814 1.00 0.00 C ATOM 1407 CD1 LEU A 535 -3.832 -6.604 7.253 1.00 0.00 C ATOM 1408 CD2 LEU A 535 -6.177 -5.812 6.892 1.00 0.00 C ATOM 0 H LEU A 535 -6.244 -9.612 6.317 1.00 0.00 H new ATOM 0 HA LEU A 535 -7.313 -7.371 5.013 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -4.470 -8.377 5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -4.863 -6.797 4.717 1.00 0.00 H new ATOM 0 HG LEU A 535 -5.596 -7.776 7.491 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -3.869 -6.198 8.264 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -3.182 -7.479 7.237 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -3.439 -5.848 6.573 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -6.181 -5.417 7.908 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -5.843 -5.037 6.203 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -7.184 -6.128 6.621 1.00 0.00 H new ATOM 1420 N VAL A 536 -6.679 -7.406 2.557 1.00 0.00 N ATOM 1421 CA VAL A 536 -6.602 -7.557 1.109 1.00 0.00 C ATOM 1422 C VAL A 536 -5.539 -6.638 0.517 1.00 0.00 C ATOM 1423 O VAL A 536 -5.729 -5.423 0.436 1.00 0.00 O ATOM 1424 CB VAL A 536 -7.956 -7.257 0.440 1.00 0.00 C ATOM 1425 CG1 VAL A 536 -7.841 -7.367 -1.073 1.00 0.00 C ATOM 1426 CG2 VAL A 536 -9.031 -8.193 0.971 1.00 0.00 C ATOM 0 H VAL A 536 -6.943 -6.472 2.870 1.00 0.00 H new ATOM 0 HA VAL A 536 -6.331 -8.594 0.913 1.00 0.00 H new ATOM 0 HB VAL A 536 -8.244 -6.234 0.684 1.00 0.00 H new ATOM 0 HG11 VAL A 536 -8.808 -7.152 -1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 536 -7.102 -6.652 -1.435 1.00 0.00 H new ATOM 0 HG13 VAL A 536 -7.530 -8.377 -1.342 1.00 0.00 H new ATOM 0 HG21 VAL A 536 -9.981 -7.967 0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 536 -8.752 -9.225 0.759 1.00 0.00 H new ATOM 0 HG23 VAL A 536 -9.131 -8.059 2.048 1.00 0.00 H new ATOM 1436 N LEU A 537 -4.421 -7.224 0.103 1.00 0.00 N ATOM 1437 CA LEU A 537 -3.327 -6.458 -0.483 1.00 0.00 C ATOM 1438 C LEU A 537 -3.511 -6.313 -1.991 1.00 0.00 C ATOM 1439 O LEU A 537 -3.684 -7.302 -2.702 1.00 0.00 O ATOM 1440 CB LEU A 537 -1.988 -7.133 -0.184 1.00 0.00 C ATOM 1441 CG LEU A 537 -1.305 -6.719 1.120 1.00 0.00 C ATOM 1442 CD1 LEU A 537 -1.787 -7.584 2.274 1.00 0.00 C ATOM 1443 CD2 LEU A 537 0.208 -6.807 0.981 1.00 0.00 C ATOM 0 H LEU A 537 -4.248 -8.228 0.162 1.00 0.00 H new ATOM 0 HA LEU A 537 -3.333 -5.463 -0.037 1.00 0.00 H new ATOM 0 HB2 LEU A 537 -2.144 -8.212 -0.163 1.00 0.00 H new ATOM 0 HB3 LEU A 537 -1.307 -6.926 -1.009 1.00 0.00 H new ATOM 0 HG LEU A 537 -1.571 -5.684 1.334 1.00 0.00 H new ATOM 0 HD11 LEU A 537 -1.290 -7.274 3.193 1.00 0.00 H new ATOM 0 HD12 LEU A 537 -2.865 -7.470 2.388 1.00 0.00 H new ATOM 0 HD13 LEU A 537 -1.552 -8.628 2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 537 0.677 -6.509 1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 537 0.492 -7.832 0.743 1.00 0.00 H new ATOM 0 HD23 LEU A 537 0.539 -6.143 0.182 1.00 0.00 H new ATOM 1455 N GLU A 538 -3.469 -5.074 -2.471 1.00 0.00 N ATOM 1456 CA GLU A 538 -3.630 -4.801 -3.894 1.00 0.00 C ATOM 1457 C GLU A 538 -2.754 -3.628 -4.325 1.00 0.00 C ATOM 1458 O GLU A 538 -2.513 -2.702 -3.550 1.00 0.00 O ATOM 1459 CB GLU A 538 -5.095 -4.503 -4.217 1.00 0.00 C ATOM 1460 CG GLU A 538 -5.929 -5.749 -4.465 1.00 0.00 C ATOM 1461 CD GLU A 538 -5.389 -6.595 -5.603 1.00 0.00 C ATOM 1462 OE1 GLU A 538 -5.395 -6.112 -6.754 1.00 0.00 O ATOM 1463 OE2 GLU A 538 -4.962 -7.739 -5.341 1.00 0.00 O ATOM 0 H GLU A 538 -3.325 -4.244 -1.896 1.00 0.00 H new ATOM 0 HA GLU A 538 -3.318 -5.688 -4.445 1.00 0.00 H new ATOM 0 HB2 GLU A 538 -5.533 -3.941 -3.392 1.00 0.00 H new ATOM 0 HB3 GLU A 538 -5.141 -3.864 -5.099 1.00 0.00 H new ATOM 0 HG2 GLU A 538 -5.960 -6.348 -3.555 1.00 0.00 H new ATOM 0 HG3 GLU A 538 -6.955 -5.457 -4.689 1.00 0.00 H new ATOM 1470 N TRP A 539 -2.281 -3.675 -5.565 1.00 0.00 N ATOM 1471 CA TRP A 539 -1.432 -2.616 -6.100 1.00 0.00 C ATOM 1472 C TRP A 539 -2.264 -1.409 -6.517 1.00 0.00 C ATOM 1473 O TRP A 539 -3.014 -1.467 -7.491 1.00 0.00 O ATOM 1474 CB TRP A 539 -0.627 -3.134 -7.293 1.00 0.00 C ATOM 1475 CG TRP A 539 0.331 -4.229 -6.933 1.00 0.00 C ATOM 1476 CD1 TRP A 539 0.122 -5.573 -7.055 1.00 0.00 C ATOM 1477 CD2 TRP A 539 1.647 -4.072 -6.391 1.00 0.00 C ATOM 1478 NE1 TRP A 539 1.229 -6.262 -6.621 1.00 0.00 N ATOM 1479 CE2 TRP A 539 2.179 -5.364 -6.210 1.00 0.00 C ATOM 1480 CE3 TRP A 539 2.428 -2.967 -6.044 1.00 0.00 C ATOM 1481 CZ2 TRP A 539 3.455 -5.578 -5.696 1.00 0.00 C ATOM 1482 CZ3 TRP A 539 3.694 -3.181 -5.533 1.00 0.00 C ATOM 1483 CH2 TRP A 539 4.198 -4.478 -5.363 1.00 0.00 C ATOM 0 H TRP A 539 -2.471 -4.435 -6.219 1.00 0.00 H new ATOM 0 HA TRP A 539 -0.744 -2.304 -5.314 1.00 0.00 H new ATOM 0 HB2 TRP A 539 -1.315 -3.499 -8.055 1.00 0.00 H new ATOM 0 HB3 TRP A 539 -0.072 -2.306 -7.735 1.00 0.00 H new ATOM 0 HD1 TRP A 539 -0.780 -6.028 -7.436 1.00 0.00 H new ATOM 0 HE1 TRP A 539 1.328 -7.277 -6.607 1.00 0.00 H new ATOM 0 HE3 TRP A 539 2.049 -1.964 -6.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 539 3.845 -6.577 -5.565 1.00 0.00 H new ATOM 0 HZ3 TRP A 539 4.306 -2.334 -5.260 1.00 0.00 H new ATOM 0 HH2 TRP A 539 5.192 -4.612 -4.962 1.00 0.00 H new ATOM 1494 N ALA A 540 -2.127 -0.315 -5.774 1.00 0.00 N ATOM 1495 CA ALA A 540 -2.866 0.906 -6.070 1.00 0.00 C ATOM 1496 C ALA A 540 -2.855 1.206 -7.565 1.00 0.00 C ATOM 1497 O ALA A 540 -1.797 1.230 -8.195 1.00 0.00 O ATOM 1498 CB ALA A 540 -2.283 2.076 -5.290 1.00 0.00 C ATOM 0 H ALA A 540 -1.511 -0.250 -4.963 1.00 0.00 H new ATOM 0 HA ALA A 540 -3.902 0.759 -5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 540 -2.844 2.982 -5.520 1.00 0.00 H new ATOM 0 HB2 ALA A 540 -2.349 1.870 -4.222 1.00 0.00 H new ATOM 0 HB3 ALA A 540 -1.239 2.215 -5.569 1.00 0.00 H new ATOM 1504 N ASP A 541 -4.037 1.434 -8.126 1.00 0.00 N ATOM 1505 CA ASP A 541 -4.163 1.733 -9.548 1.00 0.00 C ATOM 1506 C ASP A 541 -3.852 3.200 -9.824 1.00 0.00 C ATOM 1507 O ASP A 541 -4.421 4.094 -9.198 1.00 0.00 O ATOM 1508 CB ASP A 541 -5.572 1.396 -10.038 1.00 0.00 C ATOM 1509 CG ASP A 541 -6.650 1.938 -9.120 1.00 0.00 C ATOM 1510 OD1 ASP A 541 -6.808 3.175 -9.055 1.00 0.00 O ATOM 1511 OD2 ASP A 541 -7.336 1.125 -8.466 1.00 0.00 O ATOM 0 H ASP A 541 -4.922 1.418 -7.618 1.00 0.00 H new ATOM 0 HA ASP A 541 -3.442 1.120 -10.089 1.00 0.00 H new ATOM 0 HB2 ASP A 541 -5.713 1.804 -11.039 1.00 0.00 H new ATOM 0 HB3 ASP A 541 -5.677 0.314 -10.117 1.00 0.00 H new ATOM 1516 N SER A 542 -2.944 3.440 -10.765 1.00 0.00 N ATOM 1517 CA SER A 542 -2.554 4.799 -11.121 1.00 0.00 C ATOM 1518 C SER A 542 -3.219 5.232 -12.424 1.00 0.00 C ATOM 1519 O SER A 542 -3.617 4.398 -13.236 1.00 0.00 O ATOM 1520 CB SER A 542 -1.033 4.897 -11.255 1.00 0.00 C ATOM 1521 OG SER A 542 -0.622 6.241 -11.434 1.00 0.00 O ATOM 0 H SER A 542 -2.465 2.711 -11.294 1.00 0.00 H new ATOM 0 HA SER A 542 -2.886 5.466 -10.325 1.00 0.00 H new ATOM 0 HB2 SER A 542 -0.559 4.484 -10.364 1.00 0.00 H new ATOM 0 HB3 SER A 542 -0.700 4.296 -12.101 1.00 0.00 H new ATOM 0 HG SER A 542 0.354 6.277 -11.515 1.00 0.00 H new ATOM 1527 N GLU A 543 -3.335 6.543 -12.615 1.00 0.00 N ATOM 1528 CA GLU A 543 -3.953 7.087 -13.819 1.00 0.00 C ATOM 1529 C GLU A 543 -2.896 7.428 -14.866 1.00 0.00 C ATOM 1530 O GLU A 543 -1.841 7.974 -14.545 1.00 0.00 O ATOM 1531 CB GLU A 543 -4.771 8.334 -13.480 1.00 0.00 C ATOM 1532 CG GLU A 543 -4.196 9.146 -12.331 1.00 0.00 C ATOM 1533 CD GLU A 543 -4.737 8.713 -10.983 1.00 0.00 C ATOM 1534 OE1 GLU A 543 -5.856 8.160 -10.943 1.00 0.00 O ATOM 1535 OE2 GLU A 543 -4.042 8.927 -9.968 1.00 0.00 O ATOM 0 H GLU A 543 -3.010 7.247 -11.952 1.00 0.00 H new ATOM 0 HA GLU A 543 -4.617 6.327 -14.231 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -4.836 8.967 -14.365 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -5.788 8.034 -13.228 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -3.110 9.050 -12.331 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -4.422 10.201 -12.487 1.00 0.00 H new ATOM 1542 N VAL A 544 -3.188 7.101 -16.121 1.00 0.00 N ATOM 1543 CA VAL A 544 -2.265 7.372 -17.217 1.00 0.00 C ATOM 1544 C VAL A 544 -2.295 8.846 -17.608 1.00 0.00 C ATOM 1545 O VAL A 544 -3.305 9.348 -18.102 1.00 0.00 O ATOM 1546 CB VAL A 544 -2.595 6.517 -18.454 1.00 0.00 C ATOM 1547 CG1 VAL A 544 -1.886 5.173 -18.379 1.00 0.00 C ATOM 1548 CG2 VAL A 544 -4.099 6.328 -18.585 1.00 0.00 C ATOM 0 H VAL A 544 -4.057 6.648 -16.404 1.00 0.00 H new ATOM 0 HA VAL A 544 -1.267 7.113 -16.862 1.00 0.00 H new ATOM 0 HB VAL A 544 -2.238 7.040 -19.341 1.00 0.00 H new ATOM 0 HG11 VAL A 544 -2.131 4.583 -19.262 1.00 0.00 H new ATOM 0 HG12 VAL A 544 -0.808 5.332 -18.337 1.00 0.00 H new ATOM 0 HG13 VAL A 544 -2.210 4.640 -17.485 1.00 0.00 H new ATOM 0 HG21 VAL A 544 -4.314 5.721 -19.465 1.00 0.00 H new ATOM 0 HG22 VAL A 544 -4.482 5.827 -17.696 1.00 0.00 H new ATOM 0 HG23 VAL A 544 -4.580 7.301 -18.688 1.00 0.00 H new ATOM 1558 N THR A 545 -1.180 9.534 -17.386 1.00 0.00 N ATOM 1559 CA THR A 545 -1.078 10.951 -17.715 1.00 0.00 C ATOM 1560 C THR A 545 0.096 11.215 -18.650 1.00 0.00 C ATOM 1561 O THR A 545 1.249 10.960 -18.303 1.00 0.00 O ATOM 1562 CB THR A 545 -0.914 11.811 -16.448 1.00 0.00 C ATOM 1563 OG1 THR A 545 -0.791 13.192 -16.806 1.00 0.00 O ATOM 1564 CG2 THR A 545 0.309 11.377 -15.654 1.00 0.00 C ATOM 0 H THR A 545 -0.335 9.133 -16.980 1.00 0.00 H new ATOM 0 HA THR A 545 -2.006 11.227 -18.215 1.00 0.00 H new ATOM 0 HB THR A 545 -1.799 11.675 -15.826 1.00 0.00 H new ATOM 0 HG1 THR A 545 -0.689 13.732 -15.995 1.00 0.00 H new ATOM 0 HG21 THR A 545 0.404 11.999 -14.764 1.00 0.00 H new ATOM 0 HG22 THR A 545 0.199 10.334 -15.358 1.00 0.00 H new ATOM 0 HG23 THR A 545 1.201 11.487 -16.271 1.00 0.00 H new ATOM 1572 N VAL A 546 -0.204 11.727 -19.840 1.00 0.00 N ATOM 1573 CA VAL A 546 0.827 12.027 -20.825 1.00 0.00 C ATOM 1574 C VAL A 546 1.323 13.462 -20.682 1.00 0.00 C ATOM 1575 O VAL A 546 0.541 14.409 -20.759 1.00 0.00 O ATOM 1576 CB VAL A 546 0.310 11.815 -22.261 1.00 0.00 C ATOM 1577 CG1 VAL A 546 1.382 12.185 -23.275 1.00 0.00 C ATOM 1578 CG2 VAL A 546 -0.145 10.377 -22.455 1.00 0.00 C ATOM 0 H VAL A 546 -1.153 11.942 -20.144 1.00 0.00 H new ATOM 0 HA VAL A 546 1.652 11.340 -20.639 1.00 0.00 H new ATOM 0 HB VAL A 546 -0.548 12.469 -22.420 1.00 0.00 H new ATOM 0 HG11 VAL A 546 0.999 12.029 -24.283 1.00 0.00 H new ATOM 0 HG12 VAL A 546 1.656 13.233 -23.149 1.00 0.00 H new ATOM 0 HG13 VAL A 546 2.261 11.559 -23.120 1.00 0.00 H new ATOM 0 HG21 VAL A 546 -0.507 10.244 -23.474 1.00 0.00 H new ATOM 0 HG22 VAL A 546 0.693 9.703 -22.277 1.00 0.00 H new ATOM 0 HG23 VAL A 546 -0.947 10.151 -21.753 1.00 0.00 H new ATOM 1588 N GLN A 547 2.627 13.613 -20.474 1.00 0.00 N ATOM 1589 CA GLN A 547 3.227 14.933 -20.320 1.00 0.00 C ATOM 1590 C GLN A 547 3.444 15.594 -21.678 1.00 0.00 C ATOM 1591 O GLN A 547 3.503 14.919 -22.705 1.00 0.00 O ATOM 1592 CB GLN A 547 4.557 14.828 -19.572 1.00 0.00 C ATOM 1593 CG GLN A 547 5.638 14.098 -20.353 1.00 0.00 C ATOM 1594 CD GLN A 547 6.858 13.786 -19.508 1.00 0.00 C ATOM 1595 OE1 GLN A 547 7.534 14.690 -19.016 1.00 0.00 O ATOM 1596 NE2 GLN A 547 7.146 12.501 -19.336 1.00 0.00 N ATOM 0 H GLN A 547 3.288 12.839 -20.408 1.00 0.00 H new ATOM 0 HA GLN A 547 2.541 15.551 -19.741 1.00 0.00 H new ATOM 0 HB2 GLN A 547 4.909 15.831 -19.331 1.00 0.00 H new ATOM 0 HB3 GLN A 547 4.393 14.312 -18.626 1.00 0.00 H new ATOM 0 HG2 GLN A 547 5.229 13.169 -20.751 1.00 0.00 H new ATOM 0 HG3 GLN A 547 5.938 14.706 -21.207 1.00 0.00 H new ATOM 0 HE21 GLN A 547 6.558 11.785 -19.762 1.00 0.00 H new ATOM 0 HE22 GLN A 547 7.955 12.230 -18.777 1.00 0.00 H new ATOM 1605 N SER A 548 3.563 16.918 -21.674 1.00 0.00 N ATOM 1606 CA SER A 548 3.770 17.671 -22.905 1.00 0.00 C ATOM 1607 C SER A 548 5.235 18.067 -23.060 1.00 0.00 C ATOM 1608 O SER A 548 5.915 17.623 -23.984 1.00 0.00 O ATOM 1609 CB SER A 548 2.887 18.921 -22.918 1.00 0.00 C ATOM 1610 OG SER A 548 3.305 19.829 -23.923 1.00 0.00 O ATOM 0 H SER A 548 3.520 17.491 -20.831 1.00 0.00 H new ATOM 0 HA SER A 548 3.494 17.032 -23.744 1.00 0.00 H new ATOM 0 HB2 SER A 548 1.849 18.635 -23.090 1.00 0.00 H new ATOM 0 HB3 SER A 548 2.926 19.408 -21.944 1.00 0.00 H new ATOM 0 HG SER A 548 2.725 20.619 -23.912 1.00 0.00 H new ATOM 1616 N GLY A 549 5.714 18.907 -22.147 1.00 0.00 N ATOM 1617 CA GLY A 549 7.095 19.350 -22.199 1.00 0.00 C ATOM 1618 C GLY A 549 8.070 18.253 -21.820 1.00 0.00 C ATOM 1619 O GLY A 549 7.784 17.403 -20.977 1.00 0.00 O ATOM 0 H GLY A 549 5.170 19.288 -21.373 1.00 0.00 H new ATOM 0 HA2 GLY A 549 7.323 19.703 -23.205 1.00 0.00 H new ATOM 0 HA3 GLY A 549 7.227 20.198 -21.527 1.00 0.00 H new ATOM 1623 N PRO A 550 9.253 18.263 -22.453 1.00 0.00 N ATOM 1624 CA PRO A 550 10.297 17.267 -22.194 1.00 0.00 C ATOM 1625 C PRO A 550 10.924 17.430 -20.814 1.00 0.00 C ATOM 1626 O PRO A 550 10.513 18.288 -20.032 1.00 0.00 O ATOM 1627 CB PRO A 550 11.332 17.546 -23.287 1.00 0.00 C ATOM 1628 CG PRO A 550 11.131 18.979 -23.642 1.00 0.00 C ATOM 1629 CD PRO A 550 9.662 19.247 -23.469 1.00 0.00 C ATOM 0 HA PRO A 550 9.903 16.251 -22.209 1.00 0.00 H new ATOM 0 HB2 PRO A 550 12.345 17.365 -22.928 1.00 0.00 H new ATOM 0 HB3 PRO A 550 11.180 16.899 -24.151 1.00 0.00 H new ATOM 0 HG2 PRO A 550 11.724 19.627 -22.997 1.00 0.00 H new ATOM 0 HG3 PRO A 550 11.445 19.175 -24.667 1.00 0.00 H new ATOM 0 HD2 PRO A 550 9.476 20.268 -23.137 1.00 0.00 H new ATOM 0 HD3 PRO A 550 9.116 19.111 -24.403 1.00 0.00 H new ATOM 1637 N SER A 551 11.921 16.602 -20.520 1.00 0.00 N ATOM 1638 CA SER A 551 12.602 16.652 -19.232 1.00 0.00 C ATOM 1639 C SER A 551 14.005 17.232 -19.381 1.00 0.00 C ATOM 1640 O SER A 551 14.973 16.501 -19.590 1.00 0.00 O ATOM 1641 CB SER A 551 12.680 15.253 -18.617 1.00 0.00 C ATOM 1642 OG SER A 551 11.437 14.874 -18.052 1.00 0.00 O ATOM 0 H SER A 551 12.275 15.888 -21.157 1.00 0.00 H new ATOM 0 HA SER A 551 12.027 17.301 -18.571 1.00 0.00 H new ATOM 0 HB2 SER A 551 12.970 14.532 -19.381 1.00 0.00 H new ATOM 0 HB3 SER A 551 13.453 15.233 -17.849 1.00 0.00 H new ATOM 0 HG SER A 551 11.513 13.976 -17.667 1.00 0.00 H new ATOM 1648 N SER A 552 14.107 18.553 -19.273 1.00 0.00 N ATOM 1649 CA SER A 552 15.390 19.234 -19.401 1.00 0.00 C ATOM 1650 C SER A 552 16.261 18.986 -18.173 1.00 0.00 C ATOM 1651 O SER A 552 16.205 19.733 -17.197 1.00 0.00 O ATOM 1652 CB SER A 552 15.177 20.737 -19.593 1.00 0.00 C ATOM 1653 OG SER A 552 16.221 21.305 -20.366 1.00 0.00 O ATOM 0 H SER A 552 13.316 19.173 -19.097 1.00 0.00 H new ATOM 0 HA SER A 552 15.901 18.832 -20.276 1.00 0.00 H new ATOM 0 HB2 SER A 552 14.220 20.912 -20.084 1.00 0.00 H new ATOM 0 HB3 SER A 552 15.131 21.228 -18.621 1.00 0.00 H new ATOM 0 HG SER A 552 16.061 22.266 -20.476 1.00 0.00 H new ATOM 1659 N GLY A 553 17.066 17.929 -18.229 1.00 0.00 N ATOM 1660 CA GLY A 553 17.937 17.600 -17.116 1.00 0.00 C ATOM 1661 C GLY A 553 17.790 16.158 -16.672 1.00 0.00 C ATOM 1662 O GLY A 553 16.747 15.766 -16.150 1.00 0.00 O ATOM 0 H GLY A 553 17.130 17.295 -19.025 1.00 0.00 H new ATOM 0 HA2 GLY A 553 18.972 17.785 -17.402 1.00 0.00 H new ATOM 0 HA3 GLY A 553 17.715 18.260 -16.277 1.00 0.00 H new TER 1666 GLY A 553